CC(=O)Nc1sccc1C#N	ZINC000000039565	c1ccsc1
Brc3cccc(COc2ccc1ccccc1c2C=O)c3	ZINC000000276171	C(Oc2ccc1ccccc1c2)c3ccccc3
NS(=O)(=O)c1ccc(C#N)cc1	ZINC000000039566	c1ccccc1
CCN(CC)CCN(C)C(=O)Nc1ccc(NC(=O)N(C)CCN(CC)CC)cc1	ZINC000004118695	c1ccccc1
CN(C)CCN2C(=O)N[C@@](C)(c1ccc(N(=O)=O)cc1)C2=O	ZINC000000181425	O=C2NC(c1ccccc1)C(=O)N2
C1COc2c(O1)cccc2N5CCN(C4Cc3ccccc3C4)CC5	ZINC000000016050	C1COc2c(O1)cccc2N5CCN(C4Cc3ccccc3C4)CC5
O=C(Cc1ccccc1)c2ccccc2C(=O)NCc3cccs3	ZINC000000031598	O=C(Cc1ccccc1)c2ccccc2C(=O)NCc3cccs3
COC(=O)C#Cc1ccc(N(=O)=O)cc1	ZINC000000009192	c1ccccc1
Cn1ncc(Cl)c1CN	ZINC000002537600	c1cn[nH]c1
Fc1cccc(Cl)c1CSc2ccccc2C3=NCCCN3	ZINC000000139184	C3CNC(c1ccccc1SCc2ccccc2)=NC3
N#CC[N+]12CCN(CC1)CC2	ZINC000000143221	C1CN2CCN1CC2
CNCC1(C)OCCO1	ZINC000000390853	C1COCO1
COc3cc(c2nc(SC)c(C#N)c1CCCCc12)cc(OC)c3OC	ZINC000000622694	C1CCc2c(C1)ccnc2c3ccccc3
S=C(NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN4CCN(c3ccccc3)CC4)Nc6ccc(n5cccn5)cc6	ZINC000008636252	S=C(NCC1CC2CCN1CC2CN4CCN(c3ccccc3)CC4)Nc6ccc(n5cccn5)cc6
NCc1c(Br)sc2ccccc12	ZINC000000345317	c2ccc1sccc1c2
COC[C@@H](C)NC(=O)c1ccc(Cl)c(Cl)c1	ZINC000000031027	c1ccccc1
O=C3N(c1ccccc1)[C@H](\C=C\c2ccccc2)Nc4ccccc34	ZINC000000035053	O=C3N(c1ccccc1)C(C=Cc2ccccc2)Nc4ccccc34
Cc1nccn1C[C@@H]2CCc4c(C2=O)c3ccccc3n4C	ZINC000000075126	O=C3C(Cn1ccnc1)CCc4[nH]c2ccccc2c34
C[n+]1ccccc1C#N	ZINC000000164098	c1ccncc1
CCSc2nc1n(C)c(=O)n(C)c(=O)c1n2Cc3ccc(F)cc3	ZINC000000079026	O=c3[nH]c(=O)c2n(Cc1ccccc1)cnc2[nH]3
NCCSC(N)=S	ZINC000002016369	nonring
NC3=C(C#N)[C@@H](c1ccccc1)[C@@H](C(=O)c2ccccc2)S3	ZINC000000049859	O=C(C1SC=CC1c2ccccc2)c3ccccc3
Cc3oc2ccc(OCc1ccccc1F)cc2c3C(O)=O	ZINC000000096573	C(Oc2ccc1occc1c2)c3ccccc3
N#Cc2ccc(N1CCNCC1)nc2	ZINC000000127156	C2CN(c1ccccn1)CCN2
COc2ccc(Nc1nc(NN)nc(OCC(F)(F)F)n1)cc2	ZINC000000032710	N(c1ccccc1)c2ncncn2
C5CCN(CCSc4ccc(c3cc(c2ccc(SCCN1CCCCC1)cc2)ncn3)cc4)CC5	ZINC000036476203	C5CCN(CCSc4ccc(c3cc(c2ccc(SCCN1CCCCC1)cc2)ncn3)cc4)CC5
COc2ccc(CNC[C@@H](O)COc1ccc(C)cc1N(=O)=O)cc2	ZINC000000119359	C(CNCc1ccccc1)COc2ccccc2
C[C@H]1CNCCCN1S(=O)(=O)c2cccc3cncc(C)c23	ZINC000000022706	O=S(=O)(N1CCCNCC1)c2cccc3cnccc23
CC(C)(C)c1nccn1C[C@@H]4CC(c2ccccc2)(c3ccccc3)C(=O)O4	ZINC000000599226	O=C2OC(Cn1ccnc1)CC2(c3ccccc3)c4ccccc4
C[N+](C)(C)c2ccc(C(=O)c1ccccc1)cc2	ZINC000000083900	O=C(c1ccccc1)c2ccccc2
Clc3ccc([C@]12CNC[C@H]1C2)cc3Cl	ZINC000000003189	C2NCC3(c1ccccc1)CC23
O[C@@H](CNC1CCCCC1)c2ccccc2	ZINC000000157267	C2CCC(NCCc1ccccc1)CC2
Cc1nccn1C=C	ZINC000000394845	c1c[nH]cn1
Cc3nn(c1ccccn1)c4C[C@H](c2ccco2)CC(=O)c34	ZINC000000038177	O=C2CC(c1ccco1)Cc3c2cnn3c4ccccn4
CCn1c[n+](N)cn1	ZINC000003132307	c1nc[nH]n1
N#Cc2[nH]nc3nc(N1CCNCC1)ccc23	ZINC000000018395	C3CN(c2ccc1c[nH]nc1n2)CCN3
CCCCC[C@H](C)[C@H](C)c4cc(OC(=O)CCCN1CCCCC1)c3C2=C(CC[N@](CC#C)C2)C(C)(C)Oc3c4	ZINC000011681465	O=C(CCCN1CCCCC1)Oc4cccc3OCC2=C(CNCC2)c34
COc3ccc(C[C@H]1NCC[C@@]2(O)CCCC[C@H]12)cc3	ZINC000000191928	C1CCC2C(C1)CCNC2Cc3ccccc3
COc2ccc([C@@H]1NC(=O)O[C@@H]1CO)cc2	ZINC000000007490	O=C2NC(c1ccccc1)CO2
CC2CCN(C[C@H](O)COc1ccc(C)c(C)c1)CC2	ZINC000000064559	C2CCN(CCCOc1ccccc1)CC2
CC(=O)c2ccc1[nH]c(=O)sc1c2	ZINC000000058191	O=c2[nH]c1ccccc1s2
CN(C)C(=N)Nc4nc(=O)c(=Cc3ccc(N2CCC(NC[C@H](O)COc1ccccc1)CC2)cc3)s4	ZINC000028101773	O=c1ncsc1=Cc4ccc(N3CCC(NCCCOc2ccccc2)CC3)cc4
Nc2nc(N)c(N)c(Nc1ccc(Br)cc1)n2	ZINC000000135678	N(c1ccccc1)c2ccncn2
O=C(C[C@@H]1CCNC[C@@H]1Cc3cc(CN2CCCCC2)on3)NCc5ccc4OCOc4c5	ZINC000012482508	O=C(CC1CCNCC1Cc3cc(CN2CCCCC2)on3)NCc5ccc4OCOc4c5
O=C2CS[C@@H](c1cccc(N(=O)=O)c1)N2CCN3CCCCC3	ZINC000000208069	O=C2CSC(c1ccccc1)N2CCN3CCCCC3
Cc2ccc(NC(=O)CN1CCC(C(N)=O)CC1)cc2	ZINC000000299685	O=C(CN1CCCCC1)Nc2ccccc2
NCc1ccc(O)cc1	ZINC000000153933	c1ccccc1
CC[N+](C)(CC)CCNC(=O)Nc2ccc(c1ccc(NC(=O)NCC[N+](C)(CC)CC)c(OC)c1)cc2OC	ZINC000005640073	c2ccc(c1ccccc1)cc2
CN2CCC(N(C)Cc1ccccc1C(F)(F)F)CC2	ZINC000000241257	C2CC(NCc1ccccc1)CCN2
O=CCC[C@H]1CCCCN1	ZINC000001686863	C1CCNCC1
Cc2cc(C1=NCCN1)ccc2NC(=O)c5ccc(C(=O)Nc4ccc(C3=NCCN3)cc4C)cc5	ZINC000001692399	O=C(Nc2ccc(C1=NCCN1)cc2)c5ccc(C(=O)Nc4ccc(C3=NCCN3)cc4)cc5
CC(=O)CN1CCCCC1	ZINC000001646652	C1CCNCC1
CN3CCN(/N=C/c2ccc(OCc1ccccc1)cc2)CC3	ZINC000000369689	C3CN(N=Cc2ccc(OCc1ccccc1)cc2)CCN3
CC2(C)CC(NCC(=O)OC1CCCCC1)CC(C)(C)N2	ZINC000000052222	O=C(CNC1CCNCC1)OC2CCCCC2
C[N@]3CCC[C@@H](NC(=O)NCCCN2CCN(c1ncccn1)CC2)C3	ZINC000052522560	O=C(NCCCN2CCN(c1ncccn1)CC2)NC3CCCNC3
CCN2CCC(NC(=O)CN1CCC(C(=O)NCCOC)CC1)CC2	ZINC000025810765	O=C(CN1CCCCC1)NC2CCNCC2
OC2CCN(C1CCNCC1)CC2	ZINC000002559686	C2CCN(C1CCNCC1)CC2
O=N(=O)c1c[nH]nc1c3cnc2c(C#N)cnn2c3	ZINC000000049634	c3cc2ncc(c1cc[nH]n1)cn2n3
CCOC(=O)N4CCC([N@]1C[C@@H]3C[C@H](C1)c2cccc(=O)n2C3)CC4	ZINC000000228619	O=c4cccc3C2CC(CN(C1CCNCC1)C2)Cn34
COc1ccc(OC)c([C@@H](O)CNC(=O)CN)c1	ZINC000000403079	c1ccccc1
COc4ccc3n(=O)ccc([C@@H](O)[C@@H]1C[C@@H]2CC[N@@]1C[C@H]2C=C)c3c4	ZINC000000398047	O=n3ccc(CC1CC2CCN1CC2)c4ccccc34
CN3CCN(c2ccc(C(=O)c1ccc(F)cc1)cc2)CC3	ZINC000000129115	O=C(c1ccccc1)c3ccc(N2CCNCC2)cc3
Oc1cc(N(=O)=O)cc2cccnc12	ZINC000000078149	c2ccc1ncccc1c2
CSc3nc(N)c2[nH]c(=O)n(Cc1ccccc1)c2n3	ZINC000000024042	O=c2[nH]c1cncnc1n2Cc3ccccc3
N#[N+]N=C1NCCN1	ZINC000004722293	N=C1NCCN1
Fc1cccc(Cl)c1CN3CCC(C(=O)NC[C@H]2CCCO2)CC3	ZINC000000778774	O=C(NCC1CCCO1)C3CCN(Cc2ccccc2)CC3
CCN(CC)C(C)(C)CNc2cc(C)c(c1ccccc1)nn2	ZINC000000015414	c2ccc(c1cccnn1)cc2
CN(CC[N+]1(C)CCCC1)C(=O)[C@](O)(c2ccccc2)c3cccs3	ZINC000000607834	O=C(NCCN1CCCC1)C(c2ccccc2)c3cccs3
O=C2C[C@H](NCc1ccco1)C(=O)N2CCc3ccccc3	ZINC000000132832	O=C2CC(NCc1ccco1)C(=O)N2CCc3ccccc3
CC(C)(C)NC[C@@H](O)c1cc(Cl)c(N)c(Cl)c1	ZINC000000057262	c1ccccc1
Cc1ccc(C(N)=O)cc1Br	ZINC000000045937	c1ccccc1
CCn2c(C)[n+](c1ccccc1)c3ccc(C(=O)N(C)C)cc23	ZINC000000281277	c3ccc([n+]1c[nH]c2ccccc12)cc3
N[C@H](CF)CC[C@@H](N)C(O)=O	ZINC000001554452	nonring
COc3ccc(OC)c(Nc1cc(C)nc2ccccc12)c3	ZINC000000303309	N(c1ccccc1)c2ccnc3ccccc23
C[C@@H]4CCCN(C(=O)C3CCN(Cc2ccc1OCOc1c2)CC3)C4	ZINC000000317563	O=C(C3CCN(Cc2ccc1OCOc1c2)CC3)N4CCCCC4
C[C@@H](Cc1ccc(O)cc1)N4CCC(N3CCC(C(=O)NC2CC2)CC3)CC4	ZINC000011700885	O=C(NC1CC1)C4CCN(C3CCN(CCc2ccccc2)CC3)CC4
CCOC(=O)c2sc(NC(=O)CCN1CCCCC1)c(C(=O)OCC)c2C	ZINC000000715454	O=C(CCN1CCCCC1)Nc2cccs2
O=c1[nH]sc2ncccc12	ZINC000000080837	O=c1[nH]sc2ncccc12
Cc1nc(N)nc(N)c1N	ZINC000000399471	c1cncnc1
Cc3ccc(CNC(=O)Nc2ccc(OCc1ccccc1)cc2)n3C	ZINC000000157976	O=C(NCc1ccc[nH]1)Nc3ccc(OCc2ccccc2)cc3
OC(C(=O)O[C@@H]1CN2CCC1CC2)(c3ccccc3)c4ccccc4	ZINC000000057479	O=C(OC1CN2CCC1CC2)C(c3ccccc3)c4ccccc4
CC(C)(O)C#C[C@@H](O)c1ccc(F)cc1	ZINC000000052493	c1ccccc1
Brc3cccc(\C=N\N2CCN(c1ccccc1)CC2)c3	ZINC000000046640	C2CN(c1ccccc1)CCN2N=Cc3ccccc3
Clc2ccc(CCNC(=O)c1ccc(Br)cc1)cc2	ZINC000000036015	O=C(NCCc1ccccc1)c2ccccc2
C(NCc1ccco1)c2cccnc2	ZINC000000158749	C(NCc1ccco1)c2cccnc2
Cc1ccccc1N[C@@H](C(N)=O)c3cc2cccc(C)c2nc3Cl	ZINC000000047938	C(Nc1ccccc1)c3cnc2ccccc2c3
Cc4cccc5n(Cc1cccc(C(N)=N)c1)c(C(=O)NCc3ccc([N+](C)(C)Cc2ccccc2)cc3)cc45	ZINC000013474311	O=C(NCc2ccc(NCc1ccccc1)cc2)c4cc3ccccc3n4Cc5ccccc5
Fc3cccc(C(=O)Nc2nc1ccc(Cl)cc1s2)c3	ZINC000000035615	O=C(Nc2nc1ccccc1s2)c3ccccc3
COC(=O)Nc1c(C)cc(Br)cc1C	ZINC000000036013	c1ccccc1
CCn2c[n+](C[C@@H](O)COc1ccc(F)cc1)c3cc(C)c(C)cc23	ZINC000000268775	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
CN4CCN(c1ncnc3c1sc2nc(C)cc(C)c23)CC4	ZINC000000159160	C4CN(c2ncnc3c1cccnc1sc23)CCN4
COc2ccc(C(=O)[C@@H](CC[C@@H](CNC(C)(C)C)C(=O)c1ccc(OC)cc1)CNC(C)(C)C)cc2	ZINC000006075188	O=C(CCCCC(=O)c1ccccc1)c2ccccc2
CCCN2CCc1cc(O)cc4c1[C@H]2Cc3ccc(O)c(O)c34	ZINC000000011665	C2Cc3cccc4c1ccccc1CC(N2)c34
Clc3ccc2sc1ccccc1[nH]c2c3	ZINC000000035809	c3ccc2sc1ccccc1[nH]c2c3
CC[N+](C)(CC)CCOc1ccc(N(C)CC[N+](C)(CC)CC)cc1	ZINC000005333394	c1ccccc1
Cc2cc(=O)oc3cc(NC(=O)[C@@H](N)Cc1ccccc1)ccc23	ZINC000000391857	O=C(CCc1ccccc1)Nc3ccc2ccc(=O)oc2c3
NCc1cncs1	ZINC000004771123	c1cscn1
CCN(CC)CCn3nc2n(C)c1ccc(OC)cc1c(=O)c2c3C	ZINC000000390502	O=c2c1ccccc1[nH]c3n[nH]cc23
CN(C)c3nc(NCn2c(=O)c1ccccc1c2=O)nc(N(C)C)n3	ZINC000000495150	O=c2n(CNc1ncncn1)c(=O)c3ccccc23
CC(C)NCCC#N	ZINC000001688364	nonring
CCC(=O)c1cc(N)ccc1O	ZINC000000058200	c1ccccc1
CCN(CC)C#CC	ZINC000001707066	nonring
NCCCC(=O)NCCCCCCCCCCNC(=O)CCCN	ZINC000004974910	nonring
CN(C)c2cccc3c(S(=O)(=O)NCCN1CCNCCNCCNCC1)cccc23	ZINC000034745011	O=S(=O)(NCCN1CCNCCNCCNCC1)c2cccc3ccccc23
CC(=O)Nc2ccc(S(=O)(=O)Nc1nncs1)cc2	ZINC000000068398	O=S(=O)(Nc1nncs1)c2ccccc2
CS(=O)(=O)[C@@H]1CCNC1	ZINC000002386734	C1CCNC1
Cc3cc(C)n2nc(c1ccccc1)cc2[n+]3c4ccccc4	ZINC000000124373	c4ccc(c3cc2[n+](c1ccccc1)cccn2n3)cc4
O=C(Nc3ccc(CCc2nc1ccccc1o2)cc3)C4CCCCC4	ZINC000000189319	O=C(Nc3ccc(CCc2nc1ccccc1o2)cc3)C4CCCCC4
CCCN2CCC(N1CCN(S(C)(=O)=O)CC1)CC2	ZINC000000268253	C2CC(N1CCNCC1)CCN2
COc3ccc(c2oc1ccccc1c(=O)c2OCC(O)=O)cc3	ZINC000000151197	O=c2cc(c1ccccc1)oc3ccccc23
Fc4ccc(\C=C\C[N@@](CC2CCN(C1CCCC1)CC2)Cc3cccnc3)cc4	ZINC000067513951	C4CCC(N3CCC(CN(CC=Cc1ccccc1)Cc2cccnc2)CC3)C4
OC[C@@H]1C[C@@H]2CC[N@]1C[C@H]2C=C	ZINC000000403190	C1CN2CCC1CC2
C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)Nc2ccc(C)cc2C	ZINC000000054664	O=C(COc1ccccc1)Nc2ccccc2
COc3ccc(CC[N@@](CC1CCN(C)CC1)Cc2cc(CC(C)C)[nH]n2)cc3	ZINC000012204358	C3CC(CN(CCc1ccccc1)Cc2cc[nH]n2)CCN3
NC(=O)c2cc[n+](COC[n+]1ccccc1\C=N\O)cc2	ZINC000000005077	C(OC[n+]1ccccc1)[n+]2ccccc2
Cc4cccc5c(N)c3cccc(C(=O)NCC[N+](C)(C)Cc2sc(N1CCOCC1)nc2N(=O)=O)c3nc45	ZINC000005845781	O=C(NCCNCc2cnc(N1CCOCC1)s2)c4cccc5cc3ccccc3nc45
CN(C)CCN4[C@@H](c1ccccc1)c3c(oc2ccccc2c3=O)C4=O	ZINC000000536842	O=C2NC(c1ccccc1)c4c2oc3ccccc3c4=O
Cc3ccc(OCC(=O)N2CCC(N1CCCC1)CC2)cc3	ZINC000000316569	O=C(COc1ccccc1)N3CCC(N2CCCC2)CC3
CN(C)c4ccc(c3cc[n+](CCOCCOCC[n+]2ccc(c1ccc(N(C)C)cc1)cc2)cc3)cc4	ZINC000011917707	C(COCC[n+]2ccc(c1ccccc1)cc2)OCC[n+]4ccc(c3ccccc3)cc4
OC(=O)CN2CSC(=S)N(Cc1ccccc1)C2	ZINC000000001005	S=C1SCNCN1Cc2ccccc2
OC(=O)CSc1ccc(C(F)(F)F)cn1	ZINC000000093367	c1ccncc1
O=[N+](Cc1c[nH]c2ccccc12)c3ccccc3	ZINC000000079148	O=[N+](Cc1c[nH]c2ccccc12)c3ccccc3
NCCOCCO	ZINC000001760798	nonring
FC(F)(F)c5ccc4sc1ccccc1n(CCCN3CCN(CCN2CCCCC2)CC3)c4c5	ZINC000019366288	C5CCN(CCN4CCN(CCCn2c1ccccc1sc3ccccc23)CC4)CC5
Cc4ccc(N3CCN(CCCN2C(=O)[C@@H]1CCCN1C2=O)CC3)cc4	ZINC000000633293	O=C2C1CCCN1C(=O)N2CCCN4CCN(c3ccccc3)CC4
C#CCNCCC#N	ZINC000034883364	nonring
OCC[C@H]1CCCC[N@]1CC(=O)c2c[nH]c3ccccc23	ZINC000000485856	O=C(CN1CCCCC1)c2c[nH]c3ccccc23
C[C@@H](O)[C@@H](O)c1ccc(C(N)=O)nc1	ZINC000000023800	c1ccncc1
C[C@@H](NCc1ccccc1c3ccc(CN2CCCC2)cc3)c5nnc(c4ccc(C)cc4)o5	ZINC000025500787	C5CCN(Cc4ccc(c1ccccc1CNCc3nnc(c2ccccc2)o3)cc4)C5
Clc3ccc(c2nnc(SCC(=O)Nc1ccccc1)o2)cc3	ZINC000000411436	O=C(CSc2nnc(c1ccccc1)o2)Nc3ccccc3
CC4(C)CC2(CC(C)(C)c1cc(O)c(O)cc12)c3cc(O)c(O)cc34	ZINC000000045127	C3CC2(CCc1ccccc12)c4ccccc34
CCOC(=O)[C@@H]2CCC[N@@](Cc1c(F)cccc1Cl)C2	ZINC000000278588	C2CCN(Cc1ccccc1)CC2
COc2ccc([C@H](N1CCCC1)C(N)=O)cc2	ZINC000000393748	C2CCN(Cc1ccccc1)C2
C[N+]4(C[C@@H](O)Cn2c1ccccc1c3ccccc23)CCOCC4	ZINC000000303667	C(CN1CCOCC1)Cn3c2ccccc2c4ccccc34
Nc1ccccc1S[C@H]4CC(=O)N(c3ccc2OCOc2c3)C4=O	ZINC000000071170	O=C2CC(Sc1ccccc1)C(=O)N2c4ccc3OCOc3c4
O=c3c1ccccc1c4nc2nonc2nc34	ZINC000000027763	O=c3c1ccccc1c4nc2nonc2nc34
Clc7ccc6c(NCCNC1CCC5(CC1)OO[C@@]4(c2ccccc2)CC(c3ccccc3)=C[C@@H]4O5)ccnc6c7	ZINC000001550773	C(CNc1ccnc2ccccc12)NC3CCC7(CC3)OOC6(c4ccccc4)CC(c5ccccc5)=CC6O7
C[C@@H](CN(C)C)Sc1nc(C)cc(C)n1	ZINC000000141431	c1cncnc1
C[N+](C)(Cc1ccccc1)Cc2sc(Cl)c(Cl)c2Cl	ZINC000000054884	C(NCc1cccs1)c2ccccc2
O[C@@H](CN1CCCCC1)c4ccc(CCc3ccc([C@@H](O)CN2CCCCC2)cc3)cc4	ZINC000004808237	C4CCN(CCc3ccc(CCc2ccc(CCN1CCCCC1)cc2)cc3)CC4
C[C@H]1C[N@@](C)C[C@@H](C)C1(O)C#C	ZINC000000094123	C1CCNCC1
COc2cc(\C=N\c1ccc(C)cc1)cc(Br)c2O	ZINC000000059737	C(=Nc1ccccc1)c2ccccc2
CCN(CC)CCC[C@@H](C)Nc2ccnc3cc(Cl)c(SCc1ccccc1)cc23	ZINC000008614498	C(Sc2ccc1ncccc1c2)c3ccccc3
COc2cnc1n(C)cc(CCNC(C)=O)c1c2	ZINC000000021664	c2cnc1[nH]ccc1c2
C4CN(c2ncnc3n(c1ccccc1)ncc23)CCN4	ZINC000000410942	C4CN(c2ncnc3n(c1ccccc1)ncc23)CCN4
COc1c(C(O)=O)cnc2n(C)nc(C)c12	ZINC000000125153	c2cnc1[nH]ncc1c2
NC[C@@H](O)c1ccccc1	ZINC000000403283	c1ccccc1
C[C@@H](CN(C)C)OC(C)=O	ZINC000000393637	nonring
NC(=N)c1ccccc1Cl	ZINC000000110578	c1ccccc1
CC[C@@H](C)N2CCN(C(=O)c1cc(OC)c(OC)c(OC)c1)CC2	ZINC000000115838	O=C(N1CCNCC1)c2ccccc2
CCN(CC)C(=O)c2ccc(Sc1ccc(F)cc1)c(N(=O)=O)c2	ZINC000000257407	S(c1ccccc1)c2ccccc2
COC(=O)C4(c1ccccc1)CCN(CCCCCN3[C@@H](c2ccc(F)cc2F)C(C(N)=O)=C(C)N=C3C)CC4	ZINC000027549296	C(CCN2CCC(c1ccccc1)CC2)CCN3C=NC=CC3c4ccccc4
CN3CCN(C[C@@H]2CN(C[C@@H](O)CC1(O)CCC1)CCO2)CC3	ZINC000625152183	C3CC(CCCN2CCOC(CN1CCNCC1)C2)C3
Clc3ccc(C(=O)CC[N@]2CCC(c1ccc(Cl)cc1)=CC2)cc3	ZINC000000597843	O=C(CCN2CCC(c1ccccc1)=CC2)c3ccccc3
COc3cc(\C=C\C[N@@](C)CC2CCN(CCc1ccc(F)cc1)CC2)ccc3O	ZINC000011814895	C(NCC2CCN(CCc1ccccc1)CC2)C=Cc3ccccc3
Cc1ccc(CN)o1	ZINC000000395597	c1ccoc1
CC3(C)C=C(n1ccccc1=O)c2cc(C#C)ccc2C3=O	ZINC000000015980	O=C2CC=C(n1ccccc1=O)c3ccccc23
Nc2ncnc3[nH]c(SCCN1CCCCC1)nc23	ZINC000000280705	C3CCN(CCSc2nc1cncnc1[nH]2)CC3
CCOc1cc(/C=C/N(=O)=O)ccc1OCc2cccc3ccccc23	ZINC000000475175	C(Oc1ccccc1)c2cccc3ccccc23
CC1(C)C[C@@H](CC(O)=O)C(=O)O1	ZINC000000178389	O=C1CCCO1
NC3=C(c2nc1ccccc1c(=O)[nH]2)C(=O)CN3Cc4ccccc4	ZINC000000055939	O=C2CN(Cc1ccccc1)C=C2c4nc3ccccc3c(=O)[nH]4
COc3ccc(C(=O)OC1C[C@@H]2CC[C@H](C1)N2)cc3OC	ZINC000000086170	O=C(OC1CC2CCC(C1)N2)c3ccccc3
CC1(C)OC(=O)N(CC=C)[C@@]1(C)O	ZINC000000067705	O=C1NCCO1
CCN(CC)CCNc2ncnc3sc1COC(C)(C)Cc1c23	ZINC000000550138	C1Cc2c(CO1)sc3ncncc23
C[C@@H]1C(=O)N(C)c2ccc(C(C)=O)cc12	ZINC000000126421	O=C2Cc1ccccc1N2
C[C@@H](CN1CCCCC1)OC(=O)COc2ccc(Cl)cc2	ZINC000000249792	O=C(COc1ccccc1)OCCN2CCCCC2
COC(=O)CCc2[nH]c1c(C)cccc1c2Sc3ccc(C)cc3	ZINC000000036653	S(c1ccccc1)c2c[nH]c3ccccc23
CCOc4ccc3[nH]c(=O)c([C@H](N1CCC(C)CC1)c2nnnn2C(C)(C)C)cc3c4	ZINC000000782697	O=c2[nH]c1ccccc1cc2C(N3CCCCC3)c4nnn[nH]4
Nc2ccc(S(=O)(=O)Nc1ccc(Cl)nn1)cc2	ZINC000000049140	O=S(=O)(Nc1cccnn1)c2ccccc2
CCOC(=O)Cc1csc2=NCCn12	ZINC000000091663	C2Cn1ccsc1=N2
Cn2c(c1ccccn1)[n+](C)c3ccccc23	ZINC000000279151	c3ccc(c2nc1ccccc1[nH]2)nc3
CN(C)[C@@H]1CCC[C@@H]1OC(=O)C(O)(c2ccccc2)c3ccccc3	ZINC000000536434	O=C(OC1CCCC1)C(c2ccccc2)c3ccccc3
O[C@@H](CCCN2CCN(c1ncc(F)cn1)CC2)c3ccc(F)cc3	ZINC000000013635	C(CCc1ccccc1)CN3CCN(c2ncccn2)CC3
CN(C)[C@H]3CCCN(C(=O)c1cn(C)c2ccccc12)C3	ZINC000000013634	O=C(N1CCCCC1)c2c[nH]c3ccccc23
O=C(CN1CCNCC1)NC3CCN(C2CC2)CC3	ZINC000037631864	O=C(CN1CCNCC1)NC3CCN(C2CC2)CC3
CCCc2ccc(OC(=O)COc1cc(Cl)ccc1Cl)cc2	ZINC000000148523	O=C(COc1ccccc1)Oc2ccccc2
O=C(Nc2ccc(CN1CCCC1)cc2)c3ccccc3N(=O)=O	ZINC000000514855	O=C(Nc2ccc(CN1CCCC1)cc2)c3ccccc3
NC(=N)c4ccc3oc(CCc2cc1ccc(C(N)=N)cc1[nH]2)cc3c4	ZINC000000009107	C(Cc2cc1ccccc1o2)c4cc3ccccc3[nH]4
CN4CCC(O)(c3nc(c1ccc(F)cc1)c(c2ccncc2)o3)CC4	ZINC000000602685	C4CC(c3nc(c1ccccc1)c(c2ccncc2)o3)CCN4
CCOc1cccc(CNCCCNC)c1OCc2ccccc2	ZINC000008325503	C(Oc1ccccc1)c2ccccc2
C[N+]2(CCCCCC[N+]1(C)CCCCCC1)CCCCCC2	ZINC000004747928	C2CCCN(CCCCCCN1CCCCCC1)CC2
CN3CCN(c2ccc(CNC(=O)c1ccco1)cc2)CC3	ZINC000000130994	O=C(NCc2ccc(N1CCNCC1)cc2)c3ccco3
CC(C)C(=O)Nc1cc(Cl)ccc1Cl	ZINC000000029782	c1ccccc1
C[C@H](C(=O)NC1CC1)S(=O)(=O)c2ccc(Cl)cc2Cl	ZINC000000005213	O=C(CS(=O)(=O)c1ccccc1)NC2CC2
On4c3C[C@@H](c1cccc(C(F)(F)F)c1)C/C(=N\CCCCCN2CCCC2)c3c(=O)c5cc(Cl)ccc45	ZINC000027084502	O=c4c3C(=NCCCCCN1CCCC1)CC(c2ccccc2)Cc3[nH]c5ccccc45
CCOC(=O)N2CCN(C1CCN(CC)CC1)CC2	ZINC000000280529	C2CC(N1CCNCC1)CCN2
Cc2n(C)c1ccccc1[n+]2CCOCC[n+]3c(C)n(C)c4ccccc34	ZINC000003129839	C(C[n+]1c[nH]c2ccccc12)OCC[n+]3c[nH]c4ccccc34
Clc2cccc(C1=CCCNC1)c2	ZINC000000019097	C2CC=C(c1ccccc1)CN2
CCc3cc1cc(OC)c(OC)cc1c(Cc2ccccc2)n3	ZINC000000001754	C(c1ccccc1)c2nccc3ccccc23
CC(C)CNCC(=O)Nc2ccc(c1ccc(NC(=O)CNCC(C)C)cc1)cc2	ZINC000004792051	c2ccc(c1ccccc1)cc2
CN[C@@H](C)COc1ccc(O)cc1	ZINC000000394243	c1ccccc1
CC(=O)Nc1nonc1n2c(C)ccc2C	ZINC000000054533	c2ccn(c1cnon1)c2
CC[n+]1ccccc1Br	ZINC000000399124	c1ccncc1
Cc3ccc(N2CSC(=S)N(c1ccc(C)cc1C)C2)c(C)c3	ZINC000000085690	S=C2SCN(c1ccccc1)CN2c3ccccc3
CCn2cc1c(O)cccc1[o+]2	ZINC000000399123	c2ccc1[o+][nH]cc1c2
Fc3ccc(c2n/c(=C/c1ccccc1Br)c(=O)o2)cc3	ZINC000000055338	O=c2oc(c1ccccc1)nc2=Cc3ccccc3
OC(=O)Cc3ccc(NC(=O)c2cc1ccccc1oc2=O)cc3	ZINC000000054534	O=C(Nc1ccccc1)c3cc2ccccc2oc3=O
O=C2NC(=O)C1(CCCCCC1)N2	ZINC000000039914	O=C2NC(=O)C1(CCCCCC1)N2
O=C3NC(=O)[C@]2(CCc1ccccc1C2)N3	ZINC000000000754	O=C3NC(=O)C2(CCc1ccccc1C2)N3
O=C(O[C@@H]1CN2CCC1CC2)N4CCc3ccccc3[C@H]4c5ccccc5	ZINC000000602034	O=C(OC1CN2CCC1CC2)N4CCc3ccccc3C4c5ccccc5
CC[C@@H](C)[C@@H](N)CN	ZINC000035676916	nonring
CC(C)CCn1nnnc1[C@@H](C(C)C)N2CCC(C(N)=O)CC2	ZINC000000416788	C2CCN(Cc1nnn[nH]1)CC2
COc3cc2CC[N@@]1C[C@@H](CC(C)C)C(=O)C[C@@H]1c2cc3OC	ZINC000000000751	O=C3CCN2CCc1ccccc1C2C3
COc1ccc(N(=O)=O)cc1NC(=O)COc2cccc(C)c2	ZINC000000038889	O=C(COc1ccccc1)Nc2ccccc2
CCCN(CCCCCC[N@@](CCC)[C@@H]2CCc1[nH]ccc1C2)CCc3ccc(S(C)(=O)=O)cc3	ZINC000027651979	C(CCCNC2CCc1[nH]ccc1C2)CCNCCc3ccccc3
C3CCC([N@]1CCC=CC1)(c2cccs2)CC3	ZINC000000004184	C3CCC(N1CCC=CC1)(c2cccs2)CC3
Fc2ccc(n1n[o+]c(=O)[nH]1)cc2	ZINC000000051138	O=c2[nH]n(c1ccccc1)n[o+]2
CC[N+]2(CC)C[C@@H](C)O[C@@](O)(c1ccc(Cl)cc1)C2	ZINC000000162673	C2COC(c1ccccc1)CN2
Clc1ccccc1c3c[n+]2ccccc2s3	ZINC000000162671	c3ccc(c2c[n+]1ccccc1s2)cc3
C[N+]4(C[C@@H](C[C@H](C[N+]1(C)CCCCCC1)C(=O)c2ccccc2)C(=O)c3ccccc3)CCCCCC4	ZINC000008925981	O=C(C(CC(CN1CCCCCC1)C(=O)c2ccccc2)CN3CCCCCC3)c4ccccc4
CN(C)C(=O)CSc2nnc([C@@H](N)Cc1ccccc1)o2	ZINC000000531941	C(Cc1nnco1)c2ccccc2
COC(=O)c2ccc(C[N+](C)(C)CN1CCCC1=O)cc2	ZINC000000180381	O=C1CCCN1CNCc2ccccc2
Cc2cc(C)c1c(=O)cc(C(F)(F)F)oc1c2	ZINC000000090030	O=c1ccoc2ccccc12
CCn2c(c1ccc(Cl)cc1)n[nH]c2=O	ZINC000000004188	O=c2[nH]nc(c1ccccc1)[nH]2
COC(=O)c1ccccc1NC(=O)Cc2ccc(Br)cc2	ZINC000000030767	O=C(Cc1ccccc1)Nc2ccccc2
Nc1ccncc1C=O	ZINC000001495001	c1ccncc1
CC(C)C[N@](CC2CCN(Cc1ccccc1F)CC2)C[C@@H]3CCCO3	ZINC000011842448	C3COC(CNCC2CCN(Cc1ccccc1)CC2)C3
C[N+](C)(C)CCOn2c(=O)c1ccccc1c2=O	ZINC000000406271	O=c1[nH]c(=O)c2ccccc12
Fc3cc2[C@H]1CNC[C@H](C1)c2cc3F	ZINC000000024032	C1NCC2CC1c3ccccc23
CC[n+]3cccc(c2nc1ccccc1o2)c3	ZINC000000226183	c3cncc(c2nc1ccccc1o2)c3
CC2CCN(CCC(=O)Nc1ccc(F)cc1)CC2	ZINC000000176619	O=C(CCN1CCCCC1)Nc2ccccc2
C4CCC(N3CCC(C[N@@](CCCn1cccn1)C[C@@H]2CCCO2)CC3)C4	ZINC000012467321	C4CCC(N3CCC(CN(CCCn1cccn1)CC2CCCO2)CC3)C4
CCOC(=O)c2c(C)n(C1CC1)c(C)c2CN	ZINC000000161946	C1CC1n2cccc2
CC[C@H](C)NC(=N)c4cccc(OCc3ccc2cc(COc1cccc(C(=N)N[C@@H](C)CC)c1)ccc2c3)c4	ZINC000139877874	C(Oc1ccccc1)c4ccc3cc(COc2ccccc2)ccc3c4
CCOc2cc(=O)c1ccccc1c2=O	ZINC000000021240	O=c1ccc(=O)c2ccccc12
COc4cc(c1n[nH]cc1CN3CCC([C@@H](C)N2CCOCC2)CC3)cc(OC)c4OC	ZINC000012447451	C4CN(CC3CCN(Cc1c[nH]nc1c2ccccc2)CC3)CCO4
NC5CCN(C4CN(CC[C@]3(c1ccc(Cl)c(Cl)c1)CCC(=O)N(CC2CCC(F)(F)CC2)C3)C4)CC5	ZINC000028361151	O=C4CCC(CCN2CC(N1CCCCC1)C2)(c3ccccc3)CN4CC5CCCCC5
CN5CCC(c3c(O)cc(O)c4c(=O)c(=C/c2ccc(N1CCN(C)CC1)cc2)/oc34)CC5	ZINC000013473133	O=c4c(=Cc2ccc(N1CCNCC1)cc2)oc5c(C3CCNCC3)cccc45
CN(C)CCO[C@H](c1cccs1)c2ccnn2C	ZINC000000007743	C(c1ccn[nH]1)c2cccs2
O=C(c1cccs1)c3cn(CCOc2ccccc2)c4ccccc34	ZINC000000578851	O=C(c1cccs1)c3cn(CCOc2ccccc2)c4ccccc34
CCN4CCN(C3CCN(Cc2cc1ccc(Cl)cc1n(CC(=O)OC)c2=O)CC3)CC4	ZINC000023362241	O=c2[nH]c1ccccc1cc2CN4CCC(N3CCNCC3)CC4
NCCCc1cn[nH]c1	ZINC000006091384	c1cn[nH]c1
CNCc1cccs1	ZINC000000064945	c1ccsc1
NC(=N)SCc1cccc(Cl)c1	ZINC000000096804	c1ccccc1
CNCc2cc1ccccc1s2	ZINC000000064947	c2ccc1sccc1c2
Clc3ccc(Oc1ccccc1C2=NCCN2)cc3	ZINC000000007981	C3CN=C(c1ccccc1Oc2ccccc2)N3
CN(C)c3cc[n+](Cn2c(=O)c1ccccc1c2=O)cc3	ZINC000000480195	O=c2n(C[n+]1ccccc1)c(=O)c3ccccc23
Cc1cnc(C(N)=N)cn1	ZINC000002528756	c1cnccn1
Cc1nccn1CC5(O)CCN(Cc3c(C)n(CC(=O)N2CCCC2)c4ccccc34)CC5	ZINC000019581875	O=C(Cn3cc(CN2CCC(Cn1ccnc1)CC2)c4ccccc34)N5CCCC5
NC(=S)N1CCNCC1	ZINC000002528758	C1CNCCN1
C[N+](C)(C)CCSC(=O)CCCCCCC(=O)SCC[N+](C)(C)C	ZINC000004813935	nonring
O=Cc2cccc3c1ccccc1sc23	ZINC000000064949	c1ccc3c(c1)sc2ccccc23
Oc2cccc(c1cn[nH]n1)c2	ZINC000000009120	c2ccc(c1cn[nH]n1)cc2
O=N(=O)c2cccc(n1cccc1)c2	ZINC000000037525	c2ccc(n1cccc1)cc2
N[C@@H]1CCSc2ccccc12	ZINC000000243007	C2CSc1ccccc1C2
C4CN=C(NC[C@@H]2c1ccccc1CSc3ccccc23)N4	ZINC000000346608	C4CN=C(NCC2c1ccccc1CSc3ccccc23)N4
CCOC(=O)C1=C(CCl)OC(N)=C(C#N)[C@H]1c2ccccc2C	ZINC000000058557	O2C=CC(c1ccccc1)C=C2
CN2CCN(c1nccs1)CC2	ZINC000000022036	C2CN(c1nccs1)CCN2
Cc3ccc2n(C[C@@H](O)CNC(C)(C)C)c1CCCCc1c2c3	ZINC000000571478	C1CCc2c(C1)[nH]c3ccccc23
CCC(=O)N[C@@H]1C[C@@H]3[C@@H](OC1=O)c2cccc(C)c2NC3=O	ZINC000000031960	O=C1CCC3C(O1)c2ccccc2NC3=O
CN2CCC(NCC1CCCCC1)CC2	ZINC000000221160	C2CCC(CNC1CCNCC1)CC2
O=C(CC1CCCC1)N(C[C@@H]2CCCCN2)Cc6ccc(c5ccc(CNC4Cc3ccccc3C4)cc5)cc6	ZINC000045194385	O=C(CC1CCCC1)N(CC2CCCCN2)Cc6ccc(c5ccc(CNC4Cc3ccccc3C4)cc5)cc6
Cn2c(SCCN1CCCCC1)nnc2C5CCN(Cc4cc3ccccc3s4)CC5	ZINC000011997115	C5CCN(CCSc4nnc(C3CCN(Cc2cc1ccccc1s2)CC3)[nH]4)CC5
C[C@@H]1CC[N@](C(C)(C)C)CC1=O	ZINC000000062087	O=C1CCCNC1
CN(C)c1cccc(CN)c1	ZINC000000153938	c1ccccc1
Fc3ccc(N2C(=O)C[C@H](N1CCSCC1)C2=O)cc3	ZINC000000063621	O=C2CC(N1CCSCC1)C(=O)N2c3ccccc3
COc4ccc([N+]2=C1CCCCN1C[C@@]2(O)c3ccc(F)cc3)cc4	ZINC000000392165	C4CCC3=[N+](c1ccccc1)C(c2ccccc2)CN3C4
Brc1ccccc1NC(=O)C2SCSCS2	ZINC000000114509	O=C(Nc1ccccc1)C2SCSCS2
C[C@@H]1CC(O)(C#C)C[C@@H](C)N1C	ZINC000000368497	C1CCNCC1
CCc3nc(C)c(C[N@@](C)CC2CCN(CCc1ccccc1OC)CC2)[nH]3	ZINC000012199083	C2CN(CCc1ccccc1)CCC2CNCc3cnc[nH]3
CC[C@H](N)[C@H](O)C(C)C	ZINC000001759079	nonring
CCC[C@@H](O)[C@@H](N)CC	ZINC000001759078	nonring
O=Cc1cccc(C=O)c1	ZINC000000005774	c1ccccc1
NC[C@@H]1CCCC[C@@H]1O	ZINC000002516847	C1CCCCC1
c4ccc(c2nc1ccccc1n3cncc23)cc4	ZINC000000007564	c4ccc(c2nc1ccccc1n3cncc23)cc4
CC[N@]1CCC[C@@H]1CNS(=O)(=O)c2cc(Cl)c(N)cc2OC	ZINC000000000430	O=S(=O)(NCC1CCCN1)c2ccccc2
CC(C)Nc1cccnc1N4CCN(C(=O)c3cc2ccccc2[nH]3)CC4	ZINC000000587534	O=C(N2CCN(c1ccccn1)CC2)c4cc3ccccc3[nH]4
CC[C@H](O)C(C)(C)N	ZINC000001759074	nonring
CN(C)CCO[C@@](C)(c1ccccc1)c2ccccn2	ZINC000000000242	C(c1ccccc1)c2ccccn2
CC(C)NC[C@@H](O)CC(c1ccccc1)c2ccccc2	ZINC000000000243	C(c1ccccc1)c2ccccc2
Cc2cc(\C=C\c1ccccc1OC[C@H](O)CNC(C)(C)C)on2	ZINC000000000406	C(=Cc1ccno1)c2ccccc2
CC2(C)[C@H](c1cc(Br)ccc1O)OC(=O)C(C)(C)C2=O	ZINC000000092767	O=C2CC(c1ccccc1)OC(=O)C2
CC(C)c3ccc(S(=O)(=O)N(CCN1CCCC1)CCC(=O)N2CCNCC2)cc3	ZINC000045944079	O=C(CCN(CCN1CCCC1)S(=O)(=O)c2ccccc2)N3CCNCC3
Cc4ccc([C@H](N1CCCCCC1)c2nnnn2C3CCCCC3)cc4	ZINC000000883935	C4CCC(n1nnnc1C(N2CCCCCC2)c3ccccc3)CC4
CC(C)(c1ccccc1)c6cc(CN3CCN(c2ccccc2)CC3)c(O)c(CN5CCN(c4ccccc4)CC5)c6	ZINC000006076882	C2CN(c1ccccc1)CCN2Cc6cc(CN4CCN(c3ccccc3)CC4)cc(Cc5ccccc5)c6
C[N@](C1CCCCC1)[C@@H](c2ccc(C)cc2)c3nnnn3C4CCCC4	ZINC000000883939	C4CCC(NC(c1ccccc1)c2nnnn2C3CCCC3)CC4
Cc2cccc(NC(=O)CSc1nc(N)cc(N)n1)c2	ZINC000000077124	O=C(CSc1ncccn1)Nc2ccccc2
CNC[C@@H](O)COc5ccc4[nH]cc(CCNC(c1ccccc1)(c2ccccc2)c3ccccc3)c4c5	ZINC000004013240	C(Cc1c[nH]c2ccccc12)NC(c3ccccc3)(c4ccccc4)c5ccccc5
CCCCc3ncc(C[N@@](CCOC)CC2CCN(Cc1ccccc1F)CC2)[nH]3	ZINC000011935745	C2CN(Cc1ccccc1)CCC2CNCc3cnc[nH]3
COc3ccc(C(=O)Nc2ccc(N1CCN(C)CC1)cc2)cc3S(=O)(=O)NCCN(C)C	ZINC000009464740	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
CCCc2nn(c1ccc(F)cc1)c(=O)c2=CNCC3CCNCC3	ZINC000000054352	O=c2n(c1ccccc1)ncc2=CNCC3CCNCC3
Oc3cccc(Nc2ccc(Nc1cccc(O)c1)nn2)c3	ZINC000000009278	N(c1ccccc1)c3ccc(Nc2ccccc2)nn3
COc1ccc(Cl)cc1c3nc(N)nc(NN2CCCCC2)n3	ZINC000000407473	C3CCN(Nc2ncnc(c1ccccc1)n2)CC3
C[C@@H](Sc2nnc(c1ccccc1)n2C)C(=O)NC(c3ccccc3)c4ccccc4	ZINC000000624727	O=C(CSc2nnc(c1ccccc1)[nH]2)NC(c3ccccc3)c4ccccc4
CCn2c[n+](C[C@@H](O)COC1CCCCC1)c3cc(C)c(C)cc23	ZINC000000089056	C3CCC(OCCC[n+]1c[nH]c2ccccc12)CC3
CN[C@@H](C)C(=O)NO	ZINC000034596161	nonring
COc2cc(CNCCc1ncccc1C)ccc2OC[C@@H](O)C[N@@](C)C(C)C	ZINC000011821071	C(Cc1ccccn1)NCc2ccccc2
CCCN4CCC(N3CCC(C(=O)Nc2cccc(c1cccc(F)c1)c2)CC3)CC4	ZINC000019299827	O=C(Nc2cccc(c1ccccc1)c2)C4CCN(C3CCNCC3)CC4
Cc5cc(C)cc(c3[nH]c2ccc(OC(=O)N1CCNCC1)cc2c3CCNCCCCc4ccc(O)cc4)c5	ZINC000003952711	O=C(Oc4ccc3[nH]c(c1ccccc1)c(CCNCCCCc2ccccc2)c3c4)N5CCNCC5
C[C@@H](c1noc2ccc(Cl)cc12)n3ccnc3	ZINC000000015778	C(c1noc2ccccc12)n3ccnc3
COc2cc(Br)cc(CNc1cc(C)ccn1)c2O	ZINC000000135852	C(Nc1ccccn1)c2ccccc2
CCOc2ccc([C@@H](CC(O)=O)NC(=O)c1ccco1)cc2OC	ZINC000000099999	O=C(NCc1ccccc1)c2ccco2
Oc2ccc(C(=S)N1CCOCC1)cc2O	ZINC000000039177	S=C(N1CCOCC1)c2ccccc2
COc5ccc([C@@]1(O)CN3C(=[N+]1Cc2ccccc2)CCc4ccccc34)cc5	ZINC000000632971	C4Cc1ccccc1N5CC(c2ccccc2)[N+](Cc3ccccc3)=C45
CC[C@@H]([C@@H](CC)c1ccc(CN(C)C)c(O)c1)c2ccc(CN(C)C)c(O)c2	ZINC000001607577	C(Cc1ccccc1)c2ccccc2
CC(=O)c2sc1nc(=O)c(C)nn1c2C	ZINC000000053966	O=c2cnn1ccsc1n2
Cc1ccccc1NS(=O)(=O)c2ccccc2C#N	ZINC000000074795	O=S(=O)(Nc1ccccc1)c2ccccc2
Cc1nccn1CCC(C(N)=O)(c2ccccc2)c3ccccc3	ZINC000000007368	C(Cn1ccnc1)C(c2ccccc2)c3ccccc3
CCCn3ncc(C[N@@](C)CC2CCN(CCc1ccc(Cl)cc1)CC2)c3C	ZINC000012386657	C2CN(CCc1ccccc1)CCC2CNCc3cn[nH]c3
C[C@@H](O)CN1CCCC1	ZINC000000394010	C1CCNC1
C3CN=C(NN=C1CCc2ccccc12)N3	ZINC000000145576	C3CN=C(NN=C1CCc2ccccc12)N3
COc2ccc(CCNc1cc(C)nc(N)n1)cc2OC	ZINC000000073362	C(Cc1ccccc1)Nc2ccncn2
O=C(N1N=CC[C@H]1c2ccco2)c3cccnc3	ZINC000000025098	O=C(N1N=CCC1c2ccco2)c3cccnc3
CC(N)(CO)CO	ZINC000000967755	nonring
CN3CCN(c2cc(CNC(=O)NCCN1CCOCC1)ccn2)CC3	ZINC000047617824	O=C(NCCN1CCOCC1)NCc3ccnc(N2CCNCC2)c3
COc3ccc(OC[C@@H](O)Cn1c(C)nc2ccccc12)cc3	ZINC000000243065	C(COc1ccccc1)Cn2cnc3ccccc23
CCCN(CCC)CC(=O)OC	ZINC000020360945	nonring
Nc2ncnc3[nH]c(SCc1ccccc1Cl)nc23	ZINC000000034127	C(Sc2nc1cncnc1[nH]2)c3ccccc3
C[C@@H]2CC[C@@H](NC1CCC(O)CC1)C2	ZINC000000214786	C2CCC(NC1CCCC1)CC2
CN(C)CCCOc2ccc(OCCCN(C)C)c3c(=O)c1ccccc1c(=O)c23	ZINC000004783344	O=c2c1ccccc1c(=O)c3ccccc23
C[C@@H](CN(C)C)Oc2ccc(O[C@@H](C)CN(C)C)c3c(=O)c1ccccc1c(=O)c23	ZINC000004783347	O=c2c1ccccc1c(=O)c3ccccc23
CC[N+](C)(CC)CCOc2ccc(OCC[N+](C)(CC)CC)c3c(=O)c1ccccc1c(=O)c23	ZINC000004783346	O=c2c1ccccc1c(=O)c3ccccc23
C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)NC2CC(C)(C)NC(C)(C)C2	ZINC000000798385	O=C(COc1ccccc1)NC2CCNCC2
CCOC(=O)c2ccc(n1[nH]c(=O)cc1O)cc2	ZINC000000055452	O=c2ccn(c1ccccc1)[nH]2
CC(C)CCNC(=O)C2CCN(CCCc1ccccc1)CC2	ZINC000000299518	C2CCN(CCCc1ccccc1)CC2
CCNC(C)C	ZINC000001648991	nonring
Cc2ccc(OC[C@@H](O)CNCc1ccco1)cc2C	ZINC000000066433	C(CNCc1ccco1)COc2ccccc2
CCN(CC)CC(=O)NC2(Cc1ccc(O)cc1)CCCCC2	ZINC000000054513	C2CCC(Cc1ccccc1)CC2
CC2[N+](=O)[C@@H](c1ccccc1C(F)(F)F)N(O)C2(C)C	ZINC000000195005	O=[N+]1CCNC1c2ccccc2
OCC#CC[N+]3(CC#Cc2ccc(C#CC[N+]1(CC#CCO)CCCCC1)cc2)CCCCC3	ZINC000020806937	C3CCN(CC#Cc2ccc(C#CCN1CCCCC1)cc2)CC3
NCC(=O)NC1CCCCC1	ZINC000001653016	C1CCCCC1
C1CN3CC\4CN1CC(c2ccccc2)(C3)C/4=N/N=C6\C5CN8CC[N@@](C5)CC6(c7ccccc7)C8	ZINC000022942262	C1CN3CC4CN1CC(c2ccccc2)(C3)C4=NN=C6C5CN8CCN(C5)CC6(c7ccccc7)C8
O=C(NCCN1CCCC1)C3c2ccccc2Oc4ccccc34	ZINC000000099861	O=C(NCCN1CCCC1)C3c2ccccc2Oc4ccccc34
CN(C)CCCN(CCCN(C)C)Cc1ccccc1	ZINC000001719690	c1ccccc1
COc2cccc(C(=O)Nc1sc(C)c(C)c1C#N)c2	ZINC000000035591	O=C(Nc1cccs1)c2ccccc2
O=C(NCC[n+]2ccc1ccccc1c2)c3ccccc3	ZINC000000028223	O=C(NCC[n+]2ccc1ccccc1c2)c3ccccc3
CCN3CCN(c1nc(C)nc2n(C)c(=S)sc12)CC3	ZINC000000118187	S=c3[nH]c2ncnc(N1CCNCC1)c2s3
Cc3cc(C)c2oc(c1ccc(N)cc1)nc2c3	ZINC000000031293	c3ccc(c2nc1ccccc1o2)cc3
Fc5ccc([C@@H](NCC2CCN(Cc1ccc(Cl)cc1)CC2)c4nnc(c3ccccc3)o4)cc5	ZINC000009645513	C2CN(Cc1ccccc1)CCC2CNC(c3ccccc3)c5nnc(c4ccccc4)o5
COc3ccc([C@@H]1NC(=N)NC(=N)N1c2ccc(C)cc2)cc3	ZINC000000146420	N=C3NC(c1ccccc1)N(c2ccccc2)C(=N)N3
COC(=O)c1ccc(=O)n(CCN(C)C)c1	ZINC000000487069	O=c1cccc[nH]1
CCCn1c(N)nc2ccccc12	ZINC000000305709	c2ccc1[nH]cnc1c2
CCOC(=O)c2c(NC(=O)CN(C)C1CCN(C)CC1)sc3c2CC(C)(C)NC3(C)C	ZINC000002633093	O=C(CNC1CCNCC1)Nc3cc2CCNCc2s3
Cc2ccc(S(=O)(=O)Nc1nc(C)cc(C)n1)cc2	ZINC000000030981	O=S(=O)(Nc1ncccn1)c2ccccc2
C[N+](C)(C)C1COCOC1	ZINC000001702173	C1COCOC1
C[C@@H]3CCCN(C(=O)C2CCN(Cc1ccccc1O)CC2)C3	ZINC000000317591	O=C(C2CCN(Cc1ccccc1)CC2)N3CCCCC3
C2CN=C(C1=NCCN1)N2	ZINC000000349622	C2CN=C(C1=NCCN1)N2
CCOC(=O)c1c(C)csc1NS(=O)(=O)c2ccc(C)cc2	ZINC000000080336	O=S(=O)(Nc1cccs1)c2ccccc2
C[n+]2ccc(/C=C/c1ccccc1O)c3ccccc23	ZINC000000206143	C(=Cc1ccnc2ccccc12)c3ccccc3
O[C@H](COc1ccccc1N(=O)=O)Cn2cnc3ccccc23	ZINC000000036212	C(COc1ccccc1)Cn2cnc3ccccc23
COc1ccccc1OCCN	ZINC000002025135	c1ccccc1
CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CC(=O)NCCc1c[n+](CCCNC(N)=N)cn1C	ZINC000014715155	c1c[nH]cn1
CCN(CC)CCC[C@@H](C)Nc2cc(/C=C/c1ccc(N(=O)=O)cc1)nc3cc(OC)ccc23	ZINC000004424495	C(=Cc2ccc1ccccc1n2)c3ccccc3
COc2cc(C[N@@](C)CC1CCOCC1)ccc2OC[C@@H](O)CN3CCSCC3	ZINC000012429528	C(COc2ccc(CNCC1CCOCC1)cc2)CN3CCSCC3
CC(=O)c3c(C)nn4c1ccccc1n(CCN2CCCCC2)c34	ZINC000000268640	C4CCN(CCn2c1ccccc1n3nccc23)CC4
CCN3CCC(N2CCN(c1ccc(Cl)cc1)CC2)CC3	ZINC000000181982	C3CC(N2CCN(c1ccccc1)CC2)CCN3
O[C@@]([C@@H]1CN2CCC1CC2)(c3ccccc3)c4cccs4	ZINC000000204014	C1CN4CCC1C(C(c2ccccc2)c3cccs3)C4
CN(C)CCOc5cccc(CN[C@H]1C[C@@H]4N(C1)C(=O)[C@H](Cc2c[nH]c3ccccc23)NC4=O)c5	ZINC000014744740	O=C5NC(Cc1c[nH]c2ccccc12)C(=O)N4CC(NCc3ccccc3)CC45
CC1(C)NCC[C@@]14C(=O)N(Cc2ccccc2)c3ccccc34	ZINC000000103654	O=C3N(Cc1ccccc1)c2ccccc2C34CCNC4
FC(F)(F)Cc2nc1ccccc1s2	ZINC000000101509	c2ccc1scnc1c2
O=N(=O)c3cccc(c2nc1ccccc1c(=O)o2)c3	ZINC000000031562	O=c2oc(c1ccccc1)nc3ccccc23
O[C@H](CNC1CC1)Cn3c2ccccc2c4ccccc34	ZINC000000129528	C(CNC1CC1)Cn3c2ccccc2c4ccccc34
CC(C)[C@@](CCCN1CCCC1)(C#N)c2ccccc2Cl	ZINC000000408082	C2CCN(CCCCc1ccccc1)C2
CCNC(=O)c1c(C)onc1c2ccccc2Cl	ZINC000000029869	c2ccc(c1ccon1)cc2
CCN(CC)CCC/N=C(/N=c1\ccn(CCCN(CC)CC)c2cc(Cl)ccc12)c3cccnc3	ZINC000299856620	N=C(N=c1cc[nH]c2ccccc12)c3cccnc3
CN3CCN(c2nc1ccc(N(=O)=O)cc1s2)CC3	ZINC000000066588	C3CN(c2nc1ccccc1s2)CCN3
C[C@@H](NC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c4ccc(N3CCN(Cc2ccccc2)CC3)cc4)c5ccccc5	ZINC000095586130	O=C(NC(CCNCc1ccccc1)Cc2ccccc2)c5ccc(N4CCN(Cc3ccccc3)CC4)cc5
CN(C)CCNc2cnn(c1ccccc1)c(=O)c2Cl	ZINC000000118611	O=c1cccnn1c2ccccc2
CN(C)c1ccc(\C=N\NC(=S)NC(C)(C)C)cc1	ZINC000000072416	c1ccccc1
CCOC(=O)c2c(C)n(C)c3ccc(O)c(CN1CCCCC1)c23	ZINC000000547292	C3CCN(Cc1cccc2[nH]ccc12)CC3
CNCCN1CCCCC1	ZINC000019685464	C1CCNCC1
CCNCCN(C)C	ZINC000019367503	nonring
CN(C)CCN(C)C(=O)c5cc(Oc1ccc(Cl)cc1)c4n(C[C@@H]2CCNC[C@H]2F)c3ccccc3c4c5	ZINC000028889950	C5CC(Cn3c1ccccc1c4cccc(Oc2ccccc2)c34)CCN5
C[C@H]2C[C@](O)(c1ccc(C)cc1)[C@@H](C)C[N@]2C	ZINC000000051420	C2CC(c1ccccc1)CCN2
COCCN(CC2CCN(Cc1ccccc1F)CC2)C(=O)CC3CCN(C(C)C)CC3	ZINC000011842752	O=C(CC1CCNCC1)NCC3CCN(Cc2ccccc2)CC3
O[C@@H](COc2ccc1CCCc1c2)C[N@]4CCc3ccccc3C4	ZINC000000236243	C(COc2ccc1CCCc1c2)CN4CCc3ccccc3C4
O=C(NC[C@H]1C[C@@H]2CCN1C[C@@H]2CN4CCN(c3ccccc3)CC4)Nc5ccccc5	ZINC000008636246	O=C(NCC1CC2CCN1CC2CN4CCN(c3ccccc3)CC4)Nc5ccccc5
COc3ccc(Cc1[n+](C)ccc2ccccc12)cc3Oc6ccc(Cc4[n+](C)ccc5ccccc45)cc6	ZINC000001766808	C(c4ccc(Oc3cccc(Cc1nccc2ccccc12)c3)cc4)c5nccc6ccccc56
CC(C)(C)c3cccc(c2nc1ccc(C(N)=N)cc1[nH]2)c3O	ZINC000000007706	c3ccc(c2nc1ccccc1[nH]2)cc3
O[C@@]3(c1ccccc1)CN2CCCCCC2=[N+]3c5ccc4OCCOc4c5	ZINC000000623445	C5CCN4CC(c1ccccc1)[N+](c3ccc2OCCOc2c3)=C4CC5
Nc3nc(c2ccc(N1CCOCC1)c(F)c2)cs3	ZINC000000053869	C3CN(c2ccc(c1cscn1)cc2)CCO3
CC(=C)[C@H]3CCC(CN2CCN(c1ccccn1)CC2)=CC3	ZINC000000278283	C3CCC(CN2CCN(c1ccccn1)CC2)=CC3
O=c3n(c1ccccc1)c(C[n+]2ccccc2)nc4ccccc34	ZINC000000175086	O=c3n(c1ccccc1)c(C[n+]2ccccc2)nc4ccccc34
COc4ccc(c3c[n+]2cn(Cc1ccccc1)c(C)c2c(=O)[nH]3)cc4	ZINC000000161368	O=c3[nH]c(c1ccccc1)c[n+]4cn(Cc2ccccc2)cc34
CNC3=NC(=O)[C@]2(CC(C)(C)Oc1ccc(F)cc12)N3	ZINC000000008526	O=C1N=CNC13CCOc2ccccc23
C[C@@H]2C[C@](O)(C#C)[C@@H]1CCCC[C@@H]1N2	ZINC000000202062	C2CCC1NCCCC1C2
CC[N@]3CC[C@](O)(c1ccc(F)cc1)[C@H](C(=O)c2ccc(F)cc2)C3	ZINC000000269650	O=C(C1CNCCC1c2ccccc2)c3ccccc3
CC(C)[C@@H](NC(=O)c2cc1ccccc1cc2O)C(O)=O	ZINC000000072528	c2ccc1ccccc1c2
CCN(CC)[N+](\O)=N\OC	ZINC000000015795	nonring
C[C@H]3CC(=C)C[C@H](c1ccccc1OC[C@@H](O)CN2CCCCC2)O3	ZINC000000348466	C=C3CCOC(c1ccccc1OCCCN2CCCCC2)C3
CNS(=O)(=O)c1cccnc1N2CCN(C(C)C)CC2	ZINC000000481382	C2CN(c1ccccn1)CCN2
CC(=O)N1CCc2c(C1)[nH]c3ccccc23	ZINC000000015799	C1Cc2c(CN1)[nH]c3ccccc23
CN(C)CCNC(=O)c1c(C)c(C)sc1NC(=O)c2ccccc2	ZINC000000293595	O=C(Nc1cccs1)c2ccccc2
C[C@](N)(CO)c1ccccc1	ZINC000001602057	c1ccccc1
CCOc3ccc(n2nc1cc(C)c(N)cc1n2)cc3	ZINC000000038189	c3ccc(n2nc1ccccc1n2)cc3
COc3ccc(CNc2nc1ccccc1[nH]2)c(OC)c3	ZINC000000117991	C(Nc2nc1ccccc1[nH]2)c3ccccc3
O=C2C[C@@H](C(=O)NCCN1CCCC1)CN2C3CCCCC3	ZINC000000220427	O=C2CC(C(=O)NCCN1CCCC1)CN2C3CCCCC3
CCN3CCN(c2ccc(/N=C/c1ccc(N(=O)=O)cc1)cc2)CC3	ZINC000000353102	C3CN(c2ccc(N=Cc1ccccc1)cc2)CCN3
C2CN(c1cccnn1)CCN2	ZINC000013470083	C2CN(c1cccnn1)CCN2
CN(C)c2ccc(\C=N\NC(=O)c1ccc(O)cc1)cc2	ZINC000000083917	O=C(NN=Cc1ccccc1)c2ccccc2
FC(F)(F)c2nnc(NC(=O)CSc1ccccc1)s2	ZINC000000033434	O=C(CSc1ccccc1)Nc2nncs2
CC(C)[C@H]([C@H](O)CCN1CCCCC1)c2ccccc2	ZINC000000000632	C2CCN(CCCCc1ccccc1)CC2
COC(=O)[C@@]1(C(O)=O)CC=C(C)C[C@@H]1c2ccc(F)cc2	ZINC000000038184	C2CC(c1ccccc1)CC=C2
COc2ccc(C=C1C(=O)OC(C)(C)OC1=O)cc2	ZINC000000041421	O=C1OCOC(=O)C1=Cc2ccccc2
C(=N\n1cnnc1)/c2c[nH]c3ccccc23	ZINC000000061066	C(=Nn1cnnc1)c2c[nH]c3ccccc23
NS(=O)(=O)c4ccc3N[C@H](c1ccc(F)cc1)[C@H]2CC=C[C@H]2c3c4	ZINC000000053178	C1C=CC3C1C(c2ccccc2)Nc4ccccc34
Clc4ccc(c3ccc(C=c2c(=O)c1ccccc1c2=O)o3)cc4	ZINC000000044893	O=c3c(=Cc2ccc(c1ccccc1)o2)c(=O)c4ccccc34
Brc3ccc(C(=O)Cn2nc(Cc1ccccc1)oc2=S)cc3	ZINC000000622869	O=C(Cn2nc(Cc1ccccc1)oc2=S)c3ccccc3
CCCC(=O)Nc2nnc(COc1ccc(C(C)(C)C)cc1)s2	ZINC000000052488	C(Oc1ccccc1)c2nncs2
Nc2cc(N)nc(SCC(=O)NC1CCCC1)n2	ZINC000000410873	O=C(CSc1ncccn1)NC2CCCC2
CC(C)CC[C@@H](CCNC1CCN(C)CC1)c2ccc(Cl)cc2	ZINC000006670460	C(CNC1CCNCC1)Cc2ccccc2
CCOC(=O)Cn3c1CCCc1c(=N)c2CCCc23	ZINC000000198621	N=c3c1CCCc1[nH]c2CCCc23
C[N+](C)(N)CCOC(=O)[C@](O)(C1CCCCC1)c2ccccc2	ZINC000002024179	C2CCC(Cc1ccccc1)CC2
Cc1n[nH]c(C)c1N(=O)=O	ZINC000000049624	c1cn[nH]c1
COc3cccc(\C=N\N=c1/c(=O)[nH]c2ccccc12)c3OC	ZINC000000032100	O=c2[nH]c1ccccc1c2=NN=Cc3ccccc3
CC(C)[N@]3C[C@@H](C)[C@](OC(=O)c1ccccc1)(c2ccccc2)C[C@@H]3C	ZINC000000705292	O=C(OC2(c1ccccc1)CCNCC2)c3ccccc3
CC[C@@]4(C3CCN(Cc2cc(CN1CCCCC1)cs2)CC3)NC(=O)N(CC(C)=C)C4=O	ZINC000012211982	O=C4NC(C3CCN(Cc2cc(CN1CCCCC1)cs2)CC3)C(=O)N4
CCOC(=O)N3CCC(NCc2cccc(OC[C@@H](O)CN1CCCCCC1)c2)CC3	ZINC000012004998	C3CCCN(CCCOc2cccc(CNC1CCNCC1)c2)CC3
COc2cccc(CN[C@H](C)CCc1ccc(O)cc1)c2OC	ZINC000000757580	C(CNCc1ccccc1)Cc2ccccc2
O=c5nc4[nH]c3ccc(N2CCN(c1ccccc1)CC2)cc3cc4[nH]5	ZINC000000002869	O=c5nc4[nH]c3ccc(N2CCN(c1ccccc1)CC2)cc3cc4[nH]5
C2C[N+]3(Cc1ccccc1)CCN2CC3	ZINC000000281397	C2C[N+]3(Cc1ccccc1)CCN2CC3
CCN3CCN(c2ccc(NC(=O)c1ccc(F)cc1)cc2)CC3	ZINC000000588156	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
CCOC(=O)c2cnc1c(C)cc(C)cc1c2NCCCN3CCOCC3	ZINC000005958498	C(CNc1ccnc2ccccc12)CN3CCOCC3
CCCN3CCC([N@]2CCC[C@@H](C(=O)N(C)Cc1ccccc1)C2)CC3	ZINC000004723245	O=C(NCc1ccccc1)C3CCCN(C2CCNCC2)C3
CCN(CC)C(=O)C2CCN(C[C@@H](C)c1ccccc1)CC2	ZINC000000299503	C2CCN(CCc1ccccc1)CC2
Cc2ccc(N[C@@H](C(O)=O)c1ccccc1)cc2	ZINC000000070549	C(Nc1ccccc1)c2ccccc2
CCCN5CCC(N1CCC4(CC1)N(CCc2ccccc2)C(=O)N(Cc3ccccn3)C4=O)CC5	ZINC000014540650	O=C4N(Cc1ccccn1)C(=O)C3(CCN(C2CCNCC2)CC3)N4CCc5ccccc5
COc2cccc(CNCC1CCNCC1)c2OCc3ccc(C)cc3	ZINC000010434747	C3CC(CNCc1ccccc1OCc2ccccc2)CCN3
CC(C)N3CCC(N2CCN(c1ccccc1)CC2)CC3	ZINC000000207683	C3CC(N2CCN(c1ccccc1)CC2)CCN3
C[C@@H](O)CNCc1ccc(C)s1	ZINC000000360078	c1ccsc1
Cc2c(c1ccccc1)[nH]c(=O)n2C4CCN(CCc3ccccc3)CC4	ZINC000000592274	O=c2[nH]c(c1ccccc1)cn2C4CCN(CCc3ccccc3)CC4
NCc1nccn1Cc2ccsc2	ZINC000000002910	C(c1ccsc1)n2ccnc2
CN2C(=O)C[C@H](NCCc1ccc(S(N)(=O)=O)cc1)C2=O	ZINC000000077515	O=C2CC(NCCc1ccccc1)C(=O)N2
OC2(Cc1ccccc1)CCNCC2	ZINC000000160306	C2CC(Cc1ccccc1)CCN2
C[C@@H]3CN(S(=O)(=O)c1cccc2cnccc12)CCN3	ZINC000000391115	O=S(=O)(N1CCNCC1)c2cccc3cnccc23
COc4cccc(C(=O)N3CCN(C[C@H]1C[C@H]2C[C@@H]1C=C2)CC3)c4OC	ZINC000000783063	O=C(N3CCN(CC1CC2CC1C=C2)CC3)c4ccccc4
COc3ccc(C[N@]2C[C@@H](CN1CCN(C)CC1)C[C@@H](C(=O)NCC(C)C)C2)cc3OC	ZINC000023354034	C3CC(CN1CCNCC1)CN(Cc2ccccc2)C3
Oc2ccc1c(C(F)(F)F)cc(=O)[nH]c1c2	ZINC000000057275	O=c2ccc1ccccc1[nH]2
O=c2c1ccccc1c(=O)c3cnccc23	ZINC000000120276	O=c2c1ccccc1c(=O)c3cnccc23
CC(C)[C@@H](O)CN4CCN(Cc3nc(C(=O)N2CCN(C1CCCC1)CC2)co3)CC4	ZINC000034677817	O=C(N2CCN(C1CCCC1)CC2)c4coc(CN3CCNCC3)n4
CC(=O)C(C)(c1ccc([N+](C)(C)C)cc1)c2ccc([N+](C)(C)C)cc2	ZINC000001656002	C(c1ccccc1)c2ccccc2
CCN(CC)CCCNC(=S)NCCCN(CC)CC	ZINC000005561558	nonring
CC[N+](CC)(CC)Cc1ccc(C[N+](CC)(CC)CC)cc1	ZINC000001607028	c1ccccc1
CC[n+]3cccc(c2nc1ccccc1s2)c3	ZINC000000237953	c3cncc(c2nc1ccccc1s2)c3
COc4ccc(C3=C[C@H](c1ccccc1)c2ccccc2O3)cc4OC	ZINC000000266398	O3C(c1ccccc1)=CC(c2ccccc2)c4ccccc34
CN(C)CC(=O)c1c[nH]c2ccccc12	ZINC000000117500	c2ccc1[nH]ccc1c2
COc2ccc([C@](O)(CC[N+](C)(C)C)C1CCCCC1)cc2	ZINC000000492685	C2CCC(Cc1ccccc1)CC2
CCCN4CCC(N[C@H]1CCCc2c1[nH]c3ccc(N(=O)=O)cc23)CC4	ZINC000005032136	C4CC(NC1CCNCC1)c3[nH]c2ccccc2c3C4
Fc2ccc(S(=O)(=O)Nc1cccc(N(=O)=O)c1)cc2	ZINC000000102476	O=S(=O)(Nc1ccccc1)c2ccccc2
CCN(CC)c3ccc(n2c(C)cc(C=c1c(=O)[nH]c(=S)n(C)c1=O)c2C)cc3	ZINC000000658555	O=c1[nH]c(=S)[nH]c(=O)c1=Cc3ccn(c2ccccc2)c3
C[N@@](CC2CCN(Cc1ccc(C)o1)CC2)Cc4cc(=O)c3ccccc3[nH]4	ZINC000011754010	O=c3cc(CNCC2CCN(Cc1ccco1)CC2)[nH]c4ccccc34
Cc4cccc(NC(=O)CCC3CCN(C2CCN(CCc1ccccc1)CC2)CC3)c4	ZINC000012710046	O=C(CCC3CCN(C2CCN(CCc1ccccc1)CC2)CC3)Nc4ccccc4
NC(=O)C2(N1CCCCC1)CCNCC2	ZINC000000266396	C2CCN(C1CCNCC1)CC2
O=C(Cc1ccccc1)N3CCN(S(=O)(=O)c2ccccc2)CC3	ZINC000000094442	O=C(Cc1ccccc1)N3CCN(S(=O)(=O)c2ccccc2)CC3
Cc2nc1ccccn1c(=O)c2CCN4CCC(C(=O)c3ccc(F)cc3)CC4	ZINC000000538194	O=C(C3CCN(CCc2cnc1ccccn1c2=O)CC3)c4ccccc4
Nc1c(Cl)cc(C(F)(F)F)cc1Cl	ZINC000000056905	c1ccccc1
CCOc3cc2CCN[C@H](c1ccc(OC)cc1OC)c2cc3OCC	ZINC000000719040	C3Cc1ccccc1C(c2ccccc2)N3
NC(=O)C4(N1CCCCC1)CCN(CCC(C#N)(c2ccccc2)c3ccccc3)CC4	ZINC000000538198	C4CCN(C3CCN(CCC(c1ccccc1)c2ccccc2)CC3)CC4
CN(C)C(On1nnc2ccccc12)=[N+](C)C	ZINC000000156069	c2ccc1[nH]nnc1c2
CCN(c1ccccc1)c2cc(=NC)n(C)c(C)n2	ZINC000000005552	N=c2cc(Nc1ccccc1)nc[nH]2
Cc4cn3c1ccccc1n(Cc2ccc(C(C)(C)C)cc2)c3n4	ZINC000000447914	C(c1ccccc1)n3c2ccccc2n4ccnc34
CC(=O)N(c2ccc(C1CCCCC1)cc2)c3nc(C)cc(C)c3C#N	ZINC000000069700	C3CCC(c2ccc(Nc1ccccn1)cc2)CC3
Cc3n[n+]2c(c1ccccc1)ccnc2s3	ZINC000000124381	c3ccc(c1ccnc2scn[n+]12)cc3
Cc3cccc(N2[C@H](c1c(Cl)cccc1Cl)SCC2=O)n3	ZINC000000027150	O=C2CSC(c1ccccc1)N2c3ccccn3
CCCNC(=O)[C@@H](C)N	ZINC000004206114	nonring
Cc1ccccc1C(=O)NC[C@@H]2CCC[N@]3CCCC[C@@H]23	ZINC000000055271	O=C(NCC1CCCN2CCCCC12)c3ccccc3
C[C@@H](NCCn2c(=O)n(C)c1ncn(C)c1c2=O)c3ccccc3	ZINC000000033849	O=c2[nH]c1nc[nH]c1c(=O)n2CCNCc3ccccc3
C[C@@H](NCC(=O)Nc3ccc(N2CCN(Cc1ccccc1)CC2)cc3)c4ccc(F)cc4	ZINC000012532888	O=C(CNCc1ccccc1)Nc4ccc(N3CCN(Cc2ccccc2)CC3)cc4
COc2cc(C)c(Oc1cc(C)cc(O)c1O)c(O)c2	ZINC000000003968	O(c1ccccc1)c2ccccc2
O[C@H]3CN[C@@H](C(=O)Nc2ccc1ccccc1c2)C3	ZINC000000402963	O=C(Nc2ccc1ccccc1c2)C3CCCN3
CN4CCN([C@@]13CCCCC1=Cc2cc(N(=O)=O)ccc2O3)CC4	ZINC000000080831	C4CCC3(N1CCNCC1)Oc2ccccc2C=C3C4
C[C@@H]3CCC[N@](C2CCN(S(=O)(=O)c1ccc(F)cc1)CC2)C3	ZINC000000316796	O=S(=O)(N2CCC(N1CCCCC1)CC2)c3ccccc3
Oc1c(Cl)cc(Cl)cc1\C=N\C[C@@H]2CCCO2	ZINC000000068656	C2COC(CN=Cc1ccccc1)C2
CC(C)[C@@H](N)C(=O)N1CCOCCOCCOCC1	ZINC000000244260	C1COCCOCCOCCN1
C[C@H]1CNC[C@@H](C)O1	ZINC000000388171	C1COCCN1
Cc1ccc(C(O)=O)cc1c3ccc(\C=c2\[nH]c(=O)[nH]c2=O)o3	ZINC000000072898	O=c3[nH]c(=O)c(=Cc2ccc(c1ccccc1)o2)[nH]3
C4CN(c2nc(c1ccccc1)nc3ccccc23)CCO4	ZINC000000037983	C4CN(c2nc(c1ccccc1)nc3ccccc23)CCO4
Brc3ccc(\C=N\c2sc1CCCc1c2C#N)cc3	ZINC000000060011	C3Cc2cc(N=Cc1ccccc1)sc2C3
CC3CCN(CCNS(=O)(=O)c1cccc2cccnc12)CC3	ZINC000000423539	O=S(=O)(NCCN1CCCCC1)c2cccc3cccnc23
Cc4ncc(c1ccncc1C)c([C@@H]2CCCC[N@]2Cc3ccc(Cl)c(Cl)c3)n4	ZINC000019239782	C4CCN(Cc1ccccc1)C(c2ncncc2c3ccncc3)C4
CCNCCN	ZINC000006424824	nonring
C[C@@H](NC(=O)OCc1ccccc1)C(=O)Nc2ccc(C)c(C)c2	ZINC000000051235	O=C(CNC(=O)OCc1ccccc1)Nc2ccccc2
C4CCN(CCc3nc(CC(c1ccccc1)c2ccccc2)no3)CC4	ZINC000000538227	C4CCN(CCc3nc(CC(c1ccccc1)c2ccccc2)no3)CC4
O=C1CNC(=O)N1Cc2ccccc2	ZINC000000076794	O=C1CNC(=O)N1Cc2ccccc2
Cn3c(=O)sn(c1cccc2ccccc12)c3=O	ZINC000000069924	O=c3[nH]c(=O)n(c1cccc2ccccc12)s3
CC(C)SC1N=NC(=S)N1C	ZINC000000131836	S=C1NCN=N1
O=c4c(C#N)c(N2CCc1ccccc1CC2)nc3CCCn34	ZINC000000026684	O=c4cc(N2CCc1ccccc1CC2)nc3CCCn34
CC(C)N(CCN([C@@H]3CC[C@]2(c1cccc(CN(C)C)c1)C[C@@H]2C3)C(=O)Nc4ccc(F)c(Cl)c4)C(C)C	ZINC000028650169	O=C(NC3CCC2(c1ccccc1)CC2C3)Nc4ccccc4
CCOc2ccc(S(=O)(=O)NCc1ccc(OC)cc1)cc2	ZINC000000038960	O=S(=O)(NCc1ccccc1)c2ccccc2
Cc2cc(C)c(C(=O)Nc1cccc(Br)c1)c(C)c2	ZINC000000037864	O=C(Nc1ccccc1)c2ccccc2
O=C(CC[C@H]2CCC[N@@](Cc1ccco1)C2)N4CCN(Cc3ccccc3)CC4	ZINC000011873706	O=C(CCC2CCCN(Cc1ccco1)C2)N4CCN(Cc3ccccc3)CC4
CCOc2ccc(C(=O)[C@@H](CC[C@@H](CN(C)C)C(=O)c1ccc(OCC)cc1)CN(C)C)cc2	ZINC000008757106	O=C(CCCCC(=O)c1ccccc1)c2ccccc2
Brc3ccc(c2noc([C@@H]1CCCCN1)n2)cc3	ZINC000000324395	C3CCC(c2nc(c1ccccc1)no2)NC3
Cc3ccc(CNc2ncc(c1cccc(N(=O)=O)c1)n2C)cc3	ZINC000000819096	C(Nc2ncc(c1ccccc1)[nH]2)c3ccccc3
OC(=O)CNC(=O)c2cccc(CSc1ccccn1)c2	ZINC000000041870	C(Sc1ccccn1)c2ccccc2
Cc3cccc(/N=C/c2ccc(c1cc(C)c(N(=O)=O)cc1C)o2)c3C	ZINC000000062879	C(=Nc1ccccc1)c3ccc(c2ccccc2)o3
Nc2ccc(n1ccc(C(F)(F)F)n1)cc2	ZINC000000057697	c2ccc(n1cccn1)cc2
Nc3ccc2nc4c(=O)c1cccnc1c5nccc(c2c3)c45	ZINC000000026777	O=c3c1cccnc1c5nccc4c2ccccc2nc3c45
COc2cc(C(=O)NC1CCN(C)CC1)nc3ccccc23	ZINC000000108644	O=C(NC1CCNCC1)c3ccc2ccccc2n3
Cn2c1ccncc1c3cc(N(=O)=O)ccc23	ZINC000000066383	c1ccc3c(c1)[nH]c2ccncc23
CCOC(=O)C1=C(C)N=C(SC)N(C)[C@@H]1c2ccccc2	ZINC000000083575	N1C=NC=CC1c2ccccc2
COc1ccccc1C[N@]2C[C@@H]4C[C@H](C2)c3cccc(=O)n3C4	ZINC000000228620	O=c4cccc3C2CC(CN(Cc1ccccc1)C2)Cn34
CN(N)c1ncccc1C(F)(F)F	ZINC000000165264	c1ccncc1
Clc1ccccc1CSc2cccc3cccnc23	ZINC000000036131	C(Sc1cccc2cccnc12)c3ccccc3
N[C@@H](c1ccccc1)P(O)(=O)[C@@H](N)c2ccccc2	ZINC000000186743	O=P(Cc1ccccc1)Cc2ccccc2
Cc2cc(C(N)=O)c1ccccc1n2	ZINC000000036641	c2ccc1ncccc1c2
CC(C)OC(=O)Nc1nonc1C	ZINC000000039616	c1cnon1
COc3ccc(\C=c2\sc1nncn1c2=O)cc3	ZINC000000082083	O=c2c(=Cc1ccccc1)sc3nncn23
Clc4ccc3Cc1c([nH]c(=O)c2nccn12)c3c4	ZINC000000018313	O=c3[nH]c2c1ccccc1Cc2n4ccnc34
COC(=O)c2c(C)[nH]c(C(=O)CN1CCC(C)CC1)c2C	ZINC000000090023	O=C(CN1CCCCC1)c2ccc[nH]2
Cc4ccc3n(C[C@@H](O)CNCc1ccco1)c2C(=O)CCCc2c3c4	ZINC000000795437	O=C1CCCc3c1n(CCCNCc2ccco2)c4ccccc34
Cc1oc(C(C)(C)C)cc1C(N)=O	ZINC000000087843	c1ccoc1
COc1ccccc1n3cc(c2ccccc2)[n+]4c3SC[C@@]4(O)c5ccccc5	ZINC000000643793	C4Sc3n(c1ccccc1)cc(c2ccccc2)[n+]3C4c5ccccc5
NC(=N)c1ccc(OC(F)(F)F)cc1	ZINC000000264313	c1ccccc1
CC(C)CC[n+]1ccc(C(N)=O)cc1	ZINC000000394263	c1ccncc1
CN(C)CCOC(=O)c3ccc2[nH]c1CCSCc1c2c3	ZINC000000190266	C3Cc2[nH]c1ccccc1c2CS3
CN(C)CCOC(=O)C2(c1ccccc1)CCCC2	ZINC000000168965	C2CCC(c1ccccc1)C2
C[C@@H]1C[N@@](C)CCC1=O	ZINC000000158393	O=C1CCNCC1
O=C2C(=C/c1ccc(C#N)cc1)\CCc3ccccc23	ZINC000000103259	O=C2C(=Cc1ccccc1)CCc3ccccc23
Clc2ccc(C(=O)n1cc(N(=O)=O)cn1)c(Cl)c2	ZINC000000037194	O=C(c1ccccc1)n2cccn2
Cn2cc(N(=O)=O)c(C(=O)n1cccn1)n2	ZINC000000037195	O=C(c1cc[nH]n1)n2cccn2
Oc1cccnc1NS(=O)(=O)c2ccc(Cl)cc2	ZINC000000063724	O=S(=O)(Nc1ccccn1)c2ccccc2
COc3ccc(CNCC[C@@]2(Cc1ccccc1)C[C@@H](C)[N@@](C)C[C@@H]2C)cc3OC	ZINC000013475958	C3CC(CCNCc1ccccc1)(Cc2ccccc2)CCN3
Cc3cc(C)c(NC(=O)CN(C1CCCCC1)C2CCCCC2)c(C)c3	ZINC000000754192	O=C(CN(C1CCCCC1)C2CCCCC2)Nc3ccccc3
C[n+]1cccc(CO)c1	ZINC000001691360	c1ccncc1
CN(C)CCCNc1ccc(N(=O)=O)c(NCCCN(C)C)c1C#N	ZINC000004306473	c1ccccc1
COc1ccc(CNC(N)=N)cc1	ZINC000000289754	c1ccccc1
CN(C)C(=O)[C@@H]1CCCN1	ZINC000004899559	C1CCNC1
COC(=O)c3ccc(Nc1cc(C)nc2ccc(C)cc12)cc3	ZINC000000076997	N(c1ccccc1)c2ccnc3ccccc23
CC(C)C(=O)Nc1cccc(C)c1	ZINC000000029799	c1ccccc1
C[C@@H](NCCO)c1ccccc1	ZINC000001667566	c1ccccc1
CC3(C)CC(NC(=O)c2scc1CCCCc12)CC(C)(C)N3	ZINC000000140798	O=C(NC1CCNCC1)c3scc2CCCCc23
C[C@H](N1CCCC1)C(=O)Nc2cc(Cl)cc(Cl)c2	ZINC000000110415	O=C(CN1CCCC1)Nc2ccccc2
Fc2ccc(S(=O)(=O)NCCc1ccccc1)cc2	ZINC000000029199	O=S(=O)(NCCc1ccccc1)c2ccccc2
C[n+]1ccccc1CS(=O)(=O)c2ccccc2	ZINC000000399133	O=S(=O)(Cc1ccccn1)c2ccccc2
O=C1SCCN1Cc2ccccc2	ZINC000000004221	O=C1SCCN1Cc2ccccc2
CCN(CC)[C@@H](C)Cn2c1ccccc1sc3ccccc23	ZINC000000004227	c3ccc2sc1ccccc1[nH]c2c3
CN(C)CCO[C@H](NC(=O)OCCN(C)C)C(Cl)(Cl)Cl	ZINC000003167902	nonring
Cc4ccc3[nH]c(=O)c([n+]1ccccc1)c(c2ccccc2)c3c4	ZINC000000194566	O=c3[nH]c1ccccc1c(c2ccccc2)c3[n+]4ccccc4
CCN(CC)CCN1C(=O)Cn2c(C)c(C)c3cccc1c23	ZINC000000036906	O=C1Cn2ccc3cccc(N1)c23
C[C@@H](O)C[N+](=O)Cc1ccccc1	ZINC000000126541	c1ccccc1
CN4CCN(c2ccnc3ccc(NC(=O)Cc1cccc(Cl)c1Cl)cc23)CC4	ZINC000000586016	O=C(Cc1ccccc1)Nc4ccc3nccc(N2CCNCC2)c3c4
C4CCN(c3nc(Nc1ccccc1)nc(N2CCNCC2)n3)C4	ZINC000000307647	C4CCN(c3nc(Nc1ccccc1)nc(N2CCNCC2)n3)C4
CCC(=O)N(c1ccccc1)C3(COC)CCN(CCn2cccn2)CC3	ZINC000000603904	C2CN(CCn1cccn1)CCC2Nc3ccccc3
CN(C)CCCNc3ncnc4n(c1ccc(C)cc1)cc(c2ccccc2)c34	ZINC000002714333	c4ccc(c2cn(c1ccccc1)c3ncncc23)cc4
CCOC(=O)C(=C/c1cc(N(=O)=O)c(C)s1)/C#N	ZINC000000043805	c1ccsc1
COc3ccc(C(=O)C[C@@H]2CCC[C@H](CC(=O)c1ccc(OC)cc1)[N@@]2C)cc3	ZINC000000640252	O=C(CC2CCCC(CC(=O)c1ccccc1)N2)c3ccccc3
CCN2CCN(C(=O)c1cccc(N(=O)=O)c1)CC2	ZINC000000127890	O=C(N1CCNCC1)c2ccccc2
C2CN(c1ccccn1)CCN2Cc3c[nH]nc3c4ccccc4	ZINC000000151967	C2CN(c1ccccn1)CCN2Cc3c[nH]nc3c4ccccc4
C5Cc4sc3ncnc(N2CCC(Cc1ccccc1)CC2)c3c4C5	ZINC000000038231	C5Cc4sc3ncnc(N2CCC(Cc1ccccc1)CC2)c3c4C5
NCc1ccccc1Br	ZINC000000407047	c1ccccc1
CCCCN[C@H](C)[C@@H](O)c2ccc(c1ccc([C@H](O)[C@H](C)NCCCC)cc1)cc2	ZINC000004430025	c2ccc(c1ccccc1)cc2
Cc3cc(C)c2c1n(C)c(=O)n(C)c(=O)c1cn2n3	ZINC000000033669	O=c3[nH]c(=O)c2cn1ncccc1c2[nH]3
Cc1ccccc1NC(=O)COc2ccccc2Br	ZINC000000050551	O=C(COc1ccccc1)Nc2ccccc2
COc1ccccc1NC(=O)CSCc2cnc(C)c(O)c2CO	ZINC000000094351	O=C(CSCc1cccnc1)Nc2ccccc2
C[N@]1CCC[C@H]1CCSc2ccncc2	ZINC000000023851	C2CNC(CCSc1ccncc1)C2
Cn2c(O)c(Cc1ccc[nH]1)c(=O)n(C)c2=O	ZINC000001410527	O=c2[nH]cc(Cc1ccc[nH]1)c(=O)[nH]2
O=N(=O)c5ccc(c4cn3c1ccccc1n(CCN2CCCCC2)c3n4)cc5	ZINC000000716199	C5CCN(CCn3c1ccccc1n4cc(c2ccccc2)nc34)CC5
COC(=O)[C@H]1CC(=C)C[C@H]1N	ZINC000000017929	C=C1CCCC1
O=N(=O)c3cccc(c1ncc2ccccn12)c3	ZINC000000126044	c3ccc(c1ncc2ccccn12)cc3
CS(=O)(=O)c1ccc(/C=C/C(O)=O)cc1	ZINC000000154240	c1ccccc1
CCOC(=O)/C(=N\O)C1=NC(C)(C)Cc2cc(OC)c(OC)cc12	ZINC000000073924	C2Cc1ccccc1C=N2
C[C@H](N)c1ccnn1C	ZINC000002537539	c1cn[nH]c1
C[N@@](Cc2ccc1nsnc1c2)Cc3ccccc3OC[C@@H](O)CN4CCCCC4	ZINC000011879006	C4CCN(CCCOc1ccccc1CNCc3ccc2nsnc2c3)CC4
CCOC(=O)c1cc(NC(=O)CCC(O)=O)ccc1N2CCCCC2	ZINC000000146437	C2CCN(c1ccccc1)CC2
CCN(CC)CCC[C@@H](C)Nc2cc(\C=C\c1ccccc1Cl)nc3cc(Cl)ccc23	ZINC000003882238	C(=Cc2ccc1ccccc1n2)c3ccccc3
COc1ccc(C[N+](C)=O)cc1	ZINC000001385399	c1ccccc1
Nc4nc(NC1CC1)c3ncn([C@H]2C[C@@H](CO)C=C2)c3n4	ZINC000000004400	C4CC(n2cnc3c(NC1CC1)ncnc23)C=C4
CN(C(C)=O)c1ccc([N+](C)(C)C)cc1	ZINC000000281862	c1ccccc1
CC[N+](C)(C)c1ccc(NC(C)=O)cc1	ZINC000000281865	c1ccccc1
CN(Cc1ccccc1)C(=O)c3nc2ccccn2c3C[N@@](C)CCCCN4CCOCC4	ZINC000012433458	O=C(NCc1ccccc1)c3nc2ccccn2c3CNCCCCN4CCOCC4
Cc2cc(=O)oc3cc(OCc1ccc(F)cc1)c(Cl)cc23	ZINC000000037999	O=c3ccc2ccc(OCc1ccccc1)cc2o3
CN3CCN(CCCN(CCC(=O)N1CCNCC1)C(=O)c2ccc(C(C)(C)C)cc2)CC3	ZINC000045966901	O=C(CCN(CCCN1CCNCC1)C(=O)c2ccccc2)N3CCNCC3
O=C(CC[N@]2CC[C@@H](c1ccccc1)C2)c3ccco3	ZINC000000177661	O=C(CCN2CCC(c1ccccc1)C2)c3ccco3
C[C@@H](CCn1cccn1)N3CCC(Oc2ccc(C(=O)NCCN(C)C)cc2Cl)CC3	ZINC000012202135	C(CN2CCC(Oc1ccccc1)CC2)Cn3cccn3
Cc3nnc(SCCNC(=O)C12CNCC1CNC2)s3	ZINC000065395901	O=C(NCCSc1nncs1)C23CNCC2CNC3
COc4cc3CCN(c2cc(N)c1cc(OC)c(OC)cc1n2)Cc3cc4OC	ZINC000000596947	C2Cc1ccccc1CN2c4ccc3ccccc3n4
CC(C)NCCCn2c(C(C)(C)C)cn3c1ccccc1nc23	ZINC000004859449	c1ccc2c(c1)nc3[nH]ccn23
O=c4c(CNCc1cccnc1)cc3cc2OCOc2cc3n4CCN5CCCCC5	ZINC000012149108	O=c4c(CNCc1cccnc1)cc3cc2OCOc2cc3n4CCN5CCCCC5
CC[C@@H](C)C[C@@H](N)O	ZINC000001716671	nonring
Cc3c(/C=C/c1cccc(N(=O)=O)c1)c(=O)n(c2ccccc2)n3C	ZINC000000055219	O=c2c(C=Cc1ccccc1)c[nH]n2c3ccccc3
O=N(=O)c3ccc(CN2CCN(C[C@H]1CCC=CC1)CC2)cc3	ZINC000000178708	C3CC(CN2CCN(Cc1ccccc1)CC2)CC=C3
CN([C@@H]1CCCC[C@H]1N2CCCC2)C(=O)Cc3cccc4sccc34	ZINC000000607309	O=C(Cc1cccc2sccc12)NC3CCCCC3N4CCCC4
Nc2cnc(c1cc(Cl)cc(Cl)c1Cl)c(N)n2	ZINC000000009967	c2ccc(c1cnccn1)cc2
CC(C)(C)NC[C@@H](O)COc2ccc(O)c3C1CCC(CC1)c23	ZINC000000000527	C1CC2CCC1c3ccccc23
C[C@H](C(=O)OC1CCCCC1)c2ccncc2	ZINC000000009590	O=C(Cc1ccncc1)OC2CCCCC2
C[C@H]1CCCCN1CCCNC(=O)Nc4ccc(Cc3ccc(NC(=O)NCCC[N@@]2CCCC[C@@H]2C)cc3)cc4	ZINC000005648404	O=C(NCCCN1CCCCC1)Nc4ccc(Cc3ccc(NC(=O)NCCCN2CCCCC2)cc3)cc4
O=S(=O)(NCCN1CCCC1)c2cccc3nsnc23	ZINC000000174933	O=S(=O)(NCCN1CCCC1)c2cccc3nsnc23
CCCn2c(COc1ccc(Cl)cc1Cl)nc3ccccc23	ZINC000000099619	C(Oc1ccccc1)c3nc2ccccc2[nH]3
C[C@@H]1CCCC[C@@H]1NCc2ccc(N(=O)=O)cc2	ZINC000000183582	C2CCC(NCc1ccccc1)CC2
NCCCc1ccccc1	ZINC000001561633	c1ccccc1
CCn2c[n+](C[C@@H](O)COCc1ccccc1)c3ccccc23	ZINC000000089041	C(COCc1ccccc1)C[n+]2c[nH]c3ccccc23
COc3cc(CNc2ccc(N1CCCCC1)cc2)ccc3OCC(=O)NC(C)(C)C	ZINC000000679413	C3CCN(c2ccc(NCc1ccccc1)cc2)CC3
Cc2cccc(NC(=O)CCN1CCC(C(N)=O)CC1)c2	ZINC000000176292	O=C(CCN1CCCCC1)Nc2ccccc2
O=c2[nH]c(=O)c(=C[C@H]1CCC=CC1)c(=O)[nH]2	ZINC000000136766	O=c2[nH]c(=O)c(=CC1CCC=CC1)c(=O)[nH]2
C[N+]2(C)CCC(CCCCCCCCC1CC[N+](C)(C)CC1)CC2	ZINC000004683900	C(CCCCC1CCNCC1)CCCC2CCNCC2
Cc4c(c1ccccc1)oc3c(C(=O)OCCN2CCCCC2)cccc3c4=O	ZINC000000608382	O=C(OCCN1CCCCC1)c3cccc4c(=O)cc(c2ccccc2)oc34
CN3CCC(N(C)c1ncnc2ccc(Br)cc12)CC3	ZINC000000099181	C3CC(Nc1ncnc2ccccc12)CCN3
CCOC(=O)C2CCN(C(=O)Cc1cccs1)CC2	ZINC000000030664	O=C(Cc1cccs1)N2CCCCC2
CN2[C@H](c1ccccc1)CC(C)(O)C[C@H]2c3ccccc3	ZINC000000208438	C3CC(c1ccccc1)NC(c2ccccc2)C3
Cc2nc(N(=O)=O)c(C(=O)OCc1ccc(Cl)cc1Cl)n2C	ZINC000000110563	O=C(OCc1ccccc1)c2cnc[nH]2
COc3ccc(CCN[C@@H]2CC(=O)N(c1ccccc1)C2=O)cc3	ZINC000000182016	O=C2CC(NCCc1ccccc1)C(=O)N2c3ccccc3
CC(=O)NCCc2cccc3ccc1OCCCc1c23	ZINC000000020590	C3COc2ccc1ccccc1c2C3
CCOC(=O)N5CCN(C(=O)[C@@H]1CC14CCN(Cc3cc(CN2CCCCC2)cs3)CC4)CC5	ZINC000011814710	O=C(C1CC14CCN(Cc3cc(CN2CCCCC2)cs3)CC4)N5CCNCC5
Fc1cccc(F)c1c3csc(=[N+]2CCSCC2)s3	ZINC000000163048	C3C[N+](=c2scc(c1ccccc1)s2)CCS3
Cc3nn2c1ccccc1nc2n3CCN4CCCCC4	ZINC000000189096	C4CCN(CCn2cnn3c1ccccc1nc23)CC4
FC(F)(F)c4ccc3sc1ccccc1n(C(=O)CN2CCCC2)c3c4	ZINC000000752212	O=C(CN1CCCC1)n3c2ccccc2sc4ccccc34
CC(C)(C)NC[C@@H](O)COc1cc(Cl)ccc1C2=CC(=O)CC2	ZINC000000000255	O=C2CCC(c1ccccc1)=C2
CCc2n(CC)c1ccccc1[n+]2C[C@@H](O)COc3c(C)cccc3C	ZINC000000781047	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
Cc1c(Cl)ccc(N(=O)=O)c1Cl	ZINC000000122186	c1ccccc1
CC[N@]1CCC[C@@H]1CNC(=O)C(O)(c2ccccc2)c3ccccc3	ZINC000000000251	O=C(NCC1CCCN1)C(c2ccccc2)c3ccccc3
COc3c1OCOc1cc2CC[N+](C)(C)[C@H](NC(N)=O)c23	ZINC000000488688	C3Cc2cc1OCOc1cc2CN3
Fc5ccc(n3cc(C2CCN(CCN1CCNC1=O)CC2)c4cc(Cl)ccc34)cc5	ZINC000000538337	O=C1NCCN1CCN5CCC(c3cn(c2ccccc2)c4ccccc34)CC5
CCCN3CCC(N2CCC(O)(c1ccc(Br)cc1)CC2)CC3	ZINC000000757905	C3CC(N2CCC(c1ccccc1)CC2)CCN3
C3CC(c1c[nH]c2ccccc12)=CCN3	ZINC000000154399	C3CC(c1c[nH]c2ccccc12)=CCN3
CN(C)CCCOc5ccc(CN4CCC(c2c[nH]c3ccc(NCC1CCCCC1)cc23)CC4)cc5	ZINC000045194850	C5CCC(CNc4ccc3[nH]cc(C2CCN(Cc1ccccc1)CC2)c3c4)CC5
COC(=O)Nc2ccc(S(=O)(=O)Nc1ccccc1OC)cc2	ZINC000000041965	O=S(=O)(Nc1ccccc1)c2ccccc2
CCO[C@@H](C)C(=O)C(O)O	ZINC000000000411	nonring
CCC[C@@H](O)c1ccccc1OCCN(C(C)C)C(C)C	ZINC000000000413	c1ccccc1
C3CN=C(Sc1c[nH]c2ccccc12)N3	ZINC000000002177	C3CN=C(Sc1c[nH]c2ccccc12)N3
O=C2Cc1ccccc1N2C3CCNCC3	ZINC000000154390	O=C2Cc1ccccc1N2C3CCNCC3
Cc1cc[n+](C)n1C	ZINC000000406643	c1cn[nH]c1
NCc1ccc(O)c(O)c1	ZINC000000388548	c1ccccc1
COc2ccc(CNCc1ccc(OC)c(OC)c1OC)cc2	ZINC000000355356	C(NCc1ccccc1)c2ccccc2
CC[C@@H](N)Cc1ccc(C)c(O)c1	ZINC000000056470	c1ccccc1
CCc3ccc(C[N@@](CCOC)CC2CCN(Cc1ccccc1OC)CC2)o3	ZINC000012456833	C2CN(Cc1ccccc1)CCC2CNCc3ccco3
NCCc3ccc(OCc1ccccc1)c(OCc2ccccc2)c3	ZINC000000056477	C(Oc1ccccc1OCc2ccccc2)c3ccccc3
CCN3CCN(C(=O)c2ccc(NS(=O)(=O)c1c(C)c(C)cc(C)c1C)cc2)CC3	ZINC000000631062	O=C(N1CCNCC1)c3ccc(NS(=O)(=O)c2ccccc2)cc3
C[N+](C)(C)CCO[C@H](Cc1ccccc1)c2ccccc2	ZINC000000000085	C(Cc1ccccc1)c2ccccc2
CNS(=O)(=O)Cc2ccc1[nH]cc(CCN(C)C)c1c2	ZINC000000014360	c2ccc1[nH]ccc1c2
COc2ccc(c1csc(=S)s1)cc2	ZINC000000011241	S=c2scc(c1ccccc1)s2
Nc3nc(c2ccc1ccccc1c2)cs3	ZINC000000035850	c3ccc2cc(c1cscn1)ccc2c3
CCn2c(=Cc1cccc[n+]1C)ccc3ccc(C)cc23	ZINC000000188657	C(c1ccccn1)=c3ccc2ccccc2[nH]3
Cc1ccc(Cl)cc1NC(=O)[C@@H]2CCCC[C@@H]2C(O)=O	ZINC000000051443	O=C(Nc1ccccc1)C2CCCCC2
CC3CCC(N2CCN(S(=O)(=O)c1ccccc1)CC2)CC3	ZINC000000182018	O=S(=O)(N2CCN(C1CCCCC1)CC2)c3ccccc3
COc3ccc(\C=C\CN(C)C[C@@H]2CCC[N@@](CCc1ccccc1OC)C2)cc3	ZINC000014949384	C3CC(CNCC=Cc1ccccc1)CN(CCc2ccccc2)C3
CC(C)N4CCC(N3CC[N@@](Cc1cn(CC(N)=O)c2ccccc12)C[C@@H]3CCO)CC4	ZINC000019228285	C4CC(N3CCN(Cc1c[nH]c2ccccc12)CC3)CCN4
CN(C)Cc2coc1ccccc1c2=O	ZINC000000124378	O=c1ccoc2ccccc12
C[C@@H]3C[C@@H](C)CN(C(=O)c2ccc1OCOc1c2)C3	ZINC000000030192	O=C(N1CCCCC1)c3ccc2OCOc2c3
Oc4ccc(c2csc3c(=O)c1cccn1c23)cc4O	ZINC000000008650	O=c3c1cccn1c4c(c2ccccc2)csc34
COc2ccc1ccccc1c2CN(CCCN(C)C)CCCN(C)C	ZINC000002489947	c2ccc1ccccc1c2
CC(C)(C)c3ccc(Oc1ncccc1NC(=O)c2ccco2)cc3	ZINC000000084008	O=C(Nc1cccnc1Oc2ccccc2)c3ccco3
CC1(C)NC(=N)NC(=N)N1c3cccc(OCCCOc2cccc(NC(=O)CBr)c2)c3	ZINC000001703365	N=C3NCN(c2cccc(OCCCOc1ccccc1)c2)C(=N)N3
Fc1ccccc1C(=O)N2CCNCC2	ZINC000000255515	O=C(N1CCNCC1)c2ccccc2
O=c4[nH]c2CC[N@](Cc1ccccc1)Cc2c5nc(c3ccccn3)nn45	ZINC000000575824	O=c4[nH]c2CCN(Cc1ccccc1)Cc2c5nc(c3ccccn3)nn45
CCN4CCN(c3ccc(Nc1ccnc2ccccc12)cc3)CC4	ZINC000000034183	C4CN(c3ccc(Nc1ccnc2ccccc12)cc3)CCN4
CCOc2cc(C(=O)N1CCN(C)CC1)cc(OCC)c2OCC	ZINC000000263712	O=C(N1CCNCC1)c2ccccc2
CC(=O)Nc4ccc(c3c[n+]2c(ccc1ccccc12)n3C)cc4	ZINC000000387325	c4ccc(c3c[n+]2c(ccc1ccccc12)[nH]3)cc4
CC(C)NC(=O)c2ccc(N1CCN(C(C)C)CC1)nc2	ZINC000000480516	C2CN(c1ccccn1)CCN2
CCOCCC(N)=N	ZINC000002547258	nonring
COc1cc(SC)ccc1C(=O)Nc2nccs2	ZINC000000030516	O=C(Nc1nccs1)c2ccccc2
CC(=O)c1cccc(N(=O)=O)c1	ZINC000000148003	c1ccccc1
CCOC(=O)c3nc2c1cc(C)ccc1n(CC)c(=O)n2n3	ZINC000000004467	O=c2[nH]c1ccccc1c3ncnn23
Fc3ccc(N2C(=O)C[C@H](NCCC1=CCCCC1)C2=O)cc3	ZINC000000093918	O=C2CC(NCCC1=CCCCC1)C(=O)N2c3ccccc3
CC(C)c3cc(\C=C1/CN2CCC1CC2)on3	ZINC000000006806	C1CN3CCC1C(=Cc2ccno2)C3
C[C@@H](N)Cn1ccc2cc(F)c(Cl)cc12	ZINC000000006375	c2ccc1[nH]ccc1c2
COc3ccc(N1C(=N)NC(=N)NC12CCCC2)cc3	ZINC000000203702	N=C3NC(=N)N(c1ccccc1)C2(CCCC2)N3
COC(=O)c1scc(C#N)c1NN=C(C#N)C(=O)c2ccccc2	ZINC000000124811	O=C(C=NNc1ccsc1)c2ccccc2
CN1CCNCC1=O	ZINC000002146064	O=C1CNCCN1
OC(=O)[C@H]1[C@@H]3C=C[C@H]([C@@H]1C(=O)Nc2ccccc2F)C34CC4	ZINC000000066374	O=C(Nc1ccccc1)C2CC3C=CC2C34CC4
CN4CCN(c2nnc(C)c3c(C)n(c1ccc(Cl)cc1)nc23)CC4	ZINC000000642655	C4CN(c2nncc3cn(c1ccccc1)nc23)CCN4
Cc4ccc(S(=O)(=O)N2CCc1cnoc1c3ccccc23)cc4	ZINC000000044281	O=S(=O)(N2CCc1cnoc1c3ccccc23)c4ccccc4
Cc3nn(CCN1CCCC1)c(=O)c4nn(c2ccccc2F)c(C)c34	ZINC000000642658	O=c3n(CCN1CCCC1)ncc4cn(c2ccccc2)nc34
CN2CCC(N(C)S(=O)(=O)c1ccc(F)cc1)CC2	ZINC000000111161	O=S(=O)(NC1CCNCC1)c2ccccc2
COC(=O)C3=C(C)NC(C)=C(C(=O)O[C@@H]2CC[N@@](Cc1ccccc1)C2)[C@@H]3c4cccc(N(=O)=O)c4	ZINC000000598360	O=C(OC2CCN(Cc1ccccc1)C2)C3=CNC=CC3c4ccccc4
COc1ccccc1CNCCCCCCCCCCN5CCN(CC(=O)n3c2ccccc2c(=O)[nH]c4cccnc34)CC5	ZINC000026250144	O=C(CN2CCN(CCCCCCCCCCNCc1ccccc1)CC2)n4c3ccccc3c(=O)[nH]c5cccnc45
CC(=O)NCCN2CCc3ccc1OCCc1c23	ZINC000000006392	C3Cc2ccc1OCCc1c2N3
C/C=C/C(=O)N1CCNCC1	ZINC000001720096	C1CNCCN1
COc4ccc3SCCN(C(=O)CCN2CCC(Cc1ccccc1)CC2)Cc3c4	ZINC000000600324	O=C(CCN2CCC(Cc1ccccc1)CC2)N4CCSc3ccccc3C4
C3CN(c2ccc1nncn1n2)CCS3	ZINC000000080375	C3CN(c2ccc1nncn1n2)CCS3
CCCc2sc(N1CCC(C(N)=O)CC1)nc2c3ccccc3	ZINC000000079991	C3CCN(c2nc(c1ccccc1)cs2)CC3
CCC[N@@](CCO)Cc1cc(Br)ccc1OC	ZINC000000277485	c1ccccc1
Clc3ccc(NC(=O)N2CCC[N@@](Cc1ccccc1)CC2)cc3	ZINC000000066413	O=C(Nc1ccccc1)N3CCCN(Cc2ccccc2)CC3
C[C@@H](CCCC(C)(C)O)CCNCCCN(C)C	ZINC000005515588	nonring
O=C(OC(CN1CCCCC1)CN2CCCCC2)c3ccccc3	ZINC000000173906	O=C(OC(CN1CCCCC1)CN2CCCCC2)c3ccccc3
CCOC(=O)C5CCN(c2nc1c(C)cccc1cc2CNCCC[N@]3C[C@H]4C[C@@H]3C=C4)CC5	ZINC000012278946	C5CCN(c2nc1ccccc1cc2CNCCCN3CC4CC3C=C4)CC5
CCSc3nc2sc1CCCc1c2c(=O)n3c4ccccc4	ZINC000000103019	O=c3n(c1ccccc1)cnc4sc2CCCc2c34
C[N+](C)(C)C[C@@H]1CCC[C@@H]1O	ZINC000000027628	C1CCCC1
C[C@@](Cc1ccccc1)(NC(=O)CN)c2ccccc2	ZINC000000228297	C(Cc1ccccc1)c2ccccc2
COC(=O)c2ccc(C[N+](=O)c1ccccc1)cc2	ZINC000000080322	O=[N+](Cc1ccccc1)c2ccccc2
CCOC(=O)[C@@H]2CCCN(S(=O)(=O)c1ccc(F)cc1)C2	ZINC000000030990	O=S(=O)(N1CCCCC1)c2ccccc2
Cc4cccc(N3C(=O)C[C@@H]([N@]2CCc1ccccc1C2)C3=O)c4	ZINC000000382553	O=C3CC(N2CCc1ccccc1C2)C(=O)N3c4ccccc4
CC(C)(C)NC(=S)N1CCSCC1	ZINC000000100138	C1CSCCN1
Clc3ccc(COc1ccc(Cl)cc1CNCC2CCNCC2)c(Cl)c3	ZINC000040719353	C3CC(CNCc1ccccc1OCc2ccccc2)CCN3
Cc1cccc2c(=O)[nH]cc(Br)c12	ZINC000000011581	O=c1[nH]ccc2ccccc12
CN(C)C/C=C(/Br)c1ccccc1	ZINC000000162291	c1ccccc1
COC(=O)c2ccn(C(=O)c1ccnn1C)n2	ZINC000000034704	O=C(c1ccn[nH]1)n2cccn2
C[N@]2CC[C@@](OC(C)=O)(c1ccccc1)C(C)(C)C2	ZINC000000097856	C2CC(c1ccccc1)CCN2
COc2cc(OC)cc(C(=O)Nc1ccccc1C(F)(F)F)c2	ZINC000000067982	O=C(Nc1ccccc1)c2ccccc2
CN3CCN(c2ccc(NC(=O)c1cccnc1Cl)cc2)CC3	ZINC000000533536	O=C(Nc2ccc(N1CCNCC1)cc2)c3cccnc3
Oc2c(C(=O)NCc1cccc(F)c1)cnc3ccccc23	ZINC000000026375	O=C(NCc1ccccc1)c3cnc2ccccc2c3
Cc3ccc(c2ccc(\C=c1\[nH]c(=O)[nH]c1=O)o2)cc3N(=O)=O	ZINC000000037476	O=c3[nH]c(=O)c(=Cc2ccc(c1ccccc1)o2)[nH]3
O=CNc1ccccc1Oc2ccccc2	ZINC000000028148	O(c1ccccc1)c2ccccc2
O=c3n(CCc2cn1cccnc1n2)c(=O)c4ccccc34	ZINC000000032937	O=c3n(CCc2cn1cccnc1n2)c(=O)c4ccccc34
Brc1ccccc1C(=O)N4CCC(N3CCC(C(=O)NCCCN2CCOCC2)CC3)CC4	ZINC000034912406	O=C(NCCCN1CCOCC1)C4CCN(C3CCN(C(=O)c2ccccc2)CC3)CC4
NCCCN1CCOCC1	ZINC000001587821	C1COCCN1
NC(=N)SCCCCCCCCCCSC(N)=N	ZINC000005113106	nonring
CCOc3ccc(n2nc(C(O)=O)c1ccccc1c2=O)cc3	ZINC000000109891	O=c2n(c1ccccc1)ncc3ccccc23
CC3(C)CC(Nc2noc(c1ccccc1)n2)CC(C)(C)N3	ZINC000000092195	C3CC(Nc2noc(c1ccccc1)n2)CCN3
O=C(COc1cccc2ccccc12)NS(=O)(=O)c3ccccc3	ZINC000000241300	O=C(COc1cccc2ccccc12)NS(=O)(=O)c3ccccc3
CCN(CC)CC[n+]3c(C)cc(C=c2sc1ccccc1n2C)cc3C	ZINC000005444971	C(c1ccncc1)=c3[nH]c2ccccc2s3
Clc3ccc([C@H]1C[C@@H]2CC[C@H]1N2)cn3	ZINC000000402872	C1CC2NC1CC2c3cccnc3
COc2ccc(NC(=O)c1cccnc1)c(OC)c2	ZINC000000029322	O=C(Nc1ccccc1)c2cccnc2
CCC(=O)Nc2sc1c(CC(C)(C)NC1(C)C)c2C#N	ZINC000000180754	C2Cc1ccsc1CN2
CN(C)C/C=C/C(=O)Nc3cc2c(Nc1ccc(F)c(Cl)c1)ncnc2cc3O[C@@H]4CCOC4	ZINC000000595145	C4CC(Oc3ccc2c(Nc1ccccc1)ncnc2c3)CO4
COc3ccc(N2C(=O)C[C@H](NCc1ccncc1)C2=O)cc3	ZINC000000181404	O=C2CC(NCc1ccncc1)C(=O)N2c3ccccc3
CN4CCN(C(=O)C[C@@H]1CCNC[C@@H]1Cc3cc(CN(C)c2ccccc2)on3)CC4	ZINC000012482699	O=C(CC1CCNCC1Cc3cc(CNc2ccccc2)on3)N4CCNCC4
Cc2cccc(NC(=O)c1cccc(N(=O)=O)c1C)n2	ZINC000000033261	O=C(Nc1ccccn1)c2ccccc2
C3CCN(Cn1cnc2ccccc12)CC3	ZINC000000073682	C3CCN(Cn1cnc2ccccc12)CC3
Cn1c(=O)n(C)c2ccccc12	ZINC000000073681	O=c2[nH]c1ccccc1[nH]2
COc1ccc(CN)c(OC)c1	ZINC000000119693	c1ccccc1
CCOC(=O)CC12CN(C)CC(CC(=O)OCC)(CN(C)C1)C2=O	ZINC000000359984	O=C1C2CNCC1CNC2
COC(=O)C2=C(C)NC(C)=C(C(=O)OCCN1CCN(C)CC1)[C@@H]2c3cccc(N(=O)=O)c3	ZINC000000628981	O=C(OCCN1CCNCC1)C2=CNC=CC2c3ccccc3
CN3CCN(Nc2ncnc(NCCN1CCCCC1)c2N)CC3	ZINC000040756227	C3CCN(CCNc2cc(NN1CCNCC1)ncn2)CC3
CN2CCN(c1ccc(NC(=S)NC(C)=O)cc1)CC2	ZINC000000359981	C2CN(c1ccccc1)CCN2
Fc1ccccc1C(=O)N3CCC(N2CCCCCC2)CC3	ZINC000000207601	O=C(N2CCC(N1CCCCCC1)CC2)c3ccccc3
O=C(Oc2ccc(OCc1ccccc1)cc2)c3ccc(N(=O)=O)cc3	ZINC000000060380	O=C(Oc2ccc(OCc1ccccc1)cc2)c3ccccc3
Cc2nn(c1ccccc1)nc2CN	ZINC000000158831	c2ccc(n1nccn1)cc2
O=C2CSc1ccccc1CN2	ZINC000000008066	O=C2CSc1ccccc1CN2
Cc3ccc(NCn2c(=O)c1ccc(N(=O)=O)cc1c2=O)nc3	ZINC000000179253	O=c2n(CNc1ccccn1)c(=O)c3ccccc23
CN(C)CCCN(CCCN(C)C)CC1=CC[C@@H](C(C)=C)CC1	ZINC000004021937	C1CCC=CC1
OCCN(CCO)Cc1csc2ccccc12	ZINC000000345337	c2ccc1sccc1c2
COC3CCN(C[C@H]2CCN(c1ccc(Cl)cc1)C2=O)CC3	ZINC000000020541	O=C2C(CN1CCCCC1)CCN2c3ccccc3
C3C[C@H](C1=NCCN1)c2ccccc2C3	ZINC000000113428	C3CC(C1=NCCN1)c2ccccc2C3
CC1(C)NC(=N)NC(=N)N1c2c(Cl)cccc2Cl	ZINC000000071371	N=C2NCN(c1ccccc1)C(=N)N2
CN(C)CCNC(=O)c2cccc3ccc(c1ccncc1)nc23	ZINC000000024932	c3ccc2nc(c1ccncc1)ccc2c3
CC(C)Oc4ccc(CN3CCOc2ccc(C[N@@](C)CCc1ccccn1)cc2C3)cc4	ZINC000012246927	C(Cc1ccccn1)NCc4ccc3OCCN(Cc2ccccc2)Cc3c4
CN(C)CCc2cc1cc(Cl)ccc1sc3ccccc23	ZINC000000347697	c3ccc2sc1ccccc1ccc2c3
CS(=O)(=O)c1ccc(F)cc1	ZINC000000406916	c1ccccc1
Cc1ccccc1c4nc(C[N@]3CCC[C@@H](C(=O)NCCN2CCCC2)C3)c(C)o4	ZINC000005055847	O=C(NCCN1CCCC1)C4CCCN(Cc3coc(c2ccccc2)n3)C4
COc2ccc(C[C@H](C)NC[C@@H](O)c1ccc(O)c(NC=O)c1)cc2	ZINC000000000856	C(Cc1ccccc1)NCCc2ccccc2
N[C@H]1CCCCC1=O	ZINC000004722147	O=C1CCCCC1
COc5cc(Cn3c(c2ccc(OCCN1CCCC1)cc2)nc4ccccc34)ccc5CN6CCCC6	ZINC000026401475	C6CCN(CCOc5ccc(c2nc1ccccc1n2Cc4ccc(CN3CCCC3)cc4)cc5)C6
COc2ccc(O)c(C(=O)Nc1ccc(Cl)cc1)c2	ZINC000000024113	O=C(Nc1ccccc1)c2ccccc2
CCn3c(C)n[n+]4c(c1ccccc1)cc(c2ccccc2)nc34	ZINC000000391058	c4ccc(c3cc(c1ccccc1)[n+]2nc[nH]c2n3)cc4
C[C@@H](Cc3ccc(NC(=O)c2ccc(CNCCc1ccccc1)cc2)cc3)NCCc4cccc(Cl)c4	ZINC000045337537	O=C(Nc2ccc(CCNCCc1ccccc1)cc2)c4ccc(CNCCc3ccccc3)cc4
O[C@](C#CCN1CCCC1)(C2CCCC2)c3ccccc3	ZINC000000198383	C3CCC(C(C#CCN1CCCC1)c2ccccc2)C3
OCCCCCN5CCC([C@H]3[N@@](CC(=O)Nc1cc(Cl)cc(Cl)c1)CCc4cc(c2cccc(C#N)c2)ccc34)CC5	ZINC000014191784	O=C(CN3CCc2cc(c1ccccc1)ccc2C3C4CCNCC4)Nc5ccccc5
CC(NCCN1CCCCC1)=c2c(=O)[nH]c(=O)n(CC=C)c2=O	ZINC000000532596	O=c2[nH]c(=O)c(=CNCCN1CCCCC1)c(=O)[nH]2
CCN3CCN(c2ccc(/N=C/c1ccccc1O)cc2)CC3	ZINC000000353113	C3CN(c2ccc(N=Cc1ccccc1)cc2)CCN3
CCN1CCC5(CC1)Oc2ccccc2[C@H]4CC(c3ccccn3)=NN45	ZINC000000522622	C1CC5(CCN1)Oc2ccccc2C4CC(c3ccccn3)=NN45
CCOc2cccc(OCC)c3c(C)[n+](C[C@@H]1CCCO1)c(C)c23	ZINC000000198839	C3COC(C[n+]2cc1cccccc1c2)C3
Brc2cc[n+]1ccccc1c2	ZINC000000337512	c2cc[n+]1ccccc1c2
C[n+]2cc(Br)c1ccccc1c2	ZINC000000337510	c2ccc1cnccc1c2
COc2cc([C@H](C)NC1CCC(O)CC1)cc(OC)c2OC	ZINC000000016140	C2CCC(NCc1ccccc1)CC2
Cc2c(C)c1cccnc1c3ncccc23	ZINC000000120464	c1cnc3c(c1)ccc2cccnc23
CNC1CCN(C(C)=O)CC1	ZINC000012359886	C1CCNCC1
Cc1ccnc3c1ccc2c(C)ccnc23	ZINC000000120461	c1cnc3c(c1)ccc2cccnc23
C[N@]2Cc1sc(N)c(C#N)c1CC2(C)C	ZINC000000210021	C2Cc1ccsc1CN2
C[C@H](C(=O)N(C)O)c4ccc3cc(OCc2nc1ccccc1s2)ccc3c4	ZINC000000598963	C(Oc2ccc1ccccc1c2)c4nc3ccccc3s4
COC(=O)c1cccc(CN)c1	ZINC000000153955	c1ccccc1
Cc3cccc(NC(=O)CCN2CCN(c1ccccc1F)CC2)c3	ZINC000000255177	O=C(CCN2CCN(c1ccccc1)CC2)Nc3ccccc3
CCN(CC)CCSCCNc1c(C)cnc2ccc(Cl)cc12	ZINC000001683261	c2ccc1ncccc1c2
O[C@@H]4CCC[N@](C2C1CC3CC(C1)CC2C3)C4	ZINC000000291697	C4CCN(C2C1CC3CC(C1)CC2C3)CC4
COc2ccc(NC(=O)COc1ccccc1C(O)=O)cc2	ZINC000000035322	O=C(COc1ccccc1)Nc2ccccc2
CC[C@@H]1C[C@H](C#N)[C@@H]1N2CCCCC2	ZINC000000343732	C2CCN(C1CCC1)CC2
CCOC(=O)[C@@H]1CCCC[C@@H]1N	ZINC000000332584	C1CCCCC1
Fc3ccc(COc1ccccc1CNCC2CCNCC2)cc3	ZINC000010434648	C3CC(CNCc1ccccc1OCc2ccccc2)CCN3
COc4ccc(Cn2c(c1ccc(Cl)cc1)c[n+]3ccccc23)cc4	ZINC000000495020	C(c1ccccc1)n3c(c2ccccc2)c[n+]4ccccc34
CCc1[nH]c(=O)n(C(=O)C(C)C)c1C(=O)c3ccc(n2ccnc2C)cc3	ZINC000000575731	O=C(c2ccc(n1ccnc1)cc2)c3c[nH]c(=O)[nH]3
CCC[N@]1[C@H]3CC[C@@H]1CC(OC(=O)c2ccc(OC)c(OC)c2)C3	ZINC000000488024	O=C(OC1CC2CCC(C1)N2)c3ccccc3
CCCCN(CCCC)CCCNC(c1ccc(N(C)C)cc1)c2ccc(N(C)C)cc2	ZINC000004366545	C(c1ccccc1)c2ccccc2
O=C(Cc1ccccc1)Sc3nc2ccccc2[nH]3	ZINC000000035328	O=C(Cc1ccccc1)Sc3nc2ccccc2[nH]3
CC[C@@](CO)(C(=O)O[C@@H]1C[N+]2(C)CCC1CC2)c3ccccc3	ZINC000000355496	O=C(Cc1ccccc1)OC2CN3CCC2CC3
Cc2cc(C(=O)C(=NNc1cccc(Cl)c1)C#N)n(C(C)(C)C)n2	ZINC000000122922	O=C(C=NNc1ccccc1)c2ccn[nH]2
CC2=[N+](CCO)c1ccccc1C2(C)C	ZINC000000328121	C1C=Nc2ccccc12
CC1(C)CCC[C@@H]1CNC(=O)c3ccc(c2noc(CCC(F)(F)F)n2)cc3	ZINC000000603004	O=C(NCC1CCCC1)c3ccc(c2ncon2)cc3
CC[C@@H](C)[C@@](C)(N)CO	ZINC000000391128	nonring
CC(C)[N@]1CCc2c(C1)sc(N)c2C#N	ZINC000000049943	C2Cc1ccsc1CN2
COc2ccc(CCN[C@@H]1C[C@@H](C)N(C)C[C@H]1C)cc2OC	ZINC000000360065	C2CC(NCCc1ccccc1)CCN2
Fc2ccc(Cl)c(C(=O)n1cccn1)c2	ZINC000000037164	O=C(c1ccccc1)n2cccn2
COc2cc(OC)c(C(=O)CCCN1CCCC1)c(OC)c2	ZINC000000005191	O=C(CCCN1CCCC1)c2ccccc2
O=C(CC[N@]2CCC(c1ccccc1)=CC2)NCc3ccccc3	ZINC000000410092	O=C(CCN2CCC(c1ccccc1)=CC2)NCc3ccccc3
O=c3c1ccccc1c4nc2ccccc2cc34	ZINC000000064440	O=c3c1ccccc1c4nc2ccccc2cc34
CC(=O)c1c(C)cc(C)n(C)c1=O	ZINC000000033869	O=c1cccc[nH]1
Cc4ccc([C@@]2(O)CN1CCCSC1=[N+]2Cc3ccccc3)cc4	ZINC000000239738	C4CSC3=[N+](Cc1ccccc1)C(c2ccccc2)CN3C4
COc2ccc(CCNS(=O)(=O)c1ccc(SC)cc1)cc2	ZINC000000032597	O=S(=O)(NCCc1ccccc1)c2ccccc2
C/C(CN)=C/c1cn(C)cn1	ZINC000379300199	c1c[nH]cn1
FC(F)(F)c2cc(NC(=O)Nc1ccc(Cl)cc1)ccc2Cl	ZINC000000001188	O=C(Nc1ccccc1)Nc2ccccc2
C1CCc4c(C1)sc5ncnc(N3CCN(C/C=C/c2ccccc2)CC3)c45	ZINC000000894549	C1CCc4c(C1)sc5ncnc(N3CCN(CC=Cc2ccccc2)CC3)c45
O=C2C[C@@H](NCC1CCCCC1)C(=O)N2c5ccc(N4C(=O)C[C@H](NCC3CCCCC3)C4=O)cc5	ZINC000008412412	O=C2CC(NCC1CCCCC1)C(=O)N2c5ccc(N4C(=O)CC(NCC3CCCCC3)C4=O)cc5
COc3c1OCOc1cc2CC[N@](C)[C@@H](C[C@@H](C)O)c23	ZINC000000485912	C3Cc2cc1OCOc1cc2CN3
C1C[N+]3(CCO1)Cc2ccccc2C3	ZINC000000206959	C1C[N+]3(CCO1)Cc2ccccc2C3
NCCC4CCN(C(=O)[C@H](Cc1cccc(C(N)=N)c1)NS(=O)(=O)c3ccc2ccccc2c3)CC4	ZINC000034717909	O=C(C(Cc1ccccc1)NS(=O)(=O)c3ccc2ccccc2c3)N4CCCCC4
C[C@H]1COC[C@@H](C)N1C(=O)C[n+]4ccc(c3cc[n+](CC(=O)N2[C@@H](C)COC[C@H]2C)cc3)cc4	ZINC000004099019	O=C(C[n+]3ccc(c2cc[n+](CC(=O)N1CCOCC1)cc2)cc3)N4CCOCC4
O[C@@H](CNC[C@H]1CCCO1)Cn3c2ccccc2c4ccccc34	ZINC000000277126	C(CNCC1CCCO1)Cn3c2ccccc2c4ccccc34
CCOC(=O)[C@@H](C)Oc2ccc1c(C)cc(=O)oc1c2	ZINC000000041979	O=c2ccc1ccccc1o2
COC(=O)c3ccc(C[n+]2ccc1ccccc1c2)cc3	ZINC000000164277	C(c1ccccc1)[n+]3ccc2ccccc2c3
Brc3ccc(NC(=O)Cc1cccc2ccccc12)nc3	ZINC000000036036	O=C(Cc1cccc2ccccc12)Nc3ccccn3
Cc3nc([C@H]1CN2CCC1CC2)no3	ZINC000000002493	C1CN3CCC1C(c2ncon2)C3
COc5ccc(\C=N\CCC14CC3CC(C1)CC(CC/N=C/c2ccc(OC)cc2)(C3)C4)cc5	ZINC000015906655	C(CC14CC3CC(C1)CC(CCN=Cc2ccccc2)(C3)C4)N=Cc5ccccc5
CC(C)[C@@](O)([C@H](C)O)C(=O)OC[C@@H]1CC[N@]2CCC[C@@H]12	ZINC000000113464	C2CC1CCCN1C2
CC(=O)c4ccc3sc1ccccc1n(CCCN2CCC(CCO)CC2)c3c4	ZINC000000538186	C4CCN(CCCn2c1ccccc1sc3ccccc23)CC4
O=c5oc2cc(OCCN1CCCC1)ccc2c(c4ccc(OCCN3CCCC3)cc4)c5c6ccccc6	ZINC000096922047	O=c5oc2cc(OCCN1CCCC1)ccc2c(c4ccc(OCCN3CCCC3)cc4)c5c6ccccc6
COc1ccc(Cl)cc1NC(=O)Oc2ccc(CC=C)cc2OC	ZINC000000399640	O=C(Nc1ccccc1)Oc2ccccc2
OC(=O)c2ccc(CSCc1ccco1)cc2	ZINC000000060974	C(SCc1ccco1)c2ccccc2
CSc2nn(c1ccccc1)c(C)[n+]2c3ccccc3	ZINC000000156078	c3ccc(n2c[n+](c1ccccc1)cn2)cc3
CCc1cccc(CC)c1N2C(=N)NC(=N)NC2(C)C	ZINC000000071379	N=C2NCN(c1ccccc1)C(=N)N2
CCc3c(C(=O)c1ccccc1)oc4c(C)c2oc(=O)cc(C)c2cc34	ZINC000000088200	O=C(c1ccccc1)c4cc3cc2ccc(=O)oc2cc3o4
CC[C@H](N(C)C)c1nnc(SCCNCCO)n1c2ccccc2	ZINC000002655153	c2ccc(n1cnnc1)cc2
CN3CCN(c2ccc(S(=O)(=O)N1CCCCC1)cc2)CC3	ZINC000000151772	O=S(=O)(N1CCCCC1)c3ccc(N2CCNCC2)cc3
Cc3cc(C)cc(NC(=S)N2CCC(N1CCCCC1)(C(N)=O)CC2)c3	ZINC000000787378	S=C(Nc1ccccc1)N3CCC(N2CCCCC2)CC3
O[C@@H](CN2CCN(Cc1ccccc1)CC2)c3ccc(N(=O)=O)cc3	ZINC000000446528	C2CN(Cc1ccccc1)CCN2CCc3ccccc3
Cc2n(C)c1ccccc1[n+]2C[C@@H](O)COC3CCCCC3	ZINC000000110086	C3CCC(OCCC[n+]1c[nH]c2ccccc12)CC3
CCOc4ccc3nc2cc(NN=c1c(C)c(CN(CC)CC)cc(C)c1=O)ccc2c(N)c3c4	ZINC000005573694	O=c1ccccc1=NNc4ccc3cc2ccccc2nc3c4
Cc1cccc(C)c1NC(=O)CN2CCCC2	ZINC000000002011	O=C(CN1CCCC1)Nc2ccccc2
Cc2cc(c1cc(C)c(N)c(C)c1)cc(C)c2N	ZINC000000057517	c2ccc(c1ccccc1)cc2
CC(C)=CCC[C@@]2(C)OC(=O)N(Cc1ccccn1)[C@@]2(C)O	ZINC000000049470	O=C1OCCN1Cc2ccccn2
CC(=O)Nc2ccc(C(=O)NC1=NCCS1)cc2	ZINC000000030064	O=C(NC1=NCCS1)c2ccccc2
CC(C)(CN1CCCCC1)NS(=O)(=O)c2ccc(Cl)cc2	ZINC000000284040	O=S(=O)(NCCN1CCCCC1)c2ccccc2
CN(C)CCCn2c(=O)n(c1ccccc1)c3cc(Cl)ccc23	ZINC000000001182	O=c2[nH]c1ccccc1n2c3ccccc3
C[N@@](Cc2ccc(OC[C@@H](O)CN1CCCCC1)cc2)Cc3cn(C)nc3C	ZINC000011717379	C3CCN(CCCOc2ccc(CNCc1cn[nH]c1)cc2)CC3
COc3nc(Cl)nc(Nc1ccccc1c2ccccc2)n3	ZINC000000053634	N(c1ccccc1c2ccccc2)c3ncncn3
CC[N+]3=C(c1ccccc1)c2cc(OC)c(OC)cc2CC3	ZINC000000338408	C3Cc1ccccc1C(c2ccccc2)=N3
COc2ccc(CN(CCN(C)C)c1ncccn1)cc2	ZINC000000057513	C(Nc1ncccn1)c2ccccc2
C2CN(Cc1cccnc1)CCC2[N@]4CCc3ccccc3C4	ZINC000000316789	C2CN(Cc1cccnc1)CCC2N4CCc3ccccc3C4
CN2[C@@H]([N+](=O)Cc1c(F)cccc1Cl)C(C)(C)SC2=S	ZINC000000070485	O=[N+](Cc1ccccc1)C2CSC(=S)N2
COc2cc(CNC1CCCCCC1)c(N(=O)=O)cc2OC	ZINC000000263064	C2CCCC(NCc1ccccc1)CC2
Cn2nc(C(F)(F)F)c3cc(C(=O)Nc1ccc(F)cc1)sc23	ZINC000000082899	O=C(Nc1ccccc1)c3cc2cn[nH]c2s3
Cc1c(Cl)cccc1NC(=O)CSC(N)=O	ZINC000000033246	c1ccccc1
Cc2cc(C(=O)NCc1oc(C(C)(C)C)cc1C(O)=O)c(C)o2	ZINC000000032787	O=C(NCc1ccco1)c2ccoc2
c2ccc(n1ccnc1)cc2	ZINC000000160340	c2ccc(n1ccnc1)cc2
O=C4C[C@@H](c2nc(c1ccccc1)cs2)C3(CCCCC3)O4	ZINC000000044447	O=C4CC(c2nc(c1ccccc1)cs2)C3(CCCCC3)O4
CC(=O)NCCCCN	ZINC000001529505	nonring
CC(C)N5CCC(Oc4ccc(CN3CCN([C@@H](c1ccccc1)c2ccc(Cl)cc2)CC3)cc4)CC5	ZINC000045168976	C5CC(Oc4ccc(CN3CCN(C(c1ccccc1)c2ccccc2)CC3)cc4)CCN5
CCN(CC)C(=O)c2ccc(CSc1ccc(Cl)cc1)cc2	ZINC000000044448	C(Sc1ccccc1)c2ccccc2
CN(C)Cc2cc(CN(C)C)c(O)c(CCc1ccccc1)n2	ZINC000000186196	C(Cc1ccccn1)c2ccccc2
Cc4ccc(Cn2c1=NCCn1c3ccccc23)cc4	ZINC000000182195	C1Cn3c(=N1)n(Cc2ccccc2)c4ccccc34
Cc1ncc(N(=O)=O)n1Cc2ccc(Cl)cc2	ZINC000000034931	C(c1ccccc1)n2ccnc2
CCn6ccc5[n+](CCCCCCCCC[n+]2c1ccccc1c3cn(CC)ccc23)c4ccccc4c5c6	ZINC000473090947	C(CCCC[n+]2c1ccccc1c3c[nH]ccc23)CCCC[n+]5c4ccccc4c6c[nH]ccc56
Clc1ccccc1CC2=NCCN2	ZINC000000071199	C2CN=C(Cc1ccccc1)N2
COc1ccccc1N2C(=N)NC(=N)NC23CCCCC3	ZINC000000146413	N=C3NC(=N)N(c1ccccc1)C2(CCCCC2)N3
COc3cc(CN2CCc1cc(OC)c(OC)cc1C2)cc(Br)c3O	ZINC000000755742	C2Cc1ccccc1CN2Cc3ccccc3
CC(C)(C)OC(=O)N2CCC(c1cnc[nH]1)CC2	ZINC000000017075	C2CC(c1cnc[nH]1)CCN2
COc1ccccc1CNc3ccc2n(C)cnc2c3	ZINC000000170024	C(Nc2ccc1[nH]cnc1c2)c3ccccc3
COc3ccc2[nH]cc(C[C@@H]1CCC[N@]1C)c2c3	ZINC000000005452	C3CNC(Cc1c[nH]c2ccccc12)C3
CCC(=O)C[n+]1ccccc1	ZINC000001666374	c1ccncc1
Cc4ccc3O[C@H](CC(=O)NCCCN2CCC(N1CCCCC1)CC2)C(=O)Nc3c4	ZINC000005069934	O=C(CC2Oc1ccccc1NC2=O)NCCCN4CCC(N3CCCCC3)CC4
CC(=O)C[C@@H]1CCCCN1	ZINC000000001592	C1CCNCC1
CCN(CC)c2ccc(C(=O)Nc1cc(Cl)cc(Cl)c1)cc2	ZINC000000060743	O=C(Nc1ccccc1)c2ccccc2
CCOC(CN)OCC	ZINC000000404274	nonring
CN3CCN(C(=S)c2ccc(OCc1ccccc1)cc2)CC3	ZINC000000573513	S=C(N1CCNCC1)c3ccc(OCc2ccccc2)cc3
CN3CCN(C(=O)Nc1c(C)noc1c2ccccc2)CC3	ZINC000000129821	O=C(Nc1cnoc1c2ccccc2)N3CCNCC3
CC(C)N1CCC(N(C)C(=O)CNC(=O)CN)CC1	ZINC000037804657	C1CCNCC1
CN(C)C[C@H](c1ccc(O)cc1)C2(O)CCCCC2	ZINC000000009342	C2CCC(Cc1ccccc1)CC2
Fc3ccc(C(=O)NC2Cc1ccccc1C2)cc3	ZINC000000009340	O=C(NC2Cc1ccccc1C2)c3ccccc3
CN4CCN(c2nc1n(C)c(=O)n(C)c(=O)c1n2Cc3ccc(Cl)cc3Cl)CC4	ZINC000000641044	O=c4[nH]c(=O)c3n(Cc1ccccc1)c(N2CCNCC2)nc3[nH]4
CC(C)(C)OC(=O)N(CCCN)CCCCN(CCCN)C(=O)OC(C)(C)C	ZINC000005713956	nonring
COC5=C[C@]14CCC[N@]1CCc3cc2OCOc2cc3[C@@H]4[C@H]5O	ZINC000000402821	C5CN4CCc2cc1OCOc1cc2C3CC=CC34C5
COc5ccc(N2C(=O)[C@H]1[C@@H]3C=C[C@H]([C@H]1C2=O)C3=C4CCCC4)cc5	ZINC000000049360	O=C2C1C4C=CC(C1C(=O)N2c3ccccc3)C4=C5CCCC5
CN(C)CCc1c[nH]c2ccc(O)cc12	ZINC000000001070	c2ccc1[nH]ccc1c2
CCOc3cc([C@@H]1NCCc2cc(OCC)c(OCC)cc12)ccc3O	ZINC000000718277	C3Cc1ccccc1C(c2ccccc2)N3
NCC2CCC(C(=O)Oc1ccc(CCC(O)=O)cc1)CC2	ZINC000000001112	O=C(Oc1ccccc1)C2CCCCC2
CCN(CC(C)=C)C(=O)C2CCN(Cc1ccccn1)CC2	ZINC000000236121	C2CCN(Cc1ccccn1)CC2
CN3CCN(c2ccc(NC(=O)c1ccc(C)cc1C)cc2)CC3	ZINC000000557948	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
C[N@]4CCc1cc(Cl)c(O)cc1[C@H](c3cccc2CCOc23)C4	ZINC000000005515	C4Cc1ccccc1C(c3cccc2CCOc23)CN4
CCN(CC)CC(C)(C)CO	ZINC000000394084	nonring
NC(=N)[C@@H](O)c1ccccc1	ZINC000002014683	c1ccccc1
NCc1cccc(Cl)c1	ZINC000000164422	c1ccccc1
NC1CCC(CO)CC1	ZINC000001640342	C1CCCCC1
Cc1n[nH]c(C)c1Cl	ZINC000000035825	c1cn[nH]c1
CS(=O)(=O)N2CCN(c1ccc(F)cc1)CC2	ZINC000000029520	C2CN(c1ccccc1)CCN2
Clc3ccc(C(=O)CSc2nc(c1ccc(Br)cc1)n[nH]2)cc3	ZINC000000625726	O=C(CSc2nc(c1ccccc1)n[nH]2)c3ccccc3
CN4CCC(N(C)C(=O)CC[C@H]2CN(Cc1ccccc1Cl)CC[C@H]2N3CCOCC3)CC4	ZINC000011911168	O=C(CCC2CN(Cc1ccccc1)CCC2N3CCOCC3)NC4CCNCC4
Cc3nc2n(C)c1ccccc1n2c3C(=O)OCCN4CCCCC4	ZINC000000255157	O=C(OCCN1CCCCC1)c3cnc4[nH]c2ccccc2n34
CC(C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000000056646	c2ccc1[nH]ccc1c2
COC(=O)c1ccc([C@@H](C)N(C)C)o1	ZINC000000182990	c1ccoc1
NCCC(F)(F)CN	ZINC000005113415	nonring
CCOC(=O)c2cccc(NC(=O)[C@@H](C)Oc1ccc(OC)cc1)c2	ZINC000000119653	O=C(COc1ccccc1)Nc2ccccc2
C2CN=CN(Cc1cccnc1)C2	ZINC000000009127	C2CN=CN(Cc1cccnc1)C2
NCCC(=O)CN	ZINC000001690288	nonring
C[C@H]5CC[N@]6C[C@]47C[C@@]3(C(=O)Nc2c1OC=CC(C)(C)Oc1ccc23)C(C)(C)[C@@H]4C[C@]56C(=O)N7C	ZINC000000603253	O=C3Nc2c1OC=CCOc1ccc2C36CC5CC47CCCN4CC5(C6)NC7=O
CN(C)C(=O)c2ccc(CC1CCNCC1)cc2	ZINC000000008347	C2CC(Cc1ccccc1)CCN2
Clc2nc(Cl)c(C(=O)N1CCOCC1)c(Cl)c2Cl	ZINC000000054354	O=C(N1CCOCC1)c2cccnc2
CN(/N=C/c1ccc(C)o1)C2=NCCN2	ZINC000000255709	C2CN=C(NN=Cc1ccco1)N2
CCN(C[C@@H]2CCC[N@@](CCc1cccc(OC)c1)C2)Cc3cnn(C)c3	ZINC000012590259	C3CC(CNCc1cn[nH]c1)CN(CCc2ccccc2)C3
CCCN(CCCCCCC[N@](CCC)[C@H]2CCc1c(O)cccc1C2)[C@H]4CCc3c(O)cccc3C4	ZINC000095562515	C(CCCNC2CCc1ccccc1C2)CCCNC4CCc3ccccc3C4
CN(C)CCc2ccc(NC(=O)c1ccc(CCN(C)C)cc1)cc2	ZINC000008577259	O=C(Nc1ccccc1)c2ccccc2
CCNCCOCC	ZINC000002522933	nonring
COc3ccc2cc(C(=O)Nc1cc(C)on1)sc(=O)c2c3OC	ZINC000000079344	O=C(Nc1ccon1)c3cc2ccccc2c(=O)s3
COC(=O)[C@H](Cc1cnc[nH]1)NCc2ccccc2	ZINC000000402730	C(Cc1cnc[nH]1)NCc2ccccc2
Clc3ccc2c(Cl)c(C(=O)N1CCNCC1)sc2c3	ZINC000000374513	O=C(N1CCNCC1)c3cc2ccccc2s3
C4CCN(CCn2c(/N=C/c1cccs1)nc3ccccc23)CC4	ZINC000000196168	C4CCN(CCn2c(N=Cc1cccs1)nc3ccccc23)CC4
CN(C)CC[C@](O)(c1ccccc1)c2cccnc2	ZINC000000228585	C(c1ccccc1)c2cccnc2
NCC(O)(c1ccc(Cl)cc1)c2ccc(Cl)cc2	ZINC000000053230	C(c1ccccc1)c2ccccc2
CC(C)(CO)NC[C@@H](O)c1ccccc1	ZINC000000004237	c1ccccc1
CC(C)[N@@](C)C2CCN(C(=S)Nc1ccc(C)cc1)CC2	ZINC000000261028	S=C(Nc1ccccc1)N2CCCCC2
OC1C[C@@H]2CC[C@H](C1)[N@]2CCc3ccccc3	ZINC000000027584	C1CC2CCC(C1)N2CCc3ccccc3
CCCCN(CCCC)CCCOC(=O)c1ccc(CN(CC)CC)cc1	ZINC000005513640	c1ccccc1
CN1[C@H]3CC[C@@H]1CC(NCCc2ccccc2)C3	ZINC000000027586	C(Cc1ccccc1)NC2CC3CCC(C2)N3
C[C@H]3CN(C(=O)[C@H]1C[C@@H]1C(O)=O)C2(CCCC2)O3	ZINC000000041086	O=C(C1CC1)N2CCOC23CCCC3
C[C@@H](Sc1ccccc1)C(=O)Nc3ccc(Oc2ccccc2)cc3	ZINC000000443860	O=C(CSc1ccccc1)Nc3ccc(Oc2ccccc2)cc3
CCN(CC)CCCOC(=O)c2ccc1c4cccc3c(C(=O)OCCCN(CC)CC)ccc(c1c2)c34	ZINC000019926136	c1ccc2c(c1)c4cccc3cccc2c34
C3CN(c1n[nH]c2ccccc12)CCN3	ZINC000000013497	C3CN(c1n[nH]c2ccccc12)CCN3
CCN4CCN(C(=O)c3ccc(N2CCC(NCc1ccc(F)c(F)c1)CC2)cc3)CC4	ZINC000014977403	O=C(N1CCNCC1)c4ccc(N3CCC(NCc2ccccc2)CC3)cc4
CC(C)(C)OC(=O)N[C@@H]1CCOC1=O	ZINC000000057081	O=C1CCCO1
COC(=O)C1[C@@H](C)C(C)[C@@H]1C	ZINC000000039934	C1CCC1
COc4cc3cc[n+]2c(C)c1cc(OC)c(OC)cc1cc2c3cc4OC	ZINC000000625876	c4ccc3c[n+]2ccc1ccccc1c2cc3c4
Cc3c(C(=O)CC[N@]2CCC(c1ccc(F)cc1)=CC2)cnn3CCO	ZINC000000537749	O=C(CCN2CCC(c1ccccc1)=CC2)c3cn[nH]c3
C[C@@H]2CCC[C@]3(C)C[C@H]1OC(=O)C(=C)[C@H]1C=C23	ZINC000000000888	C=C3C2C=C1CCCCC1CC2OC3=O
CC(C)OCCN	ZINC000002556906	nonring
CCCn4c1ccccc1n5cc(c3ccc(c2ccccc2)cc3)nc45	ZINC000000758212	c5ccc(c4ccc(c1cn3c(n1)[nH]c2ccccc23)cc4)cc5
CCN(C[C@@H]2CCC[N@@](CCc1cccc(OC)c1)C2)C(=O)Cn3ccnc3C	ZINC000011819293	O=C(Cn1ccnc1)NCC3CCCN(CCc2ccccc2)C3
CN(C)CCCN(CCCN(C)C)CC(c1ccccc1)c2ccccc2	ZINC000004987384	C(c1ccccc1)c2ccccc2
CO/N=C(\C)c1scnc1C	ZINC000000010270	c1cscn1
CC(=O)N2CCC(NCCc1ccccc1)CC2	ZINC000000212327	C2CC(NCCc1ccccc1)CCN2
CCN2CCN(CCNC(=O)C(=O)Nc1cccc(CN(C)C)c1)CC2	ZINC000041719253	O=C(NCCN1CCNCC1)C(=O)Nc2ccccc2
CCC(=O)Nc2sc(Cc1ccccc1)c(C)c2C(N)=O	ZINC000000038752	C(c1ccccc1)c2cccs2
CO[C@@]5(c1nccs1)CCc4ccc(OCc3ccc2ccccc2c3)cc45	ZINC000000597557	C4Cc3ccc(OCc2ccc1ccccc1c2)cc3C4c5nccs5
Clc2ccc(Cn1ccc(N(=O)=O)n1)cc2	ZINC000000035828	C(c1ccccc1)n2cccn2
OCCN(CCO)Cc1cc(F)ccc1F	ZINC000000213230	c1ccccc1
CCN5CCN(c3nc2cc1OCOc1cc2cc3CN[C@@H]4CCOC(C)(C)C4)CC5	ZINC000012210484	C5CN(c3nc2cc1OCOc1cc2cc3CNC4CCOCC4)CCN5
C/N=C(\N1CCOCC1)c5ccc(NC(=O)c4ccc(C(=O)Nc3ccc(C(=N\C)\N2CCOCC2)cc3)cc4)cc5	ZINC000008622562	N=C(N1CCOCC1)c5ccc(NC(=O)c4ccc(C(=O)Nc3ccc(C(=N)N2CCOCC2)cc3)cc4)cc5
COc3ccc(C(=O)NCC2CCN(C1CCNCC1)CC2)cc3OCCc4ccc(Cl)cc4Cl	ZINC000013643465	O=C(NCC2CCN(C1CCNCC1)CC2)c4cccc(OCCc3ccccc3)c4
Oc1ccccc1c2nnco2	ZINC000000001423	c2ccc(c1nnco1)cc2
COc3ccc(c2cc(=O)c1cc(OC)ccc1o2)c(OC)c3	ZINC000000057848	O=c2cc(c1ccccc1)oc3ccccc23
C[C@H]2OC1(CCN(C)CC1)CC2=C	ZINC000000004140	C=C2COC1(CCNCC1)C2
CCN(C)C(=O)Oc1cccc([C@H](C)N(C)C)c1	ZINC000000004413	c1ccccc1
CCn1cc[n+](CC=C)c1	ZINC000144155854	c1c[nH]cn1
OC(=O)CCc2ccc(c1cccs1)o2	ZINC000000099261	c2coc(c1cccs1)c2
C[N@]1[C@H]3CC[C@@H]1CC(NC(=O)CSc2nnc(N)s2)C3	ZINC000000136089	O=C(CSc1nncs1)NC2CC3CCC(C2)N3
CN(C)CCN(Cc1ccccc1)Cc2ccc(N(=O)=O)cc2	ZINC000000234500	C(NCc1ccccc1)c2ccccc2
Cn3c(NCc1c[nH]c2ccccc12)nc4ccccc34	ZINC000000099267	C(Nc2nc1ccccc1[nH]2)c3c[nH]c4ccccc34
CC[C@H](N(C)C)C(=O)NCCCCCCNC(=O)[C@H](CC)N(C)C	ZINC000004530313	nonring
C/C=C1/C[C@H](C)[C@](C)(O)C(=O)OC[C@@H]2CC[N@]3CC[C@H](OC1=O)[C@H]23	ZINC000000000649	C=C1CCCC(=O)OCC2CCN3CCC(OC1=O)C23
CCOP(=O)(OCC)C(C)(C)NCCCC[P+](c1ccccc1)(c2ccccc2)c3ccccc3	ZINC000095581396	c3ccc(P(c1ccccc1)c2ccccc2)cc3
COc3ccc2nc(C)c1C[C@H](C)Oc1c2c3	ZINC000000053283	C3Cc2cnc1ccccc1c2O3
CC(C)C(=O)N3CCN(c1ccccc1NC(=O)COc2cc(C)c(Cl)c(C)c2)CC3	ZINC000000624095	O=C(COc1ccccc1)Nc2ccccc2N3CCNCC3
C[C@@H](NCc1cccn1CCN2CCOCC2)c3ccccc3	ZINC000004681399	C3CN(CCn1cccc1CNCc2ccccc2)CCO3
OC[C@@H]4[C@H]2Cn1c(cccc1=O)[C@H]2N(CC3CCCCC3)[C@H]4C(=O)N[C@H]6CC[N@@](Cc5ccccc5)C6	ZINC000044416806	O=C(NC2CCN(Cc1ccccc1)C2)C5CC4Cn3c(cccc3=O)C4N5CC6CCCCC6
CCCCCNCCO	ZINC000001716840	nonring
CN4CCN(c2nc1n(C)c(=O)[nH]c(=O)c1n2Cc3ccccc3)CC4	ZINC000000633258	O=c4[nH]c(=O)c3n(Cc1ccccc1)c(N2CCNCC2)nc3[nH]4
C[C@H](Cc1cc(C)cc(=O)n1O)CC(C)(C)C	ZINC000000000645	O=c1cccc[nH]1
N[C@@H](CC(=O)c1cc(Cl)ccc1N)C(O)=O	ZINC000000007614	c1ccccc1
O=C(OCCN1CCCCC1)[C@H]2CC2(c3ccccc3)c4ccccc4	ZINC000000000647	O=C(OCCN1CCCCC1)C2CC2(c3ccccc3)c4ccccc4
Nc3nc2n([C@H]1C[C@@H](CO)C=C1)cnc2c(=O)[nH]3	ZINC000000004093	O=c2[nH]cnc3n(C1CCC=C1)cnc23
CN1C(=O)C(C)(C)c2cccnc12	ZINC000000011335	O=C2Cc1cccnc1N2
CO[C@@H]1C[C@@H](NC(=O)C(F)(F)F)[C@H](O)[C@H](C)O1	ZINC000001866133	C1CCOCC1
Cc2n(C)c1ccccc1[n+]2CS(C)(=O)=O	ZINC000000282365	c2ccc1[nH]cnc1c2
COc3ccc(C[C@@H](C)N[C@H](C)c1cccc2ccccc12)cc3OC	ZINC000000217435	C(Cc1ccccc1)NCc2cccc3ccccc23
COC(=O)c2ccc(NC(=O)c1ccc(Cl)cc1)cc2	ZINC000000029637	O=C(Nc1ccccc1)c2ccccc2
CCOC(=O)c3c(NC(=O)NCC1CCNCC1)sc2CCCCc23	ZINC000000734250	O=C(NCC1CCNCC1)Nc3cc2CCCCc2s3
CCn1c(C)[n+](CC)c2cc(C(=O)N(C)C)ccc12	ZINC000000243465	c2ccc1[nH]cnc1c2
CCOc2ccc(/C=C/C(=O)Nc1cc(C)ccc1OC)cc2OC	ZINC000000145195	O=C(Nc1ccccc1)C=Cc2ccccc2
SCC(=N)NC1CCCC1	ZINC000001733093	C1CCCC1
Cc3ccc2nc(Nc1ccccc1)cc(C)c2c3	ZINC000000055003	N(c1ccccc1)c3ccc2ccccc2n3
CN1CC[N+](C)=C1F	ZINC000000404760	C1CN=CN1
Cc3sc2[nH]c(=O)n(c1ccccc1)c(=O)c2c3C	ZINC000000052908	O=c2[nH]c1sccc1c(=O)n2c3ccccc3
CC(C)(C)c2cc1OC(=O)Cc1c(C(C)(C)C)c2O	ZINC000000021359	O=C2Cc1ccccc1O2
COc3ccc2cc1c(N)n[nH]c1nc2c3	ZINC000000012789	c3ccc2nc1[nH]ncc1cc2c3
C[N+](C)(C)Cc1c[nH]c2ccccc12	ZINC000000401632	c2ccc1[nH]ccc1c2
Clc4ccc(n3c(=O)[nH]c2sc1CCCCc1c2c3=O)cc4	ZINC000000052907	O=c3[nH]c2sc1CCCCc1c2c(=O)n3c4ccccc4
Cc1ccc(C(N)=N)cc1	ZINC000000166777	c1ccccc1
CCOC(=O)Nc1cccc(Cl)c1C	ZINC000000063642	c1ccccc1
Nc2nnc(CCSc1ccc(Br)cc1)s2	ZINC000000052902	C(Cc1nncs1)Sc2ccccc2
COc3ccc(c2cs\c(=N/N1CCN(C)CC1)n2CC=C)cc3	ZINC000000392145	C3CN(N=c2[nH]c(c1ccccc1)cs2)CCN3
O[C@@H](COc2c1ccccc1nc3ccccc23)CN5CCN(c4ccccc4)CC5	ZINC000005593399	C(COc2c1ccccc1nc3ccccc23)CN5CCN(c4ccccc4)CC5
CCC[n+]1cccc2cc(OC)ccc12	ZINC000000276943	c2ccc1ncccc1c2
O=C(N1CCNCC1)c2ccccc2	ZINC000000235748	O=C(N1CCNCC1)c2ccccc2
CC(C)(C)OC(=O)N1CCC4(CC1)C[C@@H](N3CCC(N2CCCC2)CC3)CO4	ZINC000006747709	C4CCN(C3CCN(C2COC1(CCNCC1)C2)CC3)C4
CN[C@@]1(C)CCS(=O)(=O)C1	ZINC000003866151	O=S1(=O)CCCC1
Cc1ccc[n+](CC(N)=O)c1C	ZINC000001920110	c1ccncc1
CC[N+](C)(CC)CCNC(=O)Nc1ccc(C)c(NC(=O)NCC[N+](C)(CC)CC)c1	ZINC000005065265	c1ccccc1
C[C@H](CN(C)C)CN2c1ccccc1S(=O)(=O)c3ccccc23	ZINC000000000582	O=S3(=O)c1ccccc1Nc2ccccc23
C2CN=C(Cc1cccs1)N2	ZINC000001681366	C2CN=C(Cc1cccs1)N2
CNC[C@H](Cc2ccc1ccccc1c2)NC[C@@H](Cc4ccc3ccccc3c4)NCC5CCC(C)CC5	ZINC000096921312	C5CCC(CNC(CNCCc2ccc1ccccc1c2)Cc4ccc3ccccc3c4)CC5
COC(=O)c4ccc(C[n+]3cc(c1ccccc1)n2CCCc23)cc4	ZINC000000408972	C1Cc3n(C1)c(c2ccccc2)c[n+]3Cc4ccccc4
Cc2cc(C)nc(NCCc1ccc(O)c(O)c1)n2	ZINC000000024799	C(Cc1ccccc1)Nc2ncccn2
Cc1ccccc1NC(=O)CC#N	ZINC000000039365	c1ccccc1
CCSc2nc1ccccc1n2CO	ZINC000000040115	c2ccc1[nH]cnc1c2
CC(C)NC(=O)c1non(=O)c1C(=O)NC(C)C	ZINC000000000394	O=n1ccno1
COC(=O)[C@@H](CN)c1c[nH]c2ccc(OC)cc12	ZINC000000000392	c2ccc1[nH]ccc1c2
CC(C)CCNCC(C)(C)O	ZINC000001716846	nonring
COc3ccc(CNCC2(c1ccccc1)CCCC2)cc3OC	ZINC000000186772	C3CCC(CNCc1ccccc1)(c2ccccc2)C3
CN(C)c3ccc(\C=C\CN2CCN(c1ccc(F)cc1)CC2)cc3	ZINC000000217104	C2CN(c1ccccc1)CCN2CC=Cc3ccccc3
CC(C)(C)C(=O)CN	ZINC000000874081	nonring
COc3ccc([C@@H]2OC[C@@H](CN1CCCCC1)O2)cc3	ZINC000000187157	C3CCN(CC2COC(c1ccccc1)O2)CC3
C4CCN(CCC[C@H]2Oc1ccccc1Sc3ccccc23)CC4	ZINC000000347509	C4CCN(CCCC2Oc1ccccc1Sc3ccccc23)CC4
CCOC(=O)C[n+]2c(c1ccc(C)cc1)n(C)c3ccccc23	ZINC000000388791	c3ccc(c2nc1ccccc1[nH]2)cc3
CCn1c(C)[n+](CC)c2ccccc12	ZINC000000162460	c2ccc1[nH]cnc1c2
Cc3cc2c(=C/c1ccc(C)o1)/oc(=O)c2c(=O)[nH]3	ZINC000000050634	O=c2[nH]ccc3c(=Cc1ccco1)oc(=O)c23
C4CCN(CNc2ncnc3n(CN1CCCCC1)cnc23)CC4	ZINC000000077342	C4CCN(CNc2ncnc3n(CN1CCCCC1)cnc23)CC4
CN6CCN(C(=O)CCCc4cn(C[N@]1C[C@@H]3C[C@H](C1)c2cccc(=O)n2C3)c5ccccc45)CC6	ZINC000020759976	O=C(CCCc4cn(CN1CC3CC(C1)c2cccc(=O)n2C3)c5ccccc45)N6CCNCC6
O=C([C@@H]1C[C@@H]1c2ccccc2)N(Cc5ccc(c4ccc(CNCCc3ccccc3)cc4)cc5)C6CCNCC6	ZINC000049614042	O=C(C1CC1c2ccccc2)N(Cc5ccc(c4ccc(CNCCc3ccccc3)cc4)cc5)C6CCNCC6
O[C@@]3(c1ccc(F)cc1)C[n+]2ccccc2N3c4ccccc4	ZINC000000239777	C3C(c1ccccc1)N(c2ccccc2)c4cccc[n+]34
Cc2ccc(NC(=S)N1CCCCCC1)cc2	ZINC000000099084	S=C(Nc1ccccc1)N2CCCCCC2
COc1ccc(CC#N)c(O)c1OC	ZINC000000033964	c1ccccc1
CCOC(=O)c2cnc1c(CC)cccc1c2N3CCN(C)CC3	ZINC000000131539	C3CN(c1ccnc2ccccc12)CCN3
Cc2ccc(NNC=c1c(C)c(C#N)c(=O)n(C)c1=O)cc2C	ZINC000000482688	O=c2ccc(=CNNc1ccccc1)c(=O)[nH]2
CC(=O)Nc4ccc3nc(SCC(=O)c2ccc1ccccc1c2)sc3c4	ZINC000000624506	O=C(CSc2nc1ccccc1s2)c4ccc3ccccc3c4
COc1ccccc1CNC(=O)[C@H]3CN(c2ccc(F)cc2)C(=O)C3	ZINC000000084005	O=C2CC(C(=O)NCc1ccccc1)CN2c3ccccc3
CCCN3CCC(N2CCN(c1ccccn1)CC2)CC3	ZINC000000219953	C3CC(N2CCN(c1ccccn1)CC2)CCN3
CN3CCC(CNC(=O)Nc1csc2ccccc12)CC3	ZINC000000159390	O=C(NCC1CCNCC1)Nc2csc3ccccc23
CC1(C)[C@@H]2CC[C@@]1(CS(N)(=O)=O)C(=O)C2	ZINC000000039110	O=C1CC2CCC1C2
CCN(CCN(C)C)c2cc(c1cccnc1)nc3ccccc23	ZINC000005840851	c3ccc2nc(c1cccnc1)ccc2c3
NCCc1cc(O)c(O)cc1O	ZINC000000039112	c1ccccc1
CN2C(c1cccs1)N(C)c3ccccc23	ZINC000000040986	N2C(c1cccs1)Nc3ccccc23
Brc1cnc(C#N)nc1	ZINC000000053986	c1cncnc1
O=c4c([n+]1ccccc1)cc3[nH]c2ccccc2c3n4c5ccccc5	ZINC000000318448	O=c4c([n+]1ccccc1)cc3[nH]c2ccccc2c3n4c5ccccc5
CN(C)c5cc[n+](Cc4ccc(c3ccc(C[n+]2ccc(N(C)c1ccc(Cl)cc1)cc2)cc3)cc4)cc5	ZINC000103262577	C(c4ccc(c3ccc(C[n+]2ccc(Nc1ccccc1)cc2)cc3)cc4)[n+]5ccccc5
CN(C)CCNC(=O)[C@@H]2C[C@H](Sc1ccc(F)cc1)C[N@]2Cc3cccc(C)c3	ZINC000011788831	C2CN(Cc1ccccc1)CC2Sc3ccccc3
N[C@H]1[C@@H](O)Cc2ccccc12	ZINC000000154815	C2Cc1ccccc1C2
OC2CCN(Cc1cc(Br)cs1)CC2	ZINC000000040751	C2CCN(Cc1cccs1)CC2
CC(C)Oc3ccc(Cc2ccc(NC1=NCCN1)cc2)cc3	ZINC000000007547	C3CN=C(Nc2ccc(Cc1ccccc1)cc2)N3
CC(=O)N3CCC(NC(c1ccccc1)c2ccccc2)CC3	ZINC000000215472	C3CC(NC(c1ccccc1)c2ccccc2)CCN3
Cc2sc(NC(=O)c1ccccc1C(O)=O)c(C#N)c2C	ZINC000000061869	O=C(Nc1cccs1)c2ccccc2
COc3ccc(C=c1sc(=O)nc1Nc2ccccc2)c(OC)c3	ZINC000000084124	O=c3nc(Nc1ccccc1)c(=Cc2ccccc2)s3
COc3ccc(\C=N\CC2(c1ccccc1)CCCC2)cc3OC	ZINC000000507028	C3CCC(CN=Cc1ccccc1)(c2ccccc2)C3
CC4(C)CC(Nc2ncnc3sc1CCCCc1c23)CC(C)(C)N4	ZINC000000148070	C1CCc3c(C1)sc4ncnc(NC2CCNCC2)c34
CCNC[C@@H]1CCCN1C	ZINC000022073396	C1CCNC1
Cc1cc(=O)oc2cc(NC(=O)CN)ccc12	ZINC000000057339	O=c2ccc1ccccc1o2
CCN(CC)C(=O)O[n+]1ccccc1C(C)C	ZINC000000368074	c1ccncc1
CCN(CC)CCNC(=S)N/N=C(C)/C(C)=N\NC(=S)NCCN(CC)CC	ZINC000005572751	nonring
CN(C)[C@@H](CC1N(C)C=NC1=S)C(O)=O	ZINC000000012656	S=C1CNC=N1
S=C(Nc1ccccc1)c2ccccc2	ZINC000000028345	S=C(Nc1ccccc1)c2ccccc2
OC(=O)CCSC1=CCS(=O)(=O)c2ccc(Cl)cc12	ZINC000000108131	O=S2(=O)CC=Cc1ccccc12
CCOC(=O)c1ccc(CN)o1	ZINC000000031836	c1ccoc1
CC[C@@](C)(NS(=O)(=O)c1c(C)ccc2nsnc12)C#C	ZINC000000033712	c2ccc1nsnc1c2
CC[N@@](CCCNC3CCN(CC(c1ccccc1)c2ccccc2)CC3)CCc4ccc(Cl)cc4	ZINC000028331031	C(CNCCc1ccccc1)CNC4CCN(CC(c2ccccc2)c3ccccc3)CC4
NC(=O)CN4CCC(n2cc(c1cccc(O)c1)c3c(N)ncnc23)CC4	ZINC000000590741	C4CC(n2cc(c1ccccc1)c3cncnc23)CCN4
C[N+]3(C)Cc2cc1ccccc1c(Cl)c2C3	ZINC000000186996	C2NCc3cc1ccccc1cc23
Nc1ccc(C(=O)NCCC(O)=O)cc1	ZINC000000120074	c1ccccc1
Cn1cccc1CNC[C@@H]2CCCO2	ZINC000000360271	C2COC(CNCc1ccc[nH]1)C2
COc4cc(CN3CCC(c2nnc(SCCN1CCCCC1)n2C)CC3)cc5OCOc45	ZINC000011813604	C5CCN(CCSc4nnc(C3CCN(Cc2ccc1OCOc1c2)CC3)[nH]4)CC5
CNCCCNCc1ccc(OCC(=O)NC(C)(C)C)cc1	ZINC000006882415	c1ccccc1
COc1cc(C=O)ccc1OC2=NS(=O)(=O)c3ccccc23	ZINC000000041717	O=S3(=O)N=C(Oc1ccccc1)c2ccccc23
Cc6ccc([C@H]1C4=C(N=c2nc[nH]n12)c3ccccc3O[C@@H]4c5cccs5)cc6	ZINC000000635798	O5C(c1cccs1)C3=C(N=c2nc[nH]n2C3c4ccccc4)c6ccccc56
COC(=O)Cc3c(C)c2ccc(O)c(CN1CCCCC1)c2oc3=O	ZINC000000489063	O=c3ccc2cccc(CN1CCCCC1)c2o3
CNC(=O)Oc3ccc(c2c[n+]1cc(Cl)ccc1n2C)cc3	ZINC000000387370	c3ccc(c2c[n+]1ccccc1[nH]2)cc3
CC(C)(C)NCCn2c(c1ccc(Br)cc1)cn4c2nc3ccccc34	ZINC000000708905	c4ccc(c3cn2c(nc1ccccc12)[nH]3)cc4
COc1ccc(N(=O)=O)cc1C(F)(F)F	ZINC000000056590	c1ccccc1
C[N@@](C[C@@H]1COCCO1)Cc2ccccc2c3nc(CN)cc(=O)[nH]3	ZINC000023541980	O=c3ccnc(c1ccccc1CNCC2COCCO2)[nH]3
C[N+](C)(C)c1cnc(N)nc1	ZINC000000080311	c1cncnc1
C[C@@H](CN(C)C)OC(=O)c2ccc1OCOc1c2	ZINC000000206169	C2Oc1ccccc1O2
Cc1ccccc1NC(=N)Nc2nc(C(F)(F)F)cc(=O)[nH]2	ZINC000000269242	N=C(Nc1ccccc1)Nc2nccc(=O)[nH]2
CCOC(=O)N3CCC(NCCc1c[nH]c2ccccc12)CC3	ZINC000000221604	C3CC(NCCc1c[nH]c2ccccc12)CCN3
CCCCOCCN	ZINC000001672246	nonring
CCN(CC)C[C@@H](O)COc3ccc(C[N@@](C)Cc2[nH]nc1CCCCc12)cc3OC	ZINC000011820058	C1CCc2c(C1)n[nH]c2CNCc3ccccc3
CC1(C)CC(=O)c2c(C1)n[nH]c2c3ccc(F)cc3	ZINC000000090936	O=C2CCCc3n[nH]c(c1ccccc1)c23
OCCNCc1ccccn1	ZINC000001769282	c1ccncc1
Oc1ccccc1OC(=O)c2ccccc2	ZINC000000050858	O=C(Oc1ccccc1)c2ccccc2
CN(C)CCN[C@@H]1CNC[C@@H]1Cc2cccc(N)n2	ZINC000040413863	C2CC(Cc1ccccn1)CN2
C[C@@H]1CC(=O)CCN1	ZINC000004343350	O=C1CCNCC1
COCC(N)=N	ZINC000001439400	nonring
C[N@@](Cc1cc(Br)cc(Br)c1N)C2CCCCC2	ZINC000000608220	C2CCC(NCc1ccccc1)CC2
COC(=O)c2c(CN1CCCC1)n(C)c3cc(Br)c(OC)cc23	ZINC000000862818	C3CCN(Cc2cc1ccccc1[nH]2)C3
Cc3ccc(S(=O)(=O)CCc2nnc(c1ccccc1)o2)cc3C	ZINC000000053508	O=S(=O)(CCc2nnc(c1ccccc1)o2)c3ccccc3
CNCc1ccccc1O	ZINC000001661167	c1ccccc1
CN(C)CC[C@@H]2Sc1ccccc1Sc3ccccc23	ZINC000000347757	C2Sc1ccccc1Sc3ccccc23
O=C(NCc1ccccc1)O[C@@H]3CCN4Cc2ccccc2N=C34	ZINC000000485626	O=C(NCc1ccccc1)OC3CCN4Cc2ccccc2N=C34
O[C@H](CN[C@@H]2CC(=O)N(c1ccc(Cl)cc1)C2=O)c3ccccc3	ZINC000000032905	O=C2CC(NCCc1ccccc1)C(=O)N2c3ccccc3
C[C@H](Nc1ccc(Cl)cc1)c2ccncc2	ZINC000000006038	C(Nc1ccccc1)c2ccncc2
Cc1cccc(C)c1NC2=NCCCS2	ZINC000000002248	C2CSC(Nc1ccccc1)=NC2
Fc4ccc([C@@H]2C[C@@H](c1ccc(Cl)cc1)Nc3ncnn23)cc4	ZINC000000222270	C3C(c1ccccc1)Nc2ncnn2C3c4ccccc4
CC(=O)N4CCCN(Cc1ccccc1OC[C@@H](O)C[N@]3CCc2ccccc2C3)CC4	ZINC000012716153	C4CNCCN(Cc1ccccc1OCCCN3CCc2ccccc2C3)C4
NC(=O)C2(NC1CCCCC1)CCCCC2	ZINC000000066771	C2CCC(NC1CCCCC1)CC2
c3ccc(c2nc1ccccc1[nH]2)cc3	ZINC000000001932	c3ccc(c2nc1ccccc1[nH]2)cc3
CC(C)(C)C(=O)NC(=S)N1CCOCC1	ZINC000000047652	C1COCCN1
Cc3cc(C)n2nn[n+](Cc1ccccc1)c2n3	ZINC000000040970	C(c1ccccc1)[n+]2nnn3cccnc23
CC(C)c2c[n+]1cccc(C(=O)ON(C)C)c1n2C	ZINC000000387449	c2cc[n+]1cc[nH]c1c2
CCN(CC)C[C@H]1CCN1	ZINC000116766595	C1CNC1
C(CNCc1cccn1c4nnc(N3CCN(Cc2ccccc2)CC3)s4)CN5CCOCC5	ZINC000020576294	C(CNCc1cccn1c4nnc(N3CCN(Cc2ccccc2)CC3)s4)CN5CCOCC5
CN(C)c1ccncc1C(=O)Nc2ccc(F)cc2F	ZINC000000078582	O=C(Nc1ccccc1)c2cccnc2
CCN(CC)C[C@@H](O)CNC1=NS(=O)(=O)c2ccccc12	ZINC000000068169	O=S2(=O)N=Cc1ccccc12
COc3ccc(c2n\c(=C/c1cc(Cl)c(OC(C)C)c(OC)c1)c(=O)o2)cc3	ZINC000000623265	O=c2oc(c1ccccc1)nc2=Cc3ccccc3
CC(C)(C)[N+](=O)Cc4ccc(OCCCC[P+](c1ccccc1)(c2ccccc2)c3ccccc3)cc4	ZINC000095582923	C(CC[P+](c1ccccc1)(c2ccccc2)c3ccccc3)COc4ccccc4
Cc2cc(C=c1[nH]c(=O)[nH]c1=O)c(C)n2c3ccncc3	ZINC000000070514	O=c3[nH]c(=O)c(=Cc2ccn(c1ccncc1)c2)[nH]3
Cc2ccc(C)c(COc1ccc(C)nc1N)c2	ZINC000000083201	C(Oc1cccnc1)c2ccccc2
Clc2cccc(C(=O)NC1CCCCC1)c2	ZINC000000029715	O=C(NC1CCCCC1)c2ccccc2
O=C([C@@H](CCCC[C@@H](CN1CCCCC1)C(=O)c2ccccc2)CN3CCCCC3)c4ccccc4	ZINC000008838225	O=C(C(CCCCC(CN1CCCCC1)C(=O)c2ccccc2)CN3CCCCC3)c4ccccc4
NC(=N)SCc2nc(c1ccc(Cl)cc1)no2	ZINC000000137780	c2ccc(c1ncon1)cc2
CCN2[C@@H](SCC(=O)Nc1ccc(Cl)cc1)Nc3ccccc23	ZINC000000029021	O=C(CSC2Nc1ccccc1N2)Nc3ccccc3
O[C@@H]2CSc1cccc[n+]1C2	ZINC000000497165	C2CSc1cccc[n+]1C2
CN(C)CCCOc6ccc(c5nc4ccc(c3ccc2nc(c1ccc(OCCCN(C)C)cc1)[nH]c2c3)cc4[nH]5)cc6	ZINC000003927239	c6ccc(c5nc4ccc(c3ccc2nc(c1ccccc1)[nH]c2c3)cc4[nH]5)cc6
Clc2cc(NC(=O)\C=C\c1ccco1)ccc2Br	ZINC000000045890	O=C(Nc1ccccc1)C=Cc2ccco2
Cc1cc(Br)ccc1OC(=O)\C=C\c2ccccc2	ZINC000000045897	O=C(Oc1ccccc1)C=Cc2ccccc2
CN(C)S(=O)(=O)Nc1cccc(N)c1	ZINC000000035131	c1ccccc1
OC[C@@H]1CCC[N@]1CC2CC2	ZINC000000556217	C2CCN(CC1CC1)C2
O[C@@H](CNCc1ccccc1C(F)(F)F)C(F)(F)F	ZINC000000170280	c1ccccc1
Clc1cccc(Cl)c1/C=C/N(=O)=O	ZINC000000096681	c1ccccc1
CN5CCN(c4ncc(c1cc(C)no1)c(C3CCN(Cc2ccco2)CC3)n4)CC5	ZINC000019123249	C5CN(c4ncc(c1ccno1)c(C3CCN(Cc2ccco2)CC3)n4)CCN5
Clc1ccccc1n2c(=O)ccc2=O	ZINC000000096687	O=c1ccc(=O)n1c2ccccc2
CN(C)c4ccc(CCNC[C@H](N2CCN(C1CCCCC1)CC2)c3ccc(C(F)(F)F)cc3)cc4	ZINC000028522868	C4CCC(N3CCN(C(CNCCc1ccccc1)c2ccccc2)CC3)CC4
COc2ccc(CNCc1ccccc1N(=O)=O)c(OC)c2	ZINC000000293245	C(NCc1ccccc1)c2ccccc2
CC[N+]2(Cc1cc(CCC(=O)OC)ccc1OC)CCCCC2	ZINC000000502033	C2CCN(Cc1ccccc1)CC2
CC(C)[C@@H](N)C(=O)OC(C)(C)C	ZINC000000156862	nonring
CCS(=O)(=O)N1CCNCC1	ZINC000000356407	C1CNCCN1
C[n+]2cncc(c1ccccc1)c2	ZINC000000331599	c2ccc(c1cncnc1)cc2
C[C@H](NC1CCC2(CC1)OCCO2)c3ccccc3	ZINC000000163524	C3COC2(CCC(NCc1ccccc1)CC2)O3
O=C2C(=C/c1ccccc1)/COc3ccccc23	ZINC000000084787	O=C2C(=Cc1ccccc1)COc3ccccc23
O=C1SCC[C@H]1NC(=O)c2ccccc2	ZINC000000095977	O=C1SCCC1NC(=O)c2ccccc2
CC1(C)CC4(CC(C)(C)N1)OC(=O)N3CCc2ccccc2[C@@]34C	ZINC000000105572	O=C2OC1(CCNCC1)C3N2CCc4ccccc34
CC(C)NC[C@@H](O)COc2c1occc1c(=O)c3c(O)cc(C)oc23	ZINC000000000397	O=c2c1cccoc1cc3occc23
O=C([C@@H]2CCC[N@@](Cc1ccncc1)C2)N4CCc3ccccc3C4	ZINC000000212886	O=C(C2CCCN(Cc1ccncc1)C2)N4CCc3ccccc3C4
Cc3cc(N1CCCC1)c2ccccc2n3	ZINC000000120743	C3CCN(c1ccnc2ccccc12)C3
CC[C@@]1(C)Cc3c(CO1)c(N2CCOCC2)[nH]c(=S)c3C#N	ZINC000000266623	S=c3cc1CCOCc1c(N2CCOCC2)[nH]3
COc2cc(CNc1ccc(Cl)cc1)ccc2OCC(=O)NC3CCCCC3	ZINC000000623864	O=C(COc2ccc(CNc1ccccc1)cc2)NC3CCCCC3
N[C@H](CC(N)=O)C(=O)Nc2ccc1ccccc1c2	ZINC000000057189	c2ccc1ccccc1c2
COc4ccc(c2nn(c1ccccc1F)cc2CNC3CCN(C)CC3)cc4	ZINC000011841112	C4CC(NCc2cn(c1ccccc1)nc2c3ccccc3)CCN4
CCOC(=O)[C@]3(c1ccccc1)CCC(=C)c2cc(OC)c(OC)cc23	ZINC000000622805	C=C2CCC(c1ccccc1)c3ccccc23
C[N@@](CC2CCN(Cc1ccc(C)o1)CC2)Cc3cccn3c4ncccn4	ZINC000012303113	C2CN(Cc1ccco1)CCC2CNCc3cccn3c4ncccn4
Cn4c(=O)n(C)c3nc(SCCN1CCCCC1)n(Cc2ccc(Cl)cc2)c3c4=O	ZINC000000634912	O=c4[nH]c(=O)c3n(Cc1ccccc1)c(SCCN2CCCCC2)nc3[nH]4
CCN(CC)[C@H]3CC(=O)N(c2ccc(N1C(=O)C[C@H](N(CC)CC)C1=O)cc2)C3=O	ZINC000000688210	O=C1CCC(=O)N1c3ccc(N2C(=O)CCC2=O)cc3
S=C2N=NC(c1ccccn1)N2Cc3ccccc3	ZINC000000011853	S=C2N=NC(c1ccccn1)N2Cc3ccccc3
COc3ccc(CN2CCN(c1cccc(C)c1C)CC2)cc3O	ZINC000000248155	C2CN(c1ccccc1)CCN2Cc3ccccc3
Fc2cccc(NC(=O)CCN1CCCCCC1)c2	ZINC000000178114	O=C(CCN1CCCCCC1)Nc2ccccc2
Fc5ccc4cc(CN2CCN(c1ccccn1)CC2)c(=O)n(CCN3CCCCC3)c4c5	ZINC000011788529	O=c4c(CN2CCN(c1ccccn1)CC2)cc3ccccc3n4CCN5CCCCC5
Clc6ccc([C@@H](NCc4cc2cc1OCOc1cc2n(CCN3CCCCC3)c4=O)c5ccccc5)cc6	ZINC000014882492	O=c5c(CNC(c1ccccc1)c2ccccc2)cc4cc3OCOc3cc4n5CCN6CCCCC6
CCCN2CCC([N@@](CCO)Cc1ccccc1)CC2	ZINC000000220199	C2CC(NCc1ccccc1)CCN2
Cc2ccc(NC(=O)[C@H]1CC1(C)C)cc2	ZINC000000003263	O=C(Nc1ccccc1)C2CC2
COc2ccc(S(=O)(=O)Nc1cc(N(=O)=O)ccc1Cl)cc2	ZINC000000168280	O=S(=O)(Nc1ccccc1)c2ccccc2
O=C(Nc1ccccn1)c3ccc(S(=O)(=O)c2ccccc2)cc3	ZINC000000049954	O=C(Nc1ccccn1)c3ccc(S(=O)(=O)c2ccccc2)cc3
O=C(N1CCOC12CCCCC2)c3ccc(N(=O)=O)cc3	ZINC000000042067	O=C(N1CCOC12CCCCC2)c3ccccc3
CCn2c(=O)c1cc(N)cnc1oc3cc(C)cc(C)c23	ZINC000000013739	O=c2[nH]c1ccccc1oc3ncccc23
CCOc2c(Cl)cc(CNCc1ccncc1)cc2OC	ZINC000000360298	C(NCc1ccncc1)c2ccccc2
O=N(=O)N(CCc1ccncc1)c3ccc(OCc2ccccc2)cc3	ZINC000000033504	C(Cc1ccncc1)Nc3ccc(OCc2ccccc2)cc3
CCCCN(NC(=O)[C@H](CCC)N2CC[C@@](CCCNC(N)=N)(NCCCC1CCCCC1)C2=O)C(=O)OCC	ZINC000003978858	O=C1NCCC1NCCCC2CCCCC2
CC(C)CCn3c(Nc1cccc2ccccc12)nc4ccccc34	ZINC000000513981	N(c2nc1ccccc1[nH]2)c3cccc4ccccc34
O=c2[nH]c1CCCCc1c3c(=O)[nH]c(=O)c23	ZINC000000033503	O=c2[nH]c1CCCCc1c3c(=O)[nH]c(=O)c23
C[N+](C)(C)CCNC(=O)c2cc[n+](Cc1ccccc1)c(\C=N\O)c2	ZINC000000307025	C(c1ccccc1)[n+]2ccccc2
COc3cccc(NC(=O)c2nc(N)nc(Nc1ccccc1)n2)c3	ZINC000000039240	O=C(Nc1ccccc1)c3ncnc(Nc2ccccc2)n3
O=c2cc(c1ccccc1)sc3ccccc23	ZINC000000120257	O=c2cc(c1ccccc1)sc3ccccc23
O=C2OCc3cc(n1cnnn1)ccc23	ZINC000000039243	O=C2OCc3cc(n1cnnn1)ccc23
O=c5n(CO/N=C/c4cc[n+](CCC[n+]3ccc(\C=N\OCn2c(=O)c1ccccc1c2=O)cc3)cc4)c(=O)c6ccccc56	ZINC000003936470	O=c5n(CON=Cc4cc[n+](CCC[n+]3ccc(C=NOCn2c(=O)c1ccccc1c2=O)cc3)cc4)c(=O)c6ccccc56
COc2cc(C[N@@](C)C1CCN(C)CC1)cc3OCOc23	ZINC000000216558	C3CC(NCc2ccc1OCOc1c2)CCN3
Cn1cccc1CN	ZINC000000158567	c1cc[nH]c1
COC(=O)[C@H]1CN2CCC1CC2	ZINC000002572336	C1CN2CCC1CC2
CN5CCN(CCNCc1cccn1c4nnc(N3CCN(Cc2ccccc2)CC3)s4)CC5	ZINC000020576342	C5CN(CCNCc1cccn1c4nnc(N3CCN(Cc2ccccc2)CC3)s4)CCN5
COc1cc(CNC(C)(C)CO)cc(Cl)c1OCC(N)=O	ZINC000000359844	c1ccccc1
CC[C@@]2(C)C[C@](CCN)(c1ccc(C)cc1)CCO2	ZINC000000171675	C2CC(c1ccccc1)CCO2
COc3ccc(OC)c([C@H]1[N@@](C)CCc2cc(OC)c(OC)cc12)c3	ZINC000000197203	C3Cc1ccccc1C(c2ccccc2)N3
CCOc1ccccc1NC(=O)c3cc2cccc(OC)c2oc3=O	ZINC000000084715	O=C(Nc1ccccc1)c3cc2ccccc2oc3=O
CN5CCN(C[C@H]4C[C@@H](C(=O)NCCc1cnc[nH]1)C[N@@](Cc3ccc2ccccc2c3)C4)CC5	ZINC000023354132	O=C(NCCc1cnc[nH]1)C5CC(CN2CCNCC2)CN(Cc4ccc3ccccc3c4)C5
O=C1[C@H]3CC2C[C@@H]1C[N@](C2)C3	ZINC000000332488	O=C1C3CC2CC1CN(C2)C3
COC(=O)C3CCN(C[C@@H](O)COc2ccc(C[N@@](C)Cc1ccccc1)cc2)CC3	ZINC000012439343	C3CCN(CCCOc2ccc(CNCc1ccccc1)cc2)CC3
C3CN(c2nc(c1ccccc1)cs2)CCN3	ZINC000000105414	C3CN(c2nc(c1ccccc1)cs2)CCN3
CN(C)CCNc2cc(c1cc(Cl)ccc1Cl)nc3ccccc23	ZINC000000632869	c3ccc(c2ccc1ccccc1n2)cc3
CCCc4cc(N1CCN(CC)CC1)n3c(nc2ccccc23)c4C#N	ZINC000000352599	C4CN(c2cccc3nc1ccccc1n23)CCN4
NCCCO	ZINC000001688359	nonring
Cc2nnc(NC1CCCC1)s2	ZINC000000039740	C2CCC(Nc1nncs1)C2
CC(C)(C)OC(=O)NC1CCN(C(=O)CSCC(O)=O)CC1	ZINC000000070103	C1CCNCC1
Cc3cc(C)c2nc(C)cc(Nc1ccc(Br)cc1)c2c3	ZINC000000349822	N(c1ccccc1)c2ccnc3ccccc23
CCOc2c(CNCC1CCNCC1)cc(Cl)cc2OC	ZINC000010435478	C2CC(CNCc1ccccc1)CCN2
CN4CCN(c2cc(c1cccnc1)nc3ccccc23)CC4	ZINC000000018409	C4CN(c2cc(c1cccnc1)nc3ccccc23)CCN4
Fc1ccccc1Nc3nc(c2ccc(Br)cc2)cs3	ZINC000000077808	N(c1ccccc1)c3nc(c2ccccc2)cs3
CC2(C)C[C@@H]([C@@H](CCN)c1ccc(F)cc1)CCO2	ZINC000000171699	C2CC(Cc1ccccc1)CCO2
CC2(C)NC(=O)N(Cc1ccccc1)C2=O	ZINC000000093591	O=C1CNC(=O)N1Cc2ccccc2
C[N@@](C[C@@H](O)COc2ccc1OCOc1c2)C3CCCCC3	ZINC000000307778	C3CCC(NCCCOc2ccc1OCOc1c2)CC3
CCN(CC)CCSc2nnc(Nc1ccccc1)n2c3ccccc3	ZINC000000754448	N(c1ccccc1)c2nncn2c3ccccc3
O=C3Cc1ccccc1Sc4c(OCCN2CCCCC2)cccc34	ZINC000000726335	O=C3Cc1ccccc1Sc4c(OCCN2CCCCC2)cccc34
NCCCN2CCC[N@]([C@@H]1CCS(=O)(=O)C1)CC2	ZINC000038084716	O=S2(=O)CCC(N1CCCNCC1)C2
CC[C@@H](C)NC(=O)C2CCN(Cc1ccc(Cl)cc1)CC2	ZINC000000299527	C2CCN(Cc1ccccc1)CC2
CN(C)CCCn3cnc2c(C#N)c(C)n(c1ccccc1)c2c3=O	ZINC000000535294	O=c2[nH]cnc3ccn(c1ccccc1)c23
Cc3cn2c1ccccc1n(C)c2n3	ZINC000000349592	c1ccc2c(c1)[nH]c3nccn23
O=C(Nc1nccs1)C2CCCC2	ZINC000000068305	O=C(Nc1nccs1)C2CCCC2
Cc4cccc(C[N@]3CCC[C@@]2(CCN(C(=O)CCCN1CCOCC1)C2)C3)c4	ZINC000011818717	O=C(CCCN1CCOCC1)N4CCC3(CCCN(Cc2ccccc2)C3)C4
OC(=O)CCC(=O)c1ccc3CCc2cccc1c23	ZINC000000056859	C1Cc2cccc3cccc1c23
C[n+]1ccc(C(C)(C)C)nc1	ZINC000000331973	c1cncnc1
COc2ccc(NC(=S)NC1CC(C)(C)NC(C)(C)C1)c(OC)c2	ZINC000000787362	S=C(NC1CCNCC1)Nc2ccccc2
CC[N+](CC)(CC)CCO[C@@H](C)C[N+](CC)(CC)CC	ZINC000005688357	nonring
CC(C)(C)c1cc(N)ccn1	ZINC000000331970	c1ccncc1
O=C(N[C@H]2CCc1nc[nH]c1C2)c3ccccc3Oc4ccccc4	ZINC000000027170	O=C(NC2CCc1nc[nH]c1C2)c3ccccc3Oc4ccccc4
C3CN(c2ccc1ccccc1n2)CCN3	ZINC000000002020	C3CN(c2ccc1ccccc1n2)CCN3
CCOC(=O)[C@@H]1CCCC[N@]1Cc2cc(C)c(OC)cc2C	ZINC000000239875	C2CCN(Cc1ccccc1)CC2
Cc1cc(Cl)ccc1OCC(=O)Nc2cccc(N(=O)=O)c2C	ZINC000000038887	O=C(COc1ccccc1)Nc2ccccc2
OC(=O)CCCC(=O)Nc2ccc1COC(=O)c1c2	ZINC000000146622	O=C1OCc2ccccc12
NC(=N)Nc2nc1ccc(Cl)cc1[nH]2	ZINC000000408378	c2ccc1[nH]cnc1c2
NCc1csc2=NCCn12	ZINC000011850541	C2Cn1ccsc1=N2
OC([C@@H]1CN2CCC1CC2)(c3cccc(Cl)c3)c4cccc(Cl)c4	ZINC000000717123	C1CN4CCC1C(C(c2ccccc2)c3ccccc3)C4
COCC[N@@](CC2CCN(Cc1ccccc1F)CC2)Cc3nc(C(C)C)cs3	ZINC000012473085	C2CN(Cc1ccccc1)CCC2CNCc3nccs3
CN[C@@H](C)c2nc1cc(Cl)ccc1c(=O)n2C	ZINC000000250230	O=c1[nH]cnc2ccccc12
CCC(CC)n1c(C)cc3c1ccc2nc(N)nc(N)c23	ZINC000000005734	c3ncc2c(ccc1[nH]ccc12)n3
COc4ccc(C=Nc3ccc2nc(c1ccncc1)[nH]c2c3)cc4	ZINC000000050667	C(=Nc3ccc2nc(c1ccncc1)[nH]c2c3)c4ccccc4
O=C(Cn1nnc2ccccc12)c3ccc(N(=O)=O)cc3	ZINC000000041168	O=C(Cn1nnc2ccccc12)c3ccccc3
CCOC(=O)c1c(C)c(C)sc1/N=C/c2ccc(N(=O)=O)cc2	ZINC000000060039	C(=Nc1cccs1)c2ccccc2
CCN1CC[N+](CC)=C1CC	ZINC000001639393	C1CN=CN1
O=C(CSc2nc1ccccc1[nH]2)NCc3ccco3	ZINC000000036116	O=C(CSc2nc1ccccc1[nH]2)NCc3ccco3
CCN(C[C@@H]2CCC[N@@](CCc1cccc(F)c1)C2)CC(C)(C)CO	ZINC000011771791	C2CCN(CCc1ccccc1)CC2
CN(C)CC(C)(C)CNC(=O)C2CCN(Cc1ccc(C#N)cc1)CC2	ZINC000006762057	C2CCN(Cc1ccccc1)CC2
CN(C)\C=N\Cc1ccccc1OC(F)(F)F	ZINC000000165248	c1ccccc1
C[N@@](CCn1ccnc1C)Cc3cn(c2cccc(C)c2)nc3c4cccc(F)c4	ZINC000011818889	C(Cn1ccnc1)NCc3cn(c2ccccc2)nc3c4ccccc4
Cn5cc(CCc4cc[n+](CCC[n+]3ccc(CCc1cn(C)c2ccccc12)cc3)cc4)c6ccccc56	ZINC000001571019	C(C[n+]3ccc(CCc1c[nH]c2ccccc12)cc3)C[n+]6ccc(CCc4c[nH]c5ccccc45)cc6
NCc2nc1ccccc1s2	ZINC000000158627	c2ccc1scnc1c2
Clc3ccc2c(N1CCNCC1)ccnc2c3	ZINC000000171526	C3CN(c1ccnc2ccccc12)CCN3
C[N+]13CCC(CC1)[C@](O)(c2ccccc2)C3=C	ZINC000000260940	C=C2C(c1ccccc1)C3CCN2CC3
CC(=O)Oc1ccccc1C(=O)n2cnc3ccccc23	ZINC000000030102	O=C(c1ccccc1)n2cnc3ccccc23
COc4ccc3[nH]c2[C@H](Cc1ccc(OC)c(OC)c1)NCCc2c3c4	ZINC000000622003	C4Cc1c([nH]c2ccccc12)C(Cc3ccccc3)N4
Cc2cccc(C[C@@H](CC(O)=O)C(=O)Nc1cccc(Cl)c1C)c2	ZINC000000049601	O=C(CCc1ccccc1)Nc2ccccc2
COc4ccc(\C=C1/Cc2cccc3c(N(=O)=O)ccc1c23)cc4	ZINC000000033090	C2C(=Cc1ccccc1)c3cccc4cccc2c34
CC[N+](C)(CC)CC(C[N+](C)(CC)CC)OCc1ccccc1	ZINC000001883771	c1ccccc1
CCOC(=O)c2ccc(CNCc1ccc(OC)cc1)cc2	ZINC000000259071	C(NCc1ccccc1)c2ccccc2
CN(C)CCCNCc3cc2cc1OCOc1cc2[nH]c3=O	ZINC000004132835	O=c3ccc2cc1OCOc1cc2[nH]3
NC(=O)Nc2cc(c1ccccc1)sc2C(N)=O	ZINC000000027117	c2ccc(c1cccs1)cc2
Fc2cn(Cc1c(Cl)cccc1Cl)c(=O)[nH]c2=O	ZINC000000047904	O=c2ccn(Cc1ccccc1)c(=O)[nH]2
OCC[N+](=O)Cc1ccccc1	ZINC000001871506	c1ccccc1
Fc4ccc([C@@H]1CCNC[C@@H]1COc3ccc2OCOc2c3)cc4	ZINC000000527387	C4CC(c1ccccc1)C(COc3ccc2OCOc2c3)CN4
CC(C)CN(CC#C[C@@H](CO)NCc1ccccc1)CC(C)C	ZINC000002199443	c1ccccc1
O=C(CC2CCN(CC1CC1)CC2)c3ccc(C#N)cc3	ZINC000000005428	O=C(CC2CCN(CC1CC1)CC2)c3ccccc3
Cn2c(=S)[nH]c(=Cc1ccc(OCC(O)=O)cc1)c2=O	ZINC000000094024	O=c1[nH]c(=S)[nH]c1=Cc2ccccc2
CC(C)n2c(SCC(=O)c1ccccc1)nc3cc(Cl)ccc23	ZINC000000146422	O=C(CSc2nc1ccccc1[nH]2)c3ccccc3
C[N+](C)(C)C[C@@H](O)CC#N	ZINC000000393601	nonring
C[N@]2CC[C@@]14CCCC[C@H]1[C@@H]2Cc3ccc(O)cc34	ZINC000000002433	C4CCC23CCNC(Cc1ccccc12)C3C4
CN(C)CCC#N	ZINC000001555372	nonring
Clc1ccccc1n3c(=O)c2ccccc2c3=O	ZINC000000049372	O=c2n(c1ccccc1)c(=O)c3ccccc23
CN(C)CCN(Cc1ccc(Cl)s1)c2ccccn2	ZINC000000001128	C(Nc1ccccn1)c2cccs2
CN3CCC(NC[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1N2CCCC2)CC3	ZINC000020465045	C3CCN(C1CCOC1CNC2CCNCC2)C3
N[C@@H](CCc1ccc(F)cc1)c3ccc2OCCOc2c3	ZINC000000173917	C(Cc1ccccc1)Cc3ccc2OCCOc2c3
C[C@@H]([C@@H](O)c1ccc(O)cc1)N3CCC(O)(c2ccccc2)CC3	ZINC000000005936	C2CN(CCc1ccccc1)CCC2c3ccccc3
C[n+]1cccc2[nH]c(=O)[nH]c12	ZINC000000493826	O=c2[nH]c1cccnc1[nH]2
O[C@H](CNC1CCCCC1)Cn3c2ccc(Cl)cc2c4cc(Cl)ccc34	ZINC000000758191	C4CCC(NCCCn2c1ccccc1c3ccccc23)CC4
COc1ccc(F)cc1S(=O)(=O)Nc2ccccc2C	ZINC000000107532	O=S(=O)(Nc1ccccc1)c2ccccc2
Cc2ccc(NC(=O)c1ccc(F)cc1)c(F)c2	ZINC000000041206	O=C(Nc1ccccc1)c2ccccc2
Nc1cc(N)ncn1	ZINC000000967323	c1cncnc1
CSc1nsc(SC)c1NC(=O)N2CCCCC2	ZINC000000051104	O=C(Nc1cnsc1)N2CCCCC2
Cc2nn(c1cccc[n+]1C)c3ncccc23	ZINC000000151235	c3ccc(n1ncc2cccnc12)nc3
CN(C)CC[C@](O)(c1ccccc1)c3nc2ccccc2n3C	ZINC000000228820	C(c1ccccc1)c3nc2ccccc2[nH]3
CC(C)(C)NC(=O)Cc1ccccc1	ZINC000000029532	c1ccccc1
CC2CCC(N1CCN(C=O)CC1)CC2	ZINC000000279796	C2CCC(N1CCNCC1)CC2
CC(C)(C)c1cc(N)nc(N)n1	ZINC000000082209	c1cncnc1
C[C@@H]2CCc1ccccc1N2C(=N)N(C)C	ZINC000000216165	C2CNc1ccccc1C2
NC(=O)C2CCN(C/C=C/c1ccccc1)CC2	ZINC000000219757	C2CCN(CC=Cc1ccccc1)CC2
CC(C)(C)c2ccc(c1nn[nH]n1)cc2	ZINC000000118683	c2ccc(c1nn[nH]n1)cc2
NCCCC[C@H](C(=O)NCc1ccc(CN)cc1)n2cccc2C(=O)N[C@@H](Cc3ccccc3)c4ccccc4	ZINC000026490380	O=C(Cn1cccc1C(=O)NC(Cc2ccccc2)c3ccccc3)NCc4ccccc4
CN(C)CCN(Cc4ccc(c3ccc(CNC2Cc1ccccc1C2)cc3)cc4)C(=O)CCC5CCCC5	ZINC000028460560	O=C(CCC1CCCC1)NCc5ccc(c4ccc(CNC3Cc2ccccc2C3)cc4)cc5
COC(=O)c2c1CCCc1sc2NC(=O)c3ccccc3	ZINC000000038692	O=C(Nc2cc1CCCc1s2)c3ccccc3
C[C@@H](NCCc1ccc(O)cc1)[C@@H](O)c2ccc(O)cc2	ZINC000000057483	C(Cc1ccccc1)NCCc2ccccc2
CCN2CCC([N@]1CCC[C@@H](C(=O)N(CC)CC)C1)CC2	ZINC000000280575	C2CCN(C1CCNCC1)CC2
COc4ccc(CN2c1cccc[n+]1C[C@]2(O)c3ccc(Cl)cc3)cc4	ZINC000000787817	C3C(c1ccccc1)N(Cc2ccccc2)c4cccc[n+]34
C[N@]3CC[C@@](O)(c1ccccc1)[C@H](C(=O)c2ccccc2)C3	ZINC000000098212	O=C(C1CNCCC1c2ccccc2)c3ccccc3
C[N@@](C[C@@H](O)COc2ccc(CNCC1CC1)cc2)Cc3ccccc3	ZINC000011661792	C(CNCc1ccccc1)COc3ccc(CNCC2CC2)cc3
COc3cc(Nc2nc(c1ccccc1)cs2)c(OC)cc3Cl	ZINC000000432118	N(c1ccccc1)c3nc(c2ccccc2)cs3
CN(C)C(=O)N1CCN(C)CC1	ZINC000005913723	C1CNCCN1
CS(=O)(=O)c1nnnn1c2ccccc2Cl	ZINC000000109245	c2ccc(n1cnnn1)cc2
Cc3cccc4[C@H]1C=CC[C@H]1[C@H](c2ccc(N(=O)=O)cc2)Nc34	ZINC000000034209	C1C=CC3C1C(c2ccccc2)Nc4ccccc34
Cc1cccc(CC(N)=N)c1	ZINC000001442845	c1ccccc1
NCCc1c[nH]c2c(Cl)ccc(Cl)c12	ZINC000000185700	c2ccc1[nH]ccc1c2
COc2ccc1occ([C@@H](C)N)c1c2	ZINC000000201805	c2ccc1occc1c2
CC(C)(O)C1CC[N+](C)(C)CC1	ZINC000000162284	C1CCNCC1
Cc3ccnc(NC(=O)C(c1ccccc1)c2ccccc2)c3	ZINC000000036599	O=C(Nc1ccccn1)C(c2ccccc2)c3ccccc3
NNc3nc(NN)nc(Nc1cccc2ccccc12)n3	ZINC000000098455	N(c1ncncn1)c2cccc3ccccc23
O/N=C1/CN2CCC1CC2	ZINC000004619138	N=C1CN2CCC1CC2
Cn3ccc(=C/C=c1/cnc2ccccc12)cc3	ZINC000000055347	C(C=c1cnc2ccccc12)=c3cc[nH]cc3
Cc2ccc(OC[C@@H](O)CN1CCCC1)cc2	ZINC000000177590	C2CCN(CCCOc1ccccc1)C2
CCN3CCN(c1c(Cl)cccc1NC(=O)c2ccc(C#N)cc2F)CC3	ZINC000000680128	O=C(Nc1ccccc1N2CCNCC2)c3ccccc3
CN5CCN(c4ncc(c1ccc(F)cc1)c(c3cnc(C2CCNCC2)nc3C)n4)CC5	ZINC000019552669	C5CC(c4ncc(c2nc(N1CCNCC1)ncc2c3ccccc3)cn4)CCN5
NC[C@H]2COc1ccccc1O2	ZINC000000158539	C2COc1ccccc1O2
C4CCN3C[C@@H]1C[C@@H](C[N@]2CCCC[C@H]12)[C@H]3C4	ZINC000000000721	C4CCN3CC1CC(CN2CCCCC12)C3C4
COc3ccc(C(=O)OC[C@@H]1CCC[N+]2(C)CCCC[C@@H]12)cc3	ZINC000000343988	O=C(OCC1CCCN2CCCCC12)c3ccccc3
C6CCN(CCOc5ccc(c3oc2nccc(NCCN1CCNCC1)c2c3c4ccccc4)cc5)C6	ZINC000023359509	C6CCN(CCOc5ccc(c3oc2nccc(NCCN1CCNCC1)c2c3c4ccccc4)cc5)C6
CCC[N@@](CC1CC1)[C@@H]3CC(=O)N(c2ccccc2)C3=O	ZINC000000315900	O=C2CC(NCC1CC1)C(=O)N2c3ccccc3
C[N+](C)(C)c1cccc(C(=O)NO)c1	ZINC000000398545	c1ccccc1
CC(C)NC[C@@H](O)COc1cccn2nccc12	ZINC000000005305	c2ccn1nccc1c2
COc1ccc(C)cc1NC(=O)C(c2ccccc2)c3ccccc3	ZINC000000058502	O=C(Nc1ccccc1)C(c2ccccc2)c3ccccc3
COc2ccc(CNCCc1cccc(C)n1)cc2OC[C@@H](O)CN3CCCCC3	ZINC000011821900	C3CCN(CCCOc2cccc(CNCCc1ccccn1)c2)CC3
Cc2cc(C=c1c(=O)[nH]c(=S)[nH]c1=O)c(C)n2c3ccncc3	ZINC000000366339	O=c1[nH]c(=S)[nH]c(=O)c1=Cc3ccn(c2ccncc2)c3
COC(=O)c1ccccc1NC(=O)CCc2ccc(OC)cc2	ZINC000000037081	O=C(CCc1ccccc1)Nc2ccccc2
Cc4ccc(c2c[n+]1ccccc1n2c3ccc(Br)cc3)cc4	ZINC000000624170	c4ccc(c2c[n+]1ccccc1n2c3ccccc3)cc4
NC(=N)c3ccc(N2CCC(C1CCN(CC(O)=O)CC1)CC2)cc3	ZINC000000015847	C3CC(C2CCN(c1ccccc1)CC2)CCN3
CCCc2cc([C@H]1CCC[N@]1C)on2	ZINC000000008088	C2CNC(c1ccno1)C2
C[N@]2CCCN(Cc1ccccc1N(=O)=O)CC2	ZINC000000238053	C2CNCCN(Cc1ccccc1)C2
OCCN4CCN(CC/C=c2/c1ccccc1sc3ccc(Cl)cc23)CC4	ZINC000000601293	C4CN(CCC=c2c1ccccc1sc3ccccc23)CCN4
NC(=N)C23CC1CC(CC(C1)C2)C3	ZINC000000076414	C1C2CC3CC1CC(C2)C3
CC(C)=c2c(=O)[nH]n(c1ccccc1)c2=O	ZINC000000173035	C=c2c(=O)[nH]n(c1ccccc1)c2=O
CCN4CCC(N3CCC(C(=O)Nc2ccc(Oc1ccccc1F)cc2)CC3)CC4	ZINC000012073254	O=C(Nc2ccc(Oc1ccccc1)cc2)C4CCN(C3CCNCC3)CC4
O=c3oc1ccccc1c4n(CCN2CCCC2)cnc34	ZINC000000176883	O=c3oc1ccccc1c4n(CCN2CCCC2)cnc34
CCOc2cc(CNc1ccc(N(CC)CC)cc1)ccc2OCC(=O)NC(C)(C)C	ZINC000000679382	C(Nc1ccccc1)c2ccccc2
C[C@@H]2C[C@H](OC(=O)c1ccccc1)CC(C)(C)N2	ZINC000000001410	O=C(OC1CCNCC1)c2ccccc2
O=C(Cn1c(=O)c3cccc2cccc1c23)Nc5ccc4OCOc4c5	ZINC000000053814	O=C(Cn1c(=O)c3cccc2cccc1c23)Nc5ccc4OCOc4c5
COc3cc(CN(CCCN)Cc2ccc(OCc1ccccc1)c(OC)c2)ccc3OCc4ccccc4	ZINC000027710252	C(NCc2ccc(OCc1ccccc1)cc2)c4ccc(OCc3ccccc3)cc4
COc2ccc(CS(=O)(=O)/C=C/c1ccc(F)cc1)cc2	ZINC000000026245	O=S(=O)(Cc1ccccc1)C=Cc2ccccc2
Clc4ccc(N3[C@H](c1ccccc1)Nc2ccccc2C3=O)cc4	ZINC000000063098	O=C3N(c1ccccc1)C(c2ccccc2)Nc4ccccc34
CC(C)(C)NC[C@@H](O)COc1ccccc1c2ccc(NN)nn2	ZINC000000000658	c2ccc(c1cccnn1)cc2
CC(C)N(C(C)C)C(=O)CSc1nc(N)cc(N)n1	ZINC000000417998	c1cncnc1
CN(C)S(=O)(=O)c2ccc(N)c(C(=O)N1CCN(C)CC1)c2	ZINC000000001255	O=C(N1CCNCC1)c2ccccc2
CC(C)(C)[N+](=O)C[C@H]([C@@H](C[N+](=O)C(C)(C)C)c1ccccc1)c2ccccc2	ZINC000016941935	C(Cc1ccccc1)c2ccccc2
NCc2nc1CCCCCc1s2	ZINC000000336240	C2CCc1ncsc1CC2
CN(C)C[C@@H]1CCCC[C@@H](CN(C)C)C1OC(=O)C(O)(c2ccccc2)c3ccccc3	ZINC000001717444	O=C(OC1CCCCCC1)C(c2ccccc2)c3ccccc3
C[C@@H]1CN(C(N)=N)C[C@@H](C)O1	ZINC000000144164	C1COCCN1
CC2(C)CC[C@@H](Cc1ccc(Cl)cc1)[C@]2(O)Cn3cncn3	ZINC000000017104	C3CC(Cc1ccccc1)C(Cn2cncn2)C3
COc4ccc([n+]2c1SCCCn1cc2c3ccc(Cl)cc3)cc4	ZINC000000623137	C1CSc3n(C1)cc(c2ccccc2)[n+]3c4ccccc4
CN(C)CCCN(CCCN(C)C)Cc1cc(C)ccc1C	ZINC000002464074	c1ccccc1
Fc1ccccc1N3CCN(C(=O)c2ccco2)CC3	ZINC000000037576	O=C(N2CCN(c1ccccc1)CC2)c3ccco3
Cc2cc(C[N@]1CCC[C@@H](O)C1)c(C)n2c3cccc(C(F)(F)F)c3	ZINC000000756609	C3CCN(Cc2ccn(c1ccccc1)c2)CC3
COC(=O)C3[C@@H](c1c[nH]c2ccccc12)[C@@H](C(=O)OC)O[N+]3=O	ZINC000000192327	O=[N+]3CC(c1c[nH]c2ccccc12)CO3
CC(C)(C)NC[C@H](O)c1cc(Br)no1	ZINC000000000098	c1cnoc1
NCCCNCCOc1ccc(Cl)cc1Cc2ccccc2	ZINC000004833003	C(c1ccccc1)c2ccccc2
CCOC(=O)C1CCN(S(C)(=O)=O)CC1	ZINC000000029622	C1CCNCC1
CC2(C)CC(NC(=O)Cn1cccc(N(=O)=O)c1=O)CC(C)(C)N2	ZINC000000104899	O=C(Cn1ccccc1=O)NC2CCNCC2
CN(C)[C@@H]3CC[N@@](CC(c1ccccc1)c2ccccc2)C[C@@H]3CCC(=O)NCc5ccc4OCOc4c5	ZINC000012185151	O=C(CCC3CCCN(CC(c1ccccc1)c2ccccc2)C3)NCc5ccc4OCOc4c5
CCN(CC)CCC[C@@H](C)N=C3C[C@@H](c1ccc(Cl)cc1Cl)Cc4[nH]c2ccc(Cl)cc2c(=O)c34	ZINC000027084111	N=C3CC(c1ccccc1)Cc4[nH]c2ccccc2c(=O)c34
NCCCOc1ccc3c(c1)c(=O)c2cccc5c2c3c7cccc6c(=O)c4cc(OCCCN)ccc4c5c67	ZINC000101084121	O=c3c1ccccc1c5c7cccc6c(=O)c2ccccc2c(c4cccc3c45)c67
OC(=O)Cc2cccc3c(=O)cc(c1ccccc1)oc23	ZINC000000001453	O=c2cc(c1ccccc1)oc3ccccc23
CNc4cc([C@@H]1CCCNC1)nc(CN(C)C(=O)CN3CCC(c2ccccc2)CC3)n4	ZINC000019709986	O=C(CN2CCC(c1ccccc1)CC2)NCc4nccc(C3CCCNC3)n4
CC(C)[N@@](C)CCO	ZINC000001677399	nonring
Clc3ccc(SCC(=O)Nc2ccc1OCOc1c2)cc3	ZINC000000037680	O=C(CSc1ccccc1)Nc3ccc2OCOc2c3
c4ccc(c3nc(n1ccnc1)nc(n2ccnc2)n3)cc4	ZINC000000056296	c4ccc(c3nc(n1ccnc1)nc(n2ccnc2)n3)cc4
CN(C)CCNC(=O)c3ccc(OC2CCN([C@@H]1CCCC(C)(C)C1)CC2)c(Cl)c3	ZINC000012573876	C3CCC(N2CCC(Oc1ccccc1)CC2)CC3
C/C(C[N@]1C[C@@H]3C[C@H](C1)c2cccc(=O)n2C3)=C/c4ccccc4	ZINC000000234604	O=c4cccc3C2CC(CN(CC=Cc1ccccc1)C2)Cn34
CCN3CCN(c1c(Cl)cccc1NC(=O)c2ccco2)CC3	ZINC000000528737	O=C(Nc1ccccc1N2CCNCC2)c3ccco3
CNCc1ccsc1	ZINC000000064946	c1ccsc1
CN2CCN(CC(=O)Nc1ccc(Cl)c(N(=O)=O)c1)CC2	ZINC000000379454	O=C(CN1CCNCC1)Nc2ccccc2
CN[C@@H](C)Cc1ccccc1O	ZINC000001681229	c1ccccc1
C[C@H]2CCC[N@@](C[C@H](O)COc1ccc(C)cc1C)C2	ZINC000000240336	C2CCN(CCCOc1ccccc1)CC2
CCCCOc2cc(C[S+]1CCCC1)c(OC)cc2C[S+]3CCCC3	ZINC000005784086	C3CC[S+](Cc2ccc(C[S+]1CCCC1)cc2)C3
CN(C)CCNC(=O)c2ccc(S(=O)(=O)N1CCCCC1)cc2	ZINC000000306410	O=S(=O)(N1CCCCC1)c2ccccc2
Clc1ccccc1/C=C/C(=O)N2CCCCC2	ZINC000000064065	O=C(C=Cc1ccccc1)N2CCCCC2
CC(C)(C)c3cc(c2cnc1CCCCCn12)cc(C(C)(C)C)c3O	ZINC000000099965	C3CCc2ncc(c1ccccc1)n2CC3
OC(=O)[C@H]2[C@@H]1C[C@@H](C=C1)[C@@H]2C(=O)Nc4ccc(c3cnco3)cc4	ZINC000000106923	O=C(Nc2ccc(c1cnco1)cc2)C3CC4CC3C=C4
CS(=O)(=O)Nc5ccc4OC3(CCN([C@H]2CCc1cc(C#N)ccc1C2)CC3)CC(=O)c4c5	ZINC000000586740	O=C4CC3(CCN(C2CCc1ccccc1C2)CC3)Oc5ccccc45
CCN3CCN(c2cc(SC(C)C)nc(c1ccc(OC)cc1)n2)CC3	ZINC000000631249	C3CN(c2ccnc(c1ccccc1)n2)CCN3
CCOC(=O)N2CCN(C(=O)c1ccc(C#CC(C)(C)O)cc1)CC2	ZINC000000102394	O=C(N1CCNCC1)c2ccccc2
CC(C)(c1ccccc1)c3ccc(Oc2ccc(C#N)c(C#N)c2)cc3	ZINC000000056908	C(c1ccccc1)c3ccc(Oc2ccccc2)cc3
CCN1CCN(C(N)=N)CC1	ZINC000002441416	C1CNCCN1
Cc3c(N1CCNCC1)c(N)cc4c(=O)c(C(O)=O)cn(C2CC2)c34	ZINC000000008479	O=c3ccn(C1CC1)c4cc(N2CCNCC2)ccc34
COC(=O)C2C(c1cc(OC)c(OC)cc1OC)C(C(=O)OC)C(=C)NC2=C	ZINC000000628640	C=C2CC(c1ccccc1)CC(=C)N2
Cc5ccc(NC(=O)COc2ccc1ccccc1c2CNCCc3c[nH]c4ccccc34)cc5	ZINC000040736345	O=C(COc2ccc1ccccc1c2CNCCc3c[nH]c4ccccc34)Nc5ccccc5
CC(C)CNC(=O)c1ccc(F)cc1	ZINC000000029756	c1ccccc1
C[C@@H](NCC2OCc1ccccc1CO2)c3ccccc3	ZINC000000203094	C(NCc1ccccc1)C3OCc2ccccc2CO3
CCN4CCN(c2nnc(c1ccc(C)c(C)c1)c3ccccc23)CC4	ZINC000000137417	C4CN(c2nnc(c1ccccc1)c3ccccc23)CCN4
CCCc2nc(S(=O)(=O)c1ccc(C)cc1)c(NC)o2	ZINC000000035955	O=S(=O)(c1ccccc1)c2cocn2
CCN(CC)CCNc2cc(c1ccc(OC)cc1)nc3ccccc23	ZINC000004542559	c3ccc(c2ccc1ccccc1n2)cc3
CCCC(=O)Nc3ccc2nc(SCC(=O)Nc1ccccc1C)sc2c3	ZINC000000624771	O=C(CSc2nc1ccccc1s2)Nc3ccccc3
N[C@@H](Cc1ccccn1)c2ccccc2	ZINC000000006163	C(Cc1ccccn1)c2ccccc2
CN(C)CCSc2nc1ccccc1c(=O)n2c3ccccc3	ZINC000000028373	O=c2n(c1ccccc1)cnc3ccccc23
Cn1c(=O)ccc2cc(C(F)(F)F)ccc12	ZINC000000001459	O=c2ccc1ccccc1[nH]2
O=N(=O)c2cnn(C1=CNCCN=C1)c2	ZINC000000028377	C2CN=CC(n1cccn1)=CN2
COc4ccc(NC(=O)CC[C@H]3C[N@@](CC(c1ccccc1)c2ccccc2)CC[C@H]3N(C)C)cc4	ZINC000014987129	O=C(CCC3CCCN(CC(c1ccccc1)c2ccccc2)C3)Nc4ccccc4
Cc1ccccc1CN4CCC(N3CCC(C(=O)N2CCCN(C=O)CC2)CC3)CC4	ZINC000012455672	O=C(C3CCN(C2CCN(Cc1ccccc1)CC2)CC3)N4CCCNCC4
Clc2ccc(\C=N\c1cccnc1)cc2	ZINC000000072334	C(=Nc1cccnc1)c2ccccc2
COc3ccc([C@@H]1NCC[C@]2(O)CCCC[C@H]12)c(OC)c3	ZINC000000234773	C1CCC2C(C1)CCNC2c3ccccc3
CN(C)C(=O)Cc2c(c1ccc(C)cc1)nc3ccc(C)cn23	ZINC000000003876	c3ccc(c2cn1ccccc1n2)cc3
C(Cc2ccc1OCOc1c2)NC4C3CC5CC(C3)CC4C5	ZINC000000172180	C(Cc2ccc1OCOc1c2)NC4C3CC5CC(C3)CC4C5
COc2ccc([C@H](OC(C)=O)C#N)c(OCc1ccccc1)c2OC	ZINC000000036424	C(Oc1ccccc1)c2ccccc2
Fc1ccccc1N3CCN(C/C=C/c2ccccc2)CC3	ZINC000000215848	C2CN(c1ccccc1)CCN2CC=Cc3ccccc3
NCc2cn1cccnc1n2	ZINC000003887194	c2cnc1nccn1c2
Fc5ccc(c3[nH]cc(C2=C[C@@H]1CCC[N@]1CC2)c3c4ccncc4)cc5	ZINC000000590353	C5CC4C=C(c2c[nH]c(c1ccccc1)c2c3ccncc3)CCN4C5
C4CCN(CCn2c(N1CCOCC1)nc3ccccc23)CC4	ZINC000000339595	C4CCN(CCn2c(N1CCOCC1)nc3ccccc23)CC4
Cn2c(=O)[nH]c(=O)c3n(CCNC1=NCCCCC1)cnc23	ZINC000000093807	O=c3[nH]c(=O)c2n(CCNC1=NCCCCC1)cnc2[nH]3
Cc1ccc(CSC(N)=N)cc1	ZINC000000096836	c1ccccc1
COc1ncnc2c(C)csc12	ZINC000000082282	c2ncc1sccc1n2
C(Sc1nccn1Cc2ccccc2)c4nnc(c3ccccc3)o4	ZINC000000614212	C(Sc1nccn1Cc2ccccc2)c4nnc(c3ccccc3)o4
CC(C)(C)NCC(=O)c1c[nH]c2ccccc12	ZINC000000093801	c2ccc1[nH]ccc1c2
COc2cc(OC)cc(C(=O)N1CCN(C)CC1)c2	ZINC000000180934	O=C(N1CCNCC1)c2ccccc2
c4ccc(c3nn(c1ccccc1)[n+](c2ccccc2)n3)cc4	ZINC000000154828	c4ccc(c3nn(c1ccccc1)[n+](c2ccccc2)n3)cc4
CC(C)(C)c3ccc(C(=O)N2CCN(c1ccccn1)CC2)cc3	ZINC000000093939	O=C(N2CCN(c1ccccn1)CC2)c3ccccc3
COC(=O)C4CCN(C[C@@H](O)COc3ccc(CNCc2[nH]nc1CCCc12)cc3)CC4	ZINC000012299656	C4CCN(CCCOc3ccc(CNCc2[nH]nc1CCCc12)cc3)CC4
Cc1ccnc(N)c1	ZINC000000149580	c1ccncc1
OC[C@H](CC(=O)NCc1ccccc1)NCc2ccccc2	ZINC000000034176	O=C(CCNCc1ccccc1)NCc2ccccc2
C6CCN(CCOc5ccc(Sc3c(c2ccc(OCCN1CCCC1)cc2)sc4ccccc34)cc5)C6	ZINC000027729420	C6CCN(CCOc5ccc(Sc3c(c2ccc(OCCN1CCCC1)cc2)sc4ccccc34)cc5)C6
Cn3c(c1ccccc1)nn(CN2CCCC2)c3=S	ZINC000000067348	S=c2[nH]c(c1ccccc1)nn2CN3CCCC3
C[C@H]4C[C@@H](N(C(=O)c1cccs1)c2ccccc2)c3ccccc3N4	ZINC000000081301	O=C(N(C1CCNc2ccccc12)c3ccccc3)c4cccs4
FC(F)(F)c3c1CCCCc1nc(SCCN2CCCC2)c3C#N	ZINC000000663898	C3CCN(CCSc2ccc1CCCCc1n2)C3
CN(C)C(C)(CO)CO	ZINC000001759087	nonring
Nc3cc(N)nc(SCC(=O)N1CCc2ccccc12)n3	ZINC000000420137	O=C(CSc1ncccn1)N2CCc3ccccc23
CN(C)CCN4C(=O)C[C@@](CC(=O)N2CCN(Cc1ccccc1)CC2)(c3cccc(F)c3)C4=O	ZINC000012037197	O=C4CC(CC(=O)N2CCN(Cc1ccccc1)CC2)(c3ccccc3)C(=O)N4
CNCC1CCCC1	ZINC000001609656	C1CCCC1
CN(C)CCCNC(=O)[C@@H](N)Cc1ccc(O)cc1	ZINC000040458539	c1ccccc1
Oc1ccc(Br)cc1\C=N\n2cnnc2	ZINC000000028578	C(=Nn1cnnc1)c2ccccc2
CN(C)S(=O)(=O)N[C@@H]4C[C@@H]1[C@H](Cc2cn(C)c3cccc1c23)[N@@](C)C4	ZINC000000537983	C2CNC1Cc3c[nH]c4cccc(C1C2)c34
C[C@H]2CC(=O)Nc1cc(C)c(C)cc1N2	ZINC000000067183	O=C2CCNc1ccccc1N2
Cc2ccc(C(=O)NC(=S)Nc1ccccc1C(N)=O)cc2	ZINC000000014415	O=C(NC(=S)Nc1ccccc1)c2ccccc2
OC3(c1ccc(Br)cc1)CCN(CCCc2ccccc2)CC3	ZINC000000757539	C(CN2CCC(c1ccccc1)CC2)Cc3ccccc3
CCN(CC2CCN(C1CCN(C)CC1)CC2)C(=O)COc3ccc(C)nc3CC	ZINC000011874714	O=C(COc1cccnc1)NCC3CCN(C2CCNCC2)CC3
CN(C)CC[C@@H](O)c1ccccc1	ZINC000000399624	c1ccccc1
C[C@@]2(C(O)=O)Oc1cccnc1NC2=O	ZINC000001385094	O=C2COc1cccnc1N2
CN(C)C[C@@H]1CSCC[C@@]1(O)c2ccc(C(F)(F)F)cc2	ZINC000000347747	C2CC(c1ccccc1)CCS2
CN2CCN(C(=O)NCc1ccc(C)cc1)CC2	ZINC000000386874	O=C(NCc1ccccc1)N2CCNCC2
OC(=O)[C@H]1CC(=O)CC[C@H]1Cc2ccccc2	ZINC000000053538	O=C2CCC(Cc1ccccc1)CC2
CC(C)(C)OC(=O)CCN1CCC(C(N)=O)CC1	ZINC000000053539	C1CCNCC1
CCNC2(c1cccc(Cl)c1)CCC2	ZINC000000033730	C2CC(c1ccccc1)C2
O=C(CSC2=N[C@@H]1CCCC[C@@H]1N2)N3CCOCC3	ZINC000000314043	O=C(CSC2=NC1CCCCC1N2)N3CCOCC3
COc1ccc(C(=O)C[C@H](N)C(O)=O)cc1	ZINC000000019524	c1ccccc1
O[C@@H]([C@H]1CCCCN1)c2cc(C(F)(F)F)nc3c(C(F)(F)F)cccc23	ZINC000000537964	C3CCC(Cc1ccnc2ccccc12)NC3
CC1(C)[C@H]3CC[C@]1(C)c4nc(SCCN2CCCCC2)nnc34	ZINC000000415597	C4CCN(CCSc3nnc2C1CCC(C1)c2n3)CC4
NC3=C(C#N)C1=CCNC[C@@H]1[C@@H](c2ccccc2)C3(C#N)C#N	ZINC000000048995	C3NCC2C(c1ccccc1)CC=CC2=C3
CCn5nc(C(=O)N1CCC[N@@](C)CC1)c4C[C@H](N3CCC(Cc2ccccc2)CC3)CCc45	ZINC000014733045	O=C(N1CCCNCC1)c5n[nH]c4CCC(N3CCC(Cc2ccccc2)CC3)Cc45
CC(=O)c1c(O)cc(O)c(C(C)=O)c1O	ZINC000000157843	c1ccccc1
Nc1csc2=NCCn12	ZINC000000274793	C2Cn1ccsc1=N2
COCCN(CCN(C)C)C(=O)C(=O)N1CC[N@@](C[C@@H](C)O)[C@@H](C)C1	ZINC000410506279	C1CNCCN1
CC(C)NC[C@@H](O)COc1c(F)cc(Br)cc1F	ZINC000000230604	c1ccccc1
CN(C)Cc1ccc(N)cc1	ZINC000001743172	c1ccccc1
Cc4ccc(C[C@@]3(O)CN(c1ccccc1)c2cccc[n+]23)cc4	ZINC000000389458	C3C(Cc1ccccc1)[n+]2ccccc2N3c4ccccc4
O=C2CCCN(Cc1ccccc1)C2	ZINC000000119573	O=C2CCCN(Cc1ccccc1)C2
Cn3c(NCCc1ccccc1)nc(c2ccncc2)cc3=O	ZINC000000009114	O=c3cc(c1ccncc1)nc(NCCc2ccccc2)[nH]3
CCOC(=O)C2CCN(CCC(=O)c1ccc(OCC)cc1)CC2	ZINC000000206117	O=C(CCN1CCCCC1)c2ccccc2
CC(=O)Nc2nc1ccccc1n2CCN3CCCC3	ZINC000000186870	C3CCN(CCn1cnc2ccccc12)C3
COC(=O)c4cn([C@H]3C[C@@H](C(=O)NC[C@@H]1CCC[N@]2CCCC[C@H]12)N(CC=C(C)C)C3)nn4	ZINC000011967083	O=C(NCC1CCCN2CCCCC12)C4CC(n3ccnn3)CN4
CCN3CCN(c2ccc(NC(=O)c1cccc(C)c1OC)cc2)CC3	ZINC000000809997	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
O[C@H](C(O)=O)c1ccc(N(=O)=O)cc1	ZINC000000330157	c1ccccc1
CC(=O)N1CCCNCC1	ZINC000004521106	C1CNCCNC1
OC(=O)C[C@@H]2NC(=S)N(Cc1ccccc1)C2=O	ZINC000000034236	O=C1CNC(=S)N1Cc2ccccc2
CCOC(=O)N2CCN([C@@H]1CC[C@@H](C)C1)CC2	ZINC000000215999	C2CCC(N1CCNCC1)C2
COc2cc(CNCc1cccc(C)c1)ccc2OC[C@@H](O)CN3CCC(O)CC3	ZINC000012577044	C3CCN(CCCOc2ccc(CNCc1ccccc1)cc2)CC3
Nc2n[nH]c3c(c1ccccc1C(F)(F)F)[nH][nH]n23	ZINC000000038202	c3ccc(c1[nH][nH]n2cn[nH]c12)cc3
CN(C)c1cc(C(F)(F)F)cnc1C#N	ZINC000000109707	c1ccncc1
Nc2n[nH]c3c(c1ccc(F)cc1)[nH][nH]n23	ZINC000000038200	c3ccc(c1[nH][nH]n2cn[nH]c12)cc3
OC(CC=C)(CC=C)[C@@H]1CCCN1	ZINC000000286756	C1CCNC1
CSc2cc(c1nccs1)[nH]n2	ZINC000000108659	c2csc(c1ccn[nH]1)n2
Clc1ccccc1C[N@]4CCC[C@@H](C(=O)NCc3ccc(CN2CCCCC2)cc3)C4	ZINC000038830724	O=C(NCc2ccc(CN1CCCCC1)cc2)C4CCCN(Cc3ccccc3)C4
NC(=O)c2ccc[n+](Cc1ccc(F)cc1)c2	ZINC000000160604	C(c1ccccc1)[n+]2ccccc2
CCCCN1CCC(NC(=O)[C@@H](N)CC(N)=O)CC1	ZINC000037626862	C1CCNCC1
NC(=N)CSc1ccccc1	ZINC000000124482	c1ccccc1
O=C3C(C#N)=C1CCCC[C@@H]1[C@@H](c2ccco2)C3(C#N)C#N	ZINC000000028107	O=C3CC(c1ccco1)C2CCCCC2=C3
CCOC(=O)c1cc(CC)sc1NC(=O)CCNC(C)(C)C	ZINC000000247910	c1ccsc1
CN(C)C(=O)OCCc1n(C)cc[n+]1C	ZINC000000387453	c1c[nH]cn1
CC(C)N(CC[C@H](c1ccccc1)c2cc(CO)ccc2O)C(C)C	ZINC000000006047	C(c1ccccc1)c2ccccc2
CN2CCC1(CCNCC1)C2=O	ZINC000001872170	O=C1NCCC12CCNCC2
CCN5CCN(c4ccc(NC(=O)C[N@]1CCC[C@@H]1c3ccc2OCCCOc2c3)cc4)CC5	ZINC000009368340	O=C(CN1CCCC1c3ccc2OCCCOc2c3)Nc5ccc(N4CCNCC4)cc5
CN3CCN(c2ccc(N1CCN(C)CC1)nn2)CC3	ZINC000000190765	C3CN(c2ccc(N1CCNCC1)nn2)CCN3
CNC(=S)NCCN1CCCCC1	ZINC000000414894	C1CCNCC1
CN(C)C(=O)COc2ccc(N1C(=N)NC(=N)NC1(C)C)cc2	ZINC000016954281	N=C2NCN(c1ccccc1)C(=N)N2
CC1(C)CC(=O)C3=C(C1)O[C@@H]2CCCC[C@H]23	ZINC000000102682	O=C1CCCC3=C1C2CCCCC2O3
Cn1c(NN)[n+](C)c2ccccc12	ZINC000002541048	c2ccc1[nH]cnc1c2
CCN(CC)CCNc2nc(CC)c1COC(C)(C)Cc1c2C#N	ZINC000000203324	C2Cc1ccncc1CO2
CC(=O)N2CC[n+]3cc(c1ccc(Cl)cc1Cl)sc23	ZINC000000392223	C3C[n+]2cc(c1ccccc1)sc2N3
Cc2n(N)c1ccccc1[n+]2CC=C	ZINC000000440571	c2ccc1[nH]cnc1c2
CCOC(=O)C2CCN(Cc1ccco1)CC2	ZINC000000207624	C2CCN(Cc1ccco1)CC2
NC(=N)N2CCOc1ccccc1C2	ZINC000000492502	C2COc1ccccc1CN2
Cc2ccc1[nH]c(=O)c(=C(C#N)C#N)c1c2	ZINC000000047963	C=c1c(=O)[nH]c2ccccc12
O=c3n(CCc1ccccc1)c(c2ccco2)nc4ccccc34	ZINC000000049416	O=c3n(CCc1ccccc1)c(c2ccco2)nc4ccccc34
CCN(CC)CCN(C)C(=O)C[C@@]2(c1cccc(F)c1)CC(=O)N(CCN(C)C)C2=O	ZINC000012034867	O=C2CC(c1ccccc1)C(=O)N2
CCOC(=O)c4ccc(n1c(=O)c3cccc2cccc(c1=O)c23)cc4	ZINC000000049414	O=c2n(c1ccccc1)c(=O)c4cccc3cccc2c34
CN(C)CC(C)(C)CNC(=O)C2CCN(Cc1cccc(Cl)c1Cl)CC2	ZINC000004699683	C2CCN(Cc1ccccc1)CC2
C[N+](=O)Cc1cccs1	ZINC000000337382	c1ccsc1
Cc3ccn2cc(c1ccc(F)cc1)cc2c3	ZINC000000089771	c3ccc(c2cc1ccccn1c2)cc3
CC(C)C[N@]3C[C@@H](C(=O)NCCCN(C)C)C[C@@H](C(=O)Nc2ccc1CCCc1c2)C3	ZINC000014746575	O=C(Nc2ccc1CCCc1c2)C3CCCNC3
CCCc3nn(c1cccc(Cl)c1)c(N2CCN(C)CC2)c3C[N@@](Cc4sccc4C)C(C)C	ZINC000034837038	C4CN(c2c(CNCc1cccs1)cnn2c3ccccc3)CCN4
CCc2cn(Cc1ccccc1)c[n+]2Cc3ccccc3	ZINC000000161623	C(c1ccccc1)n3cc[n+](Cc2ccccc2)c3
OC(=O)c3ccc(NCn2c(=O)c1ccccc1c2=O)cc3	ZINC000000062085	O=c2n(CNc1ccccc1)c(=O)c3ccccc23
C[C@@H](C(=O)c1ccccc1)n3ccc2cc(Cl)ccc2c3=O	ZINC000000038333	O=C(Cn2ccc1ccccc1c2=O)c3ccccc3
O=C(CNC1CCCC1)Nc3ccc2OCCOc2c3	ZINC000000420261	O=C(CNC1CCCC1)Nc3ccc2OCCOc2c3
C[N@](CCCNc1ccnc2cc(Cl)ccc12)Cc4cc(=O)c(OCc3ccccc3)cn4C5CC5	ZINC000299834046	O=c4cc(CNCCCNc1ccnc2ccccc12)n(C3CC3)cc4OCc5ccccc5
COc3ccc([C@@H]2Sc1cc(Cl)ccc1N(CCN(C)C)C(=O)[C@@H]2OC(C)=O)cc3	ZINC000000607779	O=C3CC(c1ccccc1)Sc2ccccc2N3
OC(=O)CCN(Cc1ccco1)S(=O)(=O)c2ccc(Cl)cc2	ZINC000000170928	O=S(=O)(NCc1ccco1)c2ccccc2
CCC[N@@](CC1CC1)Cc2cc(OC)c(O)c(N(=O)=O)c2	ZINC000000277574	C1CC1CNCc2ccccc2
CCOc1ccccc1NC(=O)c2ccco2	ZINC000000029989	O=C(Nc1ccccc1)c2ccco2
CN(C)CCOc1ccccc1Cc2ccccc2	ZINC000000001931	C(c1ccccc1)c2ccccc2
C[N@@](CCNc1ncnc2[nH]cnc12)Cc3ccccc3	ZINC000000213922	C(CNc1ncnc2[nH]cnc12)NCc3ccccc3
FC(F)(F)c2cccc(NC(=O)CNCc1ccco1)c2	ZINC000000118220	O=C(CNCc1ccco1)Nc2ccccc2
CCn1ccnc1C[N@@](CC3CCN(CCc2ccccc2C)CC3)C4CCCC4	ZINC000012317879	C4CCC(N(CC2CCN(CCc1ccccc1)CC2)Cc3ncc[nH]3)C4
CCOc2ccc(C(=O)Nn1cnnc1)cc2	ZINC000000029981	O=C(Nn1cnnc1)c2ccccc2
COC(=O)C[C@@]2(C)OC[C@@H](CN1CCCCC1)O2	ZINC000000191960	C2CCN(CC1COCO1)CC2
OC(=O)\C=C\C(=O)Nc1ccccc1SC(F)(F)F	ZINC000000046742	c1ccccc1
Cc2cc(C)cc(NC(=O)c1ccco1)c2	ZINC000000029984	O=C(Nc1ccccc1)c2ccco2
C[C@H](O)C[N@]1CCn3c2[C@@H]1CCCc2c4cc(C)ccc34	ZINC000000201246	C2CC1NCCn3c1c(C2)c4ccccc34
CCN(C(C)=O)c2ccc(Oc1nc(OC)cc(OC)n1)cc2	ZINC000000042875	O(c1ccccc1)c2ncccn2
CCOC(=O)c1[nH]c(C=O)c(C(C)=O)c1C	ZINC000000248382	c1cc[nH]c1
Clc2cc(NC(=O)Cc1ccccc1)ccc2Br	ZINC000000045866	O=C(Cc1ccccc1)Nc2ccccc2
Cc2cnc4c1ccccc1c(=O)c3nccc2c34	ZINC000000005632	O=c2c1ccccc1c4nccc3ccnc2c34
COc4cc3nc(N2CCN(S(=O)(=O)c1ccc(Cl)cc1)CC2)nc(N)c3cc4OC	ZINC000000638654	O=S(=O)(N3CCN(c2ncc1ccccc1n2)CC3)c4ccccc4
CN(C)CCNC(=O)[C@H]3C[C@@H](C(=O)Nc1ccc(F)cc1)C[N@@](Cc2ccccc2)C3	ZINC000014747068	O=C(Nc1ccccc1)C3CCCN(Cc2ccccc2)C3
C[N+]2(Cc1csc(N)n1)CCCC2	ZINC000000497623	C2CCN(Cc1cscn1)C2
N[C@@H]([C@H](N)c1ccc(Cl)cc1Cl)c2ccc(Cl)cc2Cl	ZINC000000732112	C(Cc1ccccc1)c2ccccc2
C[C@@H](N)C(O)(CC=C)CC=C	ZINC000000286806	nonring
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)C[n+]2c(C)n(C)c3ccccc23	ZINC000000193848	O=C(C[n+]1c[nH]c2ccccc12)OC3CCCCC3
Oc3c(O)c(CN1CCCCC1)c2ccccc2c3CN4CCCCC4	ZINC000000756483	C4CCN(Cc2ccc(CN1CCCCC1)c3ccccc23)CC4
C[N@]1[C@H]4CC[C@@H]1CC(NC(=O)c2cc(C)c3ccccn23)C4	ZINC000000003818	O=C(NC1CC2CCC(C1)N2)c3ccc4ccccn34
CCN(C[C@@H]2CCC[N@@](CCc1cccc(F)c1)C2)Cc4cc(OC)c3OCOc3c4	ZINC000012477990	C4CC(CNCc2ccc1OCOc1c2)CN(CCc3ccccc3)C4
O=C(Nc3c1CCCCc1nc2CCCc23)C4CCCCC4	ZINC000000198613	O=C(Nc3c1CCCCc1nc2CCCc23)C4CCCCC4
Clc6ccc(O[C@@H]2C[C@H](N1CCCCC1)C(=O)c4c2n(CCCN3CCCCC3)c5ccccc45)cc6	ZINC000028570005	O=C3C(N1CCCCC1)CC(Oc2ccccc2)c5c3c4ccccc4n5CCCN6CCCCC6
O=C(CN1CC[n+]2c1scc2c3cccs3)c4ccccc4	ZINC000000446922	O=C(CN1CC[n+]2c1scc2c3cccs3)c4ccccc4
O=C(CN1CCCC1)N2CCc3ccccc23	ZINC000000159547	O=C(CN1CCCC1)N2CCc3ccccc23
Cc2cncc(C1=NCCCC1)c2	ZINC000000018650	C2CCC(c1cccnc1)=NC2
Cc4ccc3cc2C[N+]1(CCOCC1)Cc2cc3c4	ZINC000000346430	C1C[N+]4(CCO1)Cc3cc2ccccc2cc3C4
COC(=O)[C@@H](C#N)C1CC(C)(C)NC(C)(C)C1	ZINC000000104372	C1CCNCC1
Cn2c(=O)[nH]c(=O)c3n(CCN1CCCCC1)cnc23	ZINC000000067617	O=c3[nH]c(=O)c2n(CCN1CCCCC1)cnc2[nH]3
Fc3ccc([C@H]2CC(=O)Nc1ccccc1S2)cc3	ZINC000000104377	O=C3CC(c1ccccc1)Sc2ccccc2N3
O=C(CN1CCCCCC1)N3CCN(c2ccccc2)CC3	ZINC000000119404	O=C(CN1CCCCCC1)N3CCN(c2ccccc2)CC3
CCN=C(NCCOCCNC(SC)=NCC)SC	ZINC000004514967	nonring
Cc1ncc(Cl)c(C(N)=O)n1	ZINC000000039499	c1cncnc1
NC1(CO)CCOCC1	ZINC000002527675	C1CCOCC1
O=C2CCN(CCc1ccccc1)CC2	ZINC000000119408	O=C2CCN(CCc1ccccc1)CC2
CC(=O)N3CCC(N2CCN(c1cccc(Cl)c1)CC2)CC3	ZINC000000213857	C3CC(N2CCN(c1ccccc1)CC2)CCN3
Cc3cccc(Nc2cc(=O)c(c1ccccc1)n[nH]2)c3	ZINC000000087799	O=c2cc(Nc1ccccc1)[nH]nc2c3ccccc3
OC(=O)CON3C(=O)[C@@H]2[C@H]1C[C@H](C=C1)[C@H]2C3=O	ZINC000006021988	O=C3NC(=O)C2C1CC(C=C1)C23
O=C(c1ccccc1)n2ccc3ccccc23	ZINC000000088353	O=C(c1ccccc1)n2ccc3ccccc23
Cn2c(NCc1ccc(C#N)cc1)ncc2c4ccc3OCOc3c4	ZINC000000819158	C4Oc3ccc(c2cnc(NCc1ccccc1)[nH]2)cc3O4
Cn2cc(C(=O)OCC1CCN(CCNS(C)(=O)=O)CC1)c3ccccc23	ZINC000000598220	O=C(OCC1CCNCC1)c2c[nH]c3ccccc23
CCN(CC2CCN(C1CCN(C)CC1)CC2)C(=O)CCN4Cc3ccccc3C4=O	ZINC000012466190	O=C(CCN2Cc1ccccc1C2=O)NCC4CCN(C3CCNCC3)CC4
COC[n+]1ccc(C)c2ccccc12	ZINC000000390943	c2ccc1ncccc1c2
N[C@H](C(O)=O)c1ccc(C=O)c(O)c1	ZINC000000000327	c1ccccc1
CC(C)n2c(SCCc1ccccc1)nc3n(C)c(=O)[nH]c(=O)c23	ZINC000000093060	O=c3[nH]c(=O)c2[nH]c(SCCc1ccccc1)nc2[nH]3
C[C@H]1CC(C)=C[C@@H](C)C13COC(c2ccc[n+](C)c2)OC3	ZINC000000273314	C3CC2(COC(c1cccnc1)OC2)CC=C3
NC(=O)c2cc(Cl)c(C(O)=O)n(Cc1ccccc1)c2=N	ZINC000000058604	N=c1ccccn1Cc2ccccc2
COC(=O)[C@H]1CCN(C#N)C1	ZINC000000027296	C1CCNC1
CCOC(=O)c3csc(c1sccc1COc2ccccc2)n3	ZINC000000107638	C(Oc1ccccc1)c2ccsc2c3nccs3
CC(=O)C(=Cc1ccc(C#N)cc1)C(C)=O	ZINC000000014898	c1ccccc1
O[C@@H](COC2C1CC3CC(C1)CC2C3)CN4CCCCC4	ZINC000000289785	C4CCN(CCCOC2C1CC3CC(C1)CC2C3)CC4
COc2cc(S(=O)(=O)Nc1ccccn1)ccc2Cl	ZINC000000036385	O=S(=O)(Nc1ccccn1)c2ccccc2
Fc5cc(N4CCN(C1CCC3(CC1)OCc2ccccc23)CC4)ccc5C#N	ZINC000000581011	C1CC5(CCC1N3CCN(c2ccccc2)CC3)OCc4ccccc45
O=C1CCCN1C2CCNCC2	ZINC000002391765	O=C1CCCN1C2CCNCC2
CC[C@@H](OC(=O)c1ccc(Br)cc1)C(=O)c2ccccc2	ZINC000000316215	O=C(COC(=O)c1ccccc1)c2ccccc2
O=C(Nc2ccc(N1CCCCC1)cc2)c4ccc3ccccc3c4	ZINC000000038194	O=C(Nc2ccc(N1CCCCC1)cc2)c4ccc3ccccc3c4
COC(=O)[C@@H]4Cc1c([nH]c2ccccc12)C3(CCN(C)CC3)N4	ZINC000000083417	C4Cc1c([nH]c2ccccc12)C3(CCNCC3)N4
Cc1ccnc2ccc(Br)c[n+]12	ZINC000000285915	c2cc[n+]1cccnc1c2
CC(=O)c1cc(Cl)cc(N(=O)=O)c1O	ZINC000000056938	c1ccccc1
COc1ccc(N(=O)=O)cc1NC(=O)CCN2CCC(C)CC2	ZINC000000176384	O=C(CCN1CCCCC1)Nc2ccccc2
C[C@@H](N)c1ccc(Br)cc1	ZINC000000388329	c1ccccc1
NC(=O)[C@@H]1CCCN1	ZINC000000391898	C1CCNC1
C[n+]1cc(Cl)cc(Cl)c1	ZINC000000330896	c1ccncc1
C[n+]1ccccc1\C=c3/sc2ccccc2n3CCO	ZINC000000188599	C(c1ccccn1)=c3[nH]c2ccccc2s3
COc2cc(C(=O)Oc1cccc(N(=O)=O)c1)cc(OC)c2OC	ZINC000000045895	O=C(Oc1ccccc1)c2ccccc2
NC1CCC(O)CC1	ZINC000004072653	C1CCCCC1
NCc2ccc1OCCc1c2	ZINC000000158517	C2Cc1ccccc1O2
O=S(=O)(N[C@H]1CCN(C#N)C1)c2ccccc2	ZINC000000008873	O=S(=O)(NC1CCNC1)c2ccccc2
CN(C)C(=O)[n+]1ccc(N(C)C)cc1	ZINC000000259942	c1ccncc1
CC[N@]1CCC[C@@H]1CNC(=O)[C@@H](C)N2CCNCC2	ZINC000020521319	O=C(CN1CCNCC1)NCC2CCCN2
COc2cc(CN1CCC(C(=O)NCC(C)(C)CN(C)C)CC1)cc(Br)c2O	ZINC000009833619	C2CCN(Cc1ccccc1)CC2
Cc1cc(C(O)=O)c(C#N)c(N)n1	ZINC000000970318	c1ccncc1
CN(C)CCNC(=O)c1ccc(\C=N\O)nc1	ZINC000000174346	c1ccncc1
Cc4ccc([C@@H](Nc1cc(C)ccn1)c2c(C)[nH]c3ccccc23)cc4	ZINC000000072054	N(C(c1ccccc1)c2c[nH]c3ccccc23)c4ccccn4
CCCN4CCC(CNCc2cn(c1ccc(N(=O)=O)cc1)nc2c3ccc(C(F)(F)F)cc3)CC4	ZINC000096938554	C4CC(CNCc2cn(c1ccccc1)nc2c3ccccc3)CCN4
Cn1c[n+](CS(C)(=O)=O)c2ccccc12	ZINC000000500503	c2ccc1[nH]cnc1c2
COCCN3CCC(C[N@]1CCN2[C@@H](C1)C(=O)NCC2=O)CC3	ZINC000065533605	O=C3CNC(=O)C2CN(CC1CCNCC1)CCN23
CN(C)CCN(Cc1ccccn1)C(=O)c2cn(CCN)nn2	ZINC000662528869	O=C(NCc1ccccn1)c2c[nH]nn2
CNCCC/N=c4\cc3n(c1ccc(Cl)cc1)c2ccccc2nc3cc4Nc5ccc(Cl)cc5	ZINC000027642754	N=c4cc3n(c1ccccc1)c2ccccc2nc3cc4Nc5ccccc5
OC(=O)c2cccc(CSCC(=O)Nc1ccc(F)cc1)c2	ZINC000000151487	O=C(CSCc1ccccc1)Nc2ccccc2
C[C@]23CCC[C@@]1(CO1)[C@@H]2C[C@H]4[C@@H](C3)OC(=O)[C@@H]4CNC6CCN(Cc5ccccc5)CC6	ZINC000008790389	O=C4OC3CC2CCCC1(CO1)C2CC3C4CNC6CCN(Cc5ccccc5)CC6
O=C2Cc1ccccc1N2c3ccccc3	ZINC000000041212	O=C2Cc1ccccc1N2c3ccccc3
O=N(=O)c2cn(Cc1ccccc1)nn2	ZINC000000033797	C(c1ccccc1)n2ccnn2
Clc3ccc(c1nnnn1c2cnccn2)cc3	ZINC000000092164	c3ccc(c1nnnn1c2cnccn2)cc3
Fc4cccc(OC[C@H]3C[C@@H](C(=O)NCCCN1CCOCC1)C[N@@](Cc2ccccc2)C3)c4	ZINC000014534177	O=C(NCCCN1CCOCC1)C4CC(COc2ccccc2)CN(Cc3ccccc3)C4
Clc6ccc(OCc4c(CN2CCC(N1CCCCC1)CC2)c3ccccc3n4CCN5CCCCC5)cc6	ZINC000027193094	C6CCN(CCn4c(COc1ccccc1)c(CN3CCC(N2CCCCC2)CC3)c5ccccc45)CC6
COC(=O)C3CCN(C[C@@H](O)COc2ccc(CNCC1(C)COC1)cc2)CC3	ZINC000011839426	C3CCN(CCCOc2ccc(CNCC1COC1)cc2)CC3
Cc1ccccc1/C=C/C(N)=O	ZINC000000005707	c1ccccc1
CCOC(=O)c2cnc1c(C)c(Cl)ccc1c2N4CCN(Cc3ccccc3)CC4	ZINC000000645729	C3CN(c1ccnc2ccccc12)CCN3Cc4ccccc4
CC(C)(C)c4cc(C[C@H]1CNCC[C@H]1CC(=O)N3CCN(Cc2ccccc2)CC3)no4	ZINC000015673249	O=C(CC1CCNCC1Cc2ccon2)N4CCN(Cc3ccccc3)CC4
C[N@]1CCC[C@@H](OC(C)=O)C1	ZINC000001585334	C1CCNCC1
C[N@]1CC[C@@](C)(O)[C@H](C(C)=O)C1	ZINC000003901854	C1CCNCC1
COc4ccc3[C@@H](C1C(=O)CCCC1=O)C2=C(CCCC2=O)Oc3c4	ZINC000000090466	O=C1CCCC(=O)C1C3C2=C(CCCC2=O)Oc4ccccc34
CN(N=C(C)N)c1cccc(F)c1C#N	ZINC000000140416	c1ccccc1
C[N+](=O)Cc1ccccc1	ZINC000000335864	c1ccccc1
NCCN1CCNC1=S	ZINC000001295975	S=C1NCCN1
Cc2nc1ccc(Cl)cc1s2	ZINC000000039647	c2ccc1scnc1c2
Oc1ccc(O)c(C#N)c1C#N	ZINC000000039641	c1ccccc1
Cc3ccc2cccc(SCC(=O)NC[C@@H]1CCCO1)c2n3	ZINC000000036162	O=C(CSc1cccc2cccnc12)NCC3CCCO3
CCN(CC)CCn2cnc3cc(NS(=O)(=O)c1ccc(F)cc1)ccc23	ZINC000004707944	O=S(=O)(Nc2ccc1[nH]cnc1c2)c3ccccc3
CCCN(Cc1ccccc1)C(=O)c3ccc2nc(C)c(C)nc2c3	ZINC000000049180	O=C(NCc1ccccc1)c3ccc2nccnc2c3
CN(CCCCCCCCCCN(C)C(=O)Oc1cccc([N+](C)(C)C)c1)C(=O)Oc2cccc([N+](C)(C)C)c2	ZINC000003875376	O=C(NCCCCCCCCCCNC(=O)Oc1ccccc1)Oc2ccccc2
CCOC(=O)c2ccc(NC(=S)NCCN1CCC(C)CC1)cc2	ZINC000000614286	S=C(NCCN1CCCCC1)Nc2ccccc2
CCN(CC)CC3CCN(Cc2nc(c1ccc(OC)cc1)no2)CC3	ZINC000047976708	C3CCN(Cc2nc(c1ccccc1)no2)CC3
C[C@@H](N)c1ccc(F)cc1	ZINC000000388327	c1ccccc1
Cc2cc(C)c([n+]1cccc(C(N)=O)c1)c(C)c2	ZINC000000331464	c2ccc([n+]1ccccc1)cc2
Nc1csc(C(F)(F)F)c1c2ccccc2	ZINC000000108898	c2ccc(c1ccsc1)cc2
C[N+](C)(CCn2c(=O)c1SCCSc1c2=O)Cc3ccccc3	ZINC000000392543	O=c2c1SCCSc1c(=O)n2CCNCc3ccccc3
C3CCN(CC2OCc1ccccc1CO2)C3	ZINC000000174698	C3CCN(CC2OCc1ccccc1CO2)C3
CCC(=O)N(c1ccccc1)C2(C(=O)OC)CCN(CCC(=O)OC)CC2	ZINC000000538283	C2CC(Nc1ccccc1)CCN2
C[C@@H](N)C(=O)Nc1ccccc1	ZINC000001733289	c1ccccc1
CNCC(=O)NC(C)C	ZINC000004206305	nonring
Cc1nc(N)sc1CCN	ZINC000000005099	c1cscn1
COc3cc(c2nc1ccc(C)cn1c2NC(C)(C)C)ccc3O	ZINC000000411927	c3ccc(c2cn1ccccc1n2)cc3
CN(C)CCn1c(C#N)cc2ccccc12	ZINC000000129803	c2ccc1[nH]ccc1c2
CCOC(=O)c3cc(c1ccccc1)cc(c2ccccc2)[o+]3	ZINC000000156572	c3ccc(c2cc[o+]c(c1ccccc1)c2)cc3
Cn5c(=O)n(C)c4ncn(CCN3CCC(c1c[nH]c2ccccc12)CC3)c4c5=O	ZINC000000538412	O=c5[nH]c(=O)c4n(CCN3CCC(c1c[nH]c2ccccc12)CC3)cnc4[nH]5
COCCC(=O)N(CCN(C)C)C[C@@H]2CCC[N@@](Cc1ccccc1OC)C2	ZINC000011818478	C2CCN(Cc1ccccc1)CC2
C[C@@H](NCc1ccccc1)[C@@H]3COc2ccccc2O3	ZINC000000174660	C(NCc1ccccc1)C3COc2ccccc2O3
COc3cccc4N(CCCN2CCN(c1cccc(Cl)c1)CC2)C(=O)CCc34	ZINC000000598353	O=C2CCc1ccccc1N2CCCN4CCN(c3ccccc3)CC4
C[N@]1[C@H]3CC[C@@H]1C=C(c2ccc(Cl)cc2)C3	ZINC000000022173	C1CC3NC1CC(c2ccccc2)=C3
CCOC(=O)[C@H]1CCC[N@]1C	ZINC000000280745	C1CCNC1
C[C@@H](CC[C@H](C)[n+]1cccc(C(C)=O)c1)[n+]2cccc(C(C)=O)c2	ZINC000001666330	C(CC[n+]1ccccc1)C[n+]2ccccc2
Cn1cc(N(=O)=O)cc1C(=O)NCCCNCCCCN	ZINC000026018727	c1cc[nH]c1
Cn3c(=O)c(=Cc2ccc(c1cccc(F)c1)o2)c(=O)n(C)c3=S	ZINC000000093253	O=c1[nH]c(=S)[nH]c(=O)c1=Cc3ccc(c2ccccc2)o3
O=C2CC[C@H]1COC(=O)N12	ZINC000000005418	O=C2CCC1COC(=O)N12
CC(C)NC(=N)NC(=N)Nc1ccc(Cl)c(Cl)c1	ZINC000000001136	c1ccccc1
CC(C)COC(=O)N(C)C3CCN(C2Cc1ccccc1C2)CC3	ZINC000000006178	C3CCN(C2Cc1ccccc1C2)CC3
COCCCNC(N)=N	ZINC000001648957	nonring
Fc2ccc(\C=N\n1cnnc1)cc2	ZINC000000060136	C(=Nn1cnnc1)c2ccccc2
COc1ccccc1N4CCN(CCCN3C(=O)[C@@H]2CCCCN2C3=O)CC4	ZINC000000641749	O=C2C1CCCCN1C(=O)N2CCCN4CCN(c3ccccc3)CC4
Clc3ccc(S(=O)(=O)NC[C@@H](N1CCCCC1)c2ccccc2)cc3	ZINC000000629122	O=S(=O)(NCC(N1CCCCC1)c2ccccc2)c3ccccc3
NC(=N)NN=Cc1ccccc1N(=O)=O	ZINC000000128278	c1ccccc1
CCCC2=C(C(=O)OCC)[C@H](c1ccc(OC)cc1)C(C#N)=C(N)O2	ZINC000000071041	O2C=CC(c1ccccc1)C=C2
COc5ccc4cc(CNCCCN3CCN(CCCNCc2ccc1cc(OC)ccc1c2)CC3)ccc4c5	ZINC000019370351	C(CNCc2ccc1ccccc1c2)CN5CCN(CCCNCc4ccc3ccccc3c4)CC5
Cc1cccc(N)c1C(O)=O	ZINC000000164443	c1ccccc1
C[n+]2ccc(\C=C\c1cccs1)cc2	ZINC000000055356	C(=Cc1cccs1)c2ccncc2
CCN(Cc1ccccc1)S(C)(=O)=O	ZINC000000029508	c1ccccc1
N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(N)=O	ZINC000008076308	C1CCNC1
O=CN2CCN(CCCc1ccccc1)CC2	ZINC000000278301	C(CN1CCNCC1)Cc2ccccc2
COc1ccc(Cl)cc1NS(C)(=O)=O	ZINC000000029502	c1ccccc1
FC(F)(F)c2ccc(n1cccc1)cc2	ZINC000000112313	c2ccc(n1cccc1)cc2
C[C@@H](Sc1nc(N)cc(N)n1)C(=O)Nc2ccccc2	ZINC000000422369	O=C(CSc1ncccn1)Nc2ccccc2
Cc2oc(c1cccs1)nc2C[N@](CC4CCN(C3CCCC3)CC4)C[C@@H]5CCCO5	ZINC000012468578	C5CCC(N4CCC(CN(CC1CCCO1)Cc3coc(c2cccs2)n3)CC4)C5
CCN(CC)CCC[C@@H](C)Nc2cc(/C=C/c1ccc(Cl)cc1)nc3ccc(N(C)C)cc23	ZINC000005208922	C(=Cc2ccc1ccccc1n2)c3ccccc3
Cn2ccc(=O)n(Cc1ccoc1)c2=O	ZINC000000019214	O=c1cc[nH]c(=O)n1Cc2ccoc2
N=C2N[C@@H](Cc1cccs1)CS2	ZINC000000027432	N=C2NC(Cc1cccs1)CS2
C4CN(CCN1CCn2c1nc3ccccc23)CCO4	ZINC000000255176	C4CN(CCN1CCn2c1nc3ccccc23)CCO4
CCN(CC)CCOC(=O)C(C=CC)(/C=C\C)C(/C=C\C)(/C=C\C)C(=O)OCCN(CC)CC	ZINC000004778086	nonring
CCc1nc(C)cc(N)c1O	ZINC000000281709	c1ccncc1
O=C([C@@H]1CCCNC1)N2CCCC2	ZINC000004287430	O=C(C1CCCNC1)N2CCCC2
Cc1ccc(NN=C(C#N)C(N)=S)cc1	ZINC000000040070	c1ccccc1
Cc2nc1ccccc1nc2C=O	ZINC000000085258	c2ccc1nccnc1c2
CCN(CC)CCC(CCN(CC)CC)(CNC(C)=O)c1ccccc1	ZINC000005698973	c1ccccc1
Nc2nc(c1ccc(N(=O)=O)cc1)cs2	ZINC000000039796	c2ccc(c1cscn1)cc2
CCN(CC)Cc3cc(CN[C@@H](C)c2cnn(c1ccc(F)cc1F)c2C)ccc3OC	ZINC000012480880	C(NCc2cnn(c1ccccc1)c2)c3ccccc3
C[n+]5c1ccccc1c(Oc3c2ccccc2[n+](C)c4ccccc34)c6ccccc56	ZINC000005554836	O(c2c1ccccc1nc3ccccc23)c5c4ccccc4nc6ccccc56
CC(=O)NC2=NN(C(C)=O)[C@@](C)(c1ccccc1)S2	ZINC000000054578	N1N=CSC1c2ccccc2
S=c2oc1ccccc1n2CNc3ccccn3	ZINC000000058591	S=c2oc1ccccc1n2CNc3ccccn3
CCOC(=O)c1cc(CN)c(C)o1	ZINC000000376441	c1ccoc1
CCOC(=O)C2CCN(C/C=C/c1ccccc1N(=O)=O)CC2	ZINC000000278788	C2CCN(CC=Cc1ccccc1)CC2
Cc3cc2ncn(S(=O)(=O)c1ccccc1N(=O)=O)c2cc3C	ZINC000000053252	O=S(=O)(c1ccccc1)n2cnc3ccccc23
Fc3cccc(COc2ccc(CN[C@@H]1CCNC1=O)cc2)c3	ZINC000000022080	O=C1NCCC1NCc3ccc(OCc2ccccc2)cc3
COc2cccc(CN(C)C1CCN(C)CC1)c2	ZINC000000237155	C2CC(NCc1ccccc1)CCN2
CC(=C)C[C@H]1CC(C(N)(CC=C)CC=C)=C[C@H](CC(C)=C)N1	ZINC000005480722	C1CC=CCN1
CC[N@]3CCC[C@H](NC1=CC(=O)OC12CCCCC2)C3	ZINC000000140231	O=C3OC1(CCCCC1)C(NC2CCCNC2)=C3
Cc1nc[nH]c1c2ccc(Cl)cc2	ZINC000000001627	c2ccc(c1cnc[nH]1)cc2
CN3CCN(c1ncnc2sc(C)c(C)c12)CC3	ZINC000000087716	C3CN(c1ncnc2sccc12)CCN3
CC2=CC(C)(C)Nc3ccc(OC(=O)Cc1ccc(F)cc1)cc23	ZINC000000055372	O=C(Cc1ccccc1)Oc3ccc2NCC=Cc2c3
Brc1ccccc1Oc3nc2ccccc2n4cncc34	ZINC000000017806	O(c1ccccc1)c3nc2ccccc2n4cncc34
Nc2ccc(S(=O)(=O)c1ccc(NCC(O)=O)cc1)cc2	ZINC000000000862	O=S(=O)(c1ccccc1)c2ccccc2
C[C@@H](O)Cn1c(C)ncc1N(=O)=O	ZINC000000000711	c1c[nH]cn1
Nc1ccccc1SC[C@@H](O)COc2cccc(C(F)(F)F)n2	ZINC000000117319	C(COc1ccccn1)CSc2ccccc2
Cc3cc2C1CCC(CC1)c2cc3CC4=NCCN4	ZINC000000001725	C4CN=C(Cc3ccc2C1CCC(CC1)c2c3)N4
CC(=O)Oc1ccccc1C(=O)Oc2c(C)occc2=O	ZINC000000006255	O=C(Oc1coccc1=O)c2ccccc2
COc2cc(OC)c1c(C)cc(=O)oc1c2	ZINC000000058042	O=c2ccc1ccccc1o2
CC(C)(C)c1cc(C#N)ccn1	ZINC000000065251	c1ccncc1
CCN[C@H](Cc1ccccn1)c2sccc2C	ZINC000000015857	C(Cc1cccs1)c2ccccn2
CCN4CCN(c2ncnc3n(c1cccc(C)c1)ncc23)CC4	ZINC000000467991	C4CN(c2ncnc3n(c1ccccc1)ncc23)CCN4
Fc1ccccc1C(=O)N3CCC(Cc2ccccc2)CC3	ZINC000000027165	O=C(N2CCC(Cc1ccccc1)CC2)c3ccccc3
Fc2cccc(CN1CCNC1=S)c2	ZINC000000010251	S=C1NCCN1Cc2ccccc2
C2CN(Cc1ccco1)CCC2N4CCN(c3ccccc3)CC4	ZINC000000207675	C2CN(Cc1ccco1)CCC2N4CCN(c3ccccc3)CC4
COc2ccc(OCC(=O)Nc1ccc(C(C)=O)cc1)cc2	ZINC000000043938	O=C(COc1ccccc1)Nc2ccccc2
Fc3ccc(S(=O)(=O)N2CCN1[C@H](CCC1=O)C2)cc3	ZINC000000008705	O=C3CCC2CN(S(=O)(=O)c1ccccc1)CCN23
CC[N@]1CCC[C@@H]1CNC(=O)C5CCN(Cc3cc2ccccc2n3Cc4cccc(C)c4)CC5	ZINC000015865842	O=C(NCC1CCCN1)C5CCN(Cc3cc2ccccc2n3Cc4ccccc4)CC5
c4ccc(n1ncc2c1ncn3nnnc23)cc4	ZINC000000055497	c4ccc(n1ncc2c1ncn3nnnc23)cc4
COc2cc(C(=O)Oc1ccc(OC[C@@H](O)CNC(C)C)c(C)c1C)cc(OC)c2OC	ZINC000000638665	O=C(Oc1ccccc1)c2ccccc2
CC[C@@H](CO)NC(=O)[C@@H]2C[N@@](C)[C@H]1Cc3cn(C)c4cccc(C1=C2)c34	ZINC000000601286	C4CC=C1C(Cc2c[nH]c3cccc1c23)N4
Cn2c(=O)[nH]c(=O)c3n(CC=C)c(SCCN1CCCCC1)nc23	ZINC000000079468	O=c3[nH]c(=O)c2[nH]c(SCCN1CCCCC1)nc2[nH]3
COc1ccc(Cl)cc1S(=O)(=O)N(CCN2CCCCC2)CCC(=O)N3CCNCC3	ZINC000045945325	O=C(CCN(CCN1CCCCC1)S(=O)(=O)c2ccccc2)N3CCNCC3
CN(C)CCN(Cc2cc1ccccc1o2)c3ccccn3	ZINC000000001405	C(Nc1ccccn1)c3cc2ccccc2o3
CC(C)c2ccc(S(=O)(=O)CCc1ccc(C)[n+](C)c1)cc2	ZINC000000267932	O=S(=O)(CCc1cccnc1)c2ccccc2
CC(C)NC[C@@H](O)c1ccc(NS(C)(=O)=O)cc1	ZINC000000004166	c1ccccc1
COc3ccc(n1c(=S)[nH]c(=O)c2cccnc12)cc3	ZINC000000093473	O=c2[nH]c(=S)n(c1ccccc1)c3ncccc23
CC(=O)c2ccc1[nH]c(=O)oc1c2	ZINC000000058193	O=c2[nH]c1ccccc1o2
Cc2c(CNCCCNCCO)c1ccccc1n2Cc3ccc(Cl)cc3Cl	ZINC000013733283	C(c1ccccc1)n2ccc3ccccc23
CNC(=O)Nc1ccc(F)c(C)c1	ZINC000000039869	c1ccccc1
CCN(CC)CCCNCCCNc1cc(OC)cc2cccnc12	ZINC000001591917	c2ccc1ncccc1c2
Nc3nc(OCc1ccccc1)c2[nH]c(=O)[nH]c2n3	ZINC000000021195	O=c3[nH]c2ncnc(OCc1ccccc1)c2[nH]3
CCc2n(C)c1ccccc1[n+]2C	ZINC000000160389	c2ccc1[nH]cnc1c2
CCC(=O)c3ccc2sc1ccccc1n(C[C@H](C)N(C)C)c2c3	ZINC000000000669	c3ccc2sc1ccccc1[nH]c2c3
CCN1CCCC[C@@H]1C(=O)N5CCOc4ccc(C[N@]3CCc2ccccc2C3)cc4C5	ZINC000012131139	O=C(C1CCCCN1)N5CCOc4ccc(CN3CCc2ccccc2C3)cc4C5
CCCOc4ccc(N3C(=O)C[C@@H](NCC2CCN(Cc1ccc(F)cc1)CC2)C3=O)cc4	ZINC000009287934	O=C3CC(NCC2CCN(Cc1ccccc1)CC2)C(=O)N3c4ccccc4
CC(C)(C)C(=O)CSc2nc(c1cccnc1)c(C#N)c(=O)[nH]2	ZINC000000104888	O=c2cc(c1cccnc1)nc[nH]2
CCNC[C@H](C)C(=O)OC	ZINC000001621723	nonring
C[C@@H]2O[C@@](O)(c1ccc(N(=O)=O)cc1)CC[N+]23CCCCC3	ZINC000000162705	C1CC[N+]3(CC1)CCC(c2ccccc2)OC3
C[C@@H]2O[C@@](O)(c1ccc(Cl)cc1)C[N+]23CCCCC3	ZINC000000162700	C1CC[N+]3(CC1)COC(c2ccccc2)C3
CC1(C)CC(N)CC(C)(C)N1O	ZINC000000388403	C1CCNCC1
CCN(CC)CCC[C@H](C)Nc2c(c1ccccc1)cnc3cc(Cl)ccc23	ZINC000001729657	c3ccc(c2cnc1ccccc1c2)cc3
CC(=O)C[n+]1ccccc1C	ZINC000001578692	c1ccncc1
O[C@@]3(c1cccs1)CN2CCCCCC2=[N+]3c4ccccc4	ZINC000000407651	C4CCN3CC(c1cccs1)[N+](c2ccccc2)=C3CC4
COc2cc(C(=O)O[C@@H](C)CN1CCCC1)cc(OC)c2OC	ZINC000000531404	O=C(OCCN1CCCC1)c2ccccc2
CCCN4CCN(c3nnc(n1cccc1CNC2CCCC2)s3)CC4	ZINC000007002074	C4CCC(NCc1cccn1c3nnc(N2CCNCC2)s3)C4
Cc3cc(C)n(c2ccc1nncn1n2)n3	ZINC000000084067	c3cnn(c2ccc1nncn1n2)c3
Cc4cccc(N[C@H](c1ccccn1)c3ccc2ccc(C)nc2c3O)n4	ZINC000000684054	N(C(c2ccc1cccnc1c2)c3ccccn3)c4ccccn4
N[n+]2cc1ccccc1cc2C#N	ZINC000000162440	c2ccc1cnccc1c2
C=Cn2c(=O)c1ccccc1c2=O	ZINC000000389688	O=c1[nH]c(=O)c2ccccc12
CCCCCCN(CCCCCC)CCCNc1nccc2ccccc12	ZINC000004404067	c2ccc1cnccc1c2
COc2ccc1c(CCN)c[nH]c1c2	ZINC000000077360	c2ccc1[nH]ccc1c2
C[C@@H](Cc1ccc(O)cc1)N(C)C	ZINC000000347523	c1ccccc1
CN(C)c2cc(C)nc(N1CCCCC1)c2C#N	ZINC000000204329	C2CCN(c1ccccn1)CC2
O=C(CN1CCCC1)N3CCN(C(=O)c2ccccc2)C3	ZINC000000196482	O=C(CN1CCCC1)N3CCN(C(=O)c2ccccc2)C3
C[N@]1[C@H]3CC[C@@H]1CC(NC(=O)c2c(F)cccc2F)C3	ZINC000000132876	O=C(NC1CC2CCC(C1)N2)c3ccccc3
CC1(C)NC(=N)NC(=N)N1c2ccc(Cl)cc2	ZINC000000001233	N=C2NCN(c1ccccc1)C(=N)N2
CCC[N@]1CCc2c(C1)sc4c2c(NCCCN(C)C)nc3nnnn34	ZINC000002325569	C1Cc2c(CN1)sc4c2cnc3nnnn34
COc1nsc(Br)c1C#N	ZINC000000054464	c1cnsc1
CC2(C)CC(NC(=O)c1cncc(Br)c1)CC(C)(C)N2	ZINC000000092326	O=C(NC1CCNCC1)c2cccnc2
O[C@@H](COc1ccccc1)Cn3c2=NCCn2c4ccccc34	ZINC000000301975	C(COc1ccccc1)Cn3c2=NCCn2c4ccccc34
CN4CCN(c3ccc(Nc2nc1ccccc1[nH]2)cc3)CC4	ZINC000000045690	C4CN(c3ccc(Nc2nc1ccccc1[nH]2)cc3)CCN4
Cc2ccc(C)c(C[N@]1CC[C@@H](O)C1)c2	ZINC000000212804	C2CCN(Cc1ccccc1)C2
CCOC(=O)c1c(CN(C)C)n(C)c2ccc(OC(C)=O)cc12	ZINC000000523645	c2ccc1[nH]ccc1c2
O=C(CN2CC[n+]3cc(c1ccccc1)sc23)c4ccccc4	ZINC000000161782	O=C(CN2CC[n+]3cc(c1ccccc1)sc23)c4ccccc4
CCN/C(=N\C)c3ccc(NC(=O)c2ccc(C(=O)Nc1ccc(C(/NCC)=N\C)cc1)cc2)cc3	ZINC000001687826	O=C(Nc1ccccc1)c3ccc(C(=O)Nc2ccccc2)cc3
CCOC(=O)c1c(C)n(CC)c2cc(Br)c(O)cc12	ZINC000000055150	c2ccc1[nH]ccc1c2
CC(C)N4CCC(C(=O)N3CCC[C@@H](N2CCN(c1ccc(F)cc1)CC2)C3)CC4	ZINC000011937961	O=C(C1CCNCC1)N4CCCC(N3CCN(c2ccccc2)CC3)C4
COc3ccc2[C@H](c1c[nH]cn1)CCCc2c3	ZINC000000021284	C3CC(c1c[nH]cn1)c2ccccc2C3
NC(=O)C4CCN(CC(=O)N3CCc2[nH]c1ccccc1c2C3)CC4	ZINC000000526619	O=C(CN1CCCCC1)N4CCc3[nH]c2ccccc2c3C4
Fc4ccc(CSc1nnnn1c2cccc3ccccc23)cc4	ZINC000000060574	C(Sc1nnnn1c2cccc3ccccc23)c4ccccc4
CN(C)CCn2c(C(=O)Nc1ccccc1)cc3ccccc23	ZINC000000403667	O=C(Nc1ccccc1)c3cc2ccccc2[nH]3
COc2cc1nc(=S)n(CCN(C)C)c(N)c1cc2OC	ZINC000000166356	S=c2nc1ccccc1c[nH]2
COc1ccc([C@@H](C)N)cc1OC	ZINC000000296167	c1ccccc1
Fc3ccc(c2nc1c(Cl)cc(Cl)cc1c(=O)o2)cc3	ZINC000000041108	O=c2oc(c1ccccc1)nc3ccccc23
CC(=O)Nc2cc1CCCCc1s2	ZINC000000040133	C2CCc1sccc1C2
CCc1cccc[n+]1N	ZINC000001680217	c1ccncc1
CN(C)CCNC(=O)Cn2c(=S)[nH]c1ccccc1c2=O	ZINC000000425335	O=c1[nH]c(=S)[nH]c2ccccc12
C[C@@H]2C[C@@H](C)CN(C(=O)c1ccc(F)cc1)C2	ZINC000000029760	O=C(N1CCCCC1)c2ccccc2
COc2ccc(CC[N@@](C)CC(=O)Nc1c(C)cc(C)cc1C)cc2OC	ZINC000000762990	O=C(CNCCc1ccccc1)Nc2ccccc2
CN4CCO[C@@H]3CN(CCOCC[N@@]2C[C@H]1OCCN(C)[C@H]1C2)C[C@@H]34	ZINC000564396664	C4COC3CN(CCOCCN2CC1NCCOC1C2)CC3N4
CC(C)(C)[N+](=O)C=C1CC[C@H](C(=O)NC[C@H](O)NC(CO)(CO)CO)C=C1	ZINC000028710951	C=C1CCCC=C1
O=C(Oc3ccc(c2cnc1ccccc1n2)cc3)c4ccccc4	ZINC000000058605	O=C(Oc3ccc(c2cnc1ccccc1n2)cc3)c4ccccc4
NC(=O)c1ccccc1NC(=O)Cc2ccccc2	ZINC000000030329	O=C(Cc1ccccc1)Nc2ccccc2
Cc2cccc(NC(=O)C1C(C)(C)C1(C)C)c2C	ZINC000000050611	O=C(Nc1ccccc1)C2CC2
COc3cc2CC[N@](CC[C@@H](C)c1ccc(Cl)cc1)Cc2cc3OC	ZINC000000664923	C(CN2CCc1ccccc1C2)Cc3ccccc3
Cc2n[n+]1cccnc1s2	ZINC000000391038	c2cnc1scn[n+]1c2
CC[C@@H](CO)N(C)C	ZINC000002044667	nonring
Cc3cc(NC(=O)Nc2cc(C1CC1)[nH]n2)n(C)n3	ZINC000000026781	O=C(Nc2cc(C1CC1)[nH]n2)Nc3ccn[nH]3
C1CCC4(CC1)C2=NCCCN2c3ccccc34	ZINC000000184555	C1CCC4(CC1)C2=NCCCN2c3ccccc34
O=S(=O)(Nc2ccc(C1=NCCN1)cc2)c5cccc(S(=O)(=O)Nc4ccc(C3=NCCN3)cc4)c5	ZINC000001668430	O=S(=O)(Nc2ccc(C1=NCCN1)cc2)c5cccc(S(=O)(=O)Nc4ccc(C3=NCCN3)cc4)c5
CCN(CC)c1ccc(C=NNC(N)=NN(=O)=O)cc1	ZINC000000247755	c1ccccc1
CCCN(CCC)C[C@]1(C)C[N@@](C)[C@H](C)C[C@]1(OC(=O)CC)c2ccccc2	ZINC000005554917	C2CC(c1ccccc1)CCN2
Cn1nc(C(N)=O)c(=O)[nH]c1=S	ZINC000001685880	O=c1cn[nH]c(=S)[nH]1
CCCC(=O)Nc2ccc(S(=O)(=O)Nc1nc(C)cc(C)n1)cc2	ZINC000000116665	O=S(=O)(Nc1ncccn1)c2ccccc2
CC1(C)[C@@H]5CC[C@@]1(C)C[N@@](C[C@H](O)Cn3c2ccccc2c4ccccc34)C5	ZINC000000626724	C(CN2CC1CCC(C1)C2)Cn4c3ccccc3c5ccccc45
CN[C@@H](C)c1ccc(OC)cc1OC	ZINC000000191207	c1ccccc1
O=C(C[n+]3ccc(c2cc[n+](CC(=O)c1ccccc1)cc2)cc3)c4ccccc4	ZINC000004551475	O=C(C[n+]3ccc(c2cc[n+](CC(=O)c1ccccc1)cc2)cc3)c4ccccc4
CN3CCN(CCN(CC(=O)N1CCNCC1)S(=O)(=O)c2c(C)cc(C)cc2C)CC3	ZINC000022938590	O=C(CN(CCN1CCNCC1)S(=O)(=O)c2ccccc2)N3CCNCC3
C[C@@H](CCN1CCN(C=O)CC1)c2ccccc2	ZINC000000214581	C(CN1CCNCC1)Cc2ccccc2
COc2ccc(OC)c3c(C)cc(N1CCC[N@@](C)CC1)nc23	ZINC000000439005	C3CNCCN(c2ccc1ccccc1n2)C3
COCc3cc(C)nc4sc2c(=O)n(Cc1ccco1)nnc2c34	ZINC000000109488	O=c3n(Cc1ccco1)nnc4c2cccnc2sc34
CCCC(=O)c2cnc1c([C@H](O)CN(C)C)cccc1c2Nc3ccccc3C	ZINC000000587404	N(c1ccccc1)c2ccnc3ccccc23
CN(C)[C@@H](CNC(=O)c2ccc(C(=O)NC[C@H](N(C)C)c1ccsc1)cc2)c3ccsc3	ZINC000025332199	O=C(NCCc1ccsc1)c3ccc(C(=O)NCCc2ccsc2)cc3
Cn1nnnc1C[N+](C)(C)C	ZINC000000499882	c1nnn[nH]1
COc3ccc(CCNC(=O)c1c(C)nc2ccccn12)cc3	ZINC000000038035	O=C(NCCc1ccccc1)c2cnc3ccccn23
CN(C)CCCN(CCCN(C)C)Cc1cccc(C(F)(F)F)c1	ZINC000002489887	c1ccccc1
COc1cccc(OC)c1C(=O)c2cc[n+](C)cc2	ZINC000000142983	O=C(c1ccccc1)c2ccncc2
CC(C)Nc3ncnc4n(c1ccccc1)cc(c2ccccc2)c34	ZINC000000425751	c4ccc(c2cn(c1ccccc1)c3ncncc23)cc4
O[C@@]3(c1cccs1)CN(c2ccccc2)C4=[N+]3CCCCC4	ZINC000000425750	C1CCC3=[N+](CC1)C(c2cccs2)CN3c4ccccc4
CC(=O)O[C@@H]4[C@H](N1CCCCC1)c3c(O)c(/C=C/C(=O)N2CCCCC2)ccc3OC4(C)C	ZINC000000676886	O=C(C=Cc3ccc2OCCC(N1CCCCC1)c2c3)N4CCCCC4
CCC1(CC)C(=O)NC(=S)N(C)C1=O	ZINC000001456301	O=C1CC(=O)NC(=S)N1
NC(=N)c5cccc(CNC(=O)c3cc2cc(OCc1ccccc1)ccc2n3Cc4cccc(C(N)=N)c4)c5	ZINC000003815857	O=C(NCc1ccccc1)c4cc3cc(OCc2ccccc2)ccc3n4Cc5ccccc5
COc2cccc(C(=O)N1CCOCC1)c2	ZINC000000030034	O=C(N1CCOCC1)c2ccccc2
CC[n+]2ccc(\C=C\c1ccc(OC)cc1OC)cc2	ZINC000000044032	C(=Cc1ccncc1)c2ccccc2
Fc1ccccc1CN3CCN(Cc2cccc(N(=O)=O)c2)CC3	ZINC000000169372	C2CN(Cc1ccccc1)CCN2Cc3ccccc3
CCN(CC)CCSCCN(CC)CC	ZINC000001584361	nonring
CC(C)(C)NC(=S)NCc1ccccc1	ZINC000000039339	c1ccccc1
CCn1c(C)[o+]c2ccc(OC)cc12	ZINC000000317958	c2ccc1[o+]c[nH]c1c2
Nc2ncnc(N1CCCCC1)c2N	ZINC000000284052	C2CCN(c1ccncn1)CC2
CN(C)C(=O)C(CCN2CCC(O)(c1ccc(Cl)cc1)CC2)(c3ccccc3)c4ccccc4	ZINC000000537928	C3CN(CCC(c1ccccc1)c2ccccc2)CCC3c4ccccc4
OC4(c1ccc(Br)cc1)CCN(C3CCC(c2ccccc2)CC3)CC4	ZINC000000757052	C2CC(c1ccccc1)CCC2N4CCC(c3ccccc3)CC4
COc1cc(NC(=O)CCC(O)=O)nc(OC)n1	ZINC000000075885	c1cncnc1
O=C(NCCc1cccc2ccccc12)C3CCC3	ZINC000000005833	O=C(NCCc1cccc2ccccc12)C3CCC3
COc2ccc1[nH]c(C(N)=O)c(OC(C)C)c1c2	ZINC000000020026	c2ccc1[nH]ccc1c2
C1CCc3c(C1)sc4ncn2nnnc2c34	ZINC000000072455	C1CCc3c(C1)sc4ncn2nnnc2c34
C[N@]1CC[C@@H]3[C@@H](C1)c2cc(C)ccc2N3S(=O)(=O)c4cccnc4	ZINC000000525770	O=S(=O)(N2C1CCNCC1c3ccccc23)c4cccnc4
Cc2cc(C)c1nc(C)c(=O)[nH]c1c2	ZINC000000027921	O=c2cnc1ccccc1[nH]2
O=C(Nc2ccc(Nc1ccncc1)cc2)c5ccc(Nc3ccnc4ccccc34)cc5N(=O)=O	ZINC000013283725	O=C(Nc2ccc(Nc1ccncc1)cc2)c5ccc(Nc3ccnc4ccccc34)cc5
C[C@@H](CNC(=O)[C@@H](N)CC(N)=O)CN1CCCCC1	ZINC000038042322	C1CCNCC1
CN(C)C[C@@H]1CSCC[C@@]1(O)c2cccc(O)c2	ZINC000000347733	C2CC(c1ccccc1)CCS2
COc2ccc(CNCc1c(F)cccc1F)cc2OC	ZINC000000172182	C(NCc1ccccc1)c2ccccc2
CN(C)CCn2c(=O)c1ccccc1c2=O	ZINC000000090757	O=c1[nH]c(=O)c2ccccc12
NCc1ccsc1	ZINC000000158761	c1ccsc1
C[C@@H](CN4CCN(C[C@H](N2CCN(C1CCCCC1)CC2)c3ccc(F)cc3)CC4)C(=O)c5ccccc5	ZINC000022928002	O=C(CCN4CCN(CC(N2CCN(C1CCCCC1)CC2)c3ccccc3)CC4)c5ccccc5
CN4CCC(N=Nc2ncnc3sc1CCCCc1c23)CC4	ZINC000000351385	C1CCc3c(C1)sc4ncnc(N=NC2CCNCC2)c34
CN(C)CCNC(=O)Cn2cnc1sc(C)c(C)c1c2=O	ZINC000000109567	O=c1[nH]cnc2sccc12
Cc4cc(C[N@](CC2CCN(C1CCCC1)CC2)C[C@H]3CCCO3)oc4C	ZINC000012763922	C4CCC(N3CCC(CN(CC1CCCO1)Cc2ccco2)CC3)C4
C[N@@](CCCn2c(=S)[nH]c1ncccc1c2=O)Cc3ccccc3	ZINC000000424570	O=c2n(CCCNCc1ccccc1)c(=S)[nH]c3ncccc23
CC(=O)NCCNCCO	ZINC000001586463	nonring
O=Cc2ccc(N1CCOCC1)cc2	ZINC000000031321	C2CN(c1ccccc1)CCO2
COC(=O)c2ccc1ccccc1n2	ZINC000000031320	c2ccc1ncccc1c2
CSc1ccccc1NC(=O)CSc3nc2ccccc2o3	ZINC000000097802	O=C(CSc2nc1ccccc1o2)Nc3ccccc3
Cc2ccc(C(=O)Oc1ccccc1Cl)cc2	ZINC000000038622	O=C(Oc1ccccc1)c2ccccc2
CCOC(=O)N2CCN(C(=O)N1CCOCC1)CC2	ZINC000000030252	O=C(N1CCNCC1)N2CCOCC2
COc1ccccc1COC[C@@H](O)CNCCCN(C)C	ZINC000003418296	c1ccccc1
Cc2nn(C)c3[nH]c1CSCc1c(=O)c23	ZINC000000149536	O=c2c1CSCc1[nH]c3[nH]ncc23
CC(C)(C)c1nc(NN)c(Br)c(C(C)(C)C)n1	ZINC000000331413	c1cncnc1
Cn2nc(c1ccc(F)cc1)c3ccccc23	ZINC000000035304	c3ccc(c1n[nH]c2ccccc12)cc3
CC1=NCCc2c1[nH]c3cc(O)ccc23	ZINC000000058176	C1Cc2c(C=N1)[nH]c3ccccc23
Cc4ccc(c2nnc(n1ncc(C#N)c1N)c3ccccc23)cc4	ZINC000000038236	c4ccc(c2nnc(n1cccn1)c3ccccc23)cc4
CC[C@@H](C)NC[C@@H](O)c1ccc(N)cc1	ZINC000000000034	c1ccccc1
CC[N@@](CC2CCN(C1CCN(C)CC1)CC2)Cc4nc(c3ccccc3)cs4	ZINC000011662904	C4CC(N3CCC(CNCc2nc(c1ccccc1)cs2)CC3)CCN4
CCCN3CCC([N@]2CCC[C@@H](C(=O)N1CCCCCC1)C2)CC3	ZINC000000212627	O=C(C2CCCN(C1CCNCC1)C2)N3CCCCCC3
COc2c1CNCCn1c3ccc(F)cc23	ZINC000000017967	C1Cn2c(CN1)cc3ccccc23
NC(=O)c2c1CCCCc1sc2NC(=O)c3ccccc3C(O)=O	ZINC000000096435	O=C(Nc2cc1CCCCc1s2)c3ccccc3
CC[n+]3cc(c1ccccc1)nc(N2CCOCC2)n3	ZINC000000061025	C3CN(c2nncc(c1ccccc1)n2)CCO3
CN2CCN(C(=O)COc1ccc(CN)cc1)CC2	ZINC000022144074	O=C(COc1ccccc1)N2CCNCC2
Cc4ccc3n(C[C@@H](O)Cn1ccnc1C)c2C(=O)CCCc2c3c4	ZINC000000572134	O=C1CCCc3c1n(CCCn2ccnc2)c4ccccc34
O=C(NCCC1=CCCCC1)[C@@H]2CC25CCN(Cc4cc(CN3CCCCC3)cs4)CC5	ZINC000014879353	O=C(NCCC1=CCCCC1)C2CC25CCN(Cc4cc(CN3CCCCC3)cs4)CC5
FC(F)(F)C(F)(F)c3nnc4c1ccccc1c(N2CCNCC2)nn34	ZINC000000719247	C4CN(c2nn1cnnc1c3ccccc23)CCN4
CC(C)CC(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000000030637	c1ccccc1
CSc2nnc(NC(=O)[C@@H](C)c1ccc(CC(C)C)cc1)s2	ZINC000000364123	O=C(Cc1ccccc1)Nc2nncs2
COc3ccc2c(C)cc(N1C[C@@H](C)O[C@H](C)C1)nc2c3	ZINC000000087258	C3CN(c2ccc1ccccc1n2)CCO3
CN2C(=O)C[C@H](N1CCC(C(N)=O)CC1)C2=O	ZINC000000181384	O=C2CC(N1CCCCC1)C(=O)N2
O=C(CCn2c(=O)c1ccccc1c2=O)Nc5c3CCCCc3nc4CCCc45	ZINC000000885824	O=C(CCn2c(=O)c1ccccc1c2=O)Nc5c3CCCCc3nc4CCCc45
CNc4nc([C@@H]2CCC[N@@](CC(=O)N(Cc1ccccc1)C(C)C)C2)nc3CCNCc34	ZINC000019710473	O=C(CN3CCCC(c2ncc1CNCCc1n2)C3)NCc4ccccc4
CNS(=O)(=O)c1cnccc1N2CCN(C(C)C)CC2	ZINC000000481271	C2CN(c1ccncc1)CCN2
Cc1csc(C)[n+]1c2ccccc2	ZINC000000289577	c2ccc([n+]1ccsc1)cc2
CCOC(=O)C1CCN(CC[C@@H](O)C(F)(F)F)CC1	ZINC000000152365	C1CCNCC1
S=C2NCCN(c1ccccc1)N2	ZINC000000025270	S=C2NCCN(c1ccccc1)N2
O=C(COc1ccc(N(=O)=O)cc1)NCCC2=CCCCC2	ZINC000000038564	O=C(COc1ccccc1)NCCC2=CCCCC2
CN(C)C(=O)C(=Cc2ccc(c1ccc(C(C)=O)cc1)o2)C#N	ZINC000000037491	c2ccc(c1ccco1)cc2
COc2cc(CNC1CCCCC1)ccc2OCC(N)=O	ZINC000000349823	C2CCC(NCc1ccccc1)CC2
CC[C@](COC(=O)c1cc(OC)c(OC)c(OC)c1)(N(C)C)c2ccccc2	ZINC000000608117	O=C(OCCc1ccccc1)c2ccccc2
CN(C)CCCNCCCOc1cccc2ccccc12	ZINC000002822881	c2ccc1ccccc1c2
CO[P@@](=O)(c1ccccc1)C(O)(c2ccccc2)c3ccccc3	ZINC000000199028	O=P(C(c1ccccc1)c2ccccc2)c3ccccc3
CC4(C)Oc2ccc1ccc(=O)oc1c2[C@@H](N3CCCCC3)[C@@H]4O	ZINC000000293716	O=c4ccc3ccc2OCCC(N1CCCCC1)c2c3o4
CCC2=C[C@@](O)(C(F)(F)F)N(C(=O)Cc1ccc(N(=O)=O)cc1)N2	ZINC000000108266	O=C(Cc1ccccc1)N2CC=CN2
CC[N+](CC)(CC)C[C@@H](O)Cn1c(=O)sc2ccccc12	ZINC000000405488	O=c2[nH]c1ccccc1s2
OC(=O)c2ccc1OCCOCCOCCOc1c2	ZINC000000074732	C2COCCOc1ccccc1OCCO2
Cc4cccc(C[N@]1C[C@@H]3C[C@H](C1)c2cccc(=O)n2C3)c4	ZINC000000245104	O=c4cccc3C2CC(CN(Cc1ccccc1)C2)Cn34
CC(C)(CCCCC(C)(C)NC1=NCCO1)NC2=NCCO2	ZINC000001638854	C(CCCNC1=NCCO1)CCNC2=NCCO2
COC(=O)c1c(C)[nH]nc1c2ccco2	ZINC000000118547	c2coc(c1cc[nH]n1)c2
ClC1=CC[C@@H]3[C@H](C1)C(=O)N(CCNC2CCCCC2)C3=O	ZINC000000105276	O=C2C1CC=CCC1C(=O)N2CCNC3CCCCC3
CC(C)(C)NCC(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000000115863	c1ccccc1
Cn2c[n+](c1ccc(N(=O)=O)cn1)c3ccccc23	ZINC000000337789	c3ccc([n+]1c[nH]c2ccccc12)nc3
CCn2c(C)[n+](C[C@@H](O)COc1ccccc1)c3ccccc23	ZINC000000316206	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
CCCN2CCC(NCCNC(=O)c1ccc(OC)cc1)CC2	ZINC000006879307	O=C(NCCNC1CCNCC1)c2ccccc2
OC(=O)c1cccnc1SCCS(=O)(=O)c2ccccc2	ZINC000000149981	O=S(=O)(CCSc1ccccn1)c2ccccc2
CN(C)CCNC(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000000149980	c1ccccc1
Cc4ccc(OCC(=O)Nc3cc2nn(c1ccccc1)nc2cc3Cl)cc4	ZINC000000623806	O=C(COc1ccccc1)Nc4ccc3nn(c2ccccc2)nc3c4
C[C@@H](Oc1c(Cl)cccc1Cl)C2=NCCN2	ZINC000000005626	C2CN=C(COc1ccccc1)N2
CCN(CC)CCn1c(=N)n(CC(=O)OC)c2ccccc12	ZINC000000274214	N=c2[nH]c1ccccc1[nH]2
O=C(Nc1cccc(C#N)c1)c2ccccc2	ZINC000000046446	O=C(Nc1ccccc1)c2ccccc2
CCN(CC2CCN(C1CCN(C)CC1)CC2)C(=O)[C@@H]3COc4c(C3)cccc4OC	ZINC000011932866	O=C(NCC2CCN(C1CCNCC1)CC2)C4COc3ccccc3C4
N[C@H]2Cc1ccccc1CC2=O	ZINC000003778151	O=C2CCc1ccccc1C2
N[C@@H](O)Cc1ccccc1	ZINC000002017937	c1ccccc1
CCc1ccccc1NC(=O)c3ccc2OCOc2c3	ZINC000000035378	O=C(Nc1ccccc1)c3ccc2OCOc2c3
CC(C)[C@@](O)(C#CCN1CCCCCC1)c2ccccc2	ZINC000000198373	C2CCCN(CC#CCc1ccccc1)CC2
CC(=O)N2CCN(c1cccc(C)c1C)CC2	ZINC000000031672	C2CN(c1ccccc1)CCN2
Cc4cnc5c(NCCN1CCCCC1)nc3cc2ccccc2cc3n45	ZINC000000594520	C5CCN(CCNc3nc2cc1ccccc1cc2n4ccnc34)CC5
COc2nc(NN)nc(N1CCCCC1)n2	ZINC000000109026	C2CCN(c1ncncn1)CC2
CCCCCCNCCCNc2c1cc(OC)ccc1nc3cccc(N(=O)=O)c23	ZINC000005782634	c3ccc2nc1ccccc1cc2c3
N=C(NOC(=O)c1cccc(N(=O)=O)c1)c3ccc(CN2CCCCC2)cc3	ZINC000004785040	N=C(NOC(=O)c1ccccc1)c3ccc(CN2CCCCC2)cc3
O=S(=O)(Nc3ccc(CC[N@]1CCCC[C@@H]1CCN2CCCC2)cc3)c5ccc(c4ccccc4)cc5	ZINC000045228385	O=S(=O)(Nc3ccc(CCN1CCCCC1CCN2CCCC2)cc3)c5ccc(c4ccccc4)cc5
C2CCN(CSc1ccccc1)CC2	ZINC000000159553	C2CCN(CSc1ccccc1)CC2
Cc1ccccc1NS(=O)(=O)c3ccc([C@@H]2CNC(=O)C2)cc3	ZINC000000109315	O=C3CC(c2ccc(S(=O)(=O)Nc1ccccc1)cc2)CN3
COc1ccccc1C(=O)Nc3ccc2OCOc2c3	ZINC000000035577	O=C(Nc2ccc1OCOc1c2)c3ccccc3
CN(CCCCCCCCCCN(C)C(=O)Oc1ccccc1[N+](C)(C)C)C(=O)Oc2ccccc2[N+](C)(C)C	ZINC000004245691	O=C(NCCCCCCCCCCNC(=O)Oc1ccccc1)Oc2ccccc2
Cc4ccc3nc(c2ccc(NC(=O)c1cccc(F)c1)cc2)oc3c4	ZINC000000122517	O=C(Nc3ccc(c2nc1ccccc1o2)cc3)c4ccccc4
CN(Cc1ccccc1)C(=O)C2CCCCC2	ZINC000000031784	O=C(NCc1ccccc1)C2CCCCC2
C[N@]1[C@H]5CC[C@@H]1CC(NC(=O)N3CC2(CC2)c4ccccc34)C5	ZINC000000024877	O=C(NC1CC2CCC(C1)N2)N4CC3(CC3)c5ccccc45
OC(C(=O)OCCN1CCCCC1)(c2ccccc2)c3ccccc3	ZINC000000188746	O=C(OCCN1CCCCC1)C(c2ccccc2)c3ccccc3
Fc3ccc(Nc1ccccc1C(=O)OCC(=O)c2ccccc2)cc3	ZINC000000072675	O=C(COC(=O)c1ccccc1Nc2ccccc2)c3ccccc3
CCNc2nc(N)c(C(=O)c1ccccc1)s2	ZINC000000027064	O=C(c1ccccc1)c2cncs2
CN1CC[C@@H](N)[C@H](F)C1	ZINC000098188435	C1CCNCC1
C2CO[C@H](CNCc1ccccn1)C2	ZINC000000299729	C2COC(CNCc1ccccn1)C2
O[C@@H](CNC2Cc1ccccc1C2)COc3ccc(F)cc3	ZINC000000118430	C(CNC2Cc1ccccc1C2)COc3ccccc3
C[C@@H](CC(C(N)=O)(c1ccccc1)c2ccccc2)N(C)C	ZINC000000000030	C(c1ccccc1)c2ccccc2
CCSc2nnc(NC(=O)\C=C\c1ccc(C(C)(C)C)cc1)s2	ZINC000000442510	O=C(Nc1nncs1)C=Cc2ccccc2
N#Cc4ccc(\C=N\c2cc(c1ccccc1)nn2c3ccccc3)cc4	ZINC000000064471	C(=Nc2cc(c1ccccc1)nn2c3ccccc3)c4ccccc4
CC[N@]1CCC[C@H]1CNC(=O)c2c(O)c(CC)cc(Cl)c2OC	ZINC000000001395	O=C(NCC1CCCN1)c2ccccc2
Cc1cccc(C)c1OCC2CNC2	ZINC000000016483	C1NCC1COc2ccccc2
C[C@@H](NC(=O)CN1CCCCC1)[C@@H]3COc2ccccc2O3	ZINC000000380916	O=C(CN1CCCCC1)NCC3COc2ccccc2O3
Cn2c(NCc1cc(Cl)ccc1O)ncc2c4ccc3OCOc3c4	ZINC000000819141	C4Oc3ccc(c2cnc(NCc1ccccc1)[nH]2)cc3O4
FC(F)(F)c2ccc1CC(=O)Nc1c2	ZINC000000053088	O=C2Cc1ccccc1N2
O=C(C1CCCCC1)N2CCc3ccccc23	ZINC000000083408	O=C(C1CCCCC1)N2CCc3ccccc23
CN(C)CCN(CCN(C)C)C(=O)NCc1noc(C)n1	ZINC000074611133	c1ncon1
Cn3nc2c1ccc(N(=O)=O)cc1c(=O)c2c3C(C)(C)C	ZINC000000027282	O=c2c1ccccc1c3n[nH]cc23
CC(C)(C)NCC(=O)Nc3c1CCCc1nc2CCCc23	ZINC000000198574	C3Cc2cc1CCCc1nc2C3
O=C(CN1CCCC1)Nc4c2CCCc2nc3CCCc34	ZINC000000198577	O=C(CN1CCCC1)Nc4c2CCCc2nc3CCCc34
COc3ccc(c2c1CCCCc1[nH]c(=S)c2C#N)cc3	ZINC000000050054	S=c3cc(c1ccccc1)c2CCCCc2[nH]3
O=C(CNC(=O)c2ccc1cncn1c2)NCCN3CCOCC3	ZINC000569332030	O=C(CNC(=O)c2ccc1cncn1c2)NCCN3CCOCC3
CN(C)CCCN(CC3CCN(C2Cc1ccccc1C2)CC3)C(=O)[C@@H]4CCCO4	ZINC000012302314	O=C(NCC3CCN(C2Cc1ccccc1C2)CC3)C4CCCO4
S=c4sc3S[C@@H]2Cc1ccccc1[C@@H]2Sc3s4	ZINC000000032522	S=c4sc3SC2Cc1ccccc1C2Sc3s4
Brc4ccc(n2c(SCC(=O)c1cccs1)nnc2c3ccccc3)cc4	ZINC000000625396	O=C(CSc2nnc(c1ccccc1)n2c3ccccc3)c4cccs4
CN(C)CCn3c(C)cc(=c2c(=O)c1ccccc1c2=O)cc3C	ZINC000000073584	O=c2c(=c1cc[nH]cc1)c(=O)c3ccccc23
CCOc1ccccc1C[N@](CC3CCN(C2CCCC2)CC3)C[C@@H]4CCCO4	ZINC000012750571	C4CCC(N3CCC(CN(CC1CCCO1)Cc2ccccc2)CC3)C4
CN1CCC[C@@H]1CNC2CC2	ZINC000053649295	C2CNC(CNC1CC1)C2
C[C@H]1CCCC[N@]1CCN(CCC(=O)N2CCNCC2)S(=O)(=O)c3cc(C)ccc3C	ZINC000045945249	O=C(CCN(CCN1CCCCC1)S(=O)(=O)c2ccccc2)N3CCNCC3
NC(=O)[C@@H]1SCCN1c2ccccc2	ZINC000000083013	C2CN(c1ccccc1)CS2
Cc1cccc(C)c1OC[C@@H](O)CN3CCN(c2ccccn2)CC3	ZINC000000448306	C(COc1ccccc1)CN3CCN(c2ccccn2)CC3
COc2ccc(/C=C/C(=O)NC1CCCCC1)cc2	ZINC000000028323	O=C(NC1CCCCC1)C=Cc2ccccc2
CC[C@H]1C[N@]2CC[C@@H]1C[C@@H]2[C@H](O)c3ccnc4ccc(OC)cc34	ZINC000000156023	C1CN2CCC1CC2Cc3ccnc4ccccc34
Cc1cc(N)nn1c2ccccc2	ZINC000000156118	c2ccc(n1cccn1)cc2
Cn3c(NCc2ccc1OCOc1c2)nc4ccccc34	ZINC000000196187	C4Oc3ccc(CNc2nc1ccccc1[nH]2)cc3O4
COc1nn(C[C@H](C)N)c3c1ccc2occc23	ZINC000000017686	c3cc2c(ccc1cn[nH]c12)o3
CCc1nn(CCN)c3c1ccc2occc23	ZINC000000017687	c3cc2c(ccc1cn[nH]c12)o3
CC(C)(C)NC[C@@H](O)c1cc(O)cc(O)c1	ZINC000000002281	c1ccccc1
Cc1ncccc1C2=NCCCC2	ZINC000000018648	C2CCC(c1cccnc1)=NC2
Fc5ccc(OC4CCN(C[C@H](Cc1ccccc1)NC(=O)c3ccc(OCCCN2CCCCC2)cc3)CC4)cc5	ZINC000049711267	O=C(NC(CN2CCC(Oc1ccccc1)CC2)Cc3ccccc3)c5ccc(OCCCN4CCCCC4)cc5
O=C(Cn2ccc(=NCc1ccccc1)cc2)c3cccc(N(=O)=O)c3	ZINC000000281356	O=C(Cn2ccc(=NCc1ccccc1)cc2)c3ccccc3
COc5cc(Cc3c(c2ccc(OCCN1CCCC1)cc2)sc4cc(O)ccc34)ccc5CN(C)C	ZINC000028224721	C5CCN(CCOc4ccc(c2sc1ccccc1c2Cc3ccccc3)cc4)C5
CCOc1ccccc1NC(=O)C[C@@H]3N[C@H]2CCCC[C@H]2NC3=O	ZINC000000536822	O=C(CC2NC1CCCCC1NC2=O)Nc3ccccc3
CN(C)CCCN(CC3CCN(C2Cc1ccccc1C2)CC3)C(=O)\C=C\c4cnn(C)c4	ZINC000012592296	O=C(NCC3CCN(C2Cc1ccccc1C2)CC3)C=Cc4cn[nH]c4
Cc2cccn3n(C(=O)c1ccc(F)cc1)c(=S)nc23	ZINC000000033785	O=C(c1ccccc1)n2c(=S)nc3ccccn23
CC2=C(C)C[C@@H](C(=O)NCc1c(F)cccc1Cl)[C@@H](C(O)=O)C2	ZINC000000119100	O=C(NCc1ccccc1)C2CCC=CC2
COc3ccc(N2C(=O)C[C@@H](NCCc1ccc(OC)c(OC)c1)C2=O)cc3Cl	ZINC000000710581	O=C2CC(NCCc1ccccc1)C(=O)N2c3ccccc3
OCCN(CCO)Cc1ccc(Br)cc1	ZINC000000280229	c1ccccc1
Oc2c(c1ccccc1)c(=O)c3ccccc23	ZINC000000001925	O=c2c(c1ccccc1)cc3ccccc23
C[C@H](Sc1ccc(Cl)cc1)C(=O)NCc2ccncc2	ZINC000000037341	O=C(CSc1ccccc1)NCc2ccncc2
Nc1nonc1C(=O)N2CCCCC2	ZINC000000036176	O=C(N1CCCCC1)c2cnon2
Cc1cc(N)c(C)nn1	ZINC000001674210	c1ccnnc1
Cc3ccc(NC(=O)CSc2nc(c1ccc(Br)cc1)n[nH]2)c(C)c3	ZINC000000624081	O=C(CSc2nc(c1ccccc1)n[nH]2)Nc3ccccc3
CCCN(CCC)[C@H]3CCc2cc1CCOc1cc2C3	ZINC000000006227	C3CCc2cc1OCCc1cc2C3
O=C(N1CCNCC1)c3cc2ccccc2[nH]3	ZINC000000509902	O=C(N1CCNCC1)c3cc2ccccc2[nH]3
CC[C@H](O)CNCCO	ZINC000001695049	nonring
CC(C)(C)NC[C@@H](O)COc2ccc(c1csnn1)cc2	ZINC000000107515	c2ccc(c1csnn1)cc2
NCC1CCOCC1	ZINC000002577849	C1CCOCC1
Cc4ccc(Nc2cc(C)c(C#N)c3nc1ccccc1n23)cc4	ZINC000000044923	N(c1ccccc1)c3cccc4nc2ccccc2n34
CC(C)N(C(C)C)C(=O)Cn1ccc(=N)c2ccccc12	ZINC000000226174	N=c1cc[nH]c2ccccc12
C[N+]4(CCO)CC[N+](C)(CCCn2c1ccccc1sc3ccc(Cl)cc23)CC4	ZINC000001705061	C(CN1CCNCC1)Cn3c2ccccc2sc4ccccc34
CCOC(=O)C2CCN(CCC(=O)Nc1ccccc1)CC2	ZINC000000176360	O=C(CCN1CCCCC1)Nc2ccccc2
COC(=O)c2ccc(S(=O)(=O)NCc1ccco1)o2	ZINC000000114917	O=S(=O)(NCc1ccco1)c2ccco2
C[n+]5c(c1ccccc1)cc(c4cc(c2ccccc2)[n+](C)c(c3ccccc3)c4)cc5c6ccccc6	ZINC000002531030	c6ccc(c5cc(c3cc(c1ccccc1)nc(c2ccccc2)c3)cc(c4ccccc4)n5)cc6
C[C@]23CNC[C@](C)(CN(Cc1cccc(Br)c1)C2)C3	ZINC000000346464	C1NCC3CC1CN(Cc2ccccc2)C3
CCc3nn(CCCN2CCN(c1cccc(Cl)c1)CC2)c(=O)n3CCOc4ccccc4	ZINC000000538065	O=c2n(CCOc1ccccc1)cnn2CCCN4CCN(c3ccccc3)CC4
C2C[C@H]1NCCn3c1c(C2)c4ccccc34	ZINC000000170647	C2CC1NCCn3c1c(C2)c4ccccc34
COC(=O)c/2c(C)n(Cc1ccccc1)c(=O)c\2=C/c3cccc(O)c3	ZINC000000113015	O=c2n(Cc1ccccc1)ccc2=Cc3ccccc3
CC(C)c3ccc(O)c(CN2CCN(c1ccccc1)CC2)c3	ZINC000000333367	C2CN(c1ccccc1)CCN2Cc3ccccc3
COc2cc4CC[N+](C)(C)[C@H]3Cc1cccc(OC)c1c(c2O)c34	ZINC000000174794	C2Cc3cccc4c1ccccc1CC(N2)c34
Cc3ccc(c1csc2nc(C)n(N)c(=O)c12)cc3	ZINC000000063378	O=c2[nH]cnc3scc(c1ccccc1)c23
C[N@]2CCC[C@@H](OC(=O)c1ccco1)C2	ZINC000000187980	O=C(OC1CCCNC1)c2ccco2
COc2ccc(NC(=S)NCCc1ccc(OC)c(OC)c1)cc2	ZINC000000073144	S=C(NCCc1ccccc1)Nc2ccccc2
Cc2ccc(S(=O)(=O)N[C@@H](CC(O)=O)c1ccccc1)c(C)c2	ZINC000000096976	O=S(=O)(NCc1ccccc1)c2ccccc2
COc2ccc(CC(=O)N1CCCC1)cc2	ZINC000000029160	O=C(Cc1ccccc1)N2CCCC2
COc3ccc(c2cc(c1ccccc1)nc(NN)n2)cc3OC	ZINC000000435062	c3ccc(c2cc(c1ccccc1)ncn2)cc3
CN2CCC(N(C)S(=O)(=O)c1ccccc1N(=O)=O)CC2	ZINC000000125679	O=S(=O)(NC1CCNCC1)c2ccccc2
CN(C)Cc2cc1ccccc1o2	ZINC000000164339	c2ccc1occc1c2
N=C1N[C@H](C#C)Nc2ccccc12	ZINC000000022234	N=C1NCNc2ccccc12
CCc1[n+](C)cc(C)n2c(C)ccc12	ZINC000000270652	c2cc1cnccn1c2
O[C@@]13CCCC[C@@H]1[C@H](c2ccccc2)NCC3	ZINC000000234956	C1CCC2C(C1)CCNC2c3ccccc3
CN3CCN(c2oc(c1ccc(C)cc1)nc2C#N)CC3	ZINC000000065820	C3CN(c2cnc(c1ccccc1)o2)CCN3
CCOc3nc(c1ccccc1C)n(c2ccc(NC(C)=O)cc2)n3	ZINC000000327536	c3ccc(c1ncnn1c2ccccc2)cc3
CN(C)CCOC(=O)c2c(C)nn3c1ccccc1n(C)c23	ZINC000000090524	c1ccc3c(c1)[nH]c2ccnn23
CCN(CC)C[C@@H](O)CO	ZINC000000407012	nonring
COc2cc(C(=O)N(C)C1CC(C)(C)NC(C)(C)C1)ccc2OC3CCN(C)CC3	ZINC000012001381	O=C(NC1CCNCC1)c3ccc(OC2CCNCC2)cc3
COc1cc(CC[C@@H](C)N)ccc1O	ZINC000000083538	c1ccccc1
CC(C)(C)[C@@H](O)Cn2c1=NCCn1c3ccccc23	ZINC000000116367	C1Cn2c(=N1)[nH]c3ccccc23
CC[C@@]2(C)OC(=O)N(C1CC(C)(C)NC(C)(C)C1)[C@@]2(C)O	ZINC000000036877	O=C1OCCN1C2CCNCC2
CCOC(=O)CCC[n+]1c(C)n(N)c2ccccc12	ZINC000000386946	c2ccc1[nH]cnc1c2
CCN(CC)CCOc2nnc(c1ccccc1)c3ccccc23	ZINC000000274093	c3ccc(c1nncc2ccccc12)cc3
CC[C@@H]3C[N@]2CCc1cc(OC)c(OC)cc1[C@@H]2C[C@@H]3C[C@H]5N(C(=O)[C@@H]4CCCN4)CCc6cc(OC)c(OC)cc56	ZINC000004946267	O=C(C1CCCN1)N3CCc2ccccc2C3CC6CCN5CCc4ccccc4C5C6
CC(C)NC[C@@H](O)COc1ccccc1C2CC2	ZINC000000000659	C1CC1c2ccccc2
Cc3cc(NCc1cccnc1)c2ccccc2n3	ZINC000000120735	C(Nc1ccnc2ccccc12)c3cccnc3
CN(C)c1ccc(\C=N\N)cc1	ZINC000000129610	c1ccccc1
Cc2nc1[nH]c(=O)ccc1cc2c3ccncc3	ZINC000000018358	O=c3ccc2cc(c1ccncc1)cnc2[nH]3
FC(F)(F)c2cccc(NC(=O)OCc1cc[n+](CC=C)cc1)c2	ZINC000000480187	O=C(Nc1ccccc1)OCc2ccncc2
COC(=O)Cn1c(C)cc(C=O)c1C	ZINC000000009390	c1cc[nH]c1
O=C(CSC1=NCCN1)[C@H]3COc2ccccc2O3	ZINC000000226316	O=C(CSC1=NCCN1)C3COc2ccccc2O3
CC[N@]1CCC[C@@H]1CNC(=O)CCC4CCN(Cc3cc(OC)c2OCOc2c3)CC4	ZINC000012711354	O=C(CCC3CCN(Cc2ccc1OCOc1c2)CC3)NCC4CCCN4
C3CCC(CCNC2CCN(CCc1ccccc1)CC2)=CC3	ZINC000002498880	C3CCC(CCNC2CCN(CCc1ccccc1)CC2)=CC3
COc1cc(CCN)c(N(=O)=O)cc1OC	ZINC000000138203	c1ccccc1
CC[n+]1ccncc1	ZINC000001595132	c1cnccn1
Oc3ccc(Oc2ccc(C(=O)OCC(=O)c1ccccc1)cc2)cc3	ZINC000000051017	O=C(COC(=O)c2ccc(Oc1ccccc1)cc2)c3ccccc3
CCOC(=O)[C@@H]2CCC[N@@](CCCc1ccccc1)C2	ZINC000000243700	C2CCN(CCCc1ccccc1)CC2
Cc3ccc(/N=C/c2ccc(OCc1ccc(Cl)cc1)cc2)cc3	ZINC000000059109	C(Oc2ccc(C=Nc1ccccc1)cc2)c3ccccc3
N=C2N[C@@H](Cc1ccsc1)CS2	ZINC000000027426	N=C2NC(Cc1ccsc1)CS2
CC[C@H](c1ccccc1)c2noc(CCN(CC)CC)n2	ZINC000000000678	C(c1ccccc1)c2ncon2
C[N+](C)(C)CCC[n+]3ccc(CC[C@@H]1C=Cc2ccccc12)cc3	ZINC000003620896	C(Cc1ccncc1)C2C=Cc3ccccc23
CCOC(=O)c2[nH]c1ccc(OC)cc1c2NC(=O)CNC	ZINC000000294041	c2ccc1[nH]ccc1c2
COc3cc2CCN1C[C@H](CO)C6(C[C@@H]1c2cc3OC)C[C@@H]4[N@](CCc5cc(OC)c(OC)cc45)C[C@H]6CO	ZINC000004972685	C2Cc1ccccc1C3CC6(CCN23)CCN5CCc4ccccc4C5C6
CN(C)CCN(Cc1ccccc1)c2ccnc(N(C)C)c2C#N	ZINC000000210132	C(Nc1ccncc1)c2ccccc2
COc3cc(c2nc1ccccn1c2N)ccc3O	ZINC000000058459	c3ccc(c2cn1ccccc1n2)cc3
Oc3cc2[C@H](c1ccccc1)CNCCc2c(Cl)c3O	ZINC000000005579	C3Cc1ccccc1C(c2ccccc2)CN3
CN(C)CCN(Cc1ccccc1c3ccc(CNCCc2ccccc2)cc3)C(=O)NC4CCCCC4	ZINC000045196331	O=C(NCc1ccccc1c3ccc(CNCCc2ccccc2)cc3)NC4CCCCC4
O=C1CCCNCC1	ZINC000001420540	O=C1CCCNCC1
NC(=O)C4CCN(C3(n1nnc2ccccc12)CCCCC3)CC4	ZINC000000053066	C4CCN(C3(n1nnc2ccccc12)CCCCC3)CC4
CN3CCN(c1c(N)c(=O)oc2ccccc12)CC3	ZINC000000190898	O=c3cc(N1CCNCC1)c2ccccc2o3
C[C@@H](CCN4CCC(O)(c3ccc2oc(C(=O)N1CCC[N@@](C)CC1)cc2c3)CC4)c5ccccc5	ZINC000012217546	O=C(N1CCCNCC1)c5cc4cc(C3CCN(CCCc2ccccc2)CC3)ccc4o5
O=C(Cn2nc(c1ccccc1)ccc2=O)NCCN3CCCC3	ZINC000000219351	O=C(Cn2nc(c1ccccc1)ccc2=O)NCCN3CCCC3
CC1(C)CC(O)CC(C)(C)N1O	ZINC000000005575	C1CCNCC1
Cc1ccc(C(=O)NCC(O)=O)o1	ZINC000000376450	c1ccoc1
Fc1cccc(Cl)c1COc2ccc(Br)cc2CNCC3CCNCC3	ZINC000040720406	C3CC(CNCc1ccccc1OCc2ccccc2)CCN3
O=C(N2c1ccccc1CCc3ccccc23)c4ccc(N(=O)=O)cc4	ZINC000000055116	O=C(N2c1ccccc1CCc3ccccc23)c4ccccc4
Nc3nc(c1ccccc1)nc(n2cccc2)n3	ZINC000000054543	c3ccc(c2ncnc(n1cccc1)n2)cc3
Cc2cnc1n(C)c(=O)n(C)c(=O)c1c2C	ZINC000000032935	O=c2[nH]c(=O)c1cccnc1[nH]2
CN(C)CCCN(CCCN(C)C)Cc1ccccc1C(F)(F)F	ZINC000002479871	c1ccccc1
C[C@@H](COc1ccccc1)NC(=O)CN2CCCC2	ZINC000000394453	O=C(CN1CCCC1)NCCOc2ccccc2
O[C@H](COc1ccccc1CC=C)CN2CCCCC2	ZINC000000075554	C2CCN(CCCOc1ccccc1)CC2
CN6CCN(CCCC(=O)O[C@@H]3CC5(N1CCCCC1)C[C@@H](c2ccccc2)C3[C@H](c4ccccc4)C5)CC6	ZINC000082150195	O=C(CCCN1CCNCC1)OC4CC6(N2CCCCC2)CC(c3ccccc3)C4C(c5ccccc5)C6
Nc1nonc1c3noc(c2ccccc2)n3	ZINC000000053268	c3ccc(c2nc(c1cnon1)no2)cc3
FC(F)(F)c2cccc(NC(=O)CSC1=NCCN1)c2	ZINC000000141834	O=C(CSC1=NCCN1)Nc2ccccc2
CN(C)\C=N\c2ccn(Cc1ccccc1)c(=O)c2C#N	ZINC000000208480	O=c1ccccn1Cc2ccccc2
CN2CCN=C(c1ccccc1)c3cc(Cl)ccc23	ZINC000000001659	C3CN=C(c1ccccc1)c2ccccc2N3
NCc1n[nH]c(=O)c2ccccc12	ZINC000000329849	O=c1[nH]ncc2ccccc12
CN2CCN(c1ccc(C(F)(F)F)cc1NC(C)=O)CC2	ZINC000000075437	C2CN(c1ccccc1)CCN2
CC(C)C(=O)Nc2nc1ccccc1s2	ZINC000000029808	c2ccc1scnc1c2
COc2ccc1nsnc1c2	ZINC000000071455	c2ccc1nsnc1c2
CC(C)(C)c3cn2c1ccccc1nc2n3CCN4CCCC4	ZINC000000274325	C4CCN(CCn2ccn3c1ccccc1nc23)C4
O=C(C2CCN(C[C@H]1CCC=CC1)CC2)N4CCN(C/C=C/c3ccccc3)CC4	ZINC000000795503	O=C(C2CCN(CC1CCC=CC1)CC2)N4CCN(CC=Cc3ccccc3)CC4
CCN(CC)Cc4cc(Cc3c[nH]c2cc1ccccc1cc2c3=O)cc(CN(CC)CC)c4O	ZINC000016678390	O=c3c(Cc1ccccc1)c[nH]c4cc2ccccc2cc34
CN3CCN(C(=O)NC[C@H]2CN(Cc1ccccc1)C(=O)C2)CC3	ZINC000000347888	O=C2CC(CNC(=O)N1CCNCC1)CN2Cc3ccccc3
COc5ccc4nc1cc(Cl)ccc1c(NCC3(c2ccccc2)CCN(C)CC3)c4c5	ZINC000004769467	C5CC(CNc2c1ccccc1nc3ccccc23)(c4ccccc4)CCN5
CCOC(=O)c2cc(=O)c1c(O)cccc1o2	ZINC000000132951	O=c1ccoc2ccccc12
COc4ccc(NC(=O)c3ccc(c2ccc(c1noc(C)n1)cc2C)cc3)cc4OCCN(C)C	ZINC000000600564	O=C(Nc1ccccc1)c4ccc(c3ccc(c2ncon2)cc3)cc4
Clc3cccc(N2CCN(C(=O)c1ccc(N(=O)=O)o1)CC2)c3	ZINC000000047039	O=C(N2CCN(c1ccccc1)CC2)c3ccco3
CC2SC(c1ccccc1F)=NC2=O	ZINC000000012804	O=C2CSC(c1ccccc1)=N2
C2CN(c1cnccn1)CCN2	ZINC000002168455	C2CN(c1cnccn1)CCN2
NCC(=O)Nc1ccccc1	ZINC000001596847	c1ccccc1
CN(/N=C/c1cccc(N(=O)=O)c1)C2=NS(=O)(=O)c3ccccc23	ZINC000000088932	O=S3(=O)N=C(NN=Cc1ccccc1)c2ccccc23
CC[N+](C)(CC)CCN(=O)=O	ZINC000001596844	nonring
Cc1noc(C)c1S(=O)(=O)Nc2ccccc2OC(F)(F)F	ZINC000000112169	O=S(=O)(Nc1ccccc1)c2cnoc2
Fc2cccc3O[C@@H]1CNC[C@H]1Oc23	ZINC000000001471	C2NCC3Oc1ccccc1OC23
COC(=O)c1c(C)c(C(C)=O)sc1NC(=O)c2cccs2	ZINC000000048754	O=C(Nc1cccs1)c2cccs2
Cc2ccc(NC(=O)CCN1CCCC1)cc2	ZINC000000176406	O=C(CCN1CCCC1)Nc2ccccc2
Cc1cccc(C)c1NC(=O)c2ccc(N)cc2	ZINC000000004579	O=C(Nc1ccccc1)c2ccccc2
CNc1nc(Br)cn2cc(C#N)nc12	ZINC000000005885	c2cn1ccnc1cn2
CCn1c(C)nc2cc(N)ccc12	ZINC000000394292	c2ccc1[nH]cnc1c2
O=[S@@]1CCCS[C@@H]1c2cccnc2	ZINC000000039874	O=S1CCCSC1c2cccnc2
C4Oc3ccc(C[C@@H]1CC2CCN1CC2)cc3O4	ZINC000000213429	C4Oc3ccc(CC1CC2CCN1CC2)cc3O4
O=C(Nc1ccc(CC#N)cc1)c2ccc(N(=O)=O)cc2	ZINC000000037220	O=C(Nc1ccccc1)c2ccccc2
CN(C)CCNC(=O)c1c(C)onc1c2ccccc2	ZINC000000155132	c2ccc(c1ccon1)cc2
CCc4nc(C)c(CN3CCC(N2CCC(C(=O)NCc1ccccn1)CC2)CC3)[nH]4	ZINC000011936570	O=C(NCc1ccccn1)C4CCN(C3CCN(Cc2cnc[nH]2)CC3)CC4
Cc1nccc2c(=O)c(C)c(N)c(=O)c12	ZINC000000005656	O=c1ccc(=O)c2cnccc12
Clc4ccc(N3CCN(CC(c1ccccc1)c2ccccc2)CC3)cc4	ZINC000000766466	C2CN(c1ccccc1)CCN2CC(c3ccccc3)c4ccccc4
O=C(NCc1cccnc1)c4ccc(COc3ccc2CCCc2c3)o4	ZINC000000046838	O=C(NCc1cccnc1)c4ccc(COc3ccc2CCCc2c3)o4
CN(C)CCNC(=O)CCC3CCN(C2CCN(c1cccc(C)c1C)CC2)CC3	ZINC000011667878	C3CCN(C2CCN(c1ccccc1)CC2)CC3
CN(C)c1ccc(C[N+](=O)C(C)(C)\C=N\O)cc1	ZINC000000300048	c1ccccc1
CCN(CC)S(=O)(=O)c2cccc(C(=O)Nc1nccs1)c2	ZINC000000050605	O=C(Nc1nccs1)c2ccccc2
COc1ccccc1C(=O)Nc3ccc2c(C)cc(=O)oc2c3	ZINC000000047102	O=C(Nc2ccc1ccc(=O)oc1c2)c3ccccc3
CN5CCN(CCC(=O)Nc4ccc3[nH]c2ccc(NC(=O)CCN1CCN(C)CC1)cc2c(=O)c3c4)CC5	ZINC000028375761	O=C(CCN1CCNCC1)Nc5ccc4[nH]c3ccc(NC(=O)CCN2CCNCC2)cc3c(=O)c4c5
COc2ccc(CCN1CCC[C@@H](C[N@@](C)CC=C(C)C)C1)cc2	ZINC000011842064	C2CCN(CCc1ccccc1)CC2
COc2ccc(CCNC1=NCCN1)cc2OC	ZINC000000017381	C2CN=C(NCCc1ccccc1)N2
CN5CCN(C(=O)c4ccc3[nH]c(c2cc1ccccc1[nH]c2=O)cc3c4)CC5	ZINC000000591199	O=C(N1CCNCC1)c5ccc4[nH]c(c3cc2ccccc2[nH]c3=O)cc4c5
CCOC(=O)c2ccc(NC(=O)c1ccc(Cl)cc1Cl)cc2	ZINC000000062057	O=C(Nc1ccccc1)c2ccccc2
C[N@@](CC2CCN(CCc1ccc(F)cc1)CC2)Cc4nc(c3cccs3)oc4C	ZINC000012761112	C2CN(CCc1ccccc1)CCC2CNCc4coc(c3cccs3)n4
O=C1CCCN1C2=NCCN2	ZINC000005133381	O=C1CCCN1C2=NCCN2
Cc1cc(C)c(N(=O)=O)c(C)c1C=O	ZINC000000042516	c1ccccc1
Cc3cc(c2nc1cc(F)ccc1s2)ccc3NC(=O)[C@@H](N)CCCCN	ZINC000001549377	c3ccc(c2nc1ccccc1s2)cc3
CCOc3ccc(N2C(=O)C[C@@H](Cc1cc(C)cc(C)c1)C2=O)cc3	ZINC000000261246	O=C2CC(Cc1ccccc1)C(=O)N2c3ccccc3
COCCN(C[C@@H]3CCC[N@](C2Cc1ccccc1C2)C3)Cc4cccc5cccnc45	ZINC000012719115	C5CC(CNCc1cccc2cccnc12)CN(C4Cc3ccccc3C4)C5
CN1CCc3c(C1=O)n(C[C@@H](O)CNCc2ccccc2)c4ccccc34	ZINC000000803236	O=C1NCCc3c1n(CCCNCc2ccccc2)c4ccccc34
Nc1sc(C#N)c(N)c1C#N	ZINC000000055146	c1ccsc1
COc3ccc(C(=O)c1coc2ccc(O)c(CN(C)C)c12)cc3	ZINC000000105837	O=C(c1ccccc1)c2coc3ccccc23
Cc3ccc(S(=O)(=O)N2CCN(c1ccccc1C)CC2)cc3	ZINC000000036406	O=S(=O)(N2CCN(c1ccccc1)CC2)c3ccccc3
COc2ccc(NC(=O)CSC1=NCCN1)cc2	ZINC000000141881	O=C(CSC1=NCCN1)Nc2ccccc2
C[C@@H]5CN=C(c4ccc(NC(=O)c3ccc(C(=O)Nc2ccc(C1=NC[C@@H](C)N1)cc2)cc3)cc4)N5	ZINC000001687836	O=C(Nc2ccc(C1=NCCN1)cc2)c5ccc(C(=O)Nc4ccc(C3=NCCN3)cc4)cc5
C[N+](C)(C)c3ccc(NC(=O)c2ccc(C(=O)Nc1ccc([N+](C)(C)C)cc1)cc2)cc3	ZINC000001685588	O=C(Nc1ccccc1)c3ccc(C(=O)Nc2ccccc2)cc3
Cc1cc(C)[n+](C)n1C	ZINC000000406359	c1cn[nH]c1
CN1CCCC[C@@H]1C(=O)Nc2c(C)cccc2C	ZINC000000000456	O=C(Nc1ccccc1)C2CCCCN2
C[C@H]4CN(C(=O)c2nc1sccn1c2CNCCCCCN3CCOCC3)C[C@@H](C)O4	ZINC000015075842	O=C(N1CCOCC1)c3nc2sccn2c3CNCCCCCN4CCOCC4
COc1ccccc1OC[C@@H]2CNC(=O)O2	ZINC000000000452	O=C2NCC(COc1ccccc1)O2
O[C@H](CNC1CCCCC1)Cn3cnc2ccccc2c3=O	ZINC000000406602	O=c2n(CCCNC1CCCCC1)cnc3ccccc23
Cc1ccccc1CCN4CCC(C[N@@](C[C@@H]2CCOC2)C3CCCC3)CC4	ZINC000012202954	C4CCC(N(CC2CCN(CCc1ccccc1)CC2)CC3CCOC3)C4
CC(C)=CCn2c(N1CCCCCC1)nc3n(C)c(=O)[nH]c(=O)c23	ZINC000000044135	O=c3[nH]c(=O)c2[nH]c(N1CCCCCC1)nc2[nH]3
CN(C1CCCCC1)C(=O)c2ccc(F)cc2	ZINC000000029774	O=C(NC1CCCCC1)c2ccccc2
CCN1CCC[C@@H]1CNC(=O)c5nn(CCOC)c4CC[N@](Cc2c[nH]c3ccccc23)Cc45	ZINC000014744367	O=C(NCC1CCCN1)c5n[nH]c4CCN(Cc2c[nH]c3ccccc23)Cc45
COc2ccc(C(=O)N[C@H]1CCCCNC1=O)cc2	ZINC000000015124	O=C1NCCCCC1NC(=O)c2ccccc2
COc4ccc(C1=N[n+]2c(SC1)n(C)c3ccccc23)cc4	ZINC000000274883	C3Sc2[nH]c1ccccc1[n+]2N=C3c4ccccc4
O=C3C[C@H](N2CCN(c1ccccn1)CC2)C(=O)N3c4ccccc4	ZINC000000048937	O=C3CC(N2CCN(c1ccccn1)CC2)C(=O)N3c4ccccc4
Cn3c(N2CCN(CCc1ccccc1)CC2)cc(=O)n(C)c3=O	ZINC000000015120	O=c3cc(N2CCN(CCc1ccccc1)CC2)[nH]c(=O)[nH]3
CC[N+](CC)(CC)CC#CCCCCC#CC[N+](CC)(CC)CC	ZINC000067191239	nonring
COC(=O)c1csc(C(=O)OC)c1C	ZINC000000035814	c1ccsc1
CSc3nc2ccc(NC(=O)CCc1ccccc1)cc2s3	ZINC000000048938	O=C(CCc1ccccc1)Nc3ccc2ncsc2c3
CCN(CC)CCN	ZINC000019230110	nonring
CCOc3ccc2[nH]c(=NN=C1C(=O)CC(C)(C)CC1=O)sc2c3	ZINC000000125870	O=C1CCCC(=O)C1=NN=c3[nH]c2ccccc2s3
CN4CCN(c3cc(n1nc(C)cc1c2ccccc2)ncn3)CC4	ZINC000000102157	C4CN(c3cc(n1nccc1c2ccccc2)ncn3)CCN4
Cn3nc(C(=O)NCC12CCCN1CCC2)c4ccccc34	ZINC000000007131	O=C(NCC12CCCN1CCC2)c3n[nH]c4ccccc34
CCOc2cc(CNCCCN1CCOCC1)cc(Cl)c2OCc3ccccc3	ZINC000008254064	C(CNCc2ccc(OCc1ccccc1)cc2)CN3CCOCC3
CCOc1cc(CN(CCCN(C)C)CCCN(C)C)ccc1OC	ZINC000004988229	c1ccccc1
C[C@@H](N)c1cccc(S(=O)(=O)NCCN(C)C)c1	ZINC000021519126	c1ccccc1
C[N+](C)(C)CCOC(OCC[N+](C)(C)C)(c1ccccc1)c2ccccc2	ZINC000001673122	C(c1ccccc1)c2ccccc2
OC(=O)CCn2cnc1ccccc1c2=O	ZINC000000489662	O=c1[nH]cnc2ccccc12
CC1(C)Cc2c(CO1)[nH]c3ncnc(N)c23	ZINC000000509451	C1Cc2c(CO1)[nH]c3ncncc23
CNC(=O)C1C(C)(C)C1(C)C	ZINC000000006440	C1CC1
CC[N+]2=C(C)c1ccc(C)n1CC2	ZINC000000245877	C2Cn1cccc1C=N2
O[C@@H]3CSCc2nc1ccccc1n2C3	ZINC000000099327	C3CSCc2nc1ccccc1n2C3
Cc2cc1CCCS(=O)(=O)c1cc2S(N)(=O)=O	ZINC000000001718	O=S2(=O)CCCc1ccccc12
COc2cc1nc(C)[nH]c1cc2OC	ZINC000000246411	c2ccc1[nH]cnc1c2
NCCc2nc(c1ccccc1)n[nH]2	ZINC000000262700	c2ccc(c1nc[nH]n1)cc2
CC(C)c1nc(N)nc(NN)n1	ZINC000000163126	c1ncncn1
C[N@]1[C@H]3CC[C@@H]1CC(NC(=O)Nc2ccc(F)cc2F)C3	ZINC000000135956	O=C(NC1CC2CCC(C1)N2)Nc3ccccc3
CC(=O)CSc1n(C)c(C)c(C)[n+]1C	ZINC000000004816	c1c[nH]cn1
CCN(CC)C[C@@H](O)C=O	ZINC000001653261	nonring
CCOC(=O)N4CCC(NC2c1ccccc1c3ccccc23)CC4	ZINC000000217711	C4CC(NC2c1ccccc1c3ccccc23)CCN4
O[C@@H](CNC1CCCCC1)CSC[C@@H](O)CNC2CCCCC2	ZINC000004989801	C2CCC(NCCCSCCCNC1CCCCC1)CC2
CC[C@H](N1CCC(C(N)=O)CC1)c2nnnn2C3CCCC3	ZINC000000413524	C3CCN(Cc1nnnn1C2CCCC2)CC3
CC2CCN(C[C@@H](O)COc1cc(C)ccc1C(C)C)CC2	ZINC000000124619	C2CCN(CCCOc1ccccc1)CC2
CCN(CC)CCC[C@@H](C)NC(=N)NC(=O)c1cccc(F)c1CCc2cc(Br)ccc2Cl	ZINC000036284655	C(Cc1ccccc1)c2ccccc2
CCN(CC)C(=O)[C@@H]4CCC[N@@](Cc3ccc(C(=O)NCC2(N1CCOCC1)CCCCC2)c(=O)[nH]3)C4	ZINC000012052626	O=C(NCC2(N1CCOCC1)CCCCC2)c4ccc(CN3CCCCC3)[nH]c4=O
Cc2cc(N1CCCCC1)nc3ccc(N)cc23	ZINC000000269676	C3CCN(c2ccc1ccccc1n2)CC3
CCOC(=O)N3CCC(N2CCN(c1ccc(F)cc1)CC2)CC3	ZINC000000757046	C3CC(N2CCN(c1ccccc1)CC2)CCN3
Cc2cc[n+](C[C@@H](O)COc1ccccc1)cc2	ZINC000000297627	C(COc1ccccc1)C[n+]2ccccc2
NCCc4c[nH]c5ccc(OC(=O)c3cccc(C(=O)Oc2ccc1[nH]cc(CCN)c1c2)c3)cc45	ZINC000003144307	O=C(Oc2ccc1[nH]ccc1c2)c5cccc(C(=O)Oc4ccc3[nH]ccc3c4)c5
CN(Cc1cc[nH]n1)C(=O)C4CCN(C3CCN(CCCc2ccccc2)CC3)CC4	ZINC000012301025	O=C(NCc1cc[nH]n1)C4CCN(C3CCN(CCCc2ccccc2)CC3)CC4
C[C@@H](NC2CCN(CCc1ccccc1)CC2)c3ccc(F)cc3	ZINC000000213915	C2CN(CCc1ccccc1)CCC2NCc3ccccc3
COc3c1OCOc1cc2CC[N+](C)(C)[C@H](CC(=O)C(C)C)c23	ZINC000000487511	C3Cc2cc1OCOc1cc2CN3
C[C@H](N)[C@H]2[C@H](O)C[C@@]3(C)[C@@H]1CC[C@@H]4C(=CC1=CC[C@]23C)CC[C@H](N(C)C)C4(C)C	ZINC000006030275	C4CCC3=CC2=CCC1CCCC1C2CCC3C4
CSc2cccc(NC(=O)CCSc1ccc(Cl)cc1)c2	ZINC000000038227	O=C(CCSc1ccccc1)Nc2ccccc2
C1CN[C@@H]2[C@H](C1)[C@@H]3CC[C@H]2[C@H]4N3CCc5c4[nH]c6ccccc56	ZINC000000338156	C1CNC2C(C1)C3CCC2C4N3CCc5c4[nH]c6ccccc56
Cc3oc2cc(OC(=O)CNC(=O)OCc1ccccc1)ccc2c(=O)c3Oc4ccccc4	ZINC000000626197	O=C(CNC(=O)OCc1ccccc1)Oc4ccc3c(=O)c(Oc2ccccc2)coc3c4
Nc4ccc(CN3CCN(c2ccc1ccccc1n2)CC3)cc4	ZINC000000110981	C3CN(c2ccc1ccccc1n2)CCN3Cc4ccccc4
CCCCNC	ZINC000001672634	nonring
COc4ccc3[nH]c2c(C)c1ccnc(NCCCN(C)C)c1cc2c3c4	ZINC000006069484	c1ccc4c(c1)[nH]c3cc2ccncc2cc34
Cc2cc(C)c(C#N)c(SCCN1CCCCC1)n2	ZINC000000132850	C2CCN(CCSc1ccccn1)CC2
CN(C)CCNC(=O)c3ccc2sc1ccccc1c(=O)[nH]c2c3	ZINC000000216929	O=c2[nH]c1ccccc1sc3ccccc23
CNc4nc([C@@H]1CCCNC1)nc3CN(C(=O)C[N@@](C)Cc2ccc(OC)cc2)CCc34	ZINC000019708824	O=C(CNCc1ccccc1)N4CCc3cnc(C2CCCNC2)nc3C4
FC(F)(F)c5cccc(N4CCN(CCc2nnc3[C@H]1CCC[C@H]1Cn23)CC4)c5	ZINC000000537940	C5CC4Cn3c(CCN2CCN(c1ccccc1)CC2)nnc3C4C5
O=C2C[C@@H](NCc1ccccc1)C(=O)N2c3ccccc3	ZINC000000100409	O=C2CC(NCc1ccccc1)C(=O)N2c3ccccc3
OC2(c1cccnc1)CCNCC2	ZINC000002529120	C2CC(c1cccnc1)CCN2
CCc3ccc(OCC(=O)Nc2nc1ccc(Cl)cc1s2)cc3	ZINC000000569327	O=C(COc1ccccc1)Nc3nc2ccccc2s3
Clc3ccc(Sc1ccccc1C=c2[nH]c(=S)[nH]c2=O)cc3	ZINC000000051734	O=c1[nH]c(=S)[nH]c1=Cc2ccccc2Sc3ccccc3
C/C=C/C1=NCCN1CCO	ZINC000001589979	C1CN=CN1
CCN(CC)CCOC(=O)c3cc2cc1cc(C(=O)OCCN(CC)CC)c(=O)oc1c(C)c2oc3=O	ZINC000005496714	O=c3ccc2cc1ccc(=O)oc1cc2o3
CC(C)NC[C@@H](O)COc1cccc2cc(C(C)=O)oc12	ZINC000000000063	c2ccc1occc1c2
COC(=O)c1ccccc1S(=O)(=O)C2CCNCC2	ZINC000000154174	O=S(=O)(C1CCNCC1)c2ccccc2
C[C@@H]1CCc3c(C1)oc4ccc(NS(=O)(=O)c2ccccc2)cc34	ZINC000000102758	O=S(=O)(Nc3ccc2oc1CCCCc1c2c3)c4ccccc4
Cc2cc(C)n1c(C)cc[n+]1c2	ZINC000000368427	c2cc[n+]1cccn1c2
COc2ccc(c1csnn1)cc2S(=O)(=O)Nc3ccccc3	ZINC000000173305	O=S(=O)(Nc1ccccc1)c3cccc(c2csnn2)c3
CCN(CC)Cc3cc(Nc1ccnc2ccc(OC)cc12)ccc3O	ZINC000001729641	N(c1ccccc1)c2ccnc3ccccc23
CNC(=O)C2c1ccccc1Oc3ccccc23	ZINC000000030244	C2c1ccccc1Oc3ccccc23
CCOC(=O)[C@@H](C#N)[C@@]2(Cc1ccccc1)C[C@H](C)[N@@](C)C[C@@H]2C	ZINC000000341244	C2CC(Cc1ccccc1)CCN2
COc1cc(CNCCCN(C)C)cc(Br)c1OCc2cccnc2	ZINC000006871417	C(Oc1ccccc1)c2cccnc2
COc4ccc(OC2CCN(C1CCCC1)CC2)c(C(=O)NC[C@@H]3CCCC[N@]3C)c4	ZINC000012090273	O=C(NCC1CCCCN1)c2ccccc2OC4CCN(C3CCCC3)CC4
CCN(CC)CCN3C(=O)[C@@H]2C[N@](C[C@@H]1CCOC1)C[C@]2(C)NC(=O)c4ccccc34	ZINC000019526394	O=C4Nc1ccccc1C(=O)NC3CN(CC2CCOC2)CC34
CN(C)c2ccc(c1cc[n+](C)cc1)cc2	ZINC000000242375	c2ccc(c1ccncc1)cc2
Cn1cc(C(N)=O)c(=O)c2ccccc12	ZINC000000034622	O=c1cc[nH]c2ccccc12
CC3CCC(N2CCN(C(=O)c1ccc(F)cc1)CC2)CC3	ZINC000000283526	O=C(N2CCN(C1CCCCC1)CC2)c3ccccc3
Cn3c(c2ccc1ccccc1n2)[n+](C)c4ccccc34	ZINC000000242379	c4ccc3nc(c2nc1ccccc1[nH]2)ccc3c4
CC1(C)C[C@@H](O)C[C@](C)(CN)C1	ZINC000000405118	C1CCCCC1
CN(C)C[C@]1(C)OC(=O)C(Cl)=C1C	ZINC000000085686	O=C1OCC=C1
COc1ccc(Br)cc1CSc2ccccc2C3=NCCCN3	ZINC000000590622	C3CNC(c1ccccc1SCc2ccccc2)=NC3
Cn4cc(CNCC[C@@H]2CC[N@@](Cc1ccccc1)C2)c(c3cccc(Cl)c3)n4	ZINC000011661049	C(CC2CCN(Cc1ccccc1)C2)NCc3c[nH]nc3c4ccccc4
CCCCNCC(=O)Nc1ccc(NC(=O)CNCCCC)cc1	ZINC000004894613	c1ccccc1
CCN(CC)CCN(CCN(CC)CC)c1c(OC)cccc1OC	ZINC000005052199	c1ccccc1
O=C(N1CCCCC1)c2cccs2	ZINC000000043193	O=C(N1CCCCC1)c2cccs2
Cc1cccc2cccc(Cl)[n+]12	ZINC000000336865	c2cc[n+]1ccccc1c2
O=c2n(CN1CCCCC1)c4cccc3cccc2c34	ZINC000000125964	O=c2n(CN1CCCCC1)c4cccc3cccc2c34
CC[N@@](CCO)Cc2cc1cc(Br)ccc1s2	ZINC000000338844	c2ccc1sccc1c2
Cc3cccn4c(NC1CCCCC1)c(c2ccccc2O)nc34	ZINC000000418197	C4CCC(Nc2c(c1ccccc1)nc3ccccn23)CC4
Brc3cncc(N1CCN2CCC1CC2)c3	ZINC000000025861	C1CN3CCC1N(c2cccnc2)CC3
COc3cc2CC(C)(C)N=C(Nc1cc(C)ccc1C)c2cc3OC	ZINC000000371925	C3Cc1ccccc1C(Nc2ccccc2)=N3
CCOC(=O)c1cc(C(C)(C)C)oc1CN	ZINC000000032660	c1ccoc1
CN(C)C(=O)COc3ccc2CC[C@H](NC[C@H](O)c1ccc(O)c(CCO)c1)Cc2c3	ZINC000000584203	C(Cc1ccccc1)NC3CCc2ccccc2C3
CCOC(=O)N3CCN(CC1=CC[C@H]2C[C@@H]1C2(C)C)CC3	ZINC000000218173	C3CN(CC1=CCC2CC1C2)CCN3
CCOc2cc(S(=O)(=O)Nc1ccc(Cl)cn1)ccc2F	ZINC000000384746	O=S(=O)(Nc1ccccn1)c2ccccc2
CS(=O)(=O)c3ccc(c2cn1ccccc1n2)cc3	ZINC000000002261	c3ccc(c2cn1ccccc1n2)cc3
C2CCN(C1=NCCN1)C2	ZINC000001668194	C2CCN(C1=NCCN1)C2
CN(C)CCO[C@@H](c1ccc(Cl)cc1)c2ccccn2	ZINC000000000122	C(c1ccccc1)c2ccccn2
O=C2NCCN(c1ccccc1)N2	ZINC000000025267	O=C2NCCN(c1ccccc1)N2
CCN(CC)CCn2c(CCN1CCCC1)nc3cc(N(=O)=O)ccc23	ZINC000002016521	C3CCN(CCc2nc1ccccc1[nH]2)C3
Cc2ccc(NC(=O)c1ccccc1)cc2F	ZINC000000038651	O=C(Nc1ccccc1)c2ccccc2
COc2ccc(C(=O)CNC1=NCCOC1)cc2	ZINC000000492450	O=C(CNC1=NCCOC1)c2ccccc2
CC(C)[C@@](CN)(CCCCN1CCCC1)c2cccc3ccccc23	ZINC000005064594	C(CCN1CCCC1)CCc2cccc3ccccc23
O[C@H](CN1CCCCC1)CN(c2ccccc2)c3ccccc3	ZINC000000126997	C3CCN(CCCN(c1ccccc1)c2ccccc2)CC3
CCCN4CCN(c3nnc(n1cccc1CNCCc2ccc(OCC)cc2)s3)CC4	ZINC000009265791	C4CN(c3nnc(n1cccc1CNCCc2ccccc2)s3)CCN4
FC(F)(F)c2cccc(n1cccc1)c2	ZINC000000034362	c2ccc(n1cccc1)cc2
C[N@]2CCC[C@@H](OC(=O)COc1ccc(F)cc1)C2	ZINC000000249839	O=C(COc1ccccc1)OC2CCCNC2
O=S3(=O)C=C(SCCN1CCCC1)c2ccccc23	ZINC000000250674	O=S3(=O)C=C(SCCN1CCCC1)c2ccccc23
O=C1[C@@H]3CCC[C@H]1[C@H](N2CCCCC2)CC3	ZINC000000280955	O=C1C3CCCC1C(N2CCCCC2)CC3
CCN4CCN(C(=O)c3ccc(N1CCNCC1)c(NS(=O)(=O)c2ccc(C)cc2)c3)CC4	ZINC000033033160	O=C(N1CCNCC1)c4ccc(N2CCNCC2)c(NS(=O)(=O)c3ccccc3)c4
CC1(C)NC(=N)NC(=N)N1c3ccc(OCCOc2ccc(N(=O)=O)cc2)cc3	ZINC000001710093	N=C3NCN(c2ccc(OCCOc1ccccc1)cc2)C(=N)N3
CCN(C)C[C@@H]1CC[N@@](CCC(=O)NCC(=O)OC)C1	ZINC000072859490	C1CCNC1
CC[n+]1c(C)scc1c3c(C)oc2cc(OC(C)=O)ccc2c3=O	ZINC000000487600	O=c2c(c1cscn1)coc3ccccc23
Clc4ccc(CNCc1ccccc1CN3CCN(c2ccccc2)CC3)s4	ZINC000030913862	C2CN(c1ccccc1)CCN2Cc3ccccc3CNCc4cccs4
O[C@@H](COc2cccc(CNCCCc1cccnc1)c2)CN3CCCCCC3	ZINC000011664980	C3CCCN(CCCOc2cccc(CNCCCc1cccnc1)c2)CC3
Fc1cccc(F)c1C(=O)N2CCCC2	ZINC000000035148	O=C(N1CCCC1)c2ccccc2
CCOC(=O)c2cnc1n(C)nc(C)c1c2Oc3ccc(OC)cc3	ZINC000000096562	O(c1ccccc1)c2ccnc3[nH]ncc23
COc2cc(CNCCCN1CCOCC1)ccc2OCc3ccc(Cl)nc3	ZINC000005271646	C(CNCc2ccc(OCc1cccnc1)cc2)CN3CCOCC3
CC[N@]1CCC[C@@H]1CNC(=O)c2n[nH]c(=O)c3ccccc23	ZINC000000211527	O=C(NCC1CCCN1)c2n[nH]c(=O)c3ccccc23
O=C(NC[C@@H]1CCCO1)C3CCN(C[C@H]2CCC=CC2)CC3	ZINC000000317506	O=C(NCC1CCCO1)C3CCN(CC2CCC=CC2)CC3
OC3(c1ccc(Cl)cc1)CCN(CCCC(=O)c2ccc(F)cc2)CC3	ZINC000000537822	O=C(CCCN2CCC(c1ccccc1)CC2)c3ccccc3
S=C(NC1CC1)N4CCC[N@@](Cc2cccc3ccccc23)CC4	ZINC000000066637	S=C(NC1CC1)N4CCCN(Cc2cccc3ccccc23)CC4
COC(=O)c1ccccc1NC(=O)c2cc[n+](C)cc2	ZINC000000364621	O=C(Nc1ccccc1)c2ccncc2
CN(N)c3nc(N1CCCC1)nc(N2CCCC2)n3	ZINC000000040832	C3CCN(c2ncnc(N1CCCC1)n2)C3
CCOc2cc(Cc1cnc(N)nc1N)cc(OCC)c2n3cccc3	ZINC000000598590	C(c2ccc(n1cccc1)cc2)c3cncnc3
CCN(CC)C(=S)SCc1csc(C)n1	ZINC000000032794	c1cscn1
COc3ccc(OC[C@@H](O)CN1CCC(O)CC1)c(CNCc2cc(F)ccc2C)c3	ZINC000012591883	C3CCN(CCCOc1ccccc1CNCc2ccccc2)CC3
CN(C)CCN(C1CCN(C)CC1)C(=O)Cc3csc(Nc2cccc(C)c2)n3	ZINC000012238278	O=C(Cc2csc(Nc1ccccc1)n2)NC3CCNCC3
Cc2ccc(C(=O)NC1CCCCC1)cc2C	ZINC000000029944	O=C(NC1CCCCC1)c2ccccc2
CN2CCN(NC(=O)C1CCCC1)CC2	ZINC000000369172	O=C(NN1CCNCC1)C2CCCC2
CCOC(=O)\C=C\[n+]1cccc(C)c1	ZINC000000268326	c1ccncc1
CNC(=N)c3ccc(NC(=O)c2ccc(C(=O)Nc1ccc(C(=N)NC)cc1)cc2)cc3	ZINC000001684447	O=C(Nc1ccccc1)c3ccc(C(=O)Nc2ccccc2)cc3
O=N(=O)c3ccc2c(=O)n(CC1CCNCC1)c(=O)c2c3	ZINC000000362563	O=c2n(CC1CCNCC1)c(=O)c3ccccc23
Brc3ccc(C(=O)ONC(=N)c2ccc(CN1CCCCC1)cc2)o3	ZINC000004785055	N=C(NOC(=O)c1ccco1)c3ccc(CN2CCCCC2)cc3
CS(=O)(=O)c2ccc1ccn(O)c1c2	ZINC000000086753	c2ccc1[nH]ccc1c2
Cc4nc3n(CCN1CCCCC1)c2ccccc2n3c4C(=O)c5cccs5	ZINC000000727441	O=C(c1cccs1)c4cnc5n(CCN2CCCCC2)c3ccccc3n45
COc2ccc1c(Cl)c(C(N)=O)sc1c2	ZINC000000045997	c2ccc1sccc1c2
C[C@@H](N)Cc1[nH]nc2ccc(O)cc12	ZINC000000027231	c2ccc1n[nH]cc1c2
CCOC(=O)[C@H](C)Sc2ncnc3sc(c1ccccc1)cc23	ZINC000000132281	c3ccc(c2cc1cncnc1s2)cc3
NC(=N)c4ccc(N=NNc3ccc(c2cc1cc(C(N)=N)ccc1o2)cc3)cc4	ZINC000005842486	N(N=Nc1ccccc1)c4ccc(c3cc2ccccc2o3)cc4
CN(C)[C@@H]5CCN(C(=O)[C@H]4C[C@@H](C(=O)Nc2ccc1CCCc1c2)C[N@@](Cc3ccccc3)C4)C5	ZINC000014747192	O=C(Nc2ccc1CCCc1c2)C5CC(C(=O)N3CCCC3)CN(Cc4ccccc4)C5
C(N[n+]2cnn(Cc1ccccc1)c2)c3ccccc3	ZINC000000242786	C(N[n+]2cnn(Cc1ccccc1)c2)c3ccccc3
COc3ccc(CN(C)Cc2cc1cc(F)ccc1[nH]2)cc3OC[C@@H](O)C[N@@](C)C(C)C	ZINC000012596850	C(NCc2cc1ccccc1[nH]2)c3ccccc3
CC(C)c1nccn1[C@H](C)C(=O)Nc4ccc(Oc3cc(C)nc(C2CCNCC2)c3)cc4	ZINC000019570440	O=C(Cn1ccnc1)Nc4ccc(Oc3ccnc(C2CCNCC2)c3)cc4
CN(Cc2cccc(OC[C@H](O)C[N@@](C)C1CCCCC1)c2)Cc3ccccn3	ZINC000012304665	C3CCC(NCCCOc2cccc(CNCc1ccccn1)c2)CC3
NCCCSC[C@@H](COc4ccc(NC(=O)c2cc(c1ccccc1)nc3ccccc23)cc4)SCCCN	ZINC000027655685	O=C(Nc1ccccc1)c3cc(c2ccccc2)nc4ccccc34
Clc1cccc(Cl)c1N(CC=C)C2=NCCN2	ZINC000000003723	C2CN=C(Nc1ccccc1)N2
Clc1cc(Cl)c(C=C(C#N)C#N)s1	ZINC000000050565	c1ccsc1
C(Oc1ccccc1)c3n[nH]c2ccncc2[nH]3	ZINC000000001870	C(Oc1ccccc1)c3n[nH]c2ccncc2[nH]3
CC[C@@H](O)CN1CCCC1	ZINC000006489615	C1CCNC1
CCN(CC)CCc2nc(c1ccccc1)no2	ZINC000000001874	c2ccc(c1ncon1)cc2
O=C(CC[N@]2CCc1ccccc1C2)Nc4ccc3OCOc3c4	ZINC000000254955	O=C(CCN2CCc1ccccc1C2)Nc4ccc3OCOc3c4
Clc2ccc(Cl)c(NC(=O)C[C@@H]1NCCCNC1=O)c2	ZINC000000118114	O=C(CC1NCCCNC1=O)Nc2ccccc2
Cc3ccc(O)c([C@@H](CC(=O)N1CCNCC1)c2ccccc2)c3	ZINC000000538720	O=C(CC(c1ccccc1)c2ccccc2)N3CCNCC3
COc3ccc(C2=NN(C(C)=O)C1(CCCC1)O2)cc3OC	ZINC000000039270	C1CCC3(C1)NN=C(c2ccccc2)O3
C5CCC(c1n[nH]cc1C[N@](CC3CCN(C2CCCC2)CC3)C[C@@H]4CCCO4)CC5	ZINC000023129406	C5CCC(c1n[nH]cc1CN(CC3CCN(C2CCCC2)CC3)CC4CCCO4)CC5
Cc2cc([C@@H]1CCCN1)on2	ZINC000000008089	C2CNC(c1ccno1)C2
CC[N+](C)(C)Cc1ccc(OCC(C)C)c(C[N+](C)(C)CC)c1	ZINC000000544797	c1ccccc1
Cc5ccc4nc(c3ccc(N2C(=O)C[C@H](N1CCCCC1)C2=O)cc3)sc4c5	ZINC000000689525	O=C2CC(N1CCCCC1)C(=O)N2c5ccc(c4nc3ccccc3s4)cc5
COc3ccc(CC[N@@](CC1CCN(C)CC1)Cc2csc(C(C)=O)c2)cc3	ZINC000012297541	C3CC(CN(CCc1ccccc1)Cc2ccsc2)CCN3
Cc3c(O)c(CN1CCCCC1)cc4c(c2ccccc2)cc(=O)oc34	ZINC000000046577	O=c4cc(c1ccccc1)c3cc(CN2CCCCC2)ccc3o4
FC(F)(F)c3cc(N1CCNCC1)c2ccccc2n3	ZINC000000170653	C3CN(c1ccnc2ccccc12)CCN3
CC[N@]1CCCC[C@@H]1C(=O)N3CCC(Oc2cccc(C(=O)N(C)CCN(C)C)c2)CC3	ZINC000020915991	O=C(C1CCCCN1)N3CCC(Oc2ccccc2)CC3
CC(=O)Nc3ccc(c2n/c(=C/c1cccs1)c(=O)o2)cc3	ZINC000000032084	O=c2oc(c1ccccc1)nc2=Cc3cccs3
COC(=O)C1=CCNCC1	ZINC000014724547	C1CC=CCN1
OC[C@@H](NCc1ccccc1)C#CCN2CCCC2	ZINC000000185570	C2CCN(CC#CCNCc1ccccc1)C2
OC1CCNCC1	ZINC000000388185	C1CCNCC1
CCOC(=O)[C@@H]1CCCCN1C2CCN(C)CC2	ZINC000000291709	C2CCN(C1CCNCC1)CC2
Cc3cccc(N2C(=O)C[C@H](NCc1ccc(S(N)(=O)=O)cc1)C2=O)c3	ZINC000000714256	O=C2CC(NCc1ccccc1)C(=O)N2c3ccccc3
CCOC(=O)c2[nH]c1ccccc1c2NC(=O)CN(C)C	ZINC000000492531	c2ccc1[nH]ccc1c2
O=C(N3c1ccccc1c2ccccc2S3(=O)=O)c4ccccc4	ZINC000000032536	O=C(N3c1ccccc1c2ccccc2S3(=O)=O)c4ccccc4
O[C@@H](CNCCCCCCNC[C@@H](O)COc1ccccc1)COc2ccccc2	ZINC000004602721	C(CCCNCCCOc1ccccc1)CCNCCCOc2ccccc2
Cc2nn1c(N)c(C#N)cnc1c2c3ccccc3	ZINC000000035214	c3ccc(c1cnn2cccnc12)cc3
COc1c(Cl)ccn(=O)c1C	ZINC000000404036	O=n1ccccc1
CC[N+](C)(CC)CC/C=C\C[N+](C)(CC)CC	ZINC000001571286	nonring
CCCCN(CCCC)C[C@@H](O)CN(CC)CC	ZINC000005551836	nonring
COc3cc(CNC(=O)[C@@]12CNC[C@@H]1C[N@@](C)C2)cc(OC)c3OC	ZINC000065395529	O=C(NCc1ccccc1)C23CNCC2CNC3
CNC[C@@H]1COCCO1	ZINC000001235134	C1COCCO1
CSc2nc1ccccc1n2Cc3ccccn3	ZINC000000003833	C(c1ccccn1)n2cnc3ccccc23
FC(F)(F)c2ccc1nccnc1c2	ZINC000000071538	c2ccc1nccnc1c2
CC(C)NC[C@H](O)COc1ccccc1CC=C	ZINC000000086599	c1ccccc1
CCOc3ccc(C(=O)Nc2ccc(N1CCN(C)CC1)cc2)cc3Br	ZINC000000679578	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
Clc3ccc2nc(N1CCCNCC1)sc2c3	ZINC000000066233	C3CNCCN(c2nc1ccccc1s2)C3
CC(C)N[C@@H](C)Cc1ccc(I)cc1	ZINC000000003834	c1ccccc1
C[C@H](C3CCN(Cc2nc(c1cccc(Cl)c1)oc2C)CC3)N4CCOCC4	ZINC000011873356	C4CN(CC3CCN(Cc2coc(c1ccccc1)n2)CC3)CCO4
O=c3[nH]c(=O)c(=C/c2ccc(N1CCCC1)cc2)\[nH]3	ZINC000000033931	O=c3[nH]c(=O)c(=Cc2ccc(N1CCCC1)cc2)[nH]3
COc3cc(CN2CCC(C(=O)N1CCC(C)CC1)CC2)cc(Br)c3O	ZINC000000819289	O=C(C2CCN(Cc1ccccc1)CC2)N3CCCCC3
NCCc2c[nH]c3ccc(OCc1ccccc1)cc23	ZINC000000057128	C(Oc2ccc1[nH]ccc1c2)c3ccccc3
O=C1CCC(=O)N1c2ccc(CC#N)cc2	ZINC000000151730	O=C1CCC(=O)N1c2ccccc2
C[N@]1CCC[C@H]1c2cccnc2n4c(C)nc3ccccc3c4=O	ZINC000000519688	O=c3n(c1ncccc1C2CCCN2)cnc4ccccc34
C[C@@]1(O)CC[N+](C)(C)N1C=O	ZINC000005359651	C1CNNC1
O=C3C[C@H](Nc2ccc1ccccc1c2)C(=O)N3c4ccccc4	ZINC000000069755	O=C3CC(Nc2ccc1ccccc1c2)C(=O)N3c4ccccc4
NC(=O)C4(N1CCCCC1)CCN([C@@H]2OC(=O)c3ccccc23)CC4	ZINC000000106585	O=C3OC(N2CCC(N1CCCCC1)CC2)c4ccccc34
O[C@H](COc3ccc(CN2CCN(c1ccc(O)cc1)CC2)cc3)CN4CCCCC4	ZINC000012441813	C4CCN(CCCOc3ccc(CN2CCN(c1ccccc1)CC2)cc3)CC4
CC(C(=O)NCCN1CCCC1)(c2ccccc2)c3ccccc3	ZINC000000383097	O=C(NCCN1CCCC1)C(c2ccccc2)c3ccccc3
NCC2CCC(C(=O)Nc1cccnc1)CC2	ZINC000000012055	O=C(Nc1cccnc1)C2CCCCC2
Cn1c[n+](C)ccc1=O	ZINC000000330949	O=c1ccnc[nH]1
Brc3ccc2nc(=S)n(C(=O)c1ccccc1)n2c3	ZINC000000090406	O=C(c1ccccc1)n2c(=S)nc3ccccn23
O=C(CSc1nnnn1c3ccc2OCOc2c3)N4CCCCC4	ZINC000000035023	O=C(CSc1nnnn1c3ccc2OCOc2c3)N4CCCCC4
COc2cc(OC)cc([N+]1(C)CCOCC1)c2	ZINC000000396330	C2CN(c1ccccc1)CCO2
Nc2cc(N)nc(SCC(=O)Nc1ccccc1F)n2	ZINC000000420695	O=C(CSc1ncccn1)Nc2ccccc2
CN([C@H]2[C@H](N1CCCC1)Cc3ccccc23)C(=O)Cc4cccc(N(=O)=O)c4	ZINC000000538092	O=C(Cc1ccccc1)NC3C(N2CCCC2)Cc4ccccc34
CCOc1ccccc1CN3CCC(C(=O)N2CCCC2)CC3	ZINC000000236163	O=C(C2CCN(Cc1ccccc1)CC2)N3CCCC3
C3Cn1cccc1[C@H](Cc2ccccc2)N3	ZINC000000186715	C3Cn1cccc1C(Cc2ccccc2)N3
O=C(CCCCC(=O)Nc2ccc(C1=NCCN1)cc2)Nc4ccc(C3=NCCN3)cc4	ZINC000001668426	O=C(CCCCC(=O)Nc2ccc(C1=NCCN1)cc2)Nc4ccc(C3=NCCN3)cc4
Clc3ccc(SCn2nnc1ccccc1c2=O)cc3	ZINC000000067670	O=c2n(CSc1ccccc1)nnc3ccccc23
C[N@]2CC[C@@](O)(c1cccc(Cl)n1)C2	ZINC000000390297	C2CC(c1ccccn1)CN2
Cc3ccc(Nc1nc(C#N)c(C#N)nc1Nc2ccc(C)cc2)cc3	ZINC000000055951	N(c1ccccc1)c2nccnc2Nc3ccccc3
Clc5ccc4sc1ccccc1n(C(=O)CCN3CC[N@]2CCC[C@H]2C3)c4c5	ZINC000000607721	O=C(CCN2CCN1CCCC1C2)n4c3ccccc3sc5ccccc45
CCCC(=O)N3CCN(c2nc(N)c1cc(OC)c(OC)cc1n2)CC3	ZINC000000638562	C3CN(c2ncc1ccccc1n2)CCN3
COc2c(C)cnc(CSc1nccn1C)c2C	ZINC000000025280	C(Sc1ncc[nH]1)c2ccccn2
Cc2nc(c1ccccc1)sc2C(=O)Nc3cccc4ccccc34	ZINC000000068979	O=C(Nc1cccc2ccccc12)c4cnc(c3ccccc3)s4
Cc1cc(Cl)ccc1NC2=NCCN2	ZINC000000004737	C2CN=C(Nc1ccccc1)N2
COC[C@@H](N)Cc1ccccc1	ZINC000000403116	c1ccccc1
Clc3c(N1CCNCC1)cnn(c2ccccc2)c3=O	ZINC000000151447	O=c2cc(N1CCNCC1)cnn2c3ccccc3
Cc2cc1nnnn1c3ccccc23	ZINC000000127911	c1ccc3c(c1)ccc2nnnn23
COc3ccc(NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)cc3	ZINC000000329105	O=C(CCc1c[nH]c2ccccc12)Nc3ccccc3
COc4ccc([C@@H]1NCCc2c1[nH]c3ccccc23)cc4	ZINC000000252413	C4Cc1c([nH]c2ccccc12)C(c3ccccc3)N4
N#Cc2cn(Cc1ccccc1)nn2	ZINC000000051242	C(c1ccccc1)n2ccnn2
CC[n+]1ccn(C)c1C	ZINC000002506534	c1c[nH]cn1
CCc1c(C#N)c(=O)oc2ccc(C)cc12	ZINC000000057776	O=c2ccc1ccccc1o2
CCN(CC)c1ccc(C=C(C#N)C#N)cc1	ZINC000000028397	c1ccccc1
C[N+]3(C[C@@H]2COC1(CCCC1)O2)CCCC3	ZINC000000185910	C3CCN(CC2COC1(CCCC1)O2)C3
Cc4ccc(C(=O)N2C(=O)[C@@H](c1ccccc1)Oc3ccccc23)cc4	ZINC000000069379	O=C3C(c1ccccc1)Oc2ccccc2N3C(=O)c4ccccc4
CC(=O)OC[N+]1(C)CCCCC1	ZINC000001563697	C1CCNCC1
COc2ccc(\C=N\c1ccc(OC(F)(F)F)cc1)cc2OC	ZINC000000045811	C(=Nc1ccccc1)c2ccccc2
CSc1nccc2ccccc12	ZINC000000023550	c2ccc1cnccc1c2
Fc5ccc(N4CCN(C2C1CC3CC(C1)CC2C3)CC4)cc5	ZINC000000182064	C2CN(c1ccccc1)CCN2C4C3CC5CC(C3)CC4C5
O=c2[nH]c1c(C#N)cnn1c3ccccc23	ZINC000000078704	O=c2[nH]c1ccnn1c3ccccc23
CC(C)(C)CN3CCC(Oc2ccc(C(=O)NCCCN1CCCC1)cc2Cl)CC3	ZINC000011842275	O=C(NCCCN1CCCC1)c3ccc(OC2CCNCC2)cc3
CC(=O)c3c(C)n(CCc1c[nH]c2ccccc12)c(C)c3C(C)=O	ZINC000000033687	C(Cn1cccc1)c2c[nH]c3ccccc23
S=C(SN1CCOCC1)N2CCOCC2	ZINC000000027634	S=C(SN1CCOCC1)N2CCOCC2
Fc2ccc(S(=O)(=O)Nc1ccc(Br)cc1F)cc2	ZINC000000046160	O=S(=O)(Nc1ccccc1)c2ccccc2
CCOC(=O)c1c(C)oc2ccc(O)c(CN(C)C)c12	ZINC000000083554	c2ccc1occc1c2
CNCC(N)=O	ZINC000001555345	nonring
CCOC(=O)Nc1ccc4c(c1)c(c2ccccc2)[n+](CCCN(CC)CC)c3cc(NC(=O)OCC)ccc34	ZINC000072130475	c4ccc(c2nc1ccccc1c3ccccc23)cc4
Cc4c(C)n3c(nc2n(C)c(=O)n(CCN1CCCCC1)c(=O)c23)n4CCN5CCCCC5	ZINC000010271978	O=c4[nH]c3nc2n(CCN1CCCCC1)ccn2c3c(=O)n4CCN5CCCCC5
NC(=N)c1ccco1	ZINC000000019907	c1ccoc1
Clc3cc(/N=C/c2ccc1OCOc1c2)ccc3Br	ZINC000000046403	C3Oc2ccc(C=Nc1ccccc1)cc2O3
COc2ccc(C1(CNC(N)=N)CCCC1)cc2OC	ZINC000000488194	C2CCC(c1ccccc1)C2
COc3ccc(CC[N@@](CC1CCN(C)CC1)Cc2ccc(Cl)s2)cc3	ZINC000011878584	C3CC(CN(CCc1ccccc1)Cc2cccs2)CCN3
Cc3c(C2CCN(CCc1ccccc1)CC2)noc3c4ccc(Cl)cc4	ZINC000000602172	C2CN(CCc1ccccc1)CCC2c4cc(c3ccccc3)on4
CC2(C)[C@@H](c1ccc(Cl)cc1Cl)OC(=O)C(C)(C)C2=O	ZINC000000034815	O=C2CC(c1ccccc1)OC(=O)C2
COC(=O)[C@@H](N)CCCCNC(c1ccccc1)(c2ccccc2)c3ccccc3	ZINC000006482468	c3ccc(C(c1ccccc1)c2ccccc2)cc3
C[C@H](N1CCCC1)C(=O)NCC3(c2ccccc2)CCCC3	ZINC000000177859	O=C(CN1CCCC1)NCC3(c2ccccc2)CCCC3
NC2(CO)COC(c1ccncc1)OC2	ZINC000000227782	C2COC(c1ccncc1)OC2
Cc4cc(Cl)c(OCCOc3ccc(C[C@@H](CN)c2ccc(c1ccnc(N)c1)cc2C)cc3)c(Cl)c4	ZINC000064549354	C(COc3ccc(CCc2ccc(c1ccncc1)cc2)cc3)Oc4ccccc4
CCOC(=O)CCCc2c([n+]1ccccc1)[nH]c3ccccc23	ZINC000000259421	c3cc[n+](c2cc1ccccc1[nH]2)cc3
CCCC(=O)C2c1cccc(O)c1C(=O)c3c(O)cccc23	ZINC000000001077	O=C2c1ccccc1Cc3ccccc23
CCN(CC)CCNC(=O)C3CCN(C2CCN(Cc1cccc(C)n1)CC2)CC3	ZINC000011821434	C3CCN(C2CCN(Cc1ccccn1)CC2)CC3
CCOC(=O)C2C(c1cccc(OC)c1)C(C(=O)OCC)C(=C)NC2=C	ZINC000000628410	C=C2CC(c1ccccc1)CC(=C)N2
Clc3ccc(C1=C[C@H]2CC[C@@H](C1)N2)cc3Cl	ZINC000000022174	C1CC3NC1CC(c2ccccc2)=C3
COc2cccc(CN1CCSCC1)c2OC	ZINC000000237148	C2CN(Cc1ccccc1)CCS2
NC(=O)C3(N1CCCCC1)CCN(C(=O)c2ccco2)CC3	ZINC000000130428	O=C(N2CCC(N1CCCCC1)CC2)c3ccco3
O=C(O[C@@H]1CN2CCC1CC2)[C@@H]4COc3ccccc3O4	ZINC000000108981	O=C(OC1CN2CCC1CC2)C4COc3ccccc3O4
CC(C)(O)[C@H](N)c1ccccc1	ZINC000001594446	c1ccccc1
CCOC(=O)c2oc1ccccc1c2CN3CCC(C(N)=O)CC3	ZINC000000118667	C3CCN(Cc1coc2ccccc12)CC3
C[N@]3CCc4cc1OCOc1c5c2ccccc2C[C@H]3c45	ZINC000000306694	C3Cc4cc1OCOc1c5c2ccccc2CC(N3)c45
Nc2cc(c1ccc(F)cc1)nc(N)n2	ZINC000000082203	c2ccc(c1ccncn1)cc2
CCN3C(=O)C[C@H](N2CCC(Cc1ccccc1)CC2)C3=O	ZINC000000053073	O=C3CC(N2CCC(Cc1ccccc1)CC2)C(=O)N3
O=C(NCCN1CCNC1=O)[C@@H]5C[C@H](CN2CCCC2)C[N@@](Cc4ccc3ccccc3c4)C5	ZINC000014542777	O=C(NCCN1CCNC1=O)C5CC(CN2CCCC2)CN(Cc4ccc3ccccc3c4)C5
C[N@@](C[C@@H](O)COc1ccccc1CNCc2cccnc2)C3CCCCC3	ZINC000011873003	C3CCC(NCCCOc1ccccc1CNCc2cccnc2)CC3
CN(C)CCN(Cc1ccccc1)c3nc2ccccc2o3	ZINC000000001857	C(Nc2nc1ccccc1o2)c3ccccc3
C3CCN(c2ccc1NCCc1c2)C3	ZINC000000005505	C3CCN(c2ccc1NCCc1c2)C3
Clc2ccc(/C=C/C(=O)N1CCCCC1)cc2	ZINC000000063912	O=C(C=Cc1ccccc1)N2CCCCC2
C[C@@H](N)Cc2cn(C)c3ccc1OCCCc1c23	ZINC000000009097	C3COc2ccc1[nH]ccc1c2C3
CC(=O)Nc1ccccc1OC[C@@H](O)CN2CCC(C(N)=O)CC2	ZINC000000147011	C2CCN(CCCOc1ccccc1)CC2
COc2ccc(C(=O)c1cc(OC)c(OC)c(OC)c1)c(N)c2	ZINC000000009247	O=C(c1ccccc1)c2ccccc2
O=C(NC1CCCCC1)c2ccco2	ZINC000000068799	O=C(NC1CCCCC1)c2ccco2
COC(OC)c1c(C(=O)OC)cnn1C(=O)Nc2c(C)cccc2C	ZINC000000124044	O=C(Nc1ccccc1)n2cccn2
CCNc1cccnc1N4CCN(C(=O)c3cc2cc(F)ccc2[nH]3)CC4	ZINC000000587537	O=C(N2CCN(c1ccccn1)CC2)c4cc3ccccc3[nH]4
COC1CCC(C(O)=O)CC1	ZINC000000155917	C1CCCCC1
NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000000139845	c1ccccc1
CCNC(=O)NCc1cccc(Cl)c1	ZINC000000001640	c1ccccc1
COc2cccc(O[C@H](C)CNC(=N)Cc1cccc(C)c1)c2	ZINC000000000846	N=C(Cc1ccccc1)NCCOc2ccccc2
COc1ccccc1S[C@H](CCN(C)C)c2ccccc2	ZINC000000346571	C(Sc1ccccc1)c2ccccc2
Cc1cccc(OC[C@H](O)CNC(C)(C)C)c1C	ZINC000000000844	c1ccccc1
Cc1ccc(C(=O)N(CC#N)CC#N)cc1C	ZINC000000029940	c1ccccc1
COc2ccc(CNCc1ccccc1F)cc2OC[C@@H](O)C[N@@](C)C(C)C	ZINC000011699154	C(NCc1ccccc1)c2ccccc2
CCN(CC)CCC[C@@H](C)NC[C@@H](O)COc1c(C)ccc(C)c1C	ZINC000002651524	c1ccccc1
CCN6CCN(c4nn3c(=O)c2c1CCCCc1sc2nc3c5ccccc45)CC6	ZINC000000719354	O=c5c2c1CCCCc1sc2nc6c3ccccc3c(N4CCNCC4)nn56
C[C@H](N)COCc1ccccc1	ZINC000001649056	c1ccccc1
C[C@H]3C(c1cccs1)[N+](=O)[C@](C)(c2ccc(C)cc2)N3O	ZINC000000269079	O=[N+]2C(c1cccs1)CNC2c3ccccc3
Cc3cc(C)n(c2ccc(SCc1ccc(Cl)cc1)nn2)n3	ZINC000000091435	C(Sc2ccc(n1cccn1)nn2)c3ccccc3
CCN(CC)CC1OCC2(CO1)COC(CN(CC)CC)OC2	ZINC000003182245	C1OCC2(CO1)COCOC2
CN1CCSC1=N	ZINC000003865408	N=C1NCCS1
CN(C)CCc2cc1OCOc1c4c2ccc3ccccc34	ZINC000000187287	C4Oc3ccc2ccc1ccccc1c2c3O4
CC[N@@](CC2CCN(CCc1ccccc1C)CC2)Cc4nc3ccccc3n4C	ZINC000012205440	C2CN(CCc1ccccc1)CCC2CNCc4nc3ccccc3[nH]4
Cc2[nH]c1ccccc1c2[C@@H](Nc3cccc(F)c3)c4cccnc4	ZINC000000075405	N(C(c1cccnc1)c2c[nH]c3ccccc23)c4ccccc4
O=c2[nH]c1ccccc1n2C3=CCNCC3	ZINC000000394330	O=c2[nH]c1ccccc1n2C3=CCNCC3
CC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c2ccc(F)cc2	ZINC000000038793	O2C=CC(c1ccccc1)C=C2
C3CN=C(Cc2ccc1OCOc1c2)N3	ZINC000000009671	C3CN=C(Cc2ccc1OCOc1c2)N3
Cc3ccc2OC(C)(C)[C@H](O)[C@@H](N1CCCC1=O)c2c3	ZINC000000009677	O=C1CCCN1C2CCOc3ccccc23
C[N+]3(CC[N+]1(C)CCC[C@@H]1c2cccnc2)CCC[C@@H]3c4cccnc4	ZINC000003953809	C4CC(c1cccnc1)N(CCN2CCCC2c3cccnc3)C4
COCc1cc(C)nc(SCC[N+](C)(C)CC=C)c1C#N	ZINC000000095233	c1ccncc1
OCCn1c(N(=O)=O)cnc1c2ccc(F)cc2	ZINC000000001466	c2ccc(c1ncc[nH]1)cc2
Cc2[nH]c1ccc(N(=O)=O)cc1c2C=O	ZINC000000058616	c2ccc1[nH]ccc1c2
CCN(C4CCN(C[C@H]2C[N@@](Cc1ccccc1)C[C@@H]2c3ccccc3)CC4)C(=O)OCc5ccccc5	ZINC000026653511	O=C(NC4CCN(CC2CN(Cc1ccccc1)CC2c3ccccc3)CC4)OCc5ccccc5
CC(C)Nc2ncc1CC(=O)N(C)c1n2	ZINC000000004103	O=C2Cc1cncnc1N2
Cc2cc(C(=O)NC1CC(C)(C)NC(C)(C)C1)ccc2N(=O)=O	ZINC000000315802	O=C(NC1CCNCC1)c2ccccc2
CN4CCN(c3cc2n(C1CC1)cc(C(O)=O)c(=O)c2cc3N)CC4	ZINC000000008476	O=c3ccn(C1CC1)c4cc(N2CCNCC2)ccc34
COC(=O)c1cc(C[N+](C)(C)C[C@@H](O)CO)c(Cl)cc1Cl	ZINC000000305674	c1ccccc1
COC(=O)c1sc(SC)c(C#N)c1c2ccc(Cl)cc2	ZINC000000095303	c2ccc(c1ccsc1)cc2
COCc2cccc(C(=O)N1CCCCC1)c2	ZINC000000021774	O=C(N1CCCCC1)c2ccccc2
Cc1cccc[n+]1CCC(N)=O	ZINC000000393588	c1ccncc1
COc3ccc(S(=O)(=O)n1cnc2cc(C)c(C)cc12)cc3C	ZINC000000036222	O=S(=O)(c1ccccc1)n2cnc3ccccc23
CNC(=O)Nc1ccccc1F	ZINC000000039688	c1ccccc1
CCN(CC)C(=O)c1ccc[n+](CCC(N)=O)c1	ZINC000000393587	c1ccncc1
Cc3ccc(c2n/c(=C/c1ccc(F)cc1)c(=O)o2)cc3N(=O)=O	ZINC000000060086	O=c2oc(c1ccccc1)nc2=Cc3ccccc3
COc2ccc1CCCC(=O)Nc1c2	ZINC000000040405	O=C2CCCc1ccccc1N2
C[C@@H]1CCC[C@@H](C)N1CCN(CCC(=O)N2CCNCC2)S(=O)(=O)c3ccccc3	ZINC000045945500	O=C(CCN(CCN1CCCCC1)S(=O)(=O)c2ccccc2)N3CCNCC3
CCC(=O)N([C@H](C)CN1CCCCC1)c2ccccc2	ZINC000000000604	C2CCN(CCNc1ccccc1)CC2
CC1(C)CC3(CC(C)(C)N1)OC(=O)N(Cc2ccccn2)[C@@]3(C)O	ZINC000000036895	O=C2OC1(CCNCC1)CN2Cc3ccccn3
Cc2oc1CCCCc1c2C(=O)NCc3cc(C(O)=O)co3	ZINC000000036321	O=C(NCc1ccco1)c3coc2CCCCc23
NC(=O)CNC(=O)c1ccccc1	ZINC000000039846	c1ccccc1
C[C@H]1CCCC[N@]1CCN(CCC(=O)N2CCNCC2)C(=O)c3ccc(NC(C)=O)cc3	ZINC000035422029	O=C(CCN(CCN1CCCCC1)C(=O)c2ccccc2)N3CCNCC3
Cc2cc(c1onc(C)c1C(O)=O)no2	ZINC000000122214	c2cc(c1ccon1)on2
COc4ccc3[C@@H]2C[C@H]1[C@H](CCCN1S(C)(=O)=O)C[N@]2CCc3c4	ZINC000000597368	C4CNC3CC1N(CCc2ccccc12)CC3C4
COCC1(CN)CC1	ZINC000019091823	C1CC1
CN1CCN(NC(=O)/C=C/C(O)=O)CC1	ZINC000002086385	C1CNCCN1
C[C@H]1NCCO[C@@H]1c2ccccc2	ZINC000000000609	C2COC(c1ccccc1)CN2
Cc1ccccc1CN4CCC(C[N@@](C[C@@H]2CCCO2)Cc3ccoc3)CC4	ZINC000012457510	C4COC(CN(CC2CCN(Cc1ccccc1)CC2)Cc3ccoc3)C4
CN(C)CCN(C)n2cc(c1ccccc1)c3ccccc23	ZINC000000001032	c3ccc(c1c[nH]c2ccccc12)cc3
CNc2oc(c1ccc(C)cc1)nc2C#N	ZINC000000050670	c2ccc(c1ncco1)cc2
O=c2n(CCCN1CCCCC1)c(=S)[nH]c3ccccc23	ZINC000000425053	O=c2n(CCCN1CCCCC1)c(=S)[nH]c3ccccc23
O=c2[nH]ccc(c1ccco1)c2C#N	ZINC000000170324	O=c2cc(c1ccco1)cc[nH]2
NC(=N)Nc2ccc(C(=O)Nc1cnccn1)cc2	ZINC000000011213	O=C(Nc1cnccn1)c2ccccc2
C(NCc2cccc(OCc1ccccc1)c2)c3cccnc3	ZINC000000359775	C(NCc2cccc(OCc1ccccc1)c2)c3cccnc3
O[C@@H]3C=C5CCN4Cc2cc1OCOc1cc2[C@H]([C@H]3O)[C@@H]45	ZINC000000000024	C5Oc4cc3CN1CCC2=CCCC(C12)c3cc4O5
O[C@@]3(CC(=O)c1ccc(Br)cc1)C(=O)Nc2ccccc23	ZINC000000045536	O=C(CC1C(=O)Nc2ccccc12)c3ccccc3
Nc4ccc(C(=O)N1C[C@@H]3C[C@H](C1)C[N@@](Cc2ccccc2)C3)cc4	ZINC000000004748	O=C(N3CC2CC(CN(Cc1ccccc1)C2)C3)c4ccccc4
C4CN(c2nc1ccccc1n2Cc3ccccc3)CCN4	ZINC000000007943	C4CN(c2nc1ccccc1n2Cc3ccccc3)CCN4
COc4ccc([C@H](O)c3c(CN1CCCCC1)c2ccccc2n3C)cc4	ZINC000000633503	C4CCN(Cc2c(Cc1ccccc1)[nH]c3ccccc23)CC4
Nc1nccc[n+]1Cc2ccccc2	ZINC000000392299	C(c1ccccc1)[n+]2cccnc2
N=c2ccn(Cc1ccccc1)cc2	ZINC000000059391	N=c2ccn(Cc1ccccc1)cc2
CC(C)[C@@H]1CN(C(C)=O)CCN1	ZINC000062566484	C1CNCCN1
NCCCOc1ccccc1	ZINC000001654079	c1ccccc1
Cc3cc(C)[n+]2nc(N)c1ccccc1c2n3	ZINC000000392294	c1ccc2c(c1)cn[n+]3cccnc23
Cc4sc(NC(=O)c1ccco1)c([C@@H](N2CCCCC2)c3ccccn3)c4C	ZINC000000630637	O=C(Nc1sccc1C(N2CCCCC2)c3ccccn3)c4ccco4
COc2ccc(CNCc1ccc(F)cc1)c(OC)c2	ZINC000000172162	C(NCc1ccccc1)c2ccccc2
CCOC(=O)C(=NNc2ccc1[nH]c(C)nc1c2)C#N	ZINC000000352450	c2ccc1[nH]cnc1c2
CCN(CC)CC(=O)n2c1ccccc1sc3ccc(Cl)cc23	ZINC000000076010	c3ccc2sc1ccccc1[nH]c2c3
COc3cc([C@@H]1NC(=O)N(C)C2=C1C(=O)CCC2)cc(OC)c3OC	ZINC000000067209	O=C3NC(c1ccccc1)C2=C(CCCC2=O)N3
COc4ccc(c2nc1ccccn1c2NCCc3ccccc3)cc4	ZINC000000413887	C(Cc1ccccc1)Nc3c(c2ccccc2)nc4ccccn34
CC(=C)Cc3c(C)c(C#N)c2nc1ccccc1n2c3n4ccnc4C	ZINC000000544647	c1ccc4c(c1)nc3cccc(n2ccnc2)n34
COc1ccc(Cl)cc1NC(=O)[C@@H](C)Oc2ccccc2	ZINC000000030654	O=C(COc1ccccc1)Nc2ccccc2
O=C2CS[C@@H](c1ccccc1)N2c3ccccc3	ZINC000000067206	O=C2CSC(c1ccccc1)N2c3ccccc3
CN4CCN(c2ncnc3n(Cc1ccccc1Cl)nnc23)CC4	ZINC000000159225	C4CN(c2ncnc3n(Cc1ccccc1)nnc23)CCN4
O=CN2CCc1scc[n+]1c3ccccc23	ZINC000000384202	C3Cc1scc[n+]1c2ccccc2N3
CN(C)CCNc2ncnc3scc(c1ccccc1)c23	ZINC000000066501	c3ccc(c1csc2ncncc12)cc3
OC(=O)[C@@H]2CN[C@H](c1cc(Cl)ccc1O)S2	ZINC000000031872	C2CSC(c1ccccc1)N2
CN4CCC[C@@H](C(=O)NCCc2nnc3CC[N@@](Cc1cc(C)cc(C)c1)CCn23)C4	ZINC000014881350	O=C(NCCc2nnc3CCN(Cc1ccccc1)CCn23)C4CCCNC4
CN(C)CCCn1c(=O)n(C)c(=O)c2nc[nH]c12	ZINC000000485556	O=c2[nH]c(=O)c1nc[nH]c1[nH]2
COc3cc2CCn1c(cc(OCCN(C)C)nc1=O)c2cc3OC	ZINC000000490931	O=c3nccc2c1ccccc1CCn23
CC(=O)Cn1ccccc1=S	ZINC000000051658	S=c1cccc[nH]1
CCC3CCC(N2CCN(c1ccc(Cl)cc1)CC2)CC3	ZINC000000212517	C3CCC(N2CCN(c1ccccc1)CC2)CC3
CC[N@]1CCc2c(C1)c(O)[nH]c(=O)c2C#N	ZINC000002260762	O=c2cc1CCNCc1c[nH]2
CSc1nnc(SC)n1NC(=N)c2cccc(C(F)(F)F)c2	ZINC000000119925	N=C(Nn1cnnc1)c2ccccc2
OCc1ccccc1O	ZINC000000002054	c1ccccc1
C[N@]1[C@H]4CC[C@@H]1CC(NC(=O)c2nn(C)c3ccccc23)C4	ZINC000000005747	O=C(NC1CC2CCC(C1)N2)c3n[nH]c4ccccc34
CCc3nn(C1CCCC1)c4C(=O)N(c2ccccc2C)CCc34	ZINC000000006988	O=C3N(c1ccccc1)CCc4cnn(C2CCCC2)c34
COc3ccc(c2nc1cccc(C)n1c2NCCC(C)C)cc3	ZINC000000417141	c3ccc(c2cn1ccccc1n2)cc3
COc3ccc(CCN2CCC(C[N@@](C)Cc1[nH]cnc1C)CC2)cc3	ZINC000011663213	C2CN(CCc1ccccc1)CCC2CNCc3cnc[nH]3
C[C@@H](N)Cc1cccc(O)c1	ZINC000000000338	c1ccccc1
CCCN(CCC)C2Cc1cc(OC)c(OC)cc1C2	ZINC000000007459	C2Cc1ccccc1C2
CCN3CCC(N[C@H]2CN(CCc1ccc(OC)cc1)C(=O)C2)CC3	ZINC000011661101	O=C2CC(NC1CCNCC1)CN2CCc3ccccc3
Cc1ccc(C)n1n4c(C)nc3scc(c2cccs2)c3c4=O	ZINC000000091911	O=c3n(n1cccc1)cnc4scc(c2cccs2)c34
CC(=O)Nc2ccc(OCC[n+]1cccc(C(N)=O)c1)cc2	ZINC000000297622	C(C[n+]1ccccc1)Oc2ccccc2
Clc2ccc(NC(=O)C1CC1)nc2	ZINC000000053249	O=C(Nc1ccccn1)C2CC2
COC(=O)c2cc(c1ccccc1OC)on2	ZINC000000037052	c2ccc(c1ccno1)cc2
COC(=O)c2cc(c1ccccc1OC)[nH]n2	ZINC000000037051	c2ccc(c1ccn[nH]1)cc2
Clc1cccc(Cl)c1Cn2cnc(N(=O)=O)c2	ZINC000000037050	C(c1ccccc1)n2ccnc2
Cc2cc(N(CCO)CCO)nc(NCc1ccccc1)n2	ZINC000000378400	C(Nc1ncccn1)c2ccccc2
OC(=O)CSc2nc1ccccc1[nH]2	ZINC000000060423	c2ccc1[nH]cnc1c2
CC[C@@H](CO)NC(C)C	ZINC000001681251	nonring
Oc3ccc(N2C[C@H](C(=O)NCc1ccc(Cl)cc1)CC2=O)cc3	ZINC000000087967	O=C2CC(C(=O)NCc1ccccc1)CN2c3ccccc3
C[C@@H](C[N+]1(C)CCCCC1)OC(=O)CCCCC(=O)O[C@@H](C)C[N+]2(C)CCCCC2	ZINC000005527855	O=C(CCCCC(=O)OCCN1CCCCC1)OCCN2CCCCC2
CC(C)N4CCC(CC(=O)N3CC[C@@]2(CCC[N@@](CC1CCCCC1)C2)C3)CC4	ZINC000011935035	O=C(CC1CCNCC1)N4CCC3(CCCN(CC2CCCCC2)C3)C4
Cc2csc(NC(=O)Nc1cccnc1)n2	ZINC000000040061	O=C(Nc1cccnc1)Nc2nccs2
ClCC2=Nc1ccccc1Cc3ccccc23	ZINC000000330382	C2c1ccccc1C=Nc3ccccc23
OC(c1ccc(F)cc1)c2ccc(F)cc2	ZINC000000056553	C(c1ccccc1)c2ccccc2
Fc3ccc(N2C[C@H](C(=O)Nc1cccc(Cl)c1)CC2=O)cc3	ZINC000000043045	O=C2CC(C(=O)Nc1ccccc1)CN2c3ccccc3
COc5cccc(C[N@]4CCCN(c3nc(CN2CCN(C1CCCCC1)CC2)cc(=O)[nH]3)CC4)c5OC	ZINC000035926884	O=c5cc(CN2CCN(C1CCCCC1)CC2)nc(N4CCCN(Cc3ccccc3)CC4)[nH]5
CN2CCN(C(=O)c1ccc(N(C)S(C)(=O)=O)cc1)CC2	ZINC000000479707	O=C(N1CCNCC1)c2ccccc2
Brc3cccc(CNC2CCN(CCc1ccccc1)CC2)c3	ZINC000000757079	C2CN(CCc1ccccc1)CCC2NCc3ccccc3
NCc1ccc(Cl)cc1	ZINC000000157594	c1ccccc1
COc3cccc(c2nc1ccc(Cl)cn1c2NC(C)(C)C)c3	ZINC000000320279	c3ccc(c2cn1ccccc1n2)cc3
Clc3ccc(N2CCN(C/C=C/c1ccccc1)CC2)nn3	ZINC000000001634	C2CN(c1cccnn1)CCN2CC=Cc3ccccc3
c3ccc(c1nccnc1c2ccccc2)cc3	ZINC000000102690	c3ccc(c1nccnc1c2ccccc2)cc3
C[C@H](NC(=O)c2sc1ccccc1c2Cl)c3ccccc3	ZINC000000043048	O=C(NCc1ccccc1)c3cc2ccccc2s3
OCc3cc(=O)c(O)c([C@@H](Nc1ncccn1)c2ccc(F)cc2)o3	ZINC000000038255	O=c3ccoc(C(Nc1ncccn1)c2ccccc2)c3
CN(C/C=C/C(C[N@@](C)Cc1cccc2ccccc12)=C\C#CC(C)(C)C)Cc3cccc4ccccc34	ZINC000077313330	C=C(CNCc1cccc2ccccc12)C=CCNCc3cccc4ccccc34
CN(C)CCCN(CCCN(C)C)Cc1ccc(Cl)cc1Cl	ZINC000002489847	c1ccccc1
Clc1ccccc1Cn3cc2[nH]cccc2c3=O	ZINC000000003002	O=c2n(Cc1ccccc1)cc3[nH]cccc23
COC(=O)CNC(=O)c1c(C)onc1c2c(Cl)cccc2Cl	ZINC000000116992	c2ccc(c1ccon1)cc2
CN(CCN(C)/N=C/c1ccc(N(C)C)cc1)/N=C/c2ccc(N(C)C)cc2	ZINC000002898510	C(CNN=Cc1ccccc1)NN=Cc2ccccc2
COc3ccc2Cc1ccn(C[C@H](C)N)c1c2c3	ZINC000000020046	C2c1ccccc1c3[nH]ccc23
COc2ccc(CCNC(=O)CN1CCC(C)CC1)cc2OC	ZINC000000038258	O=C(CN1CCCCC1)NCCc2ccccc2
Cc2cccc(NC1=NCCN1)c2C	ZINC000000007221	C2CN=C(Nc1ccccc1)N2
CCOC(=O)c1c(C)[nH]c2ccc(O)cc12	ZINC000000034675	c2ccc1[nH]ccc1c2
O=C(N4CCN(C2C1CC3CC(C1)CC2C3)CC4)c5ccccc5	ZINC000000433494	O=C(N4CCN(C2C1CC3CC(C1)CC2C3)CC4)c5ccccc5
C1NCc2ncccc12	ZINC000004203917	C1NCc2ncccc12
C(c1cccnc1)n2cccc2	ZINC000000074128	C(c1cccnc1)n2cccc2
Cc2nc1ccccc1nc(C)c2=NOCc3ccc(C#N)cc3	ZINC000000033650	C(ON=c2cnc1ccccc1nc2)c3ccccc3
O=S1(=O)Nc2cccc3cccc1c23	ZINC000000120030	O=S1(=O)Nc2cccc3cccc1c23
S=C2CO[C@@H](c1ccccc1)N2c3ccccc3	ZINC000000081112	S=C2COC(c1ccccc1)N2c3ccccc3
C[N@@](Cc1ccccc1)C3CCN(Cc2cccnc2)CC3	ZINC000000317333	C2CN(Cc1cccnc1)CCC2NCc3ccccc3
Cc1ncc(N(=O)=O)n1CCc2ccncc2	ZINC000000001882	C(Cn1ccnc1)c2ccncc2
C[C@@H](CCN(C)C)N(C)C	ZINC000000404465	nonring
COc4ccc3nc1cc(Cl)ccc1c(Nc2ccc(O)c(CNCCO)c2)c3c4	ZINC000004830978	N(c1ccccc1)c3c2ccccc2nc4ccccc34
COc3ccc(Cc2c(N)nc(c1ccccc1)nc2N)cc3	ZINC000000169674	C(c1ccccc1)c3cnc(c2ccccc2)nc3
COc2ccc(C(=O)C1CC(C)(C)NC(C)(C)C1)cc2OC	ZINC000000323997	O=C(C1CCNCC1)c2ccccc2
O=C(NCc1cccnc1)\C=C\c3ccc(c2ccccc2)cc3	ZINC000000061917	O=C(NCc1cccnc1)C=Cc3ccc(c2ccccc2)cc3
CCN(CC)CCN2C(=O)CN=C(c1ccccc1F)c3cc(Cl)ccc23	ZINC000000537752	O=C3CN=C(c1ccccc1)c2ccccc2N3
CN4CCN(c2ncnc3sc(C)c(c1ccccc1)c23)CC4	ZINC000000038310	C4CN(c2ncnc3scc(c1ccccc1)c23)CCN4
C=CCc2cccc3cc(C(=O)Nc1ccccc1)c(=O)oc23	ZINC000000050816	O=C(Nc1ccccc1)c3cc2ccccc2oc3=O
COC(=O)c1ccccc1OCc2ccc(N(=O)=O)cc2	ZINC000000031301	C(Oc1ccccc1)c2ccccc2
CCn1nccc1CNC	ZINC000000034156	c1cn[nH]c1
CCCC[N@@](CCCNC(=O)C1=C(C)C(=O)OC13CCN(Cc2ccccc2)CC3)Cc4ccccc4	ZINC000020531719	O=C4OC2(CCN(Cc1ccccc1)CC2)C(C(=O)NCCCNCc3ccccc3)=C4
OCC[C@@H]1CCCCN1	ZINC000000157541	C1CCNCC1
NCc1ccc(C(F)(F)F)nc1	ZINC000000154410	c1ccncc1
Clc3ccc(S[C@H](NC(=O)c1ccco1)C(=O)c2ccccc2)cc3	ZINC000000623004	O=C(NC(Sc1ccccc1)C(=O)c2ccccc2)c3ccco3
COc1ccc(C)cc1NC(=O)c2ccc(OC(C)=O)cc2	ZINC000000030277	O=C(Nc1ccccc1)c2ccccc2
CCN(CC)c2ccc(Nc1[nH]c(=O)nnc1C)cc2	ZINC000000114347	O=c2nncc(Nc1ccccc1)[nH]2
CCc2ccc(NC(=O)c1cccs1)cc2	ZINC000000029172	O=C(Nc1ccccc1)c2cccs2
COc2cc(CSC1=NCCN1)cc(OC)c2OC	ZINC000000137632	C2CN=C(SCc1ccccc1)N2
C[C@H]1CC(C)=C[C@H](C)[C@@H]1COC(=O)CN2CCCC2	ZINC000000171958	O=C(CN1CCCC1)OCC2CCC=CC2
NC(=O)N(O)[C@@H]2CCc3cc(Oc1ccccc1)ccc23	ZINC000000015062	C3Cc2ccc(Oc1ccccc1)cc2C3
CN[C@H]1Cc2cccc3[nH]c(=O)n(C1)c23	ZINC000000007049	O=c1[nH]c3cccc2CCCn1c23
CC(C)N1CC[C@@H](O)N1C(=O)CC#N	ZINC000000039920	C1CNNC1
CC[N+](C)(C)CC/C=C2\[C@H]1C=C(Cl)C=C[C@H]1Sc3ccccc23	ZINC000000522534	C=C2C1C=CC=CC1Sc3ccccc23
C[C@H]1CC(C)=C[C@@H](C)C13COC(CN2CCCCC2)OC3	ZINC000000238659	C3CCN(CC2OCC1(CCC=CC1)CO2)CC3
Clc1cccc(S(=O)(=O)CC#N)c1	ZINC000000095930	c1ccccc1
Fc5ccc(C(CCCN1CCC3(CC1)N(c2ccccc2)CNC3=O)c4ccc(F)cc4)cc5	ZINC000000537755	O=C2NCN(c1ccccc1)C25CCN(CCCC(c3ccccc3)c4ccccc4)CC5
Clc4ccc3[n+](Cc1cccc2ccccc12)csc3c4	ZINC000000272793	C(c1cccc2ccccc12)[n+]3csc4ccccc34
CCN3CCN(C(=O)CCC2CCN(CC[C@@H](C)c1ccc(C)o1)CC2)CC3	ZINC000011773169	O=C(CCC2CCN(CCCc1ccco1)CC2)N3CCNCC3
Cc3ccc2[nH]c1[C@@H](N)CCCc1c2c3	ZINC000000190426	C1CCc2c(C1)[nH]c3ccccc23
NCCCCCCc5ccc(NC(=O)Nc4ccc(Nc2c1ccccc1nc3ccccc23)cc4)cc5	ZINC000026846519	O=C(Nc1ccccc1)Nc5ccc(Nc3c2ccccc2nc4ccccc34)cc5
NC(=N)NCc2nn(Cc1ccccc1)c(=O)c3ccccc23	ZINC000000502110	O=c2n(Cc1ccccc1)ncc3ccccc23
Cc3cc(C)[n+]2cc(c1ccc(Br)cc1)sc2n3	ZINC000000391779	c3ccc(c2c[n+]1cccnc1s2)cc3
COc3c(C)c(C[N@@](CCNc1ccnc2cc(Cl)ccc12)CC(C)(C)C)c(OC)c4ccccc34	ZINC000029134945	C(CNc1ccnc2ccccc12)NCc4ccc3ccccc3c4
NC(=N)CCc1ccccc1	ZINC000001664249	c1ccccc1
NC(=N)Nc8ccc7[nH]c6[C@@H]2Oc4c(O)ccc3C[C@H]5[N@](CC1CC1)CC[C@@]2(c34)[C@@]5(O)Cc6c7c8	ZINC000003941269	C1CC1CN6CCC48C5Cc2c([nH]c3ccccc23)C4Oc7cccc(CC56)c78
COc3ccc(\C=c2/nc(c1cccs1)oc2=O)c(OC)c3OC	ZINC000000103566	O=c2oc(c1cccs1)nc2=Cc3ccccc3
CCOC(=O)c3ccc2nc(C)cc(Nc1ccc(O)cc1)c2c3	ZINC000000081069	N(c1ccccc1)c2ccnc3ccccc23
C[C@@]12CC[C@@](CN)(CC(=O)C1)O2	ZINC000003851598	O=C1CC2CCC(C1)O2
CC[C@H](N)C(=O)N[C@H]4[C@@H](CCN)CC[C@H]3CC[C@@H](C(=O)NC(c1ccccc1)c2ccccc2)N3C4=O	ZINC000039205347	O=C4CCCCC3CCC(C(=O)NC(c1ccccc1)c2ccccc2)N34
CCN(CC)C1=NCCN1	ZINC000001665440	C1CN=CN1
COc2ccc(NC(=O)CSc1nnc(C(F)(F)F)n1C)cc2	ZINC000000040931	O=C(CSc1nnc[nH]1)Nc2ccccc2
CC(=C)C(=O)N2[C@@H](c1ccccc1)COC2=O	ZINC000000040936	O=C2NC(c1ccccc1)CO2
CN(C[C@@H]2CCC[N@@](CCc1ccccc1C)C2)C(=O)CN3CCC(C(N)=O)CC3	ZINC000012314028	O=C(CN1CCCCC1)NCC3CCCN(CCc2ccccc2)C3
COC(=O)c1cnccc1N	ZINC000003880839	c1ccncc1
C[N+]3(CCOCc1ccccc1)CC[N+](C)(CCOCc2ccccc2)CC3	ZINC000005377571	C(CN2CCN(CCOCc1ccccc1)CC2)OCc3ccccc3
Cc1noc(C)c1COc3ccc2ccc(=O)oc2c3	ZINC000000038312	O=c3ccc2ccc(OCc1cnoc1)cc2o3
O=C(CCc1ccccc1)O[C@@H]2CN3CCC2CC3	ZINC000000203531	O=C(CCc1ccccc1)OC2CN3CCC2CC3
CN(C1CC(C)(C)N(C)C(C)(C)C1)C(=O)c2ccn[nH]2	ZINC000000034376	O=C(NC1CCNCC1)c2ccn[nH]2
Cc3ccc(C(=O)COc2ccc(NC(=O)c1ccccc1)cc2)cc3	ZINC000000107882	O=C(COc2ccc(NC(=O)c1ccccc1)cc2)c3ccccc3
O=C(N1CCc2ccccc12)c4ccc3OCOc3c4	ZINC000000030204	O=C(N1CCc2ccccc12)c4ccc3OCOc3c4
CC[C@H](C)CN3CCC([C@]2(Cc1ccc(F)cc1)NC(=O)N(CCCN(C)C)C2=O)CC3	ZINC000011997443	O=C3NC(=O)C(Cc1ccccc1)(C2CCNCC2)N3
Clc5ccc4c(NCCCN3CCN(CCCNCc1cccc2ccccc12)CC3)ccnc4c5	ZINC000027638586	C(CNCc1cccc2ccccc12)CN5CCN(CCCNc3ccnc4ccccc34)CC5
COC(=O)[C@@H]1CCC[N+](C)(C)C1	ZINC000002165320	C1CCNCC1
NCc2cc1OCOc1cc2n3cccc3	ZINC000000056382	C3Oc2ccc(n1cccc1)cc2O3
CCN(CC)C[C@H](O)c1ccccc1	ZINC000000399981	c1ccccc1
Cc2cc1CCCCc1n2c5ccc(C(=O)NCCCN4CCC(N3CCCCC3)CC4)cc5	ZINC000020532486	O=C(NCCCN2CCC(N1CCCCC1)CC2)c5ccc(n4ccc3CCCCc34)cc5
COc2cc(O)c1ccccc1c2OC	ZINC000000024657	c2ccc1ccccc1c2
Cc4cc(NCCCCCCNc1cc(C)[n+](C)c2c(C)c(Cl)ccc12)c3ccc(Cl)c(C)c3[n+]4C	ZINC000001663851	C(CCCNc1ccnc2ccccc12)CCNc3ccnc4ccccc34
CCC[N@@](CC1CC1)C2CCN(C(C)=O)CC2	ZINC000000213647	C2CC(NCC1CC1)CCN2
C[N+](C)(C)c1cccc(N)c1	ZINC000000403610	c1ccccc1
CN(C)c4ccc(c2nc1cc(C)ccn1c2NC[C@@H]3CCCO3)cc4	ZINC000000888795	C4COC(CNc2c(c1ccccc1)nc3ccccn23)C4
C[C@@H]2CN(C[C@@H]1CN(C)CCO1)CC[N@]2C[C@H](O)Cn3cccn3	ZINC000075133032	C(CN2CCN(CC1CNCCO1)CC2)Cn3cccn3
Nc2nc1ccccc1n2Cc3cccc4nonc34	ZINC000000190042	C(c1cccc2nonc12)n3cnc4ccccc34
CCN4CCN(c2c(C[N@@](CC(C)C)Cc1ccccc1C(F)(F)F)c(C)nn2c3cccc(F)c3)CC4	ZINC000034835959	C4CN(c2c(CNCc1ccccc1)cnn2c3ccccc3)CCN4
CC(C)N2CCC(N(C(C)C)C(=S)Nc1ccccc1C)CC2	ZINC000000261484	S=C(NC1CCNCC1)Nc2ccccc2
C[C@@H]1[C@H](C)C(=O)CC[N@]1CCO	ZINC000001076044	O=C1CCNCC1
CCN(CC)CC(=O)Nc1c(C)cccc1C(=O)OC	ZINC000000002197	c1ccccc1
C[N+](C)(C)CCBr	ZINC000001664800	nonring
COc2cc(Cc1cnc(N)nc1N)cc3C(C)=C(F)[C@](C)(CF)Nc23	ZINC000000603382	C3Nc2ccc(Cc1cncnc1)cc2C=C3
Oc5c(CN1CCCCC1)cc(C34CC2CC(CC(C2)C3)C4)cc5CN6CCCCC6	ZINC000005248451	C6CCN(Cc5cc(CN1CCCCC1)cc(C34CC2CC(CC(C2)C3)C4)c5)CC6
CCN(CC)c2ccc(\C=N\NC(=S)Nc1ccc(C)cc1)cc2	ZINC000000499170	S=C(NN=Cc1ccccc1)Nc2ccccc2
CC[N@]2CCC[C@H](N1C(=O)OC(C)(C)[C@@]1(C)O)C2	ZINC000000086219	O=C1OCCN1C2CCCNC2
C[C@@H](CN)n1nc(C)cc1C	ZINC000000818984	c1cn[nH]c1
CN(C)Cn1nnc2ccccc12	ZINC000000344382	c2ccc1[nH]nnc1c2
Cc2ccc(C(=O)Nc1ccccn1)cc2C	ZINC000000029951	O=C(Nc1ccccn1)c2ccccc2
CCOc4ccc(C(=O)C[n+]3ccc(c2cc[n+](CC(=O)c1ccc(OCC)cc1)cc2)cc3)cc4	ZINC000026441646	O=C(C[n+]3ccc(c2cc[n+](CC(=O)c1ccccc1)cc2)cc3)c4ccccc4
Clc4ccc(C=NNc3cn2c(nc1ccccc12)[nH][nH]3)cc4	ZINC000000366875	N(N=Cc1ccccc1)c4cn3c2ccccc2nc3[nH][nH]4
CN(C)CCN(C1CCN(C)CC1)C(=O)Cc2sc(C)nc2c3ccccc3	ZINC000012238200	O=C(Cc1scnc1c2ccccc2)NC3CCNCC3
Cc3cc(c2csc(Nc1ccc(C(O)=O)cc1)n2)ccc3F	ZINC000000070729	N(c1ccccc1)c3nc(c2ccccc2)cs3
CCOc2cc(C(=O)Nc1cc(C)on1)cc(OCC)c2OCC	ZINC000000031695	O=C(Nc1ccon1)c2ccccc2
Clc3ccc(c2noc(CN1CCCC1)n2)cc3	ZINC000000137850	C3CCN(Cc2nc(c1ccccc1)no2)C3
O=C2Nc1ccccc1C23OCCCO3	ZINC000000103411	O=C2Nc1ccccc1C23OCCCO3
O=S(=O)(NCc1ccccn1)c2ccccc2	ZINC000000029395	O=S(=O)(NCc1ccccn1)c2ccccc2
CCN3CCN(c2oc(COc1ccccc1)nc2C#N)CC3	ZINC000000108334	C3CN(c2cnc(COc1ccccc1)o2)CCN3
CCN(CC)c4ccc(\C=N\N3CCN(Cc1cccc2ccccc12)CC3)cc4	ZINC000019773146	C2CN(N=Cc1ccccc1)CCN2Cc3cccc4ccccc34
C[N+](C)(CCCCCC[N+](C)(C)C2c1ccccc1c3ccccc23)C5c4ccccc4c6ccccc56	ZINC000001566899	C(CCCNC2c1ccccc1c3ccccc23)CCNC5c4ccccc4c6ccccc56
COc4cccc(C(=O)NCc3ccc(c2nc1ccccc1s2)cc3)c4	ZINC000000624171	O=C(NCc3ccc(c2nc1ccccc1s2)cc3)c4ccccc4
Cn2c(Cn1cc(C(F)(F)F)ccc1=O)n[nH]c2=S	ZINC000000127015	O=c1ccccn1Cc2n[nH]c(=S)[nH]2
Nc3c(NCCN1CCCC1)c2ccccc2oc3=O	ZINC000000198777	O=c3cc(NCCN1CCCC1)c2ccccc2o3
Clc3ccc([C@@H](Cn1ccnc1)OCc2c(Cl)cccc2Cl)cc3	ZINC000000608006	C(OC(Cn1ccnc1)c2ccccc2)c3ccccc3
Cn2c[n+](Cc1ccccc1)cn2	ZINC000000401239	C(c1ccccc1)[n+]2cn[nH]c2
CCN(CC)CC(=O)NCC2(c1ccccc1)CCOCC2	ZINC000000185020	C2CC(c1ccccc1)CCO2
CC(C)CC[C@@]1(CCNCCCN(C)C)CCO[C@H](C(C)C)C1	ZINC000009530618	C1CCOCC1
OC4(c1ccc(Cl)cc1)CCN(Cn2nnc3ccccc23)CC4	ZINC000000118451	C3CN(Cn1nnc2ccccc12)CCC3c4ccccc4
COc3ccc(CN(C)C[C@@H]2CCC[N@@](CCc1ccccc1C)C2)cc3O	ZINC000012093422	C3CC(CNCc1ccccc1)CN(CCc2ccccc2)C3
Cc1[n+](N)cc2ccccn12	ZINC000000337479	c2ccn1cncc1c2
CC1(C)C[C@@H](CN)C(C)(C)N1O	ZINC000000409212	C1CCNC1
O=C(NN=c2cc[nH]c(Cc1ccccc1)n2)c3cccc(N(=O)=O)c3	ZINC000000054808	O=C(NN=c2cc[nH]c(Cc1ccccc1)n2)c3ccccc3
COc1ccc(C(N)=N)cc1	ZINC000000391171	c1ccccc1
Cn2cc(S(=O)(=O)NCc1ccco1)c(C(F)(F)F)n2	ZINC000000066174	O=S(=O)(NCc1ccco1)c2cn[nH]c2
C2CC(Cc1c[nH]cn1)CCN2	ZINC000000005777	C2CC(Cc1c[nH]cn1)CCN2
COc4ccc3nc1cc(Cl)ccc1c(Nc2ccc([C@@H](O)CCN(C)C)cc2)c3c4	ZINC000004830966	N(c1ccccc1)c3c2ccccc2nc4ccccc34
COC(=O)[C@@H]1CSC[C@@H]1N	ZINC000000005775	C1CCSC1
NC2(C(=O)c1ccccc1)CC2	ZINC000011630576	O=C(C1CC1)c2ccccc2
CCS(=O)(=O)c2ccc(O)c(NC(=O)COc1ccccc1)c2	ZINC000000045236	O=C(COc1ccccc1)Nc2ccccc2
Fc5ccc(N4COc3ccc2c1CCCc1c(=O)oc2c3C4)cc5	ZINC000000111698	O=c5oc3c2CN(c1ccccc1)COc2ccc3c4CCCc45
CC1(C)CC(O)(C#C)CC(C)(C)N1	ZINC000000062927	C1CCNCC1
CN(C)CCN(Cc1ccccc1)c2ccccc2	ZINC000000001425	C(Nc1ccccc1)c2ccccc2
COc4ccc([C@@H](N1CCC(C)CC1)c2c(C)[nH]c3ccccc23)cc4	ZINC000000072029	C4CCN(C(c1ccccc1)c2c[nH]c3ccccc23)CC4
CN(C)CCn2c(NCc1ccc(C)o1)nc3ccccc23	ZINC000000189120	C(Nc2nc1ccccc1[nH]2)c3ccco3
CC(C)c3cc(NCCN(C)C)n2c1ccccc1nc2c3C#N	ZINC000000551384	c1ccc3c(c1)nc2ccccn23
C[N@]1CCC[C@@H]1CC(C)=O	ZINC000000967784	C1CCNC1
CN4CCN(c2nc(C)nc3n(CCc1ccccc1)ncc23)CC4	ZINC000000082118	C4CN(c2ncnc3n(CCc1ccccc1)ncc23)CCN4
CC3(C)CC(Nc2ccc(Nc1ccccc1)cc2)CC(C)(C)N3	ZINC000000086102	C3CC(Nc2ccc(Nc1ccccc1)cc2)CCN3
Cc2ccc(C)[n+](CNC(=O)c1ccc(Cl)cc1Cl)c2	ZINC000000035221	O=C(NC[n+]1ccccc1)c2ccccc2
C[N+]2=C(C=CNc1ccccc1)OCC2	ZINC000000402555	C2CN=C(C=CNc1ccccc1)O2
O=C(Nc1ccccc1)Nc3ccc2ncccc2c3	ZINC000000018751	O=C(Nc1ccccc1)Nc3ccc2ncccc2c3
COc1cc(CNC(C)(C)C)ccc1OCC(=O)NC(C)(C)C	ZINC000000359906	c1ccccc1
O=C2C=CC[C@H]1[C@H]3CCC[N@]4CCC[C@H](CN12)[C@H]34	ZINC000000008712	O=C2C=CCC1C3CCCN4CCCC(CN12)C34
Nc2ccc1N=c3n(Cc1c2)c(=O)c4ccccc34	ZINC000000003827	O=c3n2Cc1ccccc1N=c2c4ccccc34
COc3ccc(NC(=S)Nc1ccccc1N2CCOCC2)cc3	ZINC000000111695	S=C(Nc1ccccc1)Nc2ccccc2N3CCOCC3
CCNC(=O)c1ccc(Cl)s1	ZINC000000027660	c1ccsc1
CC(C)NC[C@H](O)COc1cccc(C)c1OC[C@H](O)CNC(C)C	ZINC000004655700	c1ccccc1
CS(=O)(=O)c1ccc(C(O)=O)s1	ZINC000000109556	c1ccsc1
CC(C)C(=O)OC[C@H]1CCC[N@]2CCCC[C@H]12	ZINC000000035427	C2CCN1CCCCC1C2
CCCN3CCC([C@H](Cc1ccccc1)[N@@](CCOC)Cc2cccnc2)CC3	ZINC000012152881	C3CC(C(Cc1ccccc1)NCc2cccnc2)CCN3
O=c2[nH]cnc1CNCc12	ZINC000004879293	O=c2[nH]cnc1CNCc12
Cn4cc(C[N@](CC2CCN(C1CCCC1)CC2)C[C@@H]3CCCO3)cn4	ZINC000012300691	C4CCC(N3CCC(CN(CC1CCCO1)Cc2cn[nH]c2)CC3)C4
CNC(=O)c1ccc(OC(C)=O)cc1	ZINC000000049688	c1ccccc1
COC(CN[C@@H]1CCCc2c1[nH]c3ccc(C)cc23)OC	ZINC000000200163	C1CCc2c(C1)[nH]c3ccccc23
CN(C)CCOC(=O)c1ccco1	ZINC000000187994	c1ccoc1
CN5CCN(c4ccc(Nc2ncnc3sc1CCCCc1c23)cc4)CC5	ZINC000000754665	C1CCc4c(C1)sc5ncnc(Nc3ccc(N2CCNCC2)cc3)c45
COc2ccc1[n+](C)c(C)ccc1c2	ZINC000000281375	c2ccc1ncccc1c2
CN(C)C[C@H](O)Cn2c1ccccc1c3ccccc23	ZINC000000134434	c1ccc3c(c1)[nH]c2ccccc23
COc3ccc2oc(C(=O)c1ccc(F)cc1)c(NC(C)=O)c2c3	ZINC000000054946	O=C(c1ccccc1)c3cc2ccccc2o3
C[C@H]([C@@H](O)c1ccccc1)C(O)=O	ZINC000000164006	c1ccccc1
O=N(=O)c4ccc(c3csc(Nc2ccc1OCOc1c2)n3)cc4	ZINC000000064309	C4Oc3ccc(Nc2nc(c1ccccc1)cs2)cc3O4
COc4cccc5cc(c3nc2cc1ccccc1cc2[nH]3)c(=O)oc45	ZINC000000053662	O=c2oc1ccccc1cc2c5nc4cc3ccccc3cc4[nH]5
CNC(=O)c1ccccc1SCCC(O)=O	ZINC000000161522	c1ccccc1
O=C([C@@H]1CCCCN1)N3CCN(Cc2cccnc2)CC3	ZINC000000131107	O=C(C1CCCCN1)N3CCN(Cc2cccnc2)CC3
C[C@@H](NC(=O)CSc1nnc(N)s1)c2ccccc2	ZINC000000036089	O=C(CSc1nncs1)NCc2ccccc2
O=C(NCCCN2CCN(c1ncccn1)CC2)[C@]34CNC[C@H]3COC4	ZINC000653123680	O=C(NCCCN2CCN(c1ncccn1)CC2)C34CNCC3COC4
C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN	ZINC000000141845	c2ccc1[nH]ccc1c2
O[C@@H](CN[C@@H]1CN2CCC1CC2)COc3cccc4ccccc34	ZINC000000403736	C(CNC1CN2CCC1CC2)COc3cccc4ccccc34
CCN(CC)C[C@@H](O)COc1cc(C(F)(F)F)ccn1	ZINC000000117271	c1ccncc1
COCC(=O)N(C2CCN(CCc1ccccc1)CC2)c3ccccc3	ZINC000000585304	C2CN(CCc1ccccc1)CCC2Nc3ccccc3
CNC(=O)Nc1ccc(F)cc1Cl	ZINC000000039673	c1ccccc1
NC(=S)c1c(Cl)cncc1Cl	ZINC000000076577	c1ccncc1
CN(C)CCCNCC[C@@H](Cc1ccccc1Cl)[C@@H]2CCOC(C)(C)C2	ZINC000006662238	C2CC(CCc1ccccc1)CCO2
COc5ccc4C(c2ccc(OCCN1CCCC1)cc2)=C(c3ccccc3)CCc4c5	ZINC000000538045	C5CCN(CCOc4ccc(C2=C(c1ccccc1)CCc3ccccc23)cc4)C5
CCOC(=O)c2cnc1cccc[n+]1c2Cl	ZINC000000114978	c2cc[n+]1cccnc1c2
CCSC1=NCC(=O)N1c2ccccc2	ZINC000000022380	O=C1CN=CN1c2ccccc2
CN(C)CCCN(CCCN(C)C)C(=S)Nc1ccc(F)cc1	ZINC000003317519	c1ccccc1
NC(=O)N(O)CC1CCC1	ZINC000000018577	C1CCC1
CCn5ccc(=C/C=C(/C=C\c1cc[n+](CC)c2ccccc12)c3cc[n+](CC)c4ccccc34)cc5	ZINC000004583904	C(=Cc1ccnc2ccccc12)C(=CC=c3cc[nH]cc3)c4ccnc5ccccc45
CC(C)c2ccc(Nc1nnns1)cc2	ZINC000000071577	N(c1ccccc1)c2nnns2
CCN(CC2CCN(C1CCN(C)CC1)CC2)C(=O)c3csc(C(C)C)n3	ZINC000011764869	O=C(NCC2CCN(C1CCNCC1)CC2)c3cscn3
Cc2ccc(CCSc1ccc(Cl)c(Cl)c1)cn2	ZINC000000033218	C(Cc1cccnc1)Sc2ccccc2
Cc3ccc(OCc2nn1c(=O)c(C)nnc1s2)cc3	ZINC000000023890	O=c2cnnc3sc(COc1ccccc1)nn23
Cc1cc(Br)c(O)c2ncccc12	ZINC000000002170	c2ccc1ncccc1c2
C[N@]1CCc3c(C1)sc(NC(=S)Nc2ccccc2)c3C#N	ZINC000000156000	S=C(Nc1ccccc1)Nc3cc2CCNCc2s3
OC(=O)CNc1ccc(O)cc1	ZINC000000156001	c1ccccc1
CNC(=O)c3sc2nc(c1ccc(OC)c(OC)c1)ccc2c3N	ZINC000000125897	c3ccc(c2ccc1ccsc1n2)cc3
CC(C)(C)NC[C@H](O)COc1nsnc1N2CCOCC2	ZINC000000002176	C2CN(c1cnsn1)CCO2
C[C@@H](Cc1ccccc1)NCCCCN[C@@H](C)Cc2ccccc2	ZINC000003058782	C(CCNCCc1ccccc1)CNCCc2ccccc2
CN1CC[C@H](S)C1=N	ZINC000100182023	N=C1CCCN1
CC[N+]1(CC)CCOC(=O)C1	ZINC000001666126	O=C1CNCCO1
CC(=O)Nc1cn(C(C)=O)c(C)n1	ZINC000000052407	c1c[nH]cn1
CCOc3ccc(NC(=O)c2ccc(CSc1nnc(C)s1)cc2)cc3	ZINC000000624914	O=C(Nc1ccccc1)c3ccc(CSc2nncs2)cc3
C[C@H]1CNCCN1c2ccccc2	ZINC000000393936	C2CN(c1ccccc1)CCN2
COc4ccc(C3=NN[C@@H](c2cc1ccccc1nc2Cl)C3)cc4	ZINC000000047941	C3C(c2cnc1ccccc1c2)NN=C3c4ccccc4
COC(=O)c1c(C)c(C)sc1n2cnnn2	ZINC000000033695	c2csc(n1cnnn1)c2
CCN1C(=O)N(CCN(C)C)C(=O)C14CCN(Cc3cc2OCOc2cc3Cl)CC4	ZINC000014535722	O=C4NC(=O)C3(CCN(Cc2ccc1OCOc1c2)CC3)N4
CC(C)COc3ccc(NC(=S)Nc2ccc(c1ccccn1)cc2)cc3	ZINC000000538444	S=C(Nc1ccccc1)Nc3ccc(c2ccccn2)cc3
C[N+](C)(CCCCCC[N+](C)(C)CCCN2Cc1ccccc1C2=O)CCCN4Cc3ccccc3C4=O	ZINC000013808598	O=C3N(CCCNCCCCCCNCCCN2Cc1ccccc1C2=O)Cc4ccccc34
Cn3cnc2C[N@](C[C@H](O)c1ccc(Br)cc1)CCc23	ZINC000000408249	C(Cc1ccccc1)N3CCc2[nH]cnc2C3
Clc1ccccc1NC(=O)\C=C\c3ccc2OCOc2c3	ZINC000000064245	O=C(Nc1ccccc1)C=Cc3ccc2OCOc2c3
CCC(=O)N[C@H](c1ccc(N(C)C)cc1)c2c(O)ccc3ccccc23	ZINC000000446482	C(c1ccccc1)c2cccc3ccccc23
CCCc2nc1cc(C)c(C)cc1nc2C	ZINC000000090509	c2ccc1nccnc1c2
OC[C@@H]5CCC[N@@](Cc3c(C(=O)N2CCN(C1CCCCC1)CC2)nc4ccccn34)C5	ZINC000019222125	O=C(N2CCN(C1CCCCC1)CC2)c4nc3ccccn3c4CN5CCCCC5
CC(C)(C)c1ccc(C#N)cc1NC(=O)Nc2ccccc2	ZINC000000019971	O=C(Nc1ccccc1)Nc2ccccc2
C1NCC2CNCC1O2	ZINC000001701348	C1NCC2CNCC1O2
C1NCc2cnccc12	ZINC000004203918	C1NCc2cnccc12
CC(C)Cc2nc1c(C)cccn1c2NC(C)(C)CC(C)(C)C	ZINC000000320697	c2ccn1ccnc1c2
Clc3ccc(C(=O)CN2Cc1ccccc1C2=N)cc3	ZINC000000193567	N=C2N(CC(=O)c1ccccc1)Cc3ccccc23
Oc3ccc(C[C@@H]1NCCc2cc(O)c(O)cc12)cc3	ZINC000000000857	C3Cc1ccccc1C(Cc2ccccc2)N3
Cc2cc(C)c(NC(=O)COc1ccc(Cl)cc1)c(C)c2	ZINC000000038819	O=C(COc1ccccc1)Nc2ccccc2
C/C=C/CNc4nc(NC\C=C\C)nc(N3CCC(NC(c1ccc(F)cc1)c2ccc(F)cc2)CC3)n4	ZINC000013650728	C2CN(c1ncncn1)CCC2NC(c3ccccc3)c4ccccc4
OC[C@@H](O)CN1CCCCC1	ZINC000000407024	C1CCNCC1
O=C(NCCN1CCCCC1)c3[nH]nc2CCNCc23	ZINC000035936222	O=C(NCCN1CCCCC1)c3[nH]nc2CCNCc23
CN(C)CCN(Cc1cccs1)C(=S)Nc2ccc(C)c(C)c2	ZINC000000212619	S=C(NCc1cccs1)Nc2ccccc2
COc3ccc(C(=O)c2c(N)sc1C[N@](C)CCc12)cc3	ZINC000000155021	O=C(c1ccccc1)c3csc2CNCCc23
Cc2ccc1NC(=O)CSc1c2	ZINC000000058275	O=C2CSc1ccccc1N2
Cc3cc(=O)oc4cc(OCCN2CCN(c1ccc(Cl)c(Cl)c1)CC2)ccc34	ZINC000000628464	O=c4ccc3ccc(OCCN2CCN(c1ccccc1)CC2)cc3o4
NCCCC[C@H](N)C(=O)Nc3ccc(c2nc1ccccc1s2)cc3	ZINC000001655284	c3ccc(c2nc1ccccc1s2)cc3
C2C[C@H](COc1cccnc1)N2	ZINC000000018377	C2CC(COc1cccnc1)N2
C(CCNCc1cccc2ccccc12)CNCc3cccc4ccccc34	ZINC000002009822	C(CCNCc1cccc2ccccc12)CNCc3cccc4ccccc34
Cc2cc(C)c(S(=O)(=O)n1cncn1)c(C)c2	ZINC000000057617	O=S(=O)(c1ccccc1)n2cncn2
Cc4cc(NCCCCCCNc1cc(C)nc2ccc(N)cc12)c3cc(N)ccc3n4	ZINC000001727083	C(CCCNc1ccnc2ccccc12)CCNc3ccnc4ccccc34
O[C@@H](COc1cccc2ccccc12)C[N+]3(CC=C)CCOCC3	ZINC000000309672	C(COc1cccc2ccccc12)CN3CCOCC3
CCN(CC)[C@@H]4CCN(C(=O)c3coc(CN2CCN(Cc1ccccc1)CC2)n3)C4	ZINC000019226954	O=C(N1CCCC1)c4coc(CN3CCN(Cc2ccccc2)CC3)n4
Clc2c(C(=O)NC(=S)Nc1ccccc1)sc3ccccc23	ZINC000000095273	O=C(NC(=S)Nc1ccccc1)c3cc2ccccc2s3
CC(C)CN(CC(C)C)Cc1ccccc1N4CCN(C(=O)[C@@H]2C[N@](C(C)C)C[C@H]2c3ccc(Cl)cc3)CC4	ZINC000028959709	O=C(C1CNCC1c2ccccc2)N4CCN(c3ccccc3)CC4
CC1(C)NC(=N)NC(=N)N1OCc2ccc(Cl)c(Cl)c2	ZINC000000001180	N=C2NCN(OCc1ccccc1)C(=N)N2
CC(=O)C3=NN(c1ccccc1)[C@@H](c2cccs2)N3C(C)(C)C	ZINC000000051838	N2C=NN(c1ccccc1)C2c3cccs3
CN(Cc1ccccc1)C(=O)c2cccc(C)c2	ZINC000000029579	O=C(NCc1ccccc1)c2ccccc2
Cc2coc1ccccc1c2=O	ZINC000000001707	O=c1ccoc2ccccc12
CCc1c(C)c(C(O)=O)[nH]c1Cc2[nH]c(C)c(C(C)=O)c2C	ZINC000000053046	C(c1ccc[nH]1)c2ccc[nH]2
CN1C(=O)C[C@@H]2C[C@@]1(C)Oc3ccccc23	ZINC000000027947	O=C1CC2CC(N1)Oc3ccccc23
CC(C)CCN=NC(N)=N	ZINC000004804492	nonring
Cc1ccccc1OC[C@H](O)C[N@]2CCC=CC2	ZINC000000000794	C(COc1ccccc1)CN2CCC=CC2
C/C(C[N@]1CCC[C@@H](O)C1)=C/c2ccccc2	ZINC000000219408	C2CCN(CC=Cc1ccccc1)CC2
CNS(=O)(=O)c2cc(C(=O)NC[C@H]1CCC[N@@]1CC=C)c(OC)cc2N	ZINC000000607703	O=C(NCC1CCCN1)c2ccccc2
NC(=O)C4(N1CCCCC1)CCN(c3nc(c2ccccc2)cs3)CC4	ZINC000000717883	C4CCN(C3CCN(c2nc(c1ccccc1)cs2)CC3)CC4
Cc2nc(NC(=O)c1ccccc1Br)sc2C	ZINC000000035716	O=C(Nc1nccs1)c2ccccc2
Fc5ccc([C@@H]1C4=C(N=c2nc[nH]n12)c3ccccc3OC4)cc5	ZINC000000390138	C2Oc1ccccc1C5=C2C(c3ccccc3)n4[nH]cnc4=N5
Cc1cccc(Cl)c1NC(=O)CN	ZINC000000394100	c1ccccc1
Clc1ccc(N(=O)=O)cc1C(=O)Oc2cccc3cccnc23	ZINC000000068144	O=C(Oc1cccc2cccnc12)c3ccccc3
COc3ccc(C(Cl)=C(c1ccc(OCCN(C)C)cc1)c2ccc(OCCN(C)C)cc2)cc3	ZINC000001629226	C(=C(c1ccccc1)c2ccccc2)c3ccccc3
Cc2ccc(NC(=O)c1ccc(Cl)cc1Cl)nc2	ZINC000000036080	O=C(Nc1ccccn1)c2ccccc2
CC(C)[N+](C)(C)C[C@@H](O)COc1cccc2ccccc12	ZINC000000000653	c2ccc1ccccc1c2
COc2ccc(CNc1cc(C)ccn1)c(O)c2	ZINC000000049027	C(Nc1ccccn1)c2ccccc2
COc2ccc([C@@H]1NC(=O)NC(C)=C1C(=O)OCCC(C)C)cc2	ZINC000000044545	O=C2NC=CC(c1ccccc1)N2
NC(=S)c1ncn2CCC(=S)Nc12	ZINC000000007604	S=C2CCn1cncc1N2
CCCCN(CCCC)CCCCNc1c(C)cnc2cc(Cl)ccc12	ZINC000001712669	c2ccc1ncccc1c2
CC(C)(C)c2cc(CCC(=O)N1CCNCC1)c(C(C)(C)C)cc2O	ZINC000000197926	O=C(CCc1ccccc1)N2CCNCC2
CN2CCN(c1c[nH]c(=O)[nH]c1=O)CC2	ZINC000000216970	O=c2[nH]cc(N1CCNCC1)c(=O)[nH]2
COc3ccc(c2cc1ccccn1c2)cc3	ZINC000000060167	c3ccc(c2cc1ccccn1c2)cc3
C[N+]1(C)CCC[C@@H]1COC(=O)C(O)(c2ccccc2)c3ccccc3	ZINC000000000651	O=C(OCC1CCCN1)C(c2ccccc2)c3ccccc3
CN(C)C(=O)c1ccccc1C(=O)N(C)C	ZINC000000050259	c1ccccc1
C(=N\[n+]1ccccc1)/c2ccccc2	ZINC000000287791	C(=N[n+]1ccccc1)c2ccccc2
COc4ccc3CCC=C(CCCN2CCN(c1ccccc1OC)CC2)c3c4	ZINC000000598816	C(CN2CCN(c1ccccc1)CC2)CC3=CCCc4ccccc34
Brc2csc(Cc1c[nH]cn1)c2	ZINC000000022768	C(c1c[nH]cn1)c2cccs2
O=C2CS[C@@H]1CNCCN12	ZINC000012652465	O=C2CSC1CNCCN12
CCN(CC)CCn2c1ccccc1n3nc(C)c(C(C)=O)c23	ZINC000000266077	c1ccc3c(c1)[nH]c2ccnn23
CCCc3cc(OC)c(C[C@H]1[N@@](C)CCc2cc(Cl)c(O)cc12)cc3OC	ZINC000000598818	C3Cc1ccccc1C(Cc2ccccc2)N3
OC2CCN(C[C@H]1CCC=CC1)CC2	ZINC000000183295	C2CCN(CC1CCC=CC1)CC2
CCOC(N)=c1ccc(=O)cc1	ZINC000000056700	C=c1ccc(=O)cc1
CNC(=O)[C@@H]3C[C@@H](NC2CCN(CCc1ccccc1)CC2)CN3C5Cc4ccccc4C5	ZINC000020784011	C2CN(CCc1ccccc1)CCC2NC5CCN(C4Cc3ccccc3C4)C5
F[C@H]2CCCN(C1CNC1)C2	ZINC000098091279	C2CCN(C1CNC1)CC2
C4CCN(CCOc2nnc(c1ccccc1)c3ccccc23)CC4	ZINC000000532384	C4CCN(CCOc2nnc(c1ccccc1)c3ccccc23)CC4
Cn2c[n+](C[C@@H](O)COC[C@H]1CCC=CC1)c3ccccc23	ZINC000000098638	C(COCC1CCC=CC1)C[n+]2c[nH]c3ccccc23
CCCC[N@@](C)C[C@@H](C)O	ZINC000001634199	nonring
Oc3ccc(CN[C@@H]1CCC(=O)N[C@H]1c2cc(F)cc(F)c2)cc3CN4CCOCC4	ZINC000019293001	O=C4CCC(NCc2cccc(CN1CCOCC1)c2)C(c3ccccc3)N4
CCN(CC)CCOc2ccc1c(C)cc(OCCN(CC)CC)nc1n2	ZINC000004397533	c2cnc1ncccc1c2
CN3CCN(c2nc(c1ccco1)cc(C(F)(F)F)n2)CC3	ZINC000000213243	C3CN(c2nccc(c1ccco1)n2)CCN3
CCOc4ccc([N+]3=C1CCCCCN1[C@](O)(c2ccc(F)cc2)C3)cc4	ZINC000000624138	C4CCN3C(c1ccccc1)C[N+](c2ccccc2)=C3CC4
CC(C)Oc2ccc(NC(=O)COc1ccc(C(C)C)c(C)c1)cc2	ZINC000000144464	O=C(COc1ccccc1)Nc2ccccc2
CC(C)(C)[N@]1CC[C@@H]1C(N)=O	ZINC000001850256	C1CNC1
CCN(CC)CCSc2ccc1c(C)cc(SCCN(CC)CC)nc1n2	ZINC000004397534	c2cnc1ncccc1c2
FC(F)(F)c2cccc(C(=O)N[C@@H]1CCCCNC1=O)c2	ZINC000000005201	O=C1NCCCCC1NC(=O)c2ccccc2
CN(N)C1=NS(=O)(=O)c2ccccc12	ZINC000000039695	O=S2(=O)N=Cc1ccccc12
Cn2c(SCC(=O)Nc1ccc(F)cc1)nnc2c3cccnc3	ZINC000000117297	O=C(CSc2nnc(c1cccnc1)[nH]2)Nc3ccccc3
O=C(Nc2ccc(C(=O)OC1CCCCC1)cc2)c3cccs3	ZINC000000048133	O=C(Nc2ccc(C(=O)OC1CCCCC1)cc2)c3cccs3
COc3c1OCOc1cc2CC[N+](C)=Cc23	ZINC000000001216	C3Oc2cc1CCN=Cc1cc2O3
COc3ccc2nc1cc(Cl)ccc1c(NCCCCN(C)C)c2c3	ZINC000004769462	c3ccc2nc1ccccc1cc2c3
COc2cc(NC(=O)CCN1CCCCC1)cc(OC)c2	ZINC000000176426	O=C(CCN1CCCCC1)Nc2ccccc2
Cc2cc(CNC1CC(C)(C)NC(C)(C)C1)c(C)n2c4ccc3OCOc3c4	ZINC000007984382	C4CC(NCc3ccn(c2ccc1OCOc1c2)c3)CCN4
CN2C(=O)OC1(CC(C)(C)NC(C)(C)C1)[C@@]2(C)O	ZINC000000036887	O=C2NCC1(CCNCC1)O2
CC[C@](C)(OC(=O)c1ccccc1C(O)=O)C#C	ZINC000000000616	c1ccccc1
CC3(C)CC(NC(=O)c2ccc(n1cnnn1)cc2)CC(C)(C)N3	ZINC000000036884	O=C(NC1CCNCC1)c3ccc(n2cnnn2)cc3
CC[N@]1CCC[C@@H]1CNC(=O)c2cc(N)ccc2OC	ZINC000000347683	O=C(NCC1CCCN1)c2ccccc2
CCc3nc(C)nc(N2CCN(C(=O)C1CCCC1)CC2)c3Cc4ccc(Cl)cc4	ZINC000000697340	O=C(C1CCCC1)N4CCN(c2ncncc2Cc3ccccc3)CC4
CN(C1CC(C)(C)NC(C)(C)C1)C(=O)c2ccco2	ZINC000000036880	O=C(NC1CCNCC1)c2ccco2
CCN(CC)CCCNC(=S)N(CCN(CC)CC)Cc2cc1cc(OC)ccc1[nH]c2=O	ZINC000006193083	O=c2ccc1ccccc1[nH]2
Brc3cccc(N2C(=O)C[C@H](N1CCSCC1)C2=O)c3	ZINC000000705750	O=C2CC(N1CCSCC1)C(=O)N2c3ccccc3
O=N(=O)c4ccc3oc(=O)c(c2nc1ccccc1o2)cc3c4	ZINC000000034973	O=c2oc1ccccc1cc2c4nc3ccccc3o4
CN(C)[C@@H](CNC(=O)NC[C@H](N(C)C)c1ccccc1)c2ccccc2	ZINC000003300911	O=C(NCCc1ccccc1)NCCc2ccccc2
COc1ccc(OC)c2c(N)c(C#N)c(C(F)(F)C(F)(F)F)nc12	ZINC000000036339	c2ccc1ncccc1c2
COC(=O)CC1(CN(C)C)CCCCC1	ZINC000000158401	C1CCCCC1
COc1ccc(C=O)cc1CSC2=NCCS2	ZINC000000037201	C2CN=C(SCc1ccccc1)S2
OC(=O)[C@@H](Cl)Cc1cnc[nH]1	ZINC000001571549	c1c[nH]cn1
O=C(CN1CCCCCC1)Nc3sc2CCCCc2c3C#N	ZINC000000078276	O=C(CN1CCCCCC1)Nc3cc2CCCCc2s3
Fc4ccc(c2nnc3sc(c1ccc(N(=O)=O)cc1)nn23)cc4	ZINC000000048480	c4ccc(c3nn2c(c1ccccc1)nnc2s3)cc4
CCN(CC)CCn4c1ccccc1n5cc(c2cccc3ccccc23)nc45	ZINC000000716201	c5ccc4c(c1cn3c(n1)[nH]c2ccccc23)cccc4c5
CCN4CCN(c3cc(c1ccc(F)cc1)c2CCCCCCc2n3)CC4	ZINC000000597434	C1CCCc3c(CC1)nc(N2CCNCC2)cc3c4ccccc4
Cc3ccc(C#N)c(SCC(=O)c2cc1ccccc1oc2=O)n3	ZINC000000044152	O=C(CSc1ccccn1)c3cc2ccccc2oc3=O
COc3ccc(N2CCN(C1CCN(C(C)=O)CC1)CC2)cc3	ZINC000000212462	C3CC(N2CCN(c1ccccc1)CC2)CCN3
CC2=CC(C)(C)N(C(=O)CSc1nncn1C)c3ccccc23	ZINC000000075708	O=C(CSc1nnc[nH]1)N2CC=Cc3ccccc23
OCCN2CCC(CCCC1CCN(CCO)CC1)CC2	ZINC000000056418	C(CC1CCNCC1)CC2CCNCC2
CC[N+](CC)=c2scc(c1ccc(N(=O)=O)cc1)s2	ZINC000000265644	N=c2scc(c1ccccc1)s2
ON=c2[nH]c1ccc(OC(F)(F)F)cc1s2	ZINC000000021120	N=c2[nH]c1ccccc1s2
CC[N@]1CCC[C@H]1CNc3ncnc4c2cc(OC)ccc2[nH]c34	ZINC000000539022	C4CNC(CNc2ncnc3c1ccccc1[nH]c23)C4
OC5=C(C(=O)c1ccccc1)[C@@H](c2ccccc2Cl)N(CCc3c[nH]c4ccccc34)C5=O	ZINC000000626518	O=C3C=C(C(=O)c1ccccc1)C(c2ccccc2)N3CCc4c[nH]c5ccccc45
CCN5CCC(N4CCC(n1nccc1NC(=O)c3ccc2OCOc2c3)CC4)CC5	ZINC000015073320	O=C(Nc1ccnn1C3CCN(C2CCNCC2)CC3)c5ccc4OCOc4c5
CSc2oc(c1ccccc1)nc2S(=O)(=O)c3ccccc3	ZINC000000048316	O=S(=O)(c1ccccc1)c3coc(c2ccccc2)n3
C[N@@](CCO)C[C@@H](O)Cn2c1ccc(Br)cc1c3cc(Br)ccc23	ZINC000000626512	c1ccc3c(c1)[nH]c2ccccc23
O[C@H](C(O)=O)c1ccccc1	ZINC000000000036	c1ccccc1
C(Cc4cnc1ccccc1ncc(CCC[n+]2ccccc2)c[nH]c3ccccc3[nH]c4)C[n+]5ccccc5	ZINC000040619725	C(Cc4cnc1ccccc1ncc(CCC[n+]2ccccc2)c[nH]c3ccccc3[nH]c4)C[n+]5ccccc5
C[N@]1CCCCC[C@@H]1C(=O)N4CCC(N3CCC(C(=O)N2CCOCC2)CC3)CC4	ZINC000012581079	O=C(C3CCN(C2CCN(C(=O)C1CCCCCN1)CC2)CC3)N4CCOCC4
C[C@@H]2CCc1ccccc1N2C(=N)Nc3ccc(Cl)cc3	ZINC000000216154	N=C(Nc1ccccc1)N2CCCc3ccccc23
C[n+]1ccccc1C=O	ZINC000001740513	c1ccncc1
COc2ccc(C(O)=CC(=O)c1ccc(OC)cc1)cc2	ZINC000000036429	O=C(C=Cc1ccccc1)c2ccccc2
CCN(CC)CCN3[C@@H](c1ccc(F)cc1)Nc2ccccc2C3=O	ZINC000000484245	O=C2NC(c1ccccc1)Nc3ccccc23
Oc2cccc3Cc1cccc(O)c1C(=O)c23	ZINC000000001322	O=C2c1ccccc1Cc3ccccc23
CNC(=NC)c3ccc(NC(=O)c2ccc(\C=C/C(=O)Nc1ccc(C(/NC)=N\C)cc1)cc2)cc3	ZINC000004758070	O=C(Nc1ccccc1)C=Cc3ccc(C(=O)Nc2ccccc2)cc3
O=C(N1CCCCC1)c5cccc(C[N@]4CCN2[C@@H](COc3ccccc23)C4)c5	ZINC000000600835	O=C(N1CCCCC1)c5cccc(CN4CCN2C(COc3ccccc23)C4)c5
COc2cccc(NC(=S)N(C)C1CCN(C)CC1)c2	ZINC000000109220	S=C(NC1CCNCC1)Nc2ccccc2
COc2cc(CN(C)C1CCN(C)CC1)cc(OC)c2O	ZINC000000207008	C2CC(NCc1ccccc1)CCN2
O=C(CCN1CCCCC1)NC[C@@H]2OCCc3ccccc23	ZINC000000108691	O=C(CCN1CCCCC1)NCC2OCCc3ccccc23
CN3CCC[C@@H](C[N@@](CCc1ccccc1)Cc2ccc(C#CCCO)cc2)C3	ZINC000011815680	C3CNCC(CN(CCc1ccccc1)Cc2ccccc2)C3
CC(C)(C)NC[C@@H](O)COc1ccccc1OC[C@@H]2CCCO2	ZINC000000000101	C2COC(COc1ccccc1)C2
Cc1ccc(OC[C@H](O)CNC(C)(C)C)c2oc(=O)ccc12	ZINC000000000100	O=c2ccc1ccccc1o2
C5CCC(N4CCC(C[N@](C[C@@H]1CCCO1)Cc2cccn2c3ccccn3)CC4)C5	ZINC000011937997	C5CCC(N4CCC(CN(CC1CCCO1)Cc2cccn2c3ccccn3)CC4)C5
Cc1ccc(Cl)c(OC[C@@H](O)CNC(C)(C)C)c1	ZINC000000000106	c1ccccc1
COc2cccc(OC[C@@H](O)CN1C[C@@H](C)C[C@H](C)C1)c2	ZINC000000351489	C2CCN(CCCOc1ccccc1)CC2
CCOCCCNC2CCN(CCc1ccccc1)CC2	ZINC000004022706	C2CCN(CCc1ccccc1)CC2
Cc4ccc3occ(CN2CCC(N1CCCCC1)CC2)c(=O)c3c4	ZINC000000212267	O=c3c(CN2CCC(N1CCCCC1)CC2)coc4ccccc34
COCCN4CCC(C[N@@](C)Cc2c(C(=O)N1CCCCC1)nc3sccn23)CC4	ZINC000011936134	O=C(N1CCCCC1)c3nc2sccn2c3CNCC4CCNCC4
O/N=C/C(=O)NCCCNCCCNCc1ccccc1	ZINC000002245651	c1ccccc1
CC(C)NC(=O)c1cccc(Cl)c1	ZINC000000029717	c1ccccc1
NC(=O)C3CCN(Cc2nc(c1ccccc1)no2)CC3	ZINC000000200215	C3CCN(Cc2nc(c1ccccc1)no2)CC3
CC(C)Cc3nn2c(=N)c(=C/c1cccc(Cl)c1)/c(=O)nc2s3	ZINC000000121402	N=c2c(=Cc1ccccc1)c(=O)nc3scnn23
COc1cc(C[C@@H](C)N)c(OC)cc1Br	ZINC000000000092	c1ccccc1
COc2cc(OC)nc(C1CCNCC1)n2	ZINC000000154373	C2CC(c1ncccn1)CCN2
Cc3cc(=O)n2ncn(Cc1ccccc1)c2n3	ZINC000000051727	O=c2ccnc3n(Cc1ccccc1)cnn23
O=C(Nc2cnc1sccn1c2=O)Sc3ccccc3	ZINC000000033933	O=C(Nc2cnc1sccn1c2=O)Sc3ccccc3
O=C(N(Cc1ccccc1)c2cccc(N(=O)=O)c2)c3cccnc3	ZINC000000031848	O=C(N(Cc1ccccc1)c2ccccc2)c3cccnc3
CC2(C)COC1(CCOCC1)OC2	ZINC000000347913	C2COC1(CCOCC1)OC2
Cc1cccc(C)c1N(CC(=O)NC2CCCC2)S(C)(=O)=O	ZINC000000036538	O=C(CNc1ccccc1)NC2CCCC2
O[C@H]1[C@H]3CC[C@@H]1[C@@H](N2CCCC2)CC3	ZINC000000488157	C3CCN(C1CCC2CCC1C2)C3
CCc3nc(C)nc(N2CCN(C(=O)c1ccc(OC)cc1)CC2)c3Cc4cccc(F)c4	ZINC000000697933	O=C(N3CCN(c1ncncc1Cc2ccccc2)CC3)c4ccccc4
COc3ccc(CNCc2ccc1OCOc1c2)cc3OC	ZINC000000200718	C3Oc2ccc(CNCc1ccccc1)cc2O3
O[C@H](COc3cccc(CNCc1n[nH]c(=O)c2ccccc12)c3)CN4CCCCCC4	ZINC000011839212	O=c3[nH]nc(CNCc2cccc(OCCCN1CCCCCC1)c2)c4ccccc34
COc4ccc(O)c(C[N@]3CCC[C@@H](CCC(=O)N2CCN(Cc1ccccc1)CC2)C3)c4	ZINC000012206340	O=C(CCC2CCCN(Cc1ccccc1)C2)N4CCN(Cc3ccccc3)CC4
CN(C)[C@H]3CCN(C(=O)c1nn(C)c2ccccc12)C3	ZINC000000020610	O=C(N1CCCC1)c2n[nH]c3ccccc23
O[C@@H](COc1ccccc1CNCc3cc(c2ccccc2)n[nH]3)CN4CCCCC4	ZINC000011662318	C4CCN(CCCOc1ccccc1CNCc3cc(c2ccccc2)n[nH]3)CC4
CC(C)CC[C@@H](CCNCCCN(C)C)c1ccc(Cl)cc1	ZINC000006662015	c1ccccc1
CN2CCC(N(C)C(=S)NCCc1ccccc1)CC2	ZINC000000109209	S=C(NCCc1ccccc1)NC2CCNCC2
O=N(=O)c1ccc2c(c1)[nH]c(=O)c3nncn23	ZINC000000007118	O=c2[nH]c1ccccc1n3cnnc23
CCOCC[N+](C)(C)C	ZINC000001681602	nonring
COC(=O)[C@@H](Cc1ccc(O)c(O)c1)/N=C/c2ccc(N(C)C)cc2	ZINC000000517863	C(Cc1ccccc1)N=Cc2ccccc2
COc1ccccc1NC[C@@H](O)CN	ZINC000000191148	c1ccccc1
CC[N+](CC)(CC)CCC[N+](CC)(CC)CC	ZINC000001683757	nonring
CNCCCNCc2cc(Cl)c(OCc1c(F)cccc1Cl)c(OC)c2	ZINC000040720598	C(Oc1ccccc1)c2ccccc2
Fc1ccccc1Nc4nc(NC[C@H]2CCCO2)c3ccccc3n4	ZINC000000090358	C4COC(CNc2nc(Nc1ccccc1)nc3ccccc23)C4
Brc3ccc(C(=O)c2conc(c1ccco1)[nH]2)cc3	ZINC000000045554	O=C(c1ccccc1)c3conc(c2ccco2)[nH]3
CNCc1ccncc1	ZINC000000161991	c1ccncc1
Cc2cc(c1ccc(N)c(C)c1)ccc2N	ZINC000000056751	c2ccc(c1ccccc1)cc2
C[C@@H](CN(C)C)[C@@](O)(Cc1ccccc1)c2ccccc2	ZINC000000056564	C(Cc1ccccc1)c2ccccc2
CC(C)NC(=O)[C@H]1C[N@]2CC[C@@H]1C[C@@H]2Cn3cc(CN(C)C)nn3	ZINC000008297959	C1CN2CCC1CC2Cn3ccnn3
Cc2cc(/C=C/c1ccc(F)cc1)cc(C)c2O	ZINC000000010998	C(=Cc1ccccc1)c2ccccc2
COc3ccc(n2c(SCC(C)=C)nc1ccccc1c2=O)cc3	ZINC000000028534	O=c2n(c1ccccc1)cnc3ccccc23
COc2ccc(NC1=NCCOC1)cc2	ZINC000000225233	C2CN=C(Nc1ccccc1)CO2
Cc4ccc3nc(NC(=O)c1c(C)onc1c2ccccc2)sc3c4	ZINC000000081340	O=C(Nc2nc1ccccc1s2)c3conc3c4ccccc4
COc3ccc(CSCC(=O)NC1C[C@@H]2CC[C@H](C1)[N@]2C)cc3	ZINC000000136072	O=C(CSCc1ccccc1)NC2CC3CCC(C2)N3
CC(=O)c1cc(C(C)=O)c(C)[n+](C)c1C	ZINC000000501268	c1ccncc1
CCN(CCN(C)C)Cc1cc(OC)c(OC)cc1N(=O)=O	ZINC000000215958	c1ccccc1
CN3CCC(NC(=O)c1cn(C)c2ccccc12)CC3	ZINC000000109836	O=C(NC1CCNCC1)c2c[nH]c3ccccc23
Clc1ccc(N(=O)=O)cc1c3ccc(C=c2[nH]c(=S)[nH]c2=O)o3	ZINC000000071245	O=c1[nH]c(=S)[nH]c1=Cc3ccc(c2ccccc2)o3
COc3ccc(\C=c2/c(=O)[nH]c(=O)n(c1ccc(C)cc1)c2=O)cc3	ZINC000000063172	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)n2c3ccccc3
COc4ccc([C@@H]2C[C@@](C)(O)Oc3cc1OCOc1cc23)cc4	ZINC000000046811	C4CC(c1ccccc1)c3cc2OCOc2cc3O4
O=C(CSc2ncnc3n(c1ccccc1)ncc23)c4cccs4	ZINC000000790149	O=C(CSc2ncnc3n(c1ccccc1)ncc23)c4cccs4
O=C(C(C#N)c2nc1ccccc1s2)c3ccncc3	ZINC000000041635	O=C(Cc2nc1ccccc1s2)c3ccncc3
CN(C)CCC[C@H]2[C@H](O)c1cc(Cl)ccc1Sc3ccccc23	ZINC000000347704	C2Cc1ccccc1Sc3ccccc23
C[N@]1[C@H]3CC[C@@H]1CC(NS(=O)(=O)c2ccc(F)cc2)C3	ZINC000000135914	O=S(=O)(NC1CC2CCC(C1)N2)c3ccccc3
C2CC(c1ccccc1)CCC2N5CCC(N4CCN(c3ccccc3)CC4)CC5	ZINC000004561790	C2CC(c1ccccc1)CCC2N5CCC(N4CCN(c3ccccc3)CC4)CC5
CO[n+]2ccc(c1ccccc1)cc2	ZINC000000396183	c2ccc(c1ccncc1)cc2
Cn5c(c4ccc(C=NNC(=O)C(=O)NN=Cc3ccc(c2cn1ccccc1[n+]2C)cc3)cc4)c[n+]6ccccc56	ZINC000001585627	O=C(NN=Cc3ccc(c2cn1ccccc1n2)cc3)C(=O)NN=Cc6ccc(c5c[n+]4ccccc4[nH]5)cc6
COc2cc4CC[N@](C)[C@H]3Cc1ccccc1c(c2O)c34	ZINC000000338130	C2Cc3cccc4c1ccccc1CC(N2)c34
C/C(CCc2oc1ccccc1c2c3ccc(C)o3)=N\NC(N)=S	ZINC000000089029	c3ccc2c(c1ccco1)coc2c3
C2Cc1ccccc1N2c3ccncc3	ZINC000000186923	C2Cc1ccccc1N2c3ccncc3
CCN(CC)CCOC(=O)c1ccccc1C(=O)OCCN(CC)CC	ZINC000004644765	c1ccccc1
CO[C@@H]1CCC[N@@](CCC#N)C1	ZINC000200624220	C1CCNCC1
S=C2N(CN1CCCCC1)CCN2CN3CCCCC3	ZINC000000027631	S=C2N(CN1CCCCC1)CCN2CN3CCCCC3
Cc2c[n+]1ccccc1n2N	ZINC000000337480	c2cc[n+]1cc[nH]c1c2
Fc4ccc(C(=O)NCCN3CCC(n1c(=O)[nH]c2cc(Cl)ccc12)CC3)cc4	ZINC000000537818	O=C(NCCN3CCC(n1c(=O)[nH]c2ccccc12)CC3)c4ccccc4
COc2ccc([C@@]1(C)CC(=O)NC1=O)cc2	ZINC000000050921	O=C2CC(c1ccccc1)C(=O)N2
COc3cc2N[C@H](c1ccccc1)[N+](=O)C(C)c2cc3OC	ZINC000000014171	O=[N+]2Cc1ccccc1NC2c3ccccc3
CC(=O)Nc2ccc(C1=NNC(=O)CC1)cc2	ZINC000000040672	O=C2CCC(c1ccccc1)=NN2
CCN4CCN(CC(=O)N3CCC[C@@H](N2CCN(c1cccc(Cl)c1)CC2)C3)CC4	ZINC000020210692	O=C(CN1CCNCC1)N4CCCC(N3CCN(c2ccccc2)CC3)C4
Cc4cccc(CN3CCC[C@@]2(CC[N@@](Cc1ccc(C#CCO)s1)C2)C3)c4	ZINC000011753453	C2CN(Cc1ccccc1)CC4(C2)CCN(Cc3cccs3)C4
CCOC(=O)N2CCC([N@@](CC)Cc1ccccc1)CC2	ZINC000000220004	C2CC(NCc1ccccc1)CCN2
CC(C)CC(=O)N3CCC(N2CCN(c1ccccc1)CC2)CC3	ZINC000000549193	C3CC(N2CCN(c1ccccc1)CC2)CCN3
CN(C)c5cc[n+](Cc4ccc(c3ccc(C[n+]1ccc(N(C)C)c2ccccc12)cc3)cc4)c6ccccc56	ZINC000013643630	C(c4ccc(c3ccc(C[n+]1cccc2ccccc12)cc3)cc4)[n+]5cccc6ccccc56
COc4ccc(Nc2nc(N1CCNCC1)nc3ccccc23)cc4	ZINC000000199215	C4CN(c3nc(Nc1ccccc1)c2ccccc2n3)CCN4
O=C(OC[C@H]1CCC[N@]2CCCC[C@@H]12)c3ccccc3	ZINC000000052243	O=C(OCC1CCCN2CCCCC12)c3ccccc3
C[C@@H]2C[C@@H](OC(=O)CN1CCCCC1)CC(C)(C)C2	ZINC000000171967	O=C(CN1CCCCC1)OC2CCCCC2
CN(C)Cc1cccc(C)n1	ZINC000001764132	c1ccncc1
COc4cccc(N3CCN(C[C@@H]1C[C@@H]2C[C@H]1C=C2)CC3)c4	ZINC000000277130	C2CN(c1ccccc1)CCN2CC3CC4CC3C=C4
Cc1cc(O)ccc1n3c(=O)c2ccc(N(=O)=O)cc2c3=O	ZINC000000066260	O=c2n(c1ccccc1)c(=O)c3ccccc23
COc2ccc(OC)c(CNCc1ccccc1OC)c2	ZINC000000172236	C(NCc1ccccc1)c2ccccc2
CCN(CC)CC[C@@H]1C[N@](C(C)C)CC1(c2ccccc2)c3ccccc3	ZINC000001569163	C3CC(c1ccccc1)(c2ccccc2)CN3
CCn1c(N)nc2ccccc12	ZINC000000053442	c2ccc1[nH]cnc1c2
CCN(CC)CCC[C@@H](C)Nc2ccnc(/C=C/c1ccc(Cl)cc1)c2	ZINC000005125258	C(=Cc1ccccn1)c2ccccc2
COc1ccccc1N5CCC(N4CCC(N3CCC(C(=O)NC2CC2)CC3)CC4)CC5	ZINC000012448646	O=C(NC1CC1)C5CCN(C4CCN(C3CCN(c2ccccc2)CC3)CC4)CC5
COc2ccc(Oc1ccccc1N(=O)=O)cc2	ZINC000000028149	O(c1ccccc1)c2ccccc2
C[N@]2CCc1cc(O)c(O)cc1[C@@H]2Cc3ccc(O)c(O)c3	ZINC000000056410	C3Cc1ccccc1C(Cc2ccccc2)N3
CC[N@]2CCO[C@H](C(=O)NCCC(=O)N1CCN(C)CC1)C2	ZINC000073638951	O=C(CCNC(=O)C1CNCCO1)N2CCNCC2
CNC[C@@H](C)C#N	ZINC000001672501	nonring
CN(C)CCN4CCN(C(=O)C[N@@]3C[C@@H](c1ccc(C)cc1)[C@H](c2csnn2)C3)CC4	ZINC000019211994	O=C(CN3CC(c1ccccc1)C(c2csnn2)C3)N4CCNCC4
CN(C[C@@H]2CCC[N@@](CCc1ccc(Cl)cc1)C2)C(=O)CN3CCCCC3	ZINC000011661668	O=C(CN1CCCCC1)NCC3CCCN(CCc2ccccc2)C3
O=C(NCc1ccccc1)[C@@H]3CC[C@@H](C(=O)NCc2ccccc2)N3	ZINC000000170969	O=C(NCc1ccccc1)C3CCC(C(=O)NCc2ccccc2)N3
CCN(CC)CCOc1ccc3c(c1)c(=NO)c2cc(OCCN(CC)CC)ccc23	ZINC000004737224	N=c2c1ccccc1c3ccccc23
CCOC(=O)Nc3ccc2n(C)c(CN1CCCCC1)nc2c3	ZINC000000529338	C3CCN(Cc2nc1ccccc1[nH]2)CC3
CN(C)C(=O)OC[n+]1ccn(C)c1	ZINC000000387414	c1c[nH]cn1
CC(C)NC(=N)c4ccc(OCc3ccc2ccc(COc1ccc(C(=N)NC(C)C)cc1)cc2c3)cc4	ZINC000043061782	C(Oc1ccccc1)c4ccc3ccc(COc2ccccc2)cc3c4
Cc3sc2ncnc(Nc1ccc(Cl)cc1)c2c3C	ZINC000000034745	N(c1ccccc1)c2ncnc3sccc23
CC(C)(C)C(=O)OCc2nc(c1ccc(C(F)(F)F)cc1)cs2	ZINC000000076928	c2ccc(c1cscn1)cc2
NC(=O)C5(N1CCCCC1)CCN(CCCN3c2ccccc2CCc4ccc(Cl)cc34)CC5	ZINC000000608266	C5CCN(C4CCN(CCCN2c1ccccc1CCc3ccccc23)CC4)CC5
CCOC(=O)C2CCN(C1CCN(CC)CC1)CC2	ZINC000000280142	C2CCN(C1CCNCC1)CC2
Cc2cc(=N)c1ccccc1n2C	ZINC000000293937	N=c1cc[nH]c2ccccc12
CN(C)CCNC(=O)NC2(C(F)(F)F)Oc1ccccc1O2	ZINC000000212686	C2Oc1ccccc1O2
COc2ccc(CNC(=O)[C@@H]1CCCN1)cc2OC	ZINC000000251665	O=C(NCc1ccccc1)C2CCCN2
Cc2c(C)c1ccccc1n2C[C@@H](O)CNCc3ccco3	ZINC000000086827	C(CNCc1ccco1)Cn2ccc3ccccc23
CC(C)(Cl)CCC[N+](C)(C)C	ZINC000000162344	nonring
Clc5ccc4SCc1ccccc1[C@H](O[C@@H]2CN3CCC2CC3)c4c5	ZINC000000702161	C1CN5CCC1C(OC3c2ccccc2CSc4ccccc34)C5
CC(C)N4C(=O)CC3(CC[N+](C)(CCOC(=O)C(c1ccccc1)c2ccccc2)CC3)C4=O	ZINC000000702166	O=C4CC3(CCN(CCOC(=O)C(c1ccccc1)c2ccccc2)CC3)C(=O)N4
COC(=O)[C@H]1C[C@H](O)CN1Cc2ccsc2	ZINC000000228978	C2CCN(Cc1ccsc1)C2
CC[C@H](C)[C@H]6CN1CCC[C@H]1[C@]7(O)O[C@](NC(=O)[C@@H]5C[C@H]2[C@H](Cc3c[nH]c4cccc2c34)[N@](C)C5)(C(C)C)C(=O)N67	ZINC000004212849	O=C(NC3OC2C1CCCN1CCN2C3=O)C5CNC4Cc6c[nH]c7cccc(C4C5)c67
Clc3ccc(SCC(=O)Nc2ccc(N1CCCC1)cc2)cc3	ZINC000000309956	O=C(CSc1ccccc1)Nc3ccc(N2CCCC2)cc3
O=C(NCCN1CCCCC1)Nc4ccc(Cc3ccc(NC(=O)NCCN2CCCCC2)cc3)cc4	ZINC000016401920	O=C(NCCN1CCCCC1)Nc4ccc(Cc3ccc(NC(=O)NCCN2CCCCC2)cc3)cc4
OC(=O)CCC(=O)Nc1cccc(Cl)c1Cl	ZINC000000072393	c1ccccc1
Cc3ccc(NC(=O)CSc2nnc(c1ccccc1)n2CC=C)c(C)c3	ZINC000000623101	O=C(CSc2nnc(c1ccccc1)[nH]2)Nc3ccccc3
CCCn2c(=O)n(C[C@H](C)CC)c1nn(CCN(C)C)nc1c2=O	ZINC000000024624	O=c2[nH]c(=O)c1n[nH]nc1[nH]2
O=C1CCC(=O)N1OC(N2CCCC2)=[N+]3CCCC3	ZINC000000391931	O=C1CCC(=O)N1OC(N2CCCC2)=[N+]3CCCC3
C=CCNC1COC1	ZINC000016083061	C1COC1
COc1ccc(S(N)(=O)=O)cc1C(=O)NC2CCN(C)CC2	ZINC000000347658	O=C(NC1CCNCC1)c2ccccc2
CC[C@H](C)C(N)=N	ZINC000001439399	nonring
CCOc2cc1CCN[C@H](C(CC)CC)c1cc2OCC	ZINC000000034606	C2Cc1ccccc1CN2
Cc1ccccc1C[n+]2ccn(C)c2C	ZINC000000281334	C(c1ccccc1)[n+]2cc[nH]c2
O[C@H](Cn2c(=N)n(CCN1CCCC1)c3ccccc23)c4ccco4	ZINC000000241422	N=c3n(CCN1CCCC1)c2ccccc2n3CCc4ccco4
COc4cccc(N3CCN(C2CCC(c1ccccc1)CC2)CC3)c4	ZINC000000756629	C2CC(c1ccccc1)CCC2N4CCN(c3ccccc3)CC4
CC5CCN(CCCC(=O)c4ccc3oc2ccc(C(=O)CCCN1CCC(C)CC1)cc2c3c4)CC5	ZINC000039208143	O=C(CCCN1CCCCC1)c5ccc4oc3ccc(C(=O)CCCN2CCCCC2)cc3c4c5
COc1ccc(S(O)(=O)=O)cc1N	ZINC000001620983	c1ccccc1
CC[C@@](O)(CCN1CCCCC1)c2ccccc2	ZINC000000139720	C2CCN(CCCc1ccccc1)CC2
CCN2[C@@H]1OCO[C@H]1N(CC)C2=O	ZINC000000084143	O=C2NC1OCOC1N2
CCC[C@H](N(C)C)C(=O)NCCNC(=O)[C@H](CCC)N(C)C	ZINC000004530318	nonring
CCOC(=O)c2c(C)nc3c([C@@H]1CCC[N@]1C)cccn23	ZINC000000134536	C3CNC(c1cccn2ccnc12)C3
C[C@@H](Oc1ccccc1)C(=O)N3CCc2ccccc2C3	ZINC000000030916	O=C(COc1ccccc1)N3CCc2ccccc2C3
O=CN1CCCc2ccccc12	ZINC000000028036	C2CNc1ccccc1C2
C[C@]12CCCC(=C)[C@H]1C[C@H]3[C@@H](C2)OC(=O)[C@@H]3CNCCc4c[nH]cn4	ZINC000003984920	C=C4CCCC3CC2OC(=O)C(CNCCc1c[nH]cn1)C2CC34
CN(C)CCC(=O)NCCCCCCNC(=O)CCN(C)C	ZINC000004530310	nonring
O=S(=O)(Cc1ccccc1)NCc2ccccc2	ZINC000000029840	O=S(=O)(Cc1ccccc1)NCc2ccccc2
CN2CCC(OC(=O)c1ccc(Cl)cc1Cl)CC2	ZINC000000383060	O=C(OC1CCNCC1)c2ccccc2
Cc1nccn1C[C@@H](NC(=O)CC4CCN(Cc3ccn(c2ccc(C(F)(F)F)cc2)c3)CC4)c5ccccc5	ZINC000043070419	O=C(CC3CCN(Cc2ccn(c1ccccc1)c2)CC3)NC(Cn4ccnc4)c5ccccc5
Cc2c(N(=O)=O)cc1[nH]c(=O)c(=O)[nH]c1c2CN3CCCC3	ZINC000000017349	O=c3[nH]c2cccc(CN1CCCC1)c2[nH]c3=O
CNc1nccc(N)n1	ZINC000000331866	c1cncnc1
COc2ccc(O)c(Cc1nccn1C)c2	ZINC000000003690	C(c1ccccc1)c2ncc[nH]2
CN2CCC(OC(=O)c1ccccc1F)CC2	ZINC000000383067	O=C(OC1CCNCC1)c2ccccc2
CCN(CC)Cc1c(O)ccc2c(CN(CC)CC)c(O)ccc12	ZINC000003296915	c2ccc1ccccc1c2
C[C@@H]2C[C@@H](C)CN(CCC(=O)Nc1ccccc1F)C2	ZINC000000176646	O=C(CCN1CCCCC1)Nc2ccccc2
COc1cc(N)cc(C(F)(F)F)c1	ZINC000000119848	c1ccccc1
COc3cc2[C@@H](C)[N@](CCCN)CC1(CCCC1)c2cc3OC	ZINC000003149992	C1CCC3(C1)CNCc2ccccc23
COc3ccc(CN2CCC([N@]1CCC[C@@H](C)C1)CC2)c(OC)c3	ZINC000000207752	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
Cc3sc2ccc1sccc1c2[n+]3C	ZINC000000199142	c3cc2c(ccc1scnc12)s3
N=C(NCCNC(=N)c1ccc(N(=O)=O)cc1)c2ccc(N(=O)=O)cc2	ZINC000003018414	N=C(NCCNC(=N)c1ccccc1)c2ccccc2
CC(C)NC[C@H]2CCc1cc(CO)c(N(=O)=O)cc1N2	ZINC000000000570	C2CNc1ccccc1C2
CCC(=O)Nc2nc1ccccc1n2CCN(C)C	ZINC000000186879	c2ccc1[nH]cnc1c2
C[C@]25C[N@@](Cc1ccccc1)C[C@H]2C(=O)N(CCN3CCCC3)c4ccccc4C(=O)N5	ZINC000012231867	O=C4NC2CN(Cc1ccccc1)CC2C(=O)N(CCN3CCCC3)c5ccccc45
COc4ccc3sc1ccccc1n(CC[C@H]2CCCC[N@]2C)c3c4	ZINC000000608012	C4CCC(CCn2c1ccccc1sc3ccccc23)NC4
Cc2cc(C)[n+]1cnn(N)c1n2	ZINC000000493016	c2cnc1[nH]nc[n+]1c2
CCOc2cc(CNCc1cc(OC)cc(OC)c1)ccc2OC	ZINC000000172178	C(NCc1ccccc1)c2ccccc2
C[C@]23CNC[C@](C)(CN(Cc1ccccc1Br)C2)C3	ZINC000000346472	C1NCC3CC1CN(Cc2ccccc2)C3
C[C@@H](CO)N1CCCCCC1	ZINC000001593269	C1CCCNCC1
Oc1ccccc1[C@@H](Nn2cnnc2)c3ccc(Br)cc3	ZINC000000041786	N(C(c1ccccc1)c2ccccc2)n3cnnc3
COc2ccc(C(=O)COc1ccc(Br)cc1)c(O)c2	ZINC000000041787	O=C(COc1ccccc1)c2ccccc2
FC(F)(F)c2ccc(S(=O)(=O)Cc1ccc(N(=O)=O)cc1)nc2	ZINC000000123017	O=S(=O)(Cc1ccccc1)c2ccccn2
C[C@@H]2CN(C1CC(C)(C)NC(C)(C)C1)CCC2=O	ZINC000000129256	O=C2CCN(C1CCNCC1)CC2
Cc3ccc(C[C@@H]2C[C@@H](C(=O)OCc1ccccc1)N(C(=O)OC(C)(C)C)C2=O)cc3	ZINC000000622189	O=C2NC(C(=O)OCc1ccccc1)CC2Cc3ccccc3
CCOC(=O)c4cccc(Nc1cc(C)nc3c1ccc2ccccc23)c4	ZINC000000703415	N(c1ccccc1)c2ccnc4c2ccc3ccccc34
COc1cccnc1NC(=O)NC2C[C@@H]3CC[C@H](C2)[N@]3C	ZINC000000002342	O=C(NC1CC2CCC(C1)N2)Nc3ccccn3
N#CC[n+]2ccc1ccccc1c2	ZINC000000337469	c2ccc1cnccc1c2
OC(=O)c2ccc(CSc1ccccn1)cc2	ZINC000000052099	C(Sc1ccccn1)c2ccccc2
CSC2=N[C@@H]1CCCC[C@H]1N2	ZINC000000124925	C2CCC1N=CNC1C2
COc1cc(OC)c(\C=N\O)cc1Br	ZINC000000095854	c1ccccc1
CNCCc1cn[nH]c1	ZINC000004384436	c1cn[nH]c1
CCOc1ccccc1CN3CCC(C(=O)NC[C@@H]2CCCO2)CC3	ZINC000000317502	O=C(NCC1CCCO1)C3CCN(Cc2ccccc2)CC3
CN1NC(=O)C[n+]2c(C)cccc12	ZINC000002029241	O=C2C[n+]1ccccc1NN2
CCc1nccn1Cc4cc(CNC3(c2ccccc2OC)CCCC3)ccc4OC	ZINC000019523667	C4CCC(NCc2cccc(Cn1ccnc1)c2)(c3ccccc3)C4
CN(C[C@@H]2CCC[N@@](CCc1ccccc1C)C2)Cc3cccn3c4ncccn4	ZINC000011842983	C4CC(CNCc1cccn1c2ncccn2)CN(CCc3ccccc3)C4
C2Cc1n[nH]cc1CN2	ZINC000004243542	C2Cc1n[nH]cc1CN2
CN(C)Cc1ccccc1c5ccc4[C@@H]3C[C@@H](C[N@@](Cc2ccccc2)C3)Cn4c5=O	ZINC000004237323	O=c5c(c1ccccc1)ccc4C3CC(CN(Cc2ccccc2)C3)Cn45
CNC(=S)Nc1ccc(C)c(C#N)c1	ZINC000000040103	c1ccccc1
CN1CCC2(CC1)OCCO2	ZINC000001585378	C1CC2(CCN1)OCCO2
COc1ccc(Br)cc1CO	ZINC000000056493	c1ccccc1
Nc1nonc1n3nnc(CNC2CCCCC2)c3CNC4CCCCC4	ZINC000004936481	C4CCC(NCc2nnn(c1cnon1)c2CNC3CCCCC3)CC4
CNCCSC	ZINC000005741665	nonring
CN3CCN(C(=O)N(c1ccccc1)c2ccccc2)CC3	ZINC000000152068	O=C(N1CCNCC1)N(c2ccccc2)c3ccccc3
COc3ccc2sc1C(=O)NCCNc1c2c3	ZINC000000002980	O=C1NCCNc2c1sc3ccccc23
CN(C)CC(=O)Nc4ccc3[C@@H]2C[C@@H](C[N@](C1CCN(C(C)=O)CC1)C2)Cn3c4=O	ZINC000004259185	O=c4cccc3C2CC(CN(C1CCNCC1)C2)Cn34
CCOC(=O)Nc1cc([N+](C)(C)C)ccc1OCCOc2ccc([N+](C)(C)C)cc2	ZINC000001559980	C(COc1ccccc1)Oc2ccccc2
CN(C)c3ccc(\C=N\C2=NN(c1ccccc1)CC2)cc3	ZINC000000193971	C2CC(N=Cc1ccccc1)=NN2c3ccccc3
Cc3cc(C)[n+]2nc(SCc1ccccc1)sc2n3	ZINC000000124266	C(Sc2n[n+]1cccnc1s2)c3ccccc3
COC(=O)C12CCN(CC1)C2	ZINC000000003967	C1CN2CCC1C2
O=C2CCCc3nc1CCCC(=O)c1cc23	ZINC000000083459	O=C2CCCc3nc1CCCC(=O)c1cc23
CC[N+](C)(CC)CCOC(=O)Cn3[n+](C)c(Cc1ccccc1)c2ccccc2c3=O	ZINC000005469307	O=c2[nH]nc(Cc1ccccc1)c3ccccc23
Cc2nc1ccccc1nc2CSc4nnc(c3ccccc3)n4C	ZINC000000109306	C(Sc2nnc(c1ccccc1)[nH]2)c4cnc3ccccc3n4
Clc2ccc(C(=O)c1cccs1)cc2	ZINC000000110512	O=C(c1ccccc1)c2cccs2
CN(C)CCCn4cc(c3c(c1c[nH]c2ccccc12)c(=O)[nH]c3=O)c5ccccc45	ZINC000000585151	O=c3[nH]c(=O)c(c1c[nH]c2ccccc12)c3c4c[nH]c5ccccc45
Clc2c(C(=O)NC1CC1)sc3ccccc23	ZINC000000035343	O=C(NC1CC1)c3cc2ccccc2s3
C[N@@](CCc1ccccn1)Cc2c[nH]c3ccccc23	ZINC000000088068	C(Cc1ccccn1)NCc2c[nH]c3ccccc23
NC1=NCCCN1Cc2ccc(Cl)nc2	ZINC000000008835	C2CN=CN(Cc1cccnc1)C2
Cc1ccc(C(N)=O)cn1	ZINC000000039575	c1ccncc1
Fc3ccc(NC(=O)N2CCN(c1ccncc1)CC2)cc3	ZINC000000152484	O=C(Nc1ccccc1)N3CCN(c2ccncc2)CC3
Cc1cccnc1N	ZINC000000402702	c1ccncc1
Cc4ccc(c2c[n+](Cc1ccccc1Cl)c3CCCn23)cc4	ZINC000000538671	C1Cc3n(C1)c(c2ccccc2)c[n+]3Cc4ccccc4
Cc3cc(=c2c(=O)c1ccccc1c2=O)cc(C)n3C[C@@H]4CCCO4	ZINC000000073600	O=c3c(=c2ccn(CC1CCCO1)cc2)c(=O)c4ccccc34
O=C1CCC[C@H]1CN2CCCC2	ZINC000001855950	O=C1CCCC1CN2CCCC2
Cc2cc(S(=O)(=O)c1ccc(Cl)c(C)c1)ccc2Cl	ZINC000000041259	O=S(=O)(c1ccccc1)c2ccccc2
COc3cccc(CNc2nc1ccccc1n2C)c3O	ZINC000000111513	C(Nc2nc1ccccc1[nH]2)c3ccccc3
CC[N+](C)(CC)CCOc1ccccc1N(CC[N+](C)(CC)CC)c2ccccc2	ZINC000005333403	N(c1ccccc1)c2ccccc2
CCc2c(C)nc1cccc[n+]1c2C	ZINC000000390832	c2cc[n+]1cccnc1c2
COc1cc(Br)c(C=O)cc1O	ZINC000000057570	c1ccccc1
Cc4nc(SCc1c(C)noc1C)c3c2CCCc2sc3n4	ZINC000000087285	C4Cc3sc2ncnc(SCc1cnoc1)c2c3C4
Fc6ccc(Cn4c(N3CCN(CCCNc1ccnc2cc(Cl)ccc12)CC3)nc5ccccc45)cc6	ZINC000040918301	C(CNc1ccnc2ccccc12)CN6CCN(c4nc3ccccc3n4Cc5ccccc5)CC6
CC(=O)Oc3ccc(c2nc1cc(Cl)ccc1c(=O)o2)cc3	ZINC000000049301	O=c2oc(c1ccccc1)nc3ccccc23
COc3ccc(CSc2nnc(c1ccc(OC)cc1)o2)cc3	ZINC000000064255	C(Sc2nnc(c1ccccc1)o2)c3ccccc3
CCN(CC)C(=O)CNC	ZINC000003423890	nonring
Cc4cc3c(c1ccccc1F)nc(N2CCNCC2)nc3s4	ZINC000000004901	C4CN(c3nc(c1ccccc1)c2ccsc2n3)CCN4
CC2CCN(C[C@H](O)COC1CCC(C(C)(C)C)CC1)CC2	ZINC000000448352	C2CCC(OCCCN1CCCCC1)CC2
COc5ccc4CCC[C@H](NCC3CCN(CCNS(=O)(=O)c1cccc2ccccc12)CC3)Cc4c5	ZINC000013439447	O=S(=O)(NCCN3CCC(CNC2CCCc1ccccc1C2)CC3)c4cccc5ccccc45
CC(C)[C@H](N)C(=O)Nc2ccc1ccccc1c2	ZINC000000032354	c2ccc1ccccc1c2
N[C@H]1CC=CC[C@H]1CO	ZINC000004262161	C1CCC=CC1
O=C(NCCCN1CCOCC1)[C@H]5C[C@@H](C(=O)Nc3ccc2CCCc2c3)C[N@@](Cc4ccccc4)C5	ZINC000014749790	O=C(NCCCN1CCOCC1)C5CC(C(=O)Nc3ccc2CCCc2c3)CN(Cc4ccccc4)C5
CC[N+](C)(CC)CCOCCOC(=O)[C@@H](c1ccccc1)[N+]2(C)CCCCC2	ZINC000005651730	C2CCN(Cc1ccccc1)CC2
CN(C[C@H]2CCC[N@@](CCc1ccc(Cl)cc1)C2)Cc3cccnc3	ZINC000011873543	C3CC(CNCc1cccnc1)CN(CCc2ccccc2)C3
CN(C)CCNC(=O)N(C)C	ZINC000001697682	nonring
Cn4c(=O)n(C)c3ncn(CCN2CCN(c1ccccc1Cl)CC2)c3c4=O	ZINC000000593384	O=c4[nH]c(=O)c3n(CCN2CCN(c1ccccc1)CC2)cnc3[nH]4
C[C@@H]1CCCC[C@@H]1NC2CCN(C)CC2	ZINC000000182133	C2CCC(NC1CCNCC1)CC2
Cc3cc(C)c2cc(C(=O)NCCN1CCCCC1)[nH]c2c3	ZINC000000171571	O=C(NCCN1CCCCC1)c3cc2ccccc2[nH]3
COC(=O)c3c(c1ccccc1)c(c2ccccc2)c(C(=O)OC)c3=O	ZINC000000068955	O=c3cc(c1ccccc1)c(c2ccccc2)c3
C[C@@H]1CCN(C)C[C@@H]1N	ZINC000069719805	C1CCNCC1
Fc2cc1nsnc1cc2Cl	ZINC000000071464	c2ccc1nsnc1c2
NCC3(c2ccc1OCCOc1c2)CCCC3	ZINC000000343473	C3CCC(c2ccc1OCCOc1c2)C3
COc1ccccc1[n+]3c2CCCCCn2cc3c4ccc(Br)cc4	ZINC000000622767	C1CCc3n(CC1)cc(c2ccccc2)[n+]3c4ccccc4
Fc3nc(F)c(F)c(N2C(=O)c1ccccc1S2(=O)=O)c3F	ZINC000000033357	O=C2N(c1ccncc1)S(=O)(=O)c3ccccc23
Clc4ccc3CCN(CCCCCCC[N@@]2CCc1ccc(Cl)c(Cl)c1C2)Cc3c4Cl	ZINC000027862038	C(CCCN2CCc1ccccc1C2)CCCN4CCc3ccccc3C4
COc1ccccc1[N+]3=C2CCCCCN2C[C@@]3(O)c4ccc(Br)cc4	ZINC000000622762	C4CCN3CC(c1ccccc1)[N+](c2ccccc2)=C3CC4
CN(C)c2c(C)n(C)n(c1ccccc1)c2=O	ZINC000000057115	O=c1cc[nH]n1c2ccccc2
C[C@@H]1COC[C@@H](C)N1	ZINC000003875939	C1COCCN1
Clc2ccc(S(=O)(=O)N1CCOCC1)cc2C#N	ZINC000000035044	O=S(=O)(N1CCOCC1)c2ccccc2
COc4cc3CCn2c(cc(N1CCNCC1)nc2=O)c3cc4OC	ZINC000000534361	O=c4nc(N1CCNCC1)cc3c2ccccc2CCn34
CN(Cc1ccccc1)C(=O)C[C@@H]2CCNC[C@@H]2Cc4cc(CN3CCCCC3)on4	ZINC000012482406	O=C(CC1CCNCC1Cc3cc(CN2CCCCC2)on3)NCc4ccccc4
C[C@H](COC(C)=O)[N+](C)(C)C	ZINC000001563860	nonring
NCCCCCN=C3Nc1ccccc1[C@@H](CC(=O)NCc2ccccc2)N3c5ccc(c4ccccc4)cc5	ZINC000028363095	N=C3Nc1ccccc1C(CC(=O)NCc2ccccc2)N3c5ccc(c4ccccc4)cc5
C[n+]1cccc(O)c1	ZINC000001635609	c1ccncc1
COc3ccc(CN[C@@H](C)[C@@H]2COc1ccccc1O2)c(OC)c3	ZINC000000189266	C(NCc1ccccc1)C3COc2ccccc2O3
COc2cc1nccc(N)c1cc2OC	ZINC000000000924	c2ccc1ncccc1c2
CCN(CC)CCNc1ncnc2ccc(Br)cc12	ZINC000000084960	c2ccc1ncncc1c2
CCc2ccc(CN(C)Cc1ccc(OC[C@@H](O)C[N@@](C)C(C)C)c(OC)c1)nc2	ZINC000011874205	C(NCc1ccccn1)c2ccccc2
Cc3scc4c(=O)[nH]c1ccccc1n(C(=O)CN2CCN(CCCCCCCCCCN)CC2)c34	ZINC000027980971	O=C(CN1CCNCC1)n3c2ccccc2[nH]c(=O)c4cscc34
CC(C)CN(CC(C)C)Cn1c(=O)oc2ccccc12	ZINC000000174948	O=c2[nH]c1ccccc1o2
C=CCNc4nc(NCC=C)nc(N3CCC(NC[C@@H](c1ccccc1)S(=O)(=O)c2ccccc2)CC3)n4	ZINC000013650734	O=S(=O)(C(CNC2CCN(c1ncncn1)CC2)c3ccccc3)c4ccccc4
O[C@@H](COCCOCCN1CCCCC1)CN2CCCCC2	ZINC000005375521	C2CCN(CCCOCCOCCN1CCCCC1)CC2
CC(=C)CN4CCN(c2ncnc3scc(c1ccc(Cl)cc1)c23)CC4	ZINC000000639706	C4CN(c2ncnc3scc(c1ccccc1)c23)CCN4
C[N+]14CCCC[C@@H]1[C@H](CCOC(=O)c3ccc2OCOc2c3)CCC4	ZINC000000343975	O=C(OCCC1CCCN2CCCCC12)c4ccc3OCOc3c4
CN(C)CCOC(c1ccccc1)c2ccccc2	ZINC000000020244	C(c1ccccc1)c2ccccc2
COc1ccc(S(=O)(=O)NC(C)C)cc1	ZINC000000029549	c1ccccc1
Clc2cc1NC(=O)Cc1cc2CCN5CCN(c3nsc4ccccc34)CC5	ZINC000000538550	O=C5Cc4cc(CCN3CCN(c1nsc2ccccc12)CC3)ccc4N5
NS(=O)(=O)c3cc2C(=O)N(C1CCCCC1)Cc2cc3Cl	ZINC000000001199	O=C2N(C1CCCCC1)Cc3ccccc23
Clc2cncc(OC[C@H]1CCN1)c2	ZINC000000018382	C2CC(COc1cccnc1)N2
C[N+](C)(C)Cn1c(=O)sc2ccccc12	ZINC000000405753	O=c2[nH]c1ccccc1s2
CCN(CC)CCN([C@@H](C(=O)NC1CCCCC1)c2ccc(F)cc2)C(=O)c4ccc(CN3CCCCC3)o4	ZINC000006511829	O=C(NC1CCCCC1)C(NC(=O)c3ccc(CN2CCCCC2)o3)c4ccccc4
O=C1CCCC3=C1[C@H](c2ccccn2)c4c(N3)ccc5ncccc45	ZINC000000054408	O=C1CCCC3=C1C(c2ccccn2)c4c(N3)ccc5ncccc45
CN(C)Cc1cc(NS(C)(=O)=O)ccc1Oc2ccc(C(F)(F)F)cc2	ZINC000000593144	O(c1ccccc1)c2ccccc2
Fc2ccc(C(=O)NC1(C(Cl)(Cl)Cl)OCCO1)cc2	ZINC000000045394	O=C(NC1OCCO1)c2ccccc2
CSc2ccc(Oc1ccc(S(N)(=O)=O)cc1CN(C)C)cc2	ZINC000000593140	O(c1ccccc1)c2ccccc2
OC(=O)CCC(=O)c2ccc(C1CCCCC1)c(Cl)c2	ZINC000000001067	C2CCC(c1ccccc1)CC2
CC(C)CN(CCOc3cccc(n2c(=O)c1CCCCc1c2=O)c3)CC(C)C	ZINC000000704264	O=c2c1CCCCc1c(=O)n2c3ccccc3
Nc2ccc(Cc1ccncc1)cc2	ZINC000000067652	C(c1ccccc1)c2ccncc2
CC[C@@H](C)Nc2nc1n(C)c(=O)[nH]c(=O)c1n2Cc3cccc(C)c3	ZINC000000067653	O=c3[nH]c(=O)c2n(Cc1ccccc1)cnc2[nH]3
CN(C)C(=O)Oc3ccc(c2c[n+]1cc(NC(C)=O)ccc1n2C)cc3	ZINC000000633457	c3ccc(c2c[n+]1ccccc1[nH]2)cc3
CC(C)(C)S(=O)(=O)C(=C/N1CCOCC1)/C#N	ZINC000000096057	C1COCCN1
Cc2nc1ccccc1c(O)c2C=O	ZINC000000269834	c2ccc1ncccc1c2
COc3ccc(C(=O)Nc2ccc(N1CCOCC1)cc2)cc3OC	ZINC000000032017	O=C(Nc2ccc(N1CCOCC1)cc2)c3ccccc3
COc3ccc(\C=C1/[C@@H](O)C2CCN1CC2)cc3	ZINC000000192680	C1CN2CCC1CC2=Cc3ccccc3
CN4CCN(c3cc2n(C)c1ccccc1oc2nn3)CC4	ZINC000000050247	C4CN(c3cc2[nH]c1ccccc1oc2nn3)CCN4
CC3(C)CC(NC(=O)C1C[C@@H]2CCC[C@H](C1)C2=O)CC(C)(C)N3	ZINC000000351768	O=C(NC1CCNCC1)C2CC3CCCC(C2)C3=O
Nc2nc(c1ccccc1)cn2Nc3ccccc3	ZINC000000174373	N(c1ccccc1)n3cnc(c2ccccc2)c3
Cc4cccc(OCC(=O)N3CCN(C[C@@H]1C[C@@H]2C[C@H]1C=C2)CC3)c4	ZINC000000447315	O=C(COc1ccccc1)N4CCN(CC2CC3CC2C=C3)CC4
COC(=O)N3CCN(C(=O)Cc1ccc(Cl)c(Cl)c1)[C@@H](CN2CCCC2)C3	ZINC000000597739	O=C(Cc1ccccc1)N2CCNCC2CN3CCCC3
N=C2CSc1ccccc1N2	ZINC000000336180	N=C2CSc1ccccc1N2
C[n+]1ccccc1c3nc2ccccc2s3	ZINC000000226211	c3ccc(c2nc1ccccc1s2)nc3
CCOc1ccc(CN(CCO)CCO)cc1C(=O)OC	ZINC000000213657	c1ccccc1
CC(C)N\C(=N/C(C)C)c3ccc(NC(=O)c2ccc(C(=O)Nc1ccc(C(/NC(C)C)=N/C(C)C)cc1)cc2)cc3	ZINC000004743083	O=C(Nc1ccccc1)c3ccc(C(=O)Nc2ccccc2)cc3
COc4cccc(c2nc1cc(C)ccn1c2NC3CCCC3)c4OC	ZINC000000881977	C4CCC(Nc2c(c1ccccc1)nc3ccccn23)C4
Cc3cc(CCN2CCN(c1cccc(Cl)c1)CC2)[nH]n3	ZINC000000001682	C2CN(c1ccccc1)CCN2CCc3ccn[nH]3
Nc1c(C#N)c(C(F)(F)F)nn1c2ccccc2	ZINC000000063449	c2ccc(n1cccn1)cc2
CC(C)(C)c3ccc(CC[C@@H]2OC[C@@H](C[N+]1(C)CCOCC1)O2)cc3	ZINC000000202494	C3CN(CC2COC(CCc1ccccc1)O2)CCO3
COc1cc(CCN)cc2OCOc12	ZINC000000393470	C2Oc1ccccc1O2
NCCCN(CCCCN(CCCN)C(=O)OCc1ccccc1)C(=O)OCc2ccccc2	ZINC000005834418	O=C(NCCCCNC(=O)OCc1ccccc1)OCc2ccccc2
CC(C)(C)N(NC(=O)c1ccccc1)C(=O)c2ccccc2	ZINC000000006382	O=C(NNC(=O)c1ccccc1)c2ccccc2
Cn3c(=O)c(c1c(Cl)cccc1Cl)cc4cnc(Nc2ccncc2)nc34	ZINC000000601820	O=c3[nH]c2nc(Nc1ccncc1)ncc2cc3c4ccccc4
Fc1ccccc1c3nc2ccccc2s3	ZINC000000019638	c3ccc(c2nc1ccccc1s2)cc3
O=C3[C@@H](CN(Cc1ccccc1)Cc2ccccc2)CCC[C@@H]3CN(Cc4ccccc4)Cc5ccccc5	ZINC000004783505	O=C3C(CN(Cc1ccccc1)Cc2ccccc2)CCCC3CN(Cc4ccccc4)Cc5ccccc5
Clc3ccc(CN2CCC(C(=O)N/N=C/c1ccco1)CC2)cc3	ZINC000000031047	O=C(NN=Cc1ccco1)C3CCN(Cc2ccccc2)CC3
CC[N@@](CC2CCN(CCc1ccccc1C)CC2)Cc3ccc(C#CC(C)(C)O)s3	ZINC000012717675	C2CN(CCc1ccccc1)CCC2CNCc3cccs3
O[C@H](CN[C@H]1CCCCNC1=O)c2ccccc2	ZINC000000130400	O=C1NCCCCC1NCCc2ccccc2
CSc3[nH]c(c1ccccc1)nc4nc(c2ccccc2)cc(=O)c34	ZINC000000050242	O=c3cc(c1ccccc1)nc4nc(c2ccccc2)[nH]cc34
CC(C)CN3CCC(C(=O)N2CCN(c1ccccc1F)CC2)CC3	ZINC000000455556	O=C(C1CCNCC1)N3CCN(c2ccccc2)CC3
CCN(CC)c3ccc(Nc1snc2n(C)c(=O)n(C)c(=O)c12)cc3	ZINC000000641770	O=c3[nH]c(=O)c2c(Nc1ccccc1)snc2[nH]3
COc3ccc2n(C)c(c1cccc(OC(=O)N(C)C)c1)c[n+]2c3	ZINC000000387379	c3ccc(c2c[n+]1ccccc1[nH]2)cc3
COc2ccc(c1cc(=O)ccc1=O)cc2	ZINC000000095325	O=c2ccc(=O)c(c1ccccc1)c2
Nc2nnc(SCc1ccccc1Cl)s2	ZINC000000036137	C(Sc1nncs1)c2ccccc2
CCCN2CCC(N1CCC(O)CC1)CC2	ZINC000000279581	C2CCN(C1CCNCC1)CC2
CCN(CC)C[C@@H]4CCC[N@@](Cc2c(c1ccc(OC)cc1)[nH]c3ncccc23)C4	ZINC000012144240	C4CCN(Cc2c(c1ccccc1)[nH]c3ncccc23)CC4
CCN(CC)CCC[C@@H](C)Nc1c(C)cnc2cccc(C)c12	ZINC000008581091	c2ccc1ncccc1c2
O=C(N1CCNCC1)N2CCOCC2	ZINC000000079633	O=C(N1CCNCC1)N2CCOCC2
O=C(Nc1ccccc1)c3ccc[n+](Cc2ccc(N(=O)=O)cc2)c3	ZINC000000307878	O=C(Nc1ccccc1)c3ccc[n+](Cc2ccccc2)c3
COc2ccc(C/N=C/c1ccc(OC)cc1)cc2	ZINC000000110863	C(N=Cc1ccccc1)c2ccccc2
COc2ccc(/N=C/c1cc(Cl)cc(Cl)c1O)cc2OC	ZINC000000058394	C(=Nc1ccccc1)c2ccccc2
Cc1ccccc1OCC(=O)NC2CC(C)(C)NC(C)(C)C2	ZINC000000195342	O=C(COc1ccccc1)NC2CCNCC2
Cc1ccccc1Oc2cc(C#N)c(C#N)cc2Oc3ccccc3C	ZINC000000045146	O(c1ccccc1)c2ccccc2Oc3ccccc3
Oc2ccc3cccc4c(=O)c1ccccc1c(=O)c2c34	ZINC000000044147	O=c2c1ccccc1c(=O)c4cccc3cccc2c34
Fc5ccc(N4CCN(CCCC(=O)N[C@@H]2c1ccccc1CSc3ccccc23)CC4)cc5	ZINC000000607979	O=C(CCCN2CCN(c1ccccc1)CC2)NC4c3ccccc3CSc5ccccc45
COc1ccccc1\C=C\C[N@@]4CCc3nnc([C@@H](C)NC(=O)C2CCN(C)CC2)n3CC4	ZINC000012099722	O=C(NCc3nnc2CCN(CC=Cc1ccccc1)CCn23)C4CCNCC4
COc4ccc([n+]3ccc(c2cc[n+](c1ccc(OC)cc1)cc2)cc3)cc4	ZINC000001234074	c4ccc([n+]3ccc(c2cc[n+](c1ccccc1)cc2)cc3)cc4
CN(C)CCCN=C(Nc1ccc(C)cc1)C(c2ccccc2)c3ccccc3	ZINC000001590082	N=C(Nc1ccccc1)C(c2ccccc2)c3ccccc3
CCN(CC)CCn3c1ccccc1n4c(C(C)=O)c(c2cc(C)ccc2C)nc34	ZINC000000716210	c4ccc(c1cn3c(n1)[nH]c2ccccc23)cc4
CN(C)c1ccccc1C[S@@](=O)c2nccn2c3ncccc3C	ZINC000000003722	O=S(Cc1ccccc1)c2nccn2c3ccccn3
NC(=O)N(O)Cc2ccc(c1ccccc1)o2	ZINC000000010360	c2ccc(c1ccco1)cc2
O=S(=O)(Cc1cccc[n+]1Cc2ccccc2)c3ccccc3	ZINC000000398740	O=S(=O)(Cc1cccc[n+]1Cc2ccccc2)c3ccccc3
CCc3ccnc(NC(=O)Nc2ccc(OCc1ccccc1)cc2)c3	ZINC000000148384	O=C(Nc2ccc(OCc1ccccc1)cc2)Nc3ccccn3
Cc1ccsc1\C=N\c2ccc(Cl)cc2C(=O)c3ccccc3	ZINC000000063020	O=C(c1ccccc1)c2ccccc2N=Cc3cccs3
C[N+]2(CCOC(=O)CCCCC(=O)OCC[N+]1(C)CCCCCC1)CCCCCC2	ZINC000004977198	O=C(CCCCC(=O)OCCN1CCCCCC1)OCCN2CCCCCC2
O=C(C[N@]1CCC[C@@H]1c2cccs2)Nc4ccc(CN3CCCC3)cc4	ZINC000007443169	O=C(CN1CCCC1c2cccs2)Nc4ccc(CN3CCCC3)cc4
C(CC#Cc3cccc(C#CCCC[n+]2cccc(c1ccccc1)c2)c3)C[n+]5cccc(c4ccccc4)c5	ZINC000071294238	C(CC#Cc3cccc(C#CCCC[n+]2cccc(c1ccccc1)c2)c3)C[n+]5cccc(c4ccccc4)c5
Fc3ccc(NC(=O)[C@@H]1C[C@H]2CC[C@@H]1C2)cc3	ZINC000000064815	O=C(Nc1ccccc1)C2CC3CCC2C3
Oc2cccc3c(=O)[nH]c(c1ccccc1)nc23	ZINC000000020441	O=c2[nH]c(c1ccccc1)nc3ccccc23
COc2ccc(CNC1CCN(C(C)=O)CC1)cc2	ZINC000000214630	C2CC(NCc1ccccc1)CCN2
C3CCN(CCN(Cc1ccccc1)c2ccccc2)C3	ZINC000000001534	C3CCN(CCN(Cc1ccccc1)c2ccccc2)C3
C[N+](C)(C)CCCOC(=O)CCCCCCC(=O)OCCC[N+](C)(C)C	ZINC000004977197	nonring
Fc4cccc(C[N@](CC2CCN(C1CCCC1)CC2)C[C@@H]3CCCO3)c4	ZINC000011720190	C4CCC(N3CCC(CN(CC1CCCO1)Cc2ccccc2)CC3)C4
Brc3cncc(C(=O)Nc2ccc1OCOc1c2)c3	ZINC000000037927	O=C(Nc2ccc1OCOc1c2)c3cccnc3
CON2C(=O)CC1(CCNCC1)C2=O	ZINC000000003887	O=C2CC1(CCNCC1)C(=O)N2
O=C3NCC2(CCN(CCc1ccccc1)CC2)O3	ZINC000000001441	O=C3NCC2(CCN(CCc1ccccc1)CC2)O3
Cc3ccc2[n+](Cc1ccc(Br)cc1)csc2c3	ZINC000000271714	C(c1ccccc1)[n+]2csc3ccccc23
C[N@]4C[C@H]1CNC[C@@]1(C(=O)NCCN3N=C(c2ccccc2)CCC3=O)C4	ZINC000065529907	O=C2CCC(c1ccccc1)=NN2CCNC(=O)C34CNCC3CNC4
CSc1nc(C)cc(C)c1CN	ZINC000000036450	c1ccncc1
Oc2cc1OCOc1cc2C(O)(C(F)(F)F)C(F)(F)F	ZINC000000032889	C2Oc1ccccc1O2
N[C@H]1CCC[C@H]1C(N)=O	ZINC000004262536	C1CCCC1
CN(C)CCOC(=O)c2sc1ccccc1c2Cl	ZINC000000195505	c2ccc1sccc1c2
CCOC(=O)C2CCN(C(=O)c1ccccc1Cl)CC2	ZINC000000029567	O=C(N1CCCCC1)c2ccccc2
OC(=O)[C@H]2[C@H]1O[C@H](C=C1)[C@H]2C(=O)NCc3cccc(Cl)c3	ZINC000000101810	O=C(NCc1ccccc1)C2CC3OC2C=C3
COc3ccc2sc1ccccc1n(CCCN(C)C)c2c3	ZINC000000000488	c3ccc2sc1ccccc1[nH]c2c3
O=N(=O)c3ccc(\C=N\c2sc1CCCCc1c2C#N)o3	ZINC000000037102	C3CCc2sc(N=Cc1ccco1)cc2C3
CC[N+]1(CC)CC1	ZINC000001676928	C1CN1
CC[N@]1CCC[C@@H]1CNC(=O)CCC4CCN(Cc3cc(=O)c2ccccc2[nH]3)CC4	ZINC000015065001	O=C(CCC3CCN(Cc2cc(=O)c1ccccc1[nH]2)CC3)NCC4CCCN4
Cc1cc(NC(=O)CCC(O)=O)n(C)n1	ZINC000000148545	c1cn[nH]c1
O=C(CSc2nc1ccccc1[nH]2)Nc4nc3ccccc3s4	ZINC000000051752	O=C(CSc2nc1ccccc1[nH]2)Nc4nc3ccccc3s4
O=C(COC[C@@H]1CCC[N@]2CCCC[C@@H]12)N3CCOCC3	ZINC000000035447	O=C(COCC1CCCN2CCCCC12)N3CCOCC3
O=C(CSc1ccccn1)Nc3sc2CCCCc2c3C#N	ZINC000000051637	O=C(CSc1ccccn1)Nc3cc2CCCCc2s3
O[C@H]2C[N+]3(Cc1ccccc1N(=O)=O)CCC2CC3	ZINC000000178979	C2C[N+]3(Cc1ccccc1)CCC2CC3
CC(C)(C)CC(=O)Nc1cccc(F)c1	ZINC000000030582	c1ccccc1
CN(C)c5cc[n+](Cc4ccc(CCCCc3ccc(C[n+]2ccc(N1CCCC1)cc2)cc3)cc4)cc5	ZINC000103262564	C5CCN(c4cc[n+](Cc3ccc(CCCCc2ccc(C[n+]1ccccc1)cc2)cc3)cc4)C5
O[C@@](C1=NCCN1)(c2ccc(Cl)cc2)c3ccccn3	ZINC000000000201	C3CN=C(C(c1ccccc1)c2ccccn2)N3
Cc1ccccc1C(=O)N4CCN(c3nc2ccccc2s3)CC4	ZINC000000052879	O=C(N3CCN(c2nc1ccccc1s2)CC3)c4ccccc4
COc3ccc(\C=c2/sc(N1CCN(C(C)=O)CC1)nc2=O)cc3	ZINC000000048273	O=c2nc(N1CCNCC1)sc2=Cc3ccccc3
C5CC=C(c4ccc3n2CCN[C@@H]1CCCc(c12)c3c4)C5	ZINC000000213038	C5CC=C(c4ccc3n2CCNC1CCCc(c12)c3c4)C5
Clc3ccc(NC(=O)CSc2nc1ccccc1[nH]2)nc3	ZINC000000051639	O=C(CSc2nc1ccccc1[nH]2)Nc3ccccn3
Cc3ccc(C)c(NC(=O)CSc2nc1ccccc1s2)c3	ZINC000000097873	O=C(CSc2nc1ccccc1s2)Nc3ccccc3
CNC[C@@H](OC)c1cccc(C(F)(F)F)c1	ZINC000000000313	c1ccccc1
CNC(=O)c3cccc(NC(=O)Cc2ccc1ccccc1c2)c3	ZINC000000007471	O=C(Cc2ccc1ccccc1c2)Nc3ccccc3
C[C@@H]4C[N@](CCC(=O)N2CCC([C@@H](C)N1CCOCC1)CC2)Cc3cc(Cl)ccc3O4	ZINC000012162105	O=C(CCN2CCOc1ccccc1C2)N4CCC(CN3CCOCC3)CC4
CCN(CC)CCNc2c1ccccc1nc3n(C)nc(C)c23	ZINC000000392091	c3ccc2nc1[nH]ncc1cc2c3
Fc4ccc(OCCNCC[C@@H]1CCC(=O)N1[C@@H]3CC[N@@](Cc2ccccc2)C3)cc4	ZINC000012279395	O=C2CCC(CCNCCOc1ccccc1)N2C4CCN(Cc3ccccc3)C4
O=C(C#C)N2CC[C@H]1CNC[C@H]12	ZINC000036236677	C2CC1CNCC1N2
Clc3ccc(S(=O)(=O)c2cc1OCOc1cc2N(=O)=O)cc3	ZINC000000081280	O=S(=O)(c1ccccc1)c3ccc2OCOc2c3
COc2cccc3[C@@H]1CC[N@@](CC=C)[C@H]1CCc23	ZINC000000013943	C3CC1C(CCc2ccccc12)N3
Cc3ccc(NC(=O)Nc1ccccc1C(=O)N2CCCCC2)cc3	ZINC000000045764	O=C(Nc1ccccc1)Nc2ccccc2C(=O)N3CCCCC3
Cc3ccc(C(=O)c2ccn(C(=O)c1ccc(F)cc1)n2)c(C)c3	ZINC000000045767	O=C(c1ccccc1)c3ccn(C(=O)c2ccccc2)n3
COC(=O)c1coc(=O)c(Br)c1	ZINC000000045768	O=c1cccco1
NC(=N)[C@@H](O)c2ccc1OCOc1c2	ZINC000000000559	C2Oc1ccccc1O2
COc2ccc(OCC(=O)Nc1ccccc1C(C)C)cc2	ZINC000000044486	O=C(COc1ccccc1)Nc2ccccc2
Cc3ccc2nc(N1CCCC1)[nH]c2c3	ZINC000000226437	C3CCN(c2nc1ccccc1[nH]2)C3
O=N(=O)c2ccc(C[n+]1ccc(C#N)cc1)cc2	ZINC000000157942	C(c1ccccc1)[n+]2ccccc2
CNCc1ccc(Cl)cc1	ZINC000000161985	c1ccccc1
Nc2cc(N)nc(SCC(=O)c1ccccc1)n2	ZINC000000351585	O=C(CSc1ncccn1)c2ccccc2
CNCc1cccc(Cl)c1	ZINC000000161986	c1ccccc1
CC[C@@]1(O)C[C@H](C)[N@@](C)C[C@@H]1C	ZINC000000251730	C1CCNCC1
Clc2ccc(NC(=O)c1cc[nH]n1)cc2	ZINC000000028525	O=C(Nc1ccccc1)c2cc[nH]n2
Cc2nn(c1ccccc1)c(C)c2C(N)=O	ZINC000000109940	c2ccc(n1cccn1)cc2
CCOc3cccc(\C=N\N2CCN(c1ccccc1)CC2)c3O	ZINC000000046638	C2CN(c1ccccc1)CCN2N=Cc3ccccc3
N[C@@H](CO)Cc1c[nH]cn1	ZINC000000388732	c1c[nH]cn1
FC(F)(F)c2oc1ccccc1c(=O)c2Cl	ZINC000000112303	O=c1ccoc2ccccc12
COc4ccc([C@@]2(O)CN1CCCSC1=[N+]2c3ccc(Br)cc3)cc4	ZINC000000624123	C4CSC3=[N+](c1ccccc1)C(c2ccccc2)CN3C4
CC2CCN(CC[C@@H](C)N(C)S(=O)(=O)c1cccc(C)c1)CC2	ZINC000000007275	O=S(=O)(NCCCN1CCCCC1)c2ccccc2
CC(C)Cn2c(=O)n(CC(C)C)c1[nH]c(C)nc1c2=O	ZINC000000004539	O=c2[nH]c(=O)c1nc[nH]c1[nH]2
CC2(C)COC(C1CCNCC1)OC2	ZINC000000161912	C2COC(C1CCNCC1)OC2
O=C(NC[C@H]1C[C@@H]2CCN1C[C@@H]2C[N@]4CCc3ccccc3C4)c5ccccc5	ZINC000008635584	O=C(NCC1CC2CCN1CC2CN4CCc3ccccc3C4)c5ccccc5
CCCCN1CCNCC1	ZINC000019365428	C1CNCCN1
C[N@@](CCc1ccccn1)[C@@H]3CC(=O)N(c2ccccc2)C3=O	ZINC000000272674	O=C2CC(NCCc1ccccn1)C(=O)N2c3ccccc3
COc2ccc(/N=C/c1ccc(Br)c(N(=O)=O)c1)cc2	ZINC000000062170	C(=Nc1ccccc1)c2ccccc2
C2CC(=Cc1c[nH]cn1)CCN2	ZINC000000016613	C2CC(=Cc1c[nH]cn1)CCN2
C4C[C@H](Nc1ncnc2[nH]cnc12)c3ccccc3C4	ZINC000000006896	C4CC(Nc1ncnc2[nH]cnc12)c3ccccc3C4
O[C@@H](COc2ccc(C(=O)N1CCCCC1)cc2)CN3CCCCC3	ZINC000000380785	O=C(N1CCCCC1)c3ccc(OCCCN2CCCCC2)cc3
O=C(c1ccccc1)c3cn2ccccc2n3	ZINC000000004537	O=C(c1ccccc1)c3cn2ccccc2n3
C[N@]1[C@H]3CC[C@@H]1CC(NS(=O)(=O)c2cccc(C(F)(F)F)c2)C3	ZINC000000135928	O=S(=O)(NC1CC2CCC(C1)N2)c3ccccc3
Cn1nccc1c2ccccc2O	ZINC000000139910	c2ccc(c1ccn[nH]1)cc2
CC[C@@H](C)C(=O)CN(C)C	ZINC000001761313	nonring
COC(=O)c3c(NC(=O)Cc1cccs1)sc2C[C@@H](C)CCc23	ZINC000000064653	O=C(Cc1cccs1)Nc3cc2CCCCc2s3
Brc2ccc(CC(=O)NC[C@@H]1CCCO1)cc2	ZINC000000030456	O=C(Cc1ccccc1)NCC2CCCO2
Cc2ccc(NCc1cc(Br)ccc1O)nc2	ZINC000000031566	C(Nc1ccccn1)c2ccccc2
OC(=O)c4ccc3c(=O)n(CCCc2nc1ccccc1[nH]2)c(=O)c3c4	ZINC000000197916	O=c3n(CCCc2nc1ccccc1[nH]2)c(=O)c4ccccc34
CCOC(=O)c2cnc1c(C)c(C)ccc1c2NC[C@@H](C)O	ZINC000000148366	c2ccc1ncccc1c2
Nc2cc(N)nc(SCC(=O)N1CCCCC1)n2	ZINC000000421016	O=C(CSc1ncccn1)N2CCCCC2
OCCn2ccc1CCCCc12	ZINC000000031984	C2CCc1[nH]ccc1C2
Nc3nc(N2CCN(C/C=C/c1ccccc1)CC2)nc4ccccc34	ZINC000000520249	C3CN(c2ncc1ccccc1n2)CCN3CC=Cc4ccccc4
CN(C)CCCN(CCCN(C)C)CC1CCCCC1	ZINC000002479841	C1CCCCC1
C[C@@H](CCN(C)C)NC(=O)NC[C@@](C)(O)CN1CCOCC1	ZINC000073906472	C1COCCN1
C[N@@](Cn1c(=O)oc2ccccc12)C3CCCCC3	ZINC000000034170	O=c2oc1ccccc1n2CNC3CCCCC3
CCS(=O)(=O)N2CCC(C(=O)NCC[N@]1CCCC[C@@H]1C)CC2	ZINC000000262546	O=C(NCCN1CCCCC1)C2CCNCC2
O=C3O[C@@H]([C@@H]1OC(=O)c2ccccc12)c4ccccc34	ZINC000000028457	O=C3OC(C1OC(=O)c2ccccc12)c4ccccc34
Cc2cc(NCc1cccnc1)nc(N)n2	ZINC000000073355	C(Nc1ccncn1)c2cccnc2
CN5C[C@@H](c1ccccc1)N(CCCC[N@]3C[C@@H](c2ccccc2)N(C)C[C@H]3c4ccccc4)C[C@H]5c6ccccc6	ZINC000022034992	C(CCN2CC(c1ccccc1)NCC2c3ccccc3)CN5CC(c4ccccc4)NCC5c6ccccc6
CCOc3cc(\C=N\c2sc1CCCCc1c2C#N)ccc3O	ZINC000000047317	C3CCc2sc(N=Cc1ccccc1)cc2C3
CCC[N@@](CC1CC1)Cc2ccc(N(=O)=O)cc2	ZINC000000042931	C1CC1CNCc2ccccc2
Nc2nc(c1ccncc1)cc(=O)[nH]2	ZINC000000025651	O=c2cc(c1ccncc1)nc[nH]2
FC(F)(F)c2ccnc(N1CCCNCC1)n2	ZINC000000066276	C2CNCCN(c1ncccn1)C2
CC(C)(CO)NC[C@H](O)Cn2c1ccccc1c3ccccc23	ZINC000000339502	c1ccc3c(c1)[nH]c2ccccc23
Fc3ccc(c1[nH]cnc1c2ccncc2)cc3	ZINC000000007301	c3ccc(c1[nH]cnc1c2ccncc2)cc3
CSc3ccc(C(=O)[C@@H]2CCC[N@@](Cc1ccc(OCCN(C)C)cc1)C2)cc3	ZINC000019720669	O=C(C2CCCN(Cc1ccccc1)C2)c3ccccc3
COn1c(C)c(C(C)=O)c3c1ccc2nonc23	ZINC000000087057	c3cc2c(ccc1nonc12)[nH]3
C[N@]4CCC(c3noc(CCC(=O)NCCCN2CCN(c1cc(C)ccc1C)CC2)n3)=CC4	ZINC000033069175	O=C(CCc2nc(C1=CCNCC1)no2)NCCCN4CCN(c3ccccc3)CC4
Cc3nn(c1ccccc1)c4OC(N)=C(C#N)[C@H](c2ccoc2)c34	ZINC000000031808	O3C=CC(c1ccoc1)c4cnn(c2ccccc2)c34
CC4(C)CN(c3cc(=O)c2ccc1ccccc1c2o3)CCO4	ZINC000000003117	O=c2cc(N1CCOCC1)oc4c2ccc3ccccc34
O=S(=O)(N1CCCC1)c2cccc3nonc23	ZINC000000105009	O=S(=O)(N1CCCC1)c2cccc3nonc23
C[C@@H](N1CCC(=C)CC1)[C@](O)(Cn2cncn2)c3ccc(F)cc3F	ZINC000000006251	C=C3CCN(CC(Cn1cncn1)c2ccccc2)CC3
CN(C)c1cc[n+](C#N)cc1	ZINC000000404803	c1ccncc1
C[C@@]12NCCN1C(=O)OC23CCCCC3	ZINC000000139605	O=C3OC1(CCCCC1)C2NCCN23
Cc2nc(NC(=O)CNCC1CC1)sc2C	ZINC000000256458	O=C(CNCC1CC1)Nc2nccs2
O=S2(=O)Nc1ccccc1N2	ZINC000000009186	O=S2(=O)Nc1ccccc1N2
C2CN=C(c1ccoc1)N2	ZINC000000152432	C2CN=C(c1ccoc1)N2
CN(C)S(=O)(=O)N1CCCCC1	ZINC000000030853	C1CCNCC1
CN(C1CC(C)(C)N(C)C(C)(C)C1)S(=O)(=O)c2ccc(C)cc2	ZINC000000052954	O=S(=O)(NC1CCNCC1)c2ccccc2
Cn1ccnc1S(=O)(=O)C(=C/c2ccc(C(F)(F)F)cc2)/C#N	ZINC000000096351	O=S(=O)(C=Cc1ccccc1)c2ncc[nH]2
O=C1CSCC(=O)N1c3ccc2OCOc2c3	ZINC000000101032	O=C1CSCC(=O)N1c3ccc2OCOc2c3
CCOC(=O)C(=C/c1ncc(N(=O)=O)n1C)/C(C)=O	ZINC000000001990	c1c[nH]cn1
CN2CCC(OC(=O)CCCCC(=O)OC1(C#C)CCN(C)CC1)(C#C)CC2	ZINC000005510071	O=C(CCCCC(=O)OC1CCNCC1)OC2CCNCC2
COc1cc(N)c(Cl)cc1C(=O)OCCN2CCCCC2	ZINC000000006097	O=C(OCCN1CCCCC1)c2ccccc2
C[N@@](CCOc1ccc(NS(C)(=O)=O)cc1)CCc2ccc(NS(C)(=O)=O)cc2	ZINC000000596731	C(COc1ccccc1)NCCc2ccccc2
CC(C)(C)[C@H](CN1CCCC1)OC(=O)c2ccccc2	ZINC000000111481	O=C(OCCN1CCCC1)c2ccccc2
COc3ccc2n(C)c(C)c(C(=O)CNC1=NCCS1)c2c3	ZINC000000117589	O=C(CNC1=NCCS1)c2c[nH]c3ccccc23
O=C2OC[C@H](c1ccccc1)N2C(=O)\C=C\c3ccccc3	ZINC000000044217	O=C2OCC(c1ccccc1)N2C(=O)C=Cc3ccccc3
CC2CCC(C(=O)Nc1ccc(C)cc1)CC2	ZINC000000050903	O=C(Nc1ccccc1)C2CCCCC2
CN5CCC(NC(=O)[C@@H]2C[N@@](Cc1ccccc1)C[C@]24CCc3ccccc3C4=O)CC5	ZINC000019588184	O=C(NC1CCNCC1)C3CN(Cc2ccccc2)CC35CCc4ccccc4C5=O
CN3CCN(c2c(C=O)c1ccccc1n2C)CC3	ZINC000000168735	C3CN(c2cc1ccccc1[nH]2)CCN3
c3ccc(c1ncc2ccccn12)cc3	ZINC000000145284	c3ccc(c1ncc2ccccn12)cc3
CC(=C)[C@@H]2Cc1nc(N)nc(C)c1C2	ZINC000000248514	C2Cc1cncnc1C2
C[N@@]2CC(CNC(=O)OCc1ccccc1)CC3C2Cc4cn(C)c5cccc3c45	ZINC000000537987	O=C(NCC2CNC1Cc3c[nH]c4cccc(C1C2)c34)OCc5ccccc5
CC2=C(C#N)[C@@H](c1ccc[n+](C)c1)C(C#N)=C(N)S2	ZINC000000496102	S2C=CC(c1cccnc1)C=C2
CC4[C@@H]2[C@@H](N(c1ccccc1)N=C2C)c3ccccc3[N+]4=O	ZINC000000162198	O=[N+]3CC2C=NN(c1ccccc1)C2c4ccccc34
C[S@](=O)CCCN	ZINC000014593756	nonring
CN2CCC(OC(=O)COc1ccccc1)CC2	ZINC000000383098	O=C(COc1ccccc1)OC2CCNCC2
OC(=O)c1ccccc1NS(=O)(=O)c2ccccc2C#N	ZINC000000074779	O=S(=O)(Nc1ccccc1)c2ccccc2
O=C(Nc3c1CCCCc1nc2CCCc23)C(c4ccccc4)c5ccccc5	ZINC000000721614	O=C(Nc3c1CCCCc1nc2CCCc23)C(c4ccccc4)c5ccccc5
COc1ccccc1CNC(N)=N	ZINC000000235180	c1ccccc1
CCOc2ccc(CNCc1ccccc1OC)cc2	ZINC000000172118	C(NCc1ccccc1)c2ccccc2
NCCc2ccc(S(=O)(=O)N1CCOCC1)cc2	ZINC000000056364	O=S(=O)(N1CCOCC1)c2ccccc2
CCOC(=O)C(CCN(C)C)(CCN(C)C)c1ccccc1	ZINC000001593319	c1ccccc1
CN(C[C@H]2CCC[N@@](CCc1ccc(F)cc1)C2)Cc4ccc3ccccc3n4	ZINC000011938368	C4CC(CNCc2ccc1ccccc1n2)CN(CCc3ccccc3)C4
CCOC(=O)c1cc(CC)sc1NC(=O)c2ccc(N(=O)=O)o2	ZINC000000090980	O=C(Nc1cccs1)c2ccco2
c4ccc(c3nc(c1ccccn1)nc(c2ccccn2)n3)nc4	ZINC000000039221	c4ccc(c3nc(c1ccccn1)nc(c2ccccn2)n3)nc4
CC(=O)Nc2ccc(/N=C/c1cc(Br)ccc1O)cc2	ZINC000000061151	C(=Nc1ccccc1)c2ccccc2
CNCCCNCc2c(OCc1ccc(F)cc1)ccc3ccccc23	ZINC000008376916	C(Oc2ccc1ccccc1c2)c3ccccc3
Nc2cnc1ccccc1c2	ZINC000000039224	c2ccc1ncccc1c2
CN2CCN(c1ccc(N)cn1)CC2	ZINC000000167487	C2CN(c1ccccn1)CCN2
CC(C)Oc1ccccc1N4CCN(Cc3cccc([C@H](O)c2ccccc2)c3)CC4	ZINC000000598768	C2CN(c1ccccc1)CCN2Cc4cccc(Cc3ccccc3)c4
OC(=O)[C@@H]1CCCC[C@H]1C(=O)N3CCN(c2ccc(Cl)cc2)CC3	ZINC000000031434	O=C(C1CCCCC1)N3CCN(c2ccccc2)CC3
CC[C@@H](C)c2ccc(NC(=O)c1ccccc1Br)cc2	ZINC000000101495	O=C(Nc1ccccc1)c2ccccc2
C[C@@H](N(c1ccccc1)S(C)(=O)=O)C(=O)NCc2ccccc2C	ZINC000000080399	O=C(CNc1ccccc1)NCc2ccccc2
CCOC(=O)[C@@H]3CCC[N@@](Cc2coc1ccc(Cl)cc1c2=O)C3	ZINC000000278729	O=c2c(CN1CCCCC1)coc3ccccc23
Brc3ccc(c2noc(c1ccc(N(=O)=O)cc1)n2)cc3	ZINC000000080665	c3ccc(c2noc(c1ccccc1)n2)cc3
C(CN2CCN(c1ccccn1)CC2)Cc3ccccc3	ZINC000000025902	C(CN2CCN(c1ccccn1)CC2)Cc3ccccc3
CNC(=O)c2cccc(NC(=O)OCc1ccc(C)cc1)c2	ZINC000000025903	O=C(Nc1ccccc1)OCc2ccccc2
O=C(C1CCNCC1)N4CCN(c2cccc3[nH]ccc23)CC4	ZINC000000025900	O=C(C1CCNCC1)N4CCN(c2cccc3[nH]ccc23)CC4
Clc4cccc(N3CCN(C2CCN(CCc1ccccc1)CC2)CC3)c4	ZINC000000757901	C2CN(CCc1ccccc1)CCC2N4CCN(c3ccccc3)CC4
Cc1ccc(OC[C@@H](O)CN)cc1	ZINC000000289623	c1ccccc1
COc2ccc(CNC(=O)c1ccc(C)c(C)c1)cc2	ZINC000000029936	O=C(NCc1ccccc1)c2ccccc2
C[C@@H]1CCCCC[N+]1(C)CCO	ZINC000001670746	C1CCCNCC1
CC(C)NS(=O)(=O)c2ccc(N1CCN(C)CC1)nc2	ZINC000000481386	C2CN(c1ccccn1)CCN2
COc1ccccc1N4CCN(CCc3ccc2[nH]c(=O)sc2c3)CC4	ZINC000000604740	O=c4[nH]c3ccc(CCN2CCN(c1ccccc1)CC2)cc3s4
NC(=O)C4CCN(CCCn2c1ccccc1sc3ccc(Cl)cc23)CC4	ZINC000000538183	C4CCN(CCCn2c1ccccc1sc3ccccc23)CC4
CC(=O)N4CCC([N@](CC2CCN(Cc1ccccc1F)CC2)C[C@@H]3CCCO3)CC4	ZINC000012072399	C4COC(CN(CC2CCN(Cc1ccccc1)CC2)C3CCNCC3)C4
NCc1c[nH]c2ccccc12	ZINC000000152322	c2ccc1[nH]ccc1c2
CNC(=O)CN1CCC(NC(=O)CCNC(C)C)CC1	ZINC000037618613	C1CCNCC1
C[N@]1CCCC[C@@H]1C(C)(C)OC(=O)C(c2ccccc2)c3ccccc3	ZINC000000608026	O=C(OCC1CCCCN1)C(c2ccccc2)c3ccccc3
CC(C)C(=O)N(C)C1CCCCC1	ZINC000000029802	C1CCCCC1
O=C(COc3ccc2c1CCCCCc1c(=O)oc2c3)c4ccccc4	ZINC000000118906	O=C(COc3ccc2c1CCCCCc1c(=O)oc2c3)c4ccccc4
CCN5CCN(c4nnc(n1cccc1C(=O)N3CCN(C2CCCCC2)CC3)s4)CC5	ZINC000009269466	O=C(N2CCN(C1CCCCC1)CC2)c3cccn3c5nnc(N4CCNCC4)s5
C[C@@H]3C[C@@](O)(CC(O)(c1ccccc1)c2ccccc2)[C@@H](C)C[N@]3C	ZINC000000036733	C3CC(CC(c1ccccc1)c2ccccc2)CCN3
COc2cccc(NC(=O)N1CCC([N@@](C)C(C)C)CC1)c2	ZINC000000260979	O=C(Nc1ccccc1)N2CCCCC2
Nc3nc2n([C@@H]1CC[C@H](CO)O1)cnc2c(=O)[nH]3	ZINC000000024612	O=c2[nH]cnc3n(C1CCCO1)cnc23
CN2CCN(\C=N\c1ncc(C(F)(F)F)cc1Cl)CC2	ZINC000000133240	C2CN(C=Nc1ccccn1)CCN2
CCN(CC)Cc2ccc(NC(=O)c1ccc(C)cc1Cl)cc2	ZINC000000568261	O=C(Nc1ccccc1)c2ccccc2
COc1ccc(Cl)cc1NC(=O)CN2CCC(C)CC2	ZINC000000127784	O=C(CN1CCCCC1)Nc2ccccc2
CNc1nccn2c(Br)cnc12	ZINC000000003750	c2cn1ccnc1cn2
O=C(CCN2CCN(c1ccccc1)CC2)Nc3ccccc3	ZINC000000176362	O=C(CCN2CCN(c1ccccc1)CC2)Nc3ccccc3
C2CN=C(COc1cccnc1)N2	ZINC000000066462	C2CN=C(COc1cccnc1)N2
CN(C)CCN(Cc3ccc(c2ccc(CNCCc1ccccc1)cc2)cc3)C(=O)Nc4ccccc4	ZINC000028395772	O=C(NCc3ccc(c2ccc(CNCCc1ccccc1)cc2)cc3)Nc4ccccc4
CCOc2ccc(NS(=O)(=O)c1cnc(Cl)c(Cl)c1)cc2	ZINC000000347114	O=S(=O)(Nc1ccccc1)c2cccnc2
Cc1ncsc1[C@H](O)c2ccoc2	ZINC000000006235	C(c1ccoc1)c2cncs2
C[C@@H]2[C@H](c1ccccc1)[N@@](C)CCC2(NC(C)=O)NC(C)=O	ZINC000000185341	C2CCC(c1ccccc1)NC2
CCOC(=O)[C@@H]2CCC[N@@](Cc1ccc(OC)c(C)c1C)C2	ZINC000000241132	C2CCN(Cc1ccccc1)CC2
Oc2nc(SCc1ccccc1)[nH]c(=O)c2c3ccccc3	ZINC000000053607	O=c2[nH]c(SCc1ccccc1)ncc2c3ccccc3
CCOC(=O)c2cccc(NC(=O)Cc1cccs1)c2	ZINC000000031726	O=C(Cc1cccs1)Nc2ccccc2
COc2ccc(C(=O)Nc1ccncc1)c3cccnc23	ZINC000000022966	O=C(Nc1ccncc1)c2cccc3ncccc23
CCOC(=O)C1CCN(C(C)(C)C=O)CC1	ZINC000000168201	C1CCNCC1
COc6ccc5c(C)cc(N[C@H]4CC[C@H](NCc2cn(C)c3ccc(OCc1ccccc1)cc23)C4)nc5c6	ZINC000028951154	C3CC(Nc2ccc1ccccc1n2)CC3NCc5c[nH]c6ccc(OCc4ccccc4)cc56
CCc1cc(N)nc(N)n1	ZINC000000330466	c1cncnc1
NC(=O)C3CCN([C@H]2CC(=O)N(Cc1ccc(Cl)cc1)C2=O)CC3	ZINC000000101140	O=C2CC(N1CCCCC1)C(=O)N2Cc3ccccc3
COC(=O)[C@H]2CN(c1ccc(C)cc1)C(=O)C2	ZINC000000050014	O=C1CCCN1c2ccccc2
Cc2ccc(NC(=O)c1cccc(/C=C/C(O)=O)c1)cc2	ZINC000000035248	O=C(Nc1ccccc1)c2ccccc2
Cc1ccccc1Cn2cccc2\C=c4\c(=O)nc3sccn3c4=N	ZINC000000091907	N=c3c(=Cc1cccn1Cc2ccccc2)c(=O)nc4sccn34
CC(C)(C)NC[C@@H](O)COc2cccc1CCCSc12	ZINC000000000748	C2CSc1ccccc1C2
COCCNCCNC(=O)c2cnn([C@@H]1CCCNC1)c2	ZINC000646906015	C2CNCC(n1cccn1)C2
O=C1NCCC12CCNCC2	ZINC000002391737	O=C1NCCC12CCNCC2
O=C(NC[C@H]3CCC[N@@](Cc2ccc(CN1CCCC1)s2)C3)c4ccco4	ZINC000011955699	O=C(NCC3CCCN(Cc2ccc(CN1CCCC1)s2)C3)c4ccco4
COc2cc(CC1=NCCN1)cc(OC)c2OC	ZINC000000001914	C2CN=C(Cc1ccccc1)N2
COC1CCNCC1	ZINC000002527203	C1CCNCC1
ClC(N1CCCC1)=[N+]2CCCC2	ZINC000000404790	C2CCN(C=[N+]1CCCC1)C2
CC[C@@H](O)c2ccc(OC[C@@H](O)CN1CCCCC1)c(OC)c2	ZINC000000238695	C2CCN(CCCOc1ccccc1)CC2
CN(C)c3ccc(\C=N\N2CCN(c1ccccc1)CC2)cc3	ZINC000000136497	C2CN(c1ccccc1)CCN2N=Cc3ccccc3
c2cc(c1ccncc1)ccn2	ZINC000000043467	c2cc(c1ccncc1)ccn2
Cc1ccsc1C[N@]2CCC[C@@H]2CO	ZINC000000212939	C2CCN(Cc1cccs1)C2
COCC[N@]2CCCN(C(=O)[C@H]1C[C@H](O)CN1)CC2	ZINC000037826876	O=C(C1CCCN1)N2CCCNCC2
FC(F)(F)c4cccc(CN3CCC(NC(=O)NCc2ccc(CN1CCCC1)cc2)CC3)c4	ZINC000058166396	O=C(NCc2ccc(CN1CCCC1)cc2)NC4CCN(Cc3ccccc3)CC4
CC3CCN(Cn2cnn(CN1CCC(C)CC1)c2=S)CC3	ZINC000000102969	S=c2n(CN1CCCCC1)cnn2CN3CCCCC3
O=C1CCC(=O)N1c2ccccn2	ZINC000000104018	O=C1CCC(=O)N1c2ccccn2
CN2CCC(=NOC(=O)Nc1ccccc1)CC2	ZINC000000171161	O=C(Nc1ccccc1)ON=C2CCNCC2
Cc2nc1ccccc1c(=O)n2CCCn3ccnc3	ZINC000000181323	O=c2n(CCCn1ccnc1)cnc3ccccc23
CCOC(=O)[C@@H]2CCC[N@@](CCC(=O)Nc1ccccc1C)C2	ZINC000000256744	O=C(CCN1CCCCC1)Nc2ccccc2
CN3C(=O)[C@]2(NN=C(c1ccc(C)cc1)S2)c4ccccc34	ZINC000000033902	O=C2Nc1ccccc1C24NN=C(c3ccccc3)S4
ClC1=CC[C@@H]3[C@@H](C1)C(=O)N(CC[n+]2ccccc2)C3=O	ZINC000000105262	O=C2C1CC=CCC1C(=O)N2CC[n+]3ccccc3
Cn2c(NCc1cccnc1)ncc2c3ccc(Br)cc3	ZINC000000819078	C(Nc2ncc(c1ccccc1)[nH]2)c3cccnc3
O=c3[nH]c2ccc(S(=O)(=O)NCCN1CCCCC1)cc2c4ccccc34	ZINC000000603138	O=c3[nH]c2ccc(S(=O)(=O)NCCN1CCCCC1)cc2c4ccccc34
Brc1ccc(C#N)o1	ZINC000000097639	c1ccoc1
Cn1c(Cl)c[n+](C)c1[C@@H](O)c2ccccc2	ZINC000000231570	C(c1ccccc1)c2ncc[nH]2
COc2ccc(S(=O)(=O)Nc1nc(C(F)(F)F)cs1)cc2	ZINC000000083114	O=S(=O)(Nc1nccs1)c2ccccc2
NC(=N)NCc2nc(c1ccccc1F)cs2	ZINC000000013096	c2ccc(c1cscn1)cc2
CC(=O)NNC(=O)c1ccccc1N	ZINC000000032162	c1ccccc1
CC(=NNC(N)=N)c3ccc(N2CCN(c1ccc(C(C)=NNC(N)=N)cc1)CC2)cc3	ZINC000008627530	C2CN(c1ccccc1)CCN2c3ccccc3
CNc1nc(F)cc(F)n1	ZINC000000039457	c1cncnc1
O=C(N[C@@H](c1ccccc1)n2nnc3ccccc23)c4ccccc4	ZINC000000032169	O=C(NC(c1ccccc1)n2nnc3ccccc23)c4ccccc4
Cc2cc(C)c(C#N)c(SCC(=O)c1ccc(O)c(O)c1)n2	ZINC000000121780	O=C(CSc1ccccn1)c2ccccc2
C[N+]3(C)CCc2cc1OCOc1cc2[C@@H]3[C@@H]5OC(=O)c6c4OCOc4ccc56	ZINC000000629247	O=C5OC(C2NCCc3cc1OCOc1cc23)c6ccc4OCOc4c56
CCOC(=O)C[C@@H]3CC1=[N+](CCc2cc(OC)c(OC)cc12)C[C@@H]3CC	ZINC000000638899	C1CC[N+]3=C(C1)c2ccccc2CC3
O=C(N1CCOCC1)c3nc2ccccn2c3CNCCCCN4CCCCCC4	ZINC000011664209	O=C(N1CCOCC1)c3nc2ccccn2c3CNCCCCN4CCCCCC4
COc4ccc3CC[N@@](C)[C@H](CCc1ccccc1)Cc2ccc(OC)c(O)c2c3c4	ZINC000000607716	C4Cc1ccccc1c2ccccc2CC(CCc3ccccc3)N4
O=C1NCN2CCC1CC2	ZINC000009484918	O=C1NCN2CCC1CC2
CSc2nc(c1ccco1)n[nH]2	ZINC000000115211	c2coc(c1nc[nH]n1)c2
CN(C)Cc1ccncc1	ZINC000001662338	c1ccncc1
CCOC(=O)N3CCC(N1CCC2(CC1)N(CC)C(=O)N(CCN(C)C)C2=O)CC3	ZINC000014541619	O=C3NC(=O)C2(CCN(C1CCNCC1)CC2)N3
Cn3c[n+](CCCC[n+]1cn(C)c2ccccc12)c4ccccc34	ZINC000003077449	C(CC[n+]1c[nH]c2ccccc12)C[n+]3c[nH]c4ccccc34
CNc5nc([C@@H]1CCCNC1)nc4CCN(C(=O)c3ccc(CN2CCCCC2)cc3)Cc45	ZINC000019710289	O=C(N3CCc2nc(C1CCCNC1)ncc2C3)c5ccc(CN4CCCCC4)cc5
CSC2=NC(C)(C)C[C@@](C)(c1ccc(O)cc1O)N2	ZINC000000033343	C2CC(c1ccccc1)NC=N2
Clc3c(N1CCOCC1)c(=O)c2ccccc2c3=O	ZINC000000021268	O=c2cc(N1CCOCC1)c(=O)c3ccccc23
COc2ccc(CC[C@H](C)NCc1ccc(Cl)c(Cl)c1)cc2	ZINC000000279821	C(CNCc1ccccc1)Cc2ccccc2
Cc2cc(Cl)c1c(N)c(C)cc(C)c1n2	ZINC000000092783	c2ccc1ncccc1c2
COC[C@@H](C)NCC(=O)Nc2ccc(Oc1ccc(NC(=O)CN[C@H](C)COC)cc1)cc2	ZINC000009562588	O(c1ccccc1)c2ccccc2
CC(=O)Oc2c(C)c(C)c1O[C@@](C)(CC[N+](C)(C)C)CCc1c2C	ZINC000000012154	C2COc1ccccc1C2
NCc1ccn(=O)cc1	ZINC000001733253	O=n1ccccc1
CN(C)CCNC(=O)Cn2nc(c1ccc(C)cc1)ccc2=O	ZINC000000220025	O=c2ccc(c1ccccc1)n[nH]2
CN(C)CCSc3nc(N)c2c1CC(C)(C)OCc1sc2n3	ZINC000000534356	C1Cc2c(CO1)sc3ncncc23
CN(CCCO)CCCO	ZINC000001577504	nonring
CN(C)Cc1ccc(OC(=O)N(C)C)c(Cl)c1	ZINC000000187884	c1ccccc1
Oc2ccc(C(=O)OCCN1CCCCC1)cc2	ZINC000000209540	O=C(OCCN1CCCCC1)c2ccccc2
O=C1CCNCCN1	ZINC000001529145	O=C1CCNCCN1
C/C=C(\C)CN2CCN(c1ccccc1)CC2	ZINC000000277640	C2CN(c1ccccc1)CCN2
CC[N+](CC)(CC)CCO	ZINC000000394634	nonring
CCn3c(=O)c(=C\C=C1/CCC[N@]1C)\n(c2ccccc2)c3=S	ZINC000000179482	O=c2[nH]c(=S)n(c1ccccc1)c2=CC=C3CCCN3
CNC(=O)Oc1ccccc1C(=O)Nc2ccccc2	ZINC000000000950	O=C(Nc1ccccc1)c2ccccc2
C[C@@H](Cc1c[nH]c2ccc(Cl)cc12)/N=C/c3ccc(N(C)C)cc3	ZINC000000053115	C(Cc1c[nH]c2ccccc12)N=Cc3ccccc3
N[C@H]1CCCC[C@H]1N	ZINC000003593790	C1CCCCC1
NC(=N)n2ncc1C(=O)CCCc12	ZINC000004643006	O=C1CCCc2[nH]ncc12
Nc2nc(Cl)cc(c1ccccc1)n2	ZINC000000039987	c2ccc(c1ccncn1)cc2
FC(F)(F)Oc5ccc([C@H]3[N@@](Cc2ccc1OCCc1c2)CCc4sccc34)cc5	ZINC000020432023	C5Cc4cc(CN2CCc1sccc1C2c3ccccc3)ccc4O5
CN(C)CCNS(=O)(=O)c1cc(C)sc1C	ZINC000000117014	c1ccsc1
CCOc1ccccc1OC[C@@H]2CNCCO2	ZINC000000000833	C2COC(COc1ccccc1)CN2
CC(C)CCNC(=O)C2CCN(Cc1ccccc1O)CC2	ZINC000000299325	C2CCN(Cc1ccccc1)CC2
Nc3ccc2nc(c1cc(O)ccc1N)[nH]c2c3	ZINC000000075591	c3ccc(c2nc1ccccc1[nH]2)cc3
CCN3CCN(c1c(Cl)cccc1NC(=O)COc2ccccc2)CC3	ZINC000000680147	O=C(COc1ccccc1)Nc2ccccc2N3CCNCC3
CC(C)(C)c3cc2nc(C(F)(F)F)cc(N1CCNCC1)n2n3	ZINC000000170720	C3CN(c1ccnc2ccnn12)CCN3
CC(=O)On1c(=O)c3cccc2c(Br)ccc(c1=O)c23	ZINC000000033163	O=c1[nH]c(=O)c3cccc2cccc1c23
CC(C)[N@]1CC=C3[C@H](C1)[C@H](c2cccnc2)C(C#N)(C#N)C(N)=C3C#N	ZINC000000267279	C3NCC2C(c1cccnc1)CC=CC2=C3
CN(C)CCCOc4ccc([C@@H](NC(=O)c2ccc1[nH]c(=O)c(=O)[nH]c1c2)C(=O)N3CCNCC3)cc4	ZINC000028386470	O=C(NC(C(=O)N1CCNCC1)c2ccccc2)c4ccc3[nH]c(=O)c(=O)[nH]c3c4
CCCn3cc(CN(CCc1ccccc1)C[C@@H]2CCC[N@@](C)C2)c(C)n3	ZINC000012301912	C3CNCC(CN(CCc1ccccc1)Cc2cn[nH]c2)C3
COC(=O)[C@H](CC(C)C)NC(=O)C(c1ccccc1)c2ccccc2	ZINC000000054605	C(c1ccccc1)c2ccccc2
C[C@@H](N)Cc1n[nH]c2ccc(Cl)cc12	ZINC000000025581	c2ccc1[nH]ncc1c2
CCC[N@]1CCC[C@H]2[C@H]1CCc3cccc(O)c23	ZINC000000009463	C3CNC2CCc1ccccc1C2C3
NCc1ccc(F)c(C(F)(F)F)c1	ZINC000000156205	c1ccccc1
Cc2cc(C=c1c(=O)[nH]c(=S)[nH]c1=O)c(C)n2C	ZINC000000449440	O=c1[nH]c(=S)[nH]c(=O)c1=Cc2cc[nH]c2
Nc2cc(SCc1cccnc1)nc(N)n2	ZINC000000125124	C(Sc1ccncn1)c2cccnc2
COc2ccc1[nH]c(C(O)=O)c(CCNC(C)=O)c1c2	ZINC000000112920	c2ccc1[nH]ccc1c2
Oc2ccc3C[C@H]5[N@@](CC1CC1)CC[C@@]46[C@@H](Oc2c34)C(=C)CC[C@@]56O	ZINC000000403529	C=C1CCC2C3Cc5cccc6OC1C2(CCN3CC4CC4)c56
Cc1cccc(NS(C)(=O)=O)c1	ZINC000000029557	c1ccccc1
CCN(CC)CCCNc3nccc4c(C)c2[nH]c1ccncc1c2cc34	ZINC000001551834	c4cc3cc2[nH]c1ccncc1c2cc3cn4
CC(C)(C)NS(=O)(=O)c1ccc(F)cc1	ZINC000000029553	c1ccccc1
CC[N@]1CC=C3[C@H](C1)[C@@H](c2ccncc2)C(C#N)=C(N)C3(C#N)C#N	ZINC000000483828	C3NCC2C(c1ccncc1)C=CCC2=C3
CC(C)Cc3ccc([C@H](C)C(=O)Nc2ccc1OCCOc1c2)cc3	ZINC000000112505	O=C(Cc1ccccc1)Nc3ccc2OCCOc2c3
CCN(CC)Cc1nccn1c2ccc(N(=O)=O)cc2C(=O)c3ccccc3Cl	ZINC000000538096	O=C(c1ccccc1)c2ccccc2n3ccnc3
Cc2ccc1oc(=O)ccc1c2	ZINC000000057740	O=c2ccc1ccccc1o2
CCOc2cc([C@@H]1N[C@@H](C(O)=O)CS1)ccc2O	ZINC000000085776	C2CSC(c1ccccc1)N2
CC(C)c1cc(Br)c(C)cc1O	ZINC000000001059	c1ccccc1
Cc1nnc(=O)[nH]c1N2CCNCC2	ZINC000000111708	O=c2nncc(N1CCNCC1)[nH]2
CC[N@]1CCC[C@@H]1CNC(=O)CCC4CCN(Cc3ccc2cc(Cl)ccc2n3)CC4	ZINC000012434965	O=C(CCC3CCN(Cc2ccc1ccccc1n2)CC3)NCC4CCCN4
COC(=O)c3ccc(NC(=O)c2cc[n+](Cc1ccccc1)cc2)cc3	ZINC000000437692	O=C(Nc1ccccc1)c3cc[n+](Cc2ccccc2)cc3
CN5CCC([N@@]1C[C@@H]4C[C@H](C1)c3ccc(NC(=O)NC2CCCCC2)c(=O)n3C4)CC5	ZINC000004260367	O=C(NC1CCCCC1)Nc5ccc4C3CC(CN(C2CCNCC2)C3)Cn4c5=O
Clc2c(CN1CCCCC1)c(=O)oc3ccccc23	ZINC000000247568	O=c2oc1ccccc1cc2CN3CCCCC3
COC(=O)CSc2nc(=O)c(=C/c1ccc(C)cc1)/s2	ZINC000000069439	O=c1ncsc1=Cc2ccccc2
CC(C)COC(=O)c1ccc(NC(=O)CNCCCN(C)C)cc1	ZINC000001671699	c1ccccc1
CC(C)OC(=O)Cn3cnc2scc(c1ccc(C)cc1)c2c3=O	ZINC000000098438	O=c2[nH]cnc3scc(c1ccccc1)c23
CC(C)(C)C1(O)CCS(=O)CC1	ZINC000000008932	O=S1CCCCC1
O=C(CCn1c(=O)oc2ccccc12)NCCN3CCCCC3	ZINC000000128540	O=C(CCn1c(=O)oc2ccccc12)NCCN3CCCCC3
COc3ccc(N2C(=O)C[C@H](NC[C@@H]1CCCO1)C2=O)cc3	ZINC000000084384	O=C2CC(NCC1CCCO1)C(=O)N2c3ccccc3
NCC(=O)N[C@H](Cc1ccccc1)c2ccccc2	ZINC000000004154	C(Cc1ccccc1)c2ccccc2
Cc1cccc(C(=O)NCC(O)=O)c1	ZINC000000083665	c1ccccc1
C[C@@H]2C[N@@](C)[C@H](c1ccccc1)CC2=O	ZINC000000184840	O=C2CCNC(c1ccccc1)C2
CN4CCN(c2nc(C)nc3sc1CCCc1c23)CC4	ZINC000000215577	C4Cc3sc2ncnc(N1CCNCC1)c2c3C4
CN(C)C3CCC(Nc2cc(=O)c(NC1CCC(N(C)C)CC1)cc2=O)CC3	ZINC000001614483	O=c2cc(NC1CCCCC1)c(=O)cc2NC3CCCCC3
CN(C)CCc2c[nH]c3ccc(Cn1cncn1)cc23	ZINC000000005895	C(c2ccc1[nH]ccc1c2)n3cncn3
CC3CCN(CC(=O)c2cc(C)n(c1ccc(Cl)c(C(F)(F)F)c1)c2C)CC3	ZINC000000710211	O=C(CN1CCCCC1)c3ccn(c2ccccc2)c3
NC(=N)COCc1ccccc1	ZINC000001718963	c1ccccc1
COC(=O)CCNC(c1ccccc1)c2ccccc2	ZINC000000192435	C(c1ccccc1)c2ccccc2
CCNCC(=O)N(C)C	ZINC000019398740	nonring
CC[n+]3c(C)cc2c([nH]c1ccccc12)c3C	ZINC000000363775	c1ccc3c(c1)[nH]c2cnccc23
NCc1cccn(=O)c1	ZINC000001688670	O=n1ccccc1
CC(=C)c3cccc(C(C)(C)NC(=O)N[C@@H]1CN2CCC1CC2)c3	ZINC000000094195	O=C(NCc1ccccc1)NC2CN3CCC2CC3
CN(C)c2cccc(NS(=O)(=O)c1ccccc1)c2	ZINC000000036063	O=S(=O)(Nc1ccccc1)c2ccccc2
COc4ccc(O)c(C[N@@](CC2CCN(Cc1ccccc1C)CC2)Cc3cccnc3)c4	ZINC000012076568	C2CN(Cc1ccccc1)CCC2CN(Cc3ccccc3)Cc4cccnc4
Cn6c(N4CCN[C@@H](c3ccc(N2CC[C@H](N1CCCC1)C2)cc3)C4)nc(c5ccncc5F)cc6=O	ZINC000034632248	O=c6cc(c1ccncc1)nc(N5CCNC(c4ccc(N3CCC(N2CCCC2)C3)cc4)C5)[nH]6
Cc3ccc(C(=O)Nc2nc1ccccc1c(=O)n2C)cc3	ZINC000000015392	O=C(Nc2nc1ccccc1c(=O)[nH]2)c3ccccc3
CC(C)N[C@H]1CCn2c(=O)[nH]c3cccc([C@@H]1O)c23	ZINC000000004010	O=c1[nH]c3cccc2CCCCn1c23
COc3c(C)c(=O)c2n1CC[C@H](O)c1c(CO)c2c3=O	ZINC000000004240	O=c2ccc(=O)c3n1CCCc1cc23
C1NC[C@@H]3C[C@H]1CN(c2cccnc2)C3	ZINC000000026026	C1NCC3CC1CN(c2cccnc2)C3
C[N@]2CCCN(C(=S)Nc1ccccc1)CC2	ZINC000000097838	S=C(Nc1ccccc1)N2CCCNCC2
COc4ccc(C(=O)C[C@H]([C@@H](C#N)c1cccc2ccccc12)c3ccccc3)cc4	ZINC000000624486	O=C(CC(Cc1cccc2ccccc12)c3ccccc3)c4ccccc4
Oc3ccc(n2c(=O)c1cc(Cl)c(Cl)cc1c2=O)cc3	ZINC000000062552	O=c2n(c1ccccc1)c(=O)c3ccccc23
CC(C)c2ccc(CNC(=O)c1ccccc1Cl)cc2	ZINC000000036064	O=C(NCc1ccccc1)c2ccccc2
NC[C@@H]1COCCO1	ZINC000000874074	C1COCCO1
CC(=O)c1cc(C#N)c(C)nc1C	ZINC000000066391	c1ccncc1
CCCC(=O)c1c[nH]c(C(O)=O)c1	ZINC000000170436	c1cc[nH]c1
OCC[C@@H]1CCCC[N@]1Cc2ccc(C(F)(F)F)cc2	ZINC000000209860	C2CCN(Cc1ccccc1)CC2
OC(=O)CCc1cccs1	ZINC000000085938	c1ccsc1
CN(C)CCn3nc(Cc1ccccc1)c2ccccc2c3=O	ZINC000000002122	O=c2[nH]nc(Cc1ccccc1)c3ccccc23
O[C@H](CN1CCCC1)Cn3c2ccccc2c4ccccc34	ZINC000000133763	C4CCN(CCCn2c1ccccc1c3ccccc23)C4
O=C(CN1CCCCC1)NCCNC(=O)CN2CCCCC2	ZINC000004197586	O=C(CN1CCCCC1)NCCNC(=O)CN2CCCCC2
CNC[C@@H](CC1CCCCC1)NC[C@@H](Cc3ccc2ccccc2c3)NCCc4ccc(Cl)c(Cl)c4	ZINC000096921303	C4CCC(CCNCC(Cc2ccc1ccccc1c2)NCCc3ccccc3)CC4
NC1[C@H]3CC2C[C@@H]1CC(S)(C2)C3	ZINC000000244184	C1C2CC3CC1CC(C2)C3
Nc1ccccc1C(=O)OCC[C@@H]2CCCCN2	ZINC000000000638	O=C(OCCC1CCCCN1)c2ccccc2
COC(=O)c2ccc(NC(=S)N1CCN(C)CC1)cc2	ZINC000000134398	S=C(Nc1ccccc1)N2CCNCC2
COc2c(Sc1ccc(N(=O)=O)cc1)c(C)nn2c3ccccc3	ZINC000000083110	S(c1ccccc1)c3cnn(c2ccccc2)c3
Cn2ncc3c(Nc1ccccc1Br)ncnc23	ZINC000000103307	N(c1ccccc1)c2ncnc3[nH]ncc23
Cc3ccc(C(=O)O/N=C/c2ccc1OCOc1c2)cc3	ZINC000000042299	O=C(ON=Cc2ccc1OCOc1c2)c3ccccc3
CC(C)(C)NC[C@@H](O)c1ccc(O)c(CO)n1	ZINC000000000637	c1ccncc1
C3CCN(C[C@H]2COc1ccccc1O2)CC3	ZINC000000000631	C3CCN(CC2COc1ccccc1O2)CC3
O[C@H](CN1CCCCC1)Cn2ccnc2N(=O)=O	ZINC000000000630	C2CCN(CCCn1ccnc1)CC2
OC([C@@H]1CCCCN1)(c2ccccc2)c3ccccc3	ZINC000000000633	C3CCC(C(c1ccccc1)c2ccccc2)NC3
C3CCN(CCSc2nc1ccccc1[nH]2)C3	ZINC000000182699	C3CCN(CCSc2nc1ccccc1[nH]2)C3
CC(C)NC(=O)N=S(O)(=O)c1cnccc1Nc2cccc(C)c2	ZINC000000005823	N(c1ccccc1)c2ccncc2
C[N@]1CCC[C@@H]1CCNS(=O)(=O)c2ccc(Br)cc2	ZINC000000352673	O=S(=O)(NCCC1CCCN1)c2ccccc2
COc1cccc(OC)c1CN2CCC(N)CC2	ZINC000000154317	C2CCN(Cc1ccccc1)CC2
CCCNCCC	ZINC000001672989	nonring
COc1cc(OCC(O)=O)ccc1CO	ZINC000000156916	c1ccccc1
O=C(NCC2(CN1CCOCC1)CC2)c4cn(C[C@@H]3CCCNC3)nn4	ZINC000067842608	O=C(NCC2(CN1CCOCC1)CC2)c4cn(CC3CCCNC3)nn4
COc3ccc2nc1cc(Cl)ccc1c(N[C@@H](C)CCCN(C)C)c2n3	ZINC000001690210	c3ccc2nc1cccnc1cc2c3
Fc3ccc(C(=O)N2CCN(C[C@H]1CCC=CC1)CC2)cc3	ZINC000000300413	O=C(N2CCN(CC1CCC=CC1)CC2)c3ccccc3
CN(C)C[C@@H](O)COc1ccccc1CCc2ccccc2	ZINC000000013099	C(Cc1ccccc1)c2ccccc2
Cc1csc(NC(=O)/C=C/C(O)=O)n1	ZINC000000313987	c1cscn1
Cc4ccc([C@@H](O)Cn2c1=NCCCn1c3ccccc23)cc4	ZINC000000315384	C1CN=c3n(C1)c2ccccc2n3CCc4ccccc4
Cc1cccc(C)c1CNc2nccn3c(C)c(C)nc23	ZINC000000007680	C(Nc1nccn2ccnc12)c3ccccc3
COc3ccc2c1CCN=Cc1[nH]c2c3	ZINC000000011835	C1Cc2c(C=N1)[nH]c3ccccc23
Cc4ccc3n2CCN=C1CCCc(c12)c3c4	ZINC000000032914	C2CC1=NCCn3c1c(C2)c4ccccc34
Nc1ccncc1Oc2ccccc2	ZINC000000004796	O(c1ccccc1)c2cccnc2
Nc2sc1CCCCc1c2C(=O)c3cccc(Cl)c3	ZINC000000004121	O=C(c1ccccc1)c3csc2CCCCc23
COC(=O)c4ccc(CNCC[C@@H]1CCC(=O)N1C[C@@H]2CCC[N@]3CCCC[C@H]23)cc4	ZINC000012190252	O=C2CCC(CCNCc1ccccc1)N2CC3CCCN4CCCCC34
CC(C)c1nnsc1C(O)=O	ZINC000000166275	c1csnn1
COc3ccc(C(=O)N2CCN(C1CCCCC1)CC2)cc3OC	ZINC000000350356	O=C(N2CCN(C1CCCCC1)CC2)c3ccccc3
O=C(CCN1CCCC1)Nc4c2CCCc2cc3CCCc34	ZINC000000347599	O=C(CCN1CCCC1)Nc4c2CCCc2cc3CCCc34
C[C@@]34CC[C@@H]1[C@H](CCc2cc(O)ccc12)[C@H]3C[C@@H](O)C4=O	ZINC000000001543	O=C4CCC3C2CCc1ccccc1C2CCC34
C/C(=C(/C)c1ccc(O)cc1)c2ccc(O)cc2	ZINC000000001306	C(=Cc1ccccc1)c2ccccc2
Clc1cccc2ccc(N(=O)=O)cc12	ZINC000000039953	c2ccc1ccccc1c2
CN(C)C[C@H]1CCn5c(C1)c(c4c(c2cn(C)c3ccccc23)c(=O)[nH]c4=O)c6ccccc56	ZINC000000591953	O=c4[nH]c(=O)c(c2c1CCCCn1c3ccccc23)c4c5c[nH]c6ccccc56
CCOC(=O)Nc3cc2N[C@@H](C)C(c1ccccc1)=Nc2c(N)n3	ZINC000000004088	C2Nc1ccncc1N=C2c3ccccc3
O=C(CSc2nc1ccccc1[nH]2)N4CCC[C@@H]3CCCC[C@@H]34	ZINC000000051360	O=C(CSc2nc1ccccc1[nH]2)N4CCCC3CCCCC34
Cc2cccn3cc(c1cccs1)cc23	ZINC000000105877	c3ccn2cc(c1cccs1)cc2c3
CC2(C)CC(NC(=O)c1ccccc1F)CC(C)(C)N2	ZINC000000186275	O=C(NC1CCNCC1)c2ccccc2
Cc2cc(C(=O)Nc1ccccc1)no2	ZINC000000121955	O=C(Nc1ccccc1)c2ccon2
Cc3ccc(c2ccc(\C=N\n1cnnc1)o2)c(Br)c3	ZINC000000037664	C(=Nn1cnnc1)c3ccc(c2ccccc2)o3
CCN(C(C)C)C(=O)c2cc(C)cc(OC[C@H](C)Nc1ccncc1)c2	ZINC000000602556	C(COc1ccccc1)Nc2ccncc2
CC[C@@H](N)Cc1cc(OC)c(C)cc1OC	ZINC000000001308	c1ccccc1
CCN(CC)CCC[C@H](C)NCc2c(C)nn(c1ccc(F)cc1)c2C	ZINC000007003612	c2ccc(n1cccn1)cc2
CCCCSC[C@H](N)CO	ZINC000001730265	nonring
Nc2ccn(C1CC(CO)C1)c(=O)n2	ZINC000000011599	O=c1ncccn1C2CCC2
C3CC(c2nc1ccccc1o2)CCN3	ZINC000000252257	C3CC(c2nc1ccccc1o2)CCN3
CC(C)(C)Nc2nc(NC(C)(C)C)nc(N1CCCCC1)n2	ZINC000000185371	C2CCN(c1ncncn1)CC2
CN(C)CCO[C@](C)(c1ccccc1)c2ccc(Cl)cc2	ZINC000000000137	C(c1ccccc1)c2ccccc2
CC(=O)Nc1ccccc1Cl	ZINC000000038614	c1ccccc1
CN([C@@H]1CCCC[C@@H]1N2CCCC2)C(=O)Cc3ccc(Cl)c(Cl)c3	ZINC000000643035	O=C(Cc1ccccc1)NC2CCCCC2N3CCCC3
COc1ccc(C)c(CN(C)C)c1	ZINC000000182967	c1ccccc1
CCOC(=O)C1=C(C)NC3=C([C@H]1c2cc(C)sc2C)C(=O)CCC3	ZINC000000122315	O=C1CCCC3=C1C(c2ccsc2)C=CN3
O=C(CCCCCCC(=O)NCCN1CCCC1)NCCN2CCCC2	ZINC000003901893	O=C(CCCCCCC(=O)NCCN1CCCC1)NCCN2CCCC2
CC[C@](CCCc1cc(OC)c(OC)c(OC)c1)(N(C)C)c2cccs2	ZINC000000596944	C(CCc1cccs1)Cc2ccccc2
COc3ccc(\C=N\n2cnc1ccccc1c2=O)cc3OC	ZINC000000028517	O=c2n(N=Cc1ccccc1)cnc3ccccc23
CCN(C(=O)c1cc(Cl)ccc1OC)c2ccccc2	ZINC000000030822	O=C(Nc1ccccc1)c2ccccc2
CC(C)Nc2nc(N1CCNCC1)nc(Cl)c2C	ZINC000000004468	C2CN(c1ncccn1)CCN2
OC(=O)c1ccc(N(=O)=O)cc1NC(=O)c2ccco2	ZINC000000089134	O=C(Nc1ccccc1)c2ccco2
COc3ccc(N[C@H]2CC(=O)N(c1cccc(Cl)c1)C2=O)cc3	ZINC000000059348	O=C2CC(Nc1ccccc1)C(=O)N2c3ccccc3
CC(=O)N2CC[n+]3cc(c1ccccc1)sc23	ZINC000000392222	C3C[n+]2cc(c1ccccc1)sc2N3
COc3cc2CC[C@H](N)c1cc(=O)c(N)ccc1c2c(OC)c3OC	ZINC000000265532	O=c3cccc2c(CCCc1ccccc12)c3
Cc3ccc2n(C[C@H](O)CN(CC=C)CC=C)c1CCCCc1c2c3	ZINC000000571514	C1CCc2c(C1)[nH]c3ccccc23
Fc3ccc(n2c(=S)[nH]c(=O)\c(=C/c1ccoc1)c2=O)cc3	ZINC000000037485	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc3ccoc3
Cn2nc(c1ccc(Cl)cc1)cc2NC(=O)CCCC(O)=O	ZINC000000154958	c2ccc(c1cc[nH]n1)cc2
CC[C@]2(C)C[C@@H]([C@@H](O)CNCc1ccc(OC)c(OC)c1)CCO2	ZINC000000434064	C(CC1CCOCC1)NCc2ccccc2
NC(=N)Cc3ccc(NC(=O)c2ccc(C(=O)Nc1ccc(CC(N)=N)cc1)cc2)cc3	ZINC000001685586	O=C(Nc1ccccc1)c3ccc(C(=O)Nc2ccccc2)cc3
Clc1ccccc1c3csc(NC(=O)COc2ccccc2)n3	ZINC000000151313	O=C(COc1ccccc1)Nc3nc(c2ccccc2)cs3
CC(=O)Oc1cccc2ccc[n+](C)c12	ZINC000000372370	c2ccc1ncccc1c2
CCC[S@](=O)c2ccc1nc(NC(=O)OC)[nH]c1c2	ZINC000000000017	c2ccc1[nH]cnc1c2
Clc1ccccc1CSC2=NCCCN2	ZINC000000144272	C2CNC(SCc1ccccc1)=NC2
CCN(CC)c3ccc2[nH]c1nc(=O)[nH]c1cc2c3	ZINC000000002864	O=c3nc2[nH]c1ccccc1cc2[nH]3
CC(C)(C)NCC(=O)Nc3c2CCN(Cc1ccccc1)c2nc4ccccc34	ZINC000000755160	C3Cc2cc1ccccc1nc2N3Cc4ccccc4
Clc6ccc5c(NCCCN4CCN(C(c1ccccc1)(c2ccccc2)c3ccccc3)CC4)ccnc5c6	ZINC000064264533	C(CNc1ccnc2ccccc12)CN6CCN(C(c3ccccc3)(c4ccccc4)c5ccccc5)CC6
CCCCN(CCCC)CC#Cc1ccc(C#CCN(CCCC)CCCC)cc1	ZINC000004827949	c1ccccc1
C[C@@H]2CN=C(SCc1ccc(C)cc1)N2	ZINC000000144278	C2CN=C(SCc1ccccc1)N2
COc2cccc(C(=O)Nc1ccc(C(C)=O)cc1)c2	ZINC000000029082	O=C(Nc1ccccc1)c2ccccc2
COc4cccc(C[C@@H](C2CCN(C(=O)[C@@H]1CCCN(C)C1)CC2)[N@@](C)Cc3ccccn3)c4	ZINC000012247041	O=C(C1CCCNC1)N4CCC(C(Cc2ccccc2)NCc3ccccn3)CC4
O=C(CN1CCCCC1)c2c[nH]c3ccccc23	ZINC000000217289	O=C(CN1CCCCC1)c2c[nH]c3ccccc23
NC[C@H](CC(O)=O)c1ccc(Cl)cc1	ZINC000000000061	c1ccccc1
CN(C)CCn1cnc2n(C)c(=O)[nH]c(=O)c12	ZINC000000094845	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
Cc4cccc([N+]3=C1SCCCN1[C@@](O)(c2ccccc2)C3)c4C	ZINC000000425725	C4CSC3=[N+](c1ccccc1)CC(c2ccccc2)N3C4
CC(C)N2CCN(C(=O)c1ccccc1)CC2	ZINC000000115771	O=C(N1CCNCC1)c2ccccc2
Clc2cc(Cl)c(NC(=O)c1ccccc1N(=O)=O)cc2Cl	ZINC000000103157	O=C(Nc1ccccc1)c2ccccc2
O=C(N2CCc1ccccc1C2)C(=C/c3c[nH]c4ccccc34)/C#N	ZINC000000029025	O=C(C=Cc1c[nH]c2ccccc12)N4CCc3ccccc3C4
COc1ccccc1C=Nc2nnc[nH]2	ZINC000000040058	C(=Nc1nnc[nH]1)c2ccccc2
C[N@@]4CCCN(C(=O)[C@@H]2C[C@@H](Sc1nccn1C)CN2CC3CCCCC3)CC4	ZINC000012246540	O=C(C2CC(Sc1ncc[nH]1)CN2CC3CCCCC3)N4CCCNCC4
CCOC(=O)c2c(Cl)c1ccccc1[nH]c2=O	ZINC000000040542	O=c2ccc1ccccc1[nH]2
C2CCC(NCCOCCOCCNC1CCCCC1)CC2	ZINC000005374566	C2CCC(NCCOCCOCCNC1CCCCC1)CC2
COc3ccc(CN2CCN(c1cccc(C(F)(F)F)c1)CC2)c(OC)c3	ZINC000000752272	C2CN(c1ccccc1)CCN2Cc3ccccc3
CN(C)CCn2c(COc1ccccc1)nc3ccccc23	ZINC000000346679	C(Oc1ccccc1)c3nc2ccccc2[nH]3
Oc3c([C@H](N1CCCC1)c2ccc(Cl)cc2)ccc4cccnc34	ZINC000000038269	C4CCN(C(c1ccccc1)c3ccc2cccnc2c3)C4
CNC(=O)C[N@@](C)CCC=C	ZINC000379297316	nonring
C[C@@H]2CN(C(=O)c1ccc(N(=O)=O)cc1)C[C@@H](C)O2	ZINC000000038987	O=C(N1CCOCC1)c2ccccc2
OC(=O)C(=C/c1ccccc1)/C#N	ZINC000000084158	c1ccccc1
CN(C)C(=O)Oc3ccc(OCc2n(C)c1ccccc1[n+]2C)cc3	ZINC000000387384	C(Oc1ccccc1)c3nc2ccccc2[nH]3
CCOC(=O)C1=C(C)N(C)C(SC)=N[C@@H]1c2ccccc2	ZINC000000063631	N2C=CC(c1ccccc1)N=C2
Cc2nnc(Nc1ccc(OC(F)(F)Cl)cc1)c3ccccc23	ZINC000000039058	N(c1ccccc1)c2nncc3ccccc23
CCC5=C(C[C@H]1NCCc2cc(OC)c(OC)cc12)C[C@H]3[N@@](CCc4ccccc34)C5	ZINC000001721518	C5Cc1ccccc1C(CC4=CCN3CCc2ccccc2C3C4)N5
CN(C)CCCN(CCCN(C)C)CC1=CC[C@@H]2C[C@H]1C2(C)C	ZINC000004987446	C1C=CC2CC1C2
C[C@@H](N)[C@@H]2COc1ccccc1O2	ZINC000000197693	C2COc1ccccc1O2
Cc4ccc(S(=O)(=O)N(CCCCNCCCCN)Cc2c1ccccc1cc3ccccc23)cc4	ZINC000013522126	O=S(=O)(NCc2c1ccccc1cc3ccccc23)c4ccccc4
COc1ccc(CCN)cc1OC2CCCC2	ZINC000000006316	C2CCC(Oc1ccccc1)C2
C[N+](C)(C)c1cnc(=O)[nH]c1	ZINC000000039052	O=c1nccc[nH]1
Nc1ccccc1SC=C	ZINC000000047330	c1ccccc1
O[C@H](COc2cccc(CN1CCCN(C=O)CC1)c2)C[N@]4CCc3ccccc3C4	ZINC000012298976	C4CNCCN(Cc3cccc(OCCCN2CCc1ccccc1C2)c3)C4
Cc2ccc(NS(=O)(=O)c1ccc(F)cc1)cn2	ZINC000000017876	O=S(=O)(Nc1cccnc1)c2ccccc2
CCN(CC)C[C@@H](O)COc1ccc(OC[C@H](O)CN(CC)CC)cc1	ZINC000003900006	c1ccccc1
CCN(CC)C(=O)C[N+](C)(CCc1ccccc1)CC[N+](C)(CC)CC	ZINC000005452804	c1ccccc1
C3CC(COCc1ccccc1)(c2ccccc2)CCN3	ZINC000000018461	C3CC(COCc1ccccc1)(c2ccccc2)CCN3
Cc3ccc([C@H]1C(C#N)=C(N)Oc2cc(C)oc(=O)c12)cc3	ZINC000000043078	O=c3occc2OC=CC(c1ccccc1)c23
Cc1ccccc1C[N@]2CCCC[C@@H]2CO	ZINC000000300397	C2CCN(Cc1ccccc1)CC2
N[C@H](C(O)=O)c1ccccc1O	ZINC000000006795	c1ccccc1
COc3ccc(CN2CCN(c1ccccc1)CC2)c(OC)c3OC	ZINC000000292359	C2CN(c1ccccc1)CCN2Cc3ccccc3
FC(F)(F)Oc2ccc(NC(=O)COc1ccccc1C#N)cc2	ZINC000000098963	O=C(COc1ccccc1)Nc2ccccc2
Fc4cccc(C(=O)N3CCN(C[C@H]1C[C@H]2C[C@@H]1C=C2)CC3)c4	ZINC000000300636	O=C(N3CCN(CC1CC2CC1C=C2)CC3)c4ccccc4
CCN4CCN(CCCNC(=O)c2cnn(c1ccc(C)c(C)c1)c2C3CCNCC3)CC4	ZINC000021231901	O=C(NCCCN1CCNCC1)c3cnn(c2ccccc2)c3C4CCNCC4
COc1ccn(C)c(=O)c1C(O)=O	ZINC000000902069	O=c1cccc[nH]1
CC(=O)c2sc(NS(=O)(=O)c1ccc(C)cc1)nc2C	ZINC000000098969	O=S(=O)(Nc1nccs1)c2ccccc2
Nc4nn3[C@@H](c1ccccc1)C=C(c2ccccc2)N=c3[nH]4	ZINC000000051515	C3=C(c1ccccc1)N=c2[nH]cnn2C3c4ccccc4
Cn1cc[n+](C)c1SC[C@@H](O)c2ccccc2	ZINC000000331443	C(Cc1ccccc1)Sc2ncc[nH]2
Clc4ccc3NC(NCC1CC1)=C[N+](=O)C(c2ccccc2)c3c4	ZINC000000001238	O=[N+]3C=C(NCC1CC1)Nc2ccccc2C3c4ccccc4
COc4ccc(c2nc1ccc(C)cn1c2NC3CCCCC3)cc4	ZINC000000320043	C4CCC(Nc2c(c1ccccc1)nc3ccccn23)CC4
Cc2ccc(S(=O)(=O)c1cn(C)c(=O)n1C)cc2	ZINC000000053935	O=c2[nH]cc(S(=O)(=O)c1ccccc1)[nH]2
C[C@H]1CCCCN1C(=S)Nc2ccccc2C	ZINC000000093882	S=C(Nc1ccccc1)N2CCCCC2
C[C@@]13CCC(=O)N1c2ccccc2C(=O)N3c4ccccc4	ZINC000000034425	O=C1CCC3N1c2ccccc2C(=O)N3c4ccccc4
C[C@H]4C[C@H](C)CN(C[C@@H](O)Cn2c1ccc(Cl)cc1c3cc(Cl)ccc23)C4	ZINC000000643893	C4CCN(CCCn2c1ccccc1c3ccccc23)CC4
CCC(CC)NCC(C)(C)O	ZINC000001717258	nonring
CNCCCNCc2ccc(OCc1ccccc1)c(OC)c2	ZINC000008377063	C(Oc1ccccc1)c2ccccc2
O[C@@H](COc1ccccc1CNCc2ccccc2n3cncn3)CN4CCSCC4	ZINC000012022589	C(COc1ccccc1CNCc2ccccc2n3cncn3)CN4CCSCC4
C/C(=N\NC(=O)C[n+]1ccccc1)c4sc(c3nc(C)c(C(\C)=N\NC(=O)C[n+]2ccccc2)s3)nc4C	ZINC000005810419	O=C(C[n+]1ccccc1)NN=Cc4cnc(c3ncc(C=NNC(=O)C[n+]2ccccc2)s3)s4
CCCN2CCC([N@@](C)CCc1ccc(OC)c(OC)c1)CC2	ZINC000004989517	C2CC(NCCc1ccccc1)CCN2
COC(=O)c3ccc(C[n+]1c(C)n(N)c2ccccc12)cc3	ZINC000000386963	C(c1ccccc1)[n+]2c[nH]c3ccccc23
Cc2ccc1nsnc1c2NC(=O)c3cccc(Br)c3	ZINC000000097743	O=C(Nc1cccc2nsnc12)c3ccccc3
CCc3c(C)[nH]c2nnc(c1ccccc1OC)n2c3=O	ZINC000000034728	O=c2cc[nH]c3nnc(c1ccccc1)n23
CCOC(=O)c1c(CNC(C)C)oc2ccc(OC)cc12	ZINC000000036656	c2ccc1occc1c2
Nc4nc(N1CCCCC1)nc(N(c2ccccc2)c3ccccc3)n4	ZINC000000105017	C4CCN(c3ncnc(N(c1ccccc1)c2ccccc2)n3)CC4
Cc1oc(C(N)=O)nc1c2ccccc2	ZINC000000107595	c2ccc(c1cocn1)cc2
Cn4c2c1ccccc1C[n+]2c3ccccc3c4=O	ZINC000000225105	O=c3[nH]c2c1ccccc1C[n+]2c4ccccc34
COCCNC(=O)[C@H]1C[N@]2CC[C@@H]1C[C@@H]2Cn4cc(CN(C)Cc3ccccc3)nn4	ZINC000008297667	C1CN2CCC1CC2Cn4cc(CNCc3ccccc3)nn4
N[C@@H](CC(O)=O)c1cccn1c2ccc(N(=O)=O)cc2	ZINC000000032764	c2ccc(n1cccc1)cc2
CN(C)CCn3c(Cn1nnc2ccccc12)nc4ccccc34	ZINC000000025531	C(c2nc1ccccc1[nH]2)n3nnc4ccccc34
C(CCC/N=C/c2ccc(OCc1ccccc1)cc2)CC/N=C/c4ccc(OCc3ccccc3)cc4	ZINC000017819991	C(CCCN=Cc2ccc(OCc1ccccc1)cc2)CCN=Cc4ccc(OCc3ccccc3)cc4
NC(=N)NC(=N)S[C@@H]2CC(=O)N(c1ccccc1)C2=O	ZINC000000051993	O=C1CCC(=O)N1c2ccccc2
CN3CCC(OC(=O)C(Oc1ccc(Cl)cc1)Oc2ccc(Cl)cc2)CC3	ZINC000000537906	O=C(OC1CCNCC1)C(Oc2ccccc2)Oc3ccccc3
COc3ccc(C[N+]12CCN(CC1)CC2)cc3	ZINC000000387542	C2C[N+]3(Cc1ccccc1)CCN2CC3
CN2CCC([N@@](C)Cc1cc(Br)cs1)CC2	ZINC000000199303	C2CC(NCc1cccs1)CCN2
Fc1ccc2c(c1)C(=O)CCS2(=O)=O	ZINC000000111333	O=C1CCS(=O)(=O)c2ccccc12
CCOC(=O)[C@@H](Oc2ccc1CCN(C(N)=N)Cc1c2)c4ccc(OC3CCN(C(=N)CC)CC3)cc4	ZINC000013782207	C4CC(Oc3ccc(COc2ccc1CCNCc1c2)cc3)CCN4
CS(=O)(=O)Cc2cc[n+](Cc1ccc(F)cc1)cc2	ZINC000000398866	C(c1ccccc1)[n+]2ccccc2
COC1CCC(OC)CC1	ZINC000000031221	C1CCCCC1
CCC[C@@H](N)C(=O)N1CCC(C(=O)OCC)CC1	ZINC000000252392	C1CCNCC1
CC(C)(C)NC(=O)c1cc(Cl)ccc1Cl	ZINC000000060718	c1ccccc1
COc3cc(CN2CCN(c1ccc(F)cc1)CC2)cc4OCOc34	ZINC000000300793	C4Oc3ccc(CN2CCN(c1ccccc1)CC2)cc3O4
NCCc2c[nH]c3ccc(C1CCCCC1)cc23	ZINC000000077296	C3CCC(c2ccc1[nH]ccc1c2)CC3
O=Cc2ccc(c1ccccc1N(=O)=O)o2	ZINC000000035744	c2ccc(c1ccco1)cc2
CS(=O)(=O)N2CCN(c1cccc(Cl)c1)CC2	ZINC000000029519	C2CN(c1ccccc1)CCN2
C[C@@H](c1ccccc1)n2cnc3cc(N)ccc23	ZINC000000056372	C(c1ccccc1)n2cnc3ccccc23
COc2ccc(CNC1CCCCC1)cc2OC[C@@H](O)C[N@@](C)Cc3ccccc3	ZINC000012055353	C3CCC(NCc2cccc(OCCCNCc1ccccc1)c2)CC3
CCOC(=O)[C@@H]2CCC[N@@](Cc1cccc(C(F)(F)F)c1)C2	ZINC000000239168	C2CCN(Cc1ccccc1)CC2
COC(=O)c2cc(=O)n1ccccc1c2C#N	ZINC000000108787	O=c1cccc2ccccn12
CCOC(=O)[C@@H]2CCCN(C(=O)c1ccccc1)C2	ZINC000000030938	O=C(N1CCCCC1)c2ccccc2
OC3=C[C@@H](C(=O)Nc1cccc2ccccc12)SC(=N)N3	ZINC000000100151	N=C3NC=CC(C(=O)Nc1cccc2ccccc12)S3
O=C2C[C@H](N1CCSCC1)C(=O)N2CCc3ccccc3	ZINC000000033217	O=C2CC(N1CCSCC1)C(=O)N2CCc3ccccc3
NC(=N)NC(=N)Nc1c(Cl)cccc1Cl	ZINC000000016382	c1ccccc1
OCN1CCCCC1	ZINC000002047806	C1CCNCC1
CC(=O)N[C@@H](c1ccccc1)c3cc(N(=O)=O)c2cccnc2c3O	ZINC000000087173	C(c1ccccc1)c3ccc2cccnc2c3
Clc4c1ccccc1c(CN3CCN(c2ccc(N(=O)=O)cc2)CC3)c5ccccc45	ZINC000016662895	C2CN(c1ccccc1)CCN2Cc4c3ccccc3cc5ccccc45
C[N+](C)(C)Cc1ccc(N(=O)=O)cc1O	ZINC000000294699	c1ccccc1
CC(C)(CO)NC(=O)[C@@H]2C[C@@H]1CCCC[C@@H]1C[N@]2C[C@@H](O)[C@@H](N)CSc3ccccc3	ZINC000022048461	C(CCN2CCC1CCCCC1C2)CSc3ccccc3
OC3(c1ccc(Br)cc1)CCN(Cc2ccc(F)cc2)CC3	ZINC000000756990	C2CN(Cc1ccccc1)CCC2c3ccccc3
CC3CCN(C(=O)C2CCN(Cc1c(F)cccc1Cl)CC2)CC3	ZINC000000778807	O=C(C2CCN(Cc1ccccc1)CC2)N3CCCCC3
CC(=O)c3ccc(N2CCN(C(=O)c1cccs1)CC2)c(F)c3	ZINC000000034434	O=C(N2CCN(c1ccccc1)CC2)c3cccs3
COc1cc(CN(C)C)c(O)c(CN(C)C)c1	ZINC000000187878	c1ccccc1
O[C@@H](CNCc2ccc1OCOc1c2)COc3ccccc3	ZINC000000119165	C(CNCc2ccc1OCOc1c2)COc3ccccc3
CCOC(=O)N3CCC(N[C@@H](Cc1ccccc1)c2ccccc2)CC3	ZINC000000757913	C3CC(NC(Cc1ccccc1)c2ccccc2)CCN3
Nc1cnccc1NCCN3CCN(c2ccccc2)CC3	ZINC000001699156	C(CN2CCN(c1ccccc1)CC2)Nc3ccncc3
COc3cccc(CN2CCC(C(=O)N1CCC(C)CC1)CC2)c3OC	ZINC000000778808	O=C(C2CCN(Cc1ccccc1)CC2)N3CCCCC3
C[N+](CC[N+](C)(CC=C)CC=C)(CC=C)CC=C	ZINC000001683759	nonring
CC(C)C[N@]4C[C@@H](COc2ccc1CCCc1c2)C[C@@H](C(=O)NCCCN3CCOCC3)C4	ZINC000014536837	O=C(NCCCN1CCOCC1)C4CNCC(COc3ccc2CCCc2c3)C4
Cn2c(c1ccccc1)c[n+]3ccccc23	ZINC000000283586	c3ccc(c2c[n+]1ccccc1[nH]2)cc3
COc1ccccc1CCN[C@H]3CC(=O)N(c2ccc(C)cc2)C3=O	ZINC000000339240	O=C2CC(NCCc1ccccc1)C(=O)N2c3ccccc3
Oc3ccc2n(c1ccccc1)cnc2c3	ZINC000000017525	c3ccc(n1cnc2ccccc12)cc3
Cc4ccnc(S[C@H]3CC(=O)N(c2ccc1ccccc1c2)C3=O)n4	ZINC000000118397	O=C2CC(Sc1ncccn1)C(=O)N2c4ccc3ccccc3c4
C[C@@H](NC(C)(C)C)C(C)=O	ZINC000000328457	nonring
NC(=O)C(CCN2CC[N@]1CCC[C@H]1C2)(c3ccccc3)c4ccccc4	ZINC000000608031	C4CC3CN(CCC(c1ccccc1)c2ccccc2)CCN3C4
CC(C)(C)OC(=O)N2CCN(c1ccc(CN)cc1)CC2	ZINC000000168873	C2CN(c1ccccc1)CCN2
Nc4c(Cl)cc(c3nn(C2CCN(CCc1ccccc1)CC2)c(=O)o3)c5OCCOc45	ZINC000000603773	O=c3oc(c2cccc1OCCOc12)nn3C5CCN(CCc4ccccc4)CC5
CN(C)CCN(Cc3ccc(c2ccc(CNCCc1ccccc1)cn2)cc3)C(=O)\C=C\c4ccccc4	ZINC000028457826	O=C(NCc3ccc(c2ccc(CNCCc1ccccc1)cn2)cc3)C=Cc4ccccc4
CNCCCNCc1cc(Cl)ccc1OCc2ccc(Cl)cc2	ZINC000008376991	C(Oc1ccccc1)c2ccccc2
OC(=O)C=CC(=O)Nc2ccc1c[nH]nc1c2	ZINC000000282211	c2ccc1n[nH]cc1c2
CCOc2ccc(\C=N\NC(=S)Nc1ccc(C)cc1)cc2	ZINC000000046058	S=C(NN=Cc1ccccc1)Nc2ccccc2
CC(=O)c2cc(F)c(N1CCCC1)cc2C	ZINC000000052949	C2CCN(c1ccccc1)C2
O=C2CCCCc1sccc1N2	ZINC000000028298	O=C2CCCCc1sccc1N2
CN1CCc5c([C@H]1c2cccnc2)c4[C@@H](c3cccnc3)[N@@](C)CCc4n5C	ZINC000001305704	C5Cc3[nH]c2CCNC(c1cccnc1)c2c3C(c4cccnc4)N5
COc3ccc(CC[N@@](CC1CCN(C)CC1)Cc2ccc(OC(C)C)c(CO)c2)cc3	ZINC000012314789	C3CC(CN(CCc1ccccc1)Cc2ccccc2)CCN3
COc3ccc(CNCc1cccc(C(F)(F)F)c1)c(OC[C@@H](O)CN2CCCC2)c3	ZINC000012192030	C3CCN(CCCOc1ccccc1CNCc2ccccc2)C3
CC(C)(C)NC[C@H](O)COc2ccc(NC(=O)NC1CCCCC1)cc2	ZINC000000538582	O=C(NC1CCCCC1)Nc2ccccc2
COc2ccc(\C=C\c1cccc[n+]1C)cc2CN3CCCC3	ZINC000005002317	C3CCN(Cc2cccc(C=Cc1ccccn1)c2)C3
C[C@]23CCC[C@]1(CO1)[C@@H]2C[C@H]4[C@@H](C3)OC(=O)[C@@H]4CNCCCn5ccnc5	ZINC000003985049	O=C4OC3CC2CCCC1(CO1)C2CC3C4CNCCCn5ccnc5
Cc2ccc([C@@H](O)c1cccnc1)o2	ZINC000000045881	C(c1cccnc1)c2ccco2
CC(C)(CN1CCOCC1)C[N@]4CC[C@@H](N3CCN(CCc2ccccc2)CC3)[C@H](O)C4	ZINC000020774826	C(CN1CCOCC1)CN4CCC(N3CCN(CCc2ccccc2)CC3)CC4
CCN4CCN(C(=O)CCC(=O)Nc3ccc2nc(N1CCN(C)CC1)cc(C)c2c3)CC4	ZINC000020136221	O=C(CCC(=O)N1CCNCC1)Nc4ccc3nc(N2CCNCC2)ccc3c4
C[N@]1CC=C3[C@H](C1)[C@@H](c2ccc(C)cc2)C(C#N)(C#N)C(N)=C3C#N	ZINC000000408309	C3NCC2C(c1ccccc1)CC=CC2=C3
COC(=O)C2[C@H](c1ccccc1C(F)(F)F)C(C(=O)OCCCCCCCC[N+](C)(C)C)C(=C)NC2=C	ZINC000027202622	C=C2CC(c1ccccc1)CC(=C)N2
Cc3cccc(NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)Oc2ccccc2)c3	ZINC000000062974	O=C(Nc1ccccc1)C2CCCN2C(=O)Oc3ccccc3
COc4ccc([C@@H]2Sc1ccccc1NC(=O)[C@H]2OC(=O)CN3CCN(C)CC3)cc4	ZINC000000638704	O=C(CN1CCNCC1)OC4C(c2ccccc2)Sc3ccccc3NC4=O
O=c2c1ccccc1nc3ccccn23	ZINC000000111199	O=c2c1ccccc1nc3ccccn23
C2COCCN(CCOCCN1CCOCCOCCOCC1)CCOCCO2	ZINC000020083554	C2COCCN(CCOCCN1CCOCCOCCOCC1)CCOCCO2
O/N=C/c2ccc[n+](CCC(=O)NCc1ccccc1)c2	ZINC000000254757	O=C(CC[n+]1ccccc1)NCc2ccccc2
CCN3CCN(c2cc(=O)n(c1ccc(OC)cc1)c(=O)[nH]2)CC3	ZINC000000252560	O=c2cc(N1CCNCC1)[nH]c(=O)n2c3ccccc3
COc5ccc4c2C[N@@]1CCC[C@H]1Cc2c3cc(OC)c(OC)cc3c4c5OC	ZINC000000608124	C2CC1Cc4c(CN1C2)c3ccccc3c5ccccc45
Cc1ccccc1[N+](=O)Cc2cccs2	ZINC000000116170	O=[N+](Cc1cccs1)c2ccccc2
OC(=O)c2cn1nc(Cl)ccc1n2	ZINC000000161976	c2cnn1ccnc1c2
Cc3ccc(NC(=O)CNC1=NC(C)(C)Cc2ccccc12)cc3	ZINC000000343642	O=C(CNC1=NCCc2ccccc12)Nc3ccccc3
CN(C)CCNS(=O)(=O)c2ccc(c1csc(C)n1)s2	ZINC000000066520	c2csc(c1cscn1)c2
CN2CCN(NC(=O)c1ccc(Cl)c(N(=O)=O)c1)CC2	ZINC000000369132	O=C(NN1CCNCC1)c2ccccc2
CCOC(=O)c3c(N)n(c1ccc(C)cc1)c4nc2ccccc2nc34	ZINC000000088047	c4ccc(n2ccc3nc1ccccc1nc23)cc4
CC2(C)C[C@H](O)[C@@H]([C@H](O)c1cccc(N(=O)=O)c1)C(C)(C)N2	ZINC000000205531	C2CNCC(Cc1ccccc1)C2
C[C@@H](Oc2cncc(N1CCNCC1)n2)c3cccc(F)c3	ZINC000000003309	C3CN(c2cncc(OCc1ccccc1)n2)CCN3
Cc1cc(C)[n+](C)c(=O)n1C	ZINC000000391780	O=c1nccc[nH]1
COc1ccccc1OCc2ccc(C(=O)NCCN(C)C)o2	ZINC000000115387	C(Oc1ccccc1)c2ccco2
O=C2CCN(C(=O)c1cccs1)c3ccccc23	ZINC000000049500	O=C2CCN(C(=O)c1cccs1)c3ccccc23
C5CCN(CCOc4ccc(c3cnc2n(c1ccccc1)cnc2c3)cc4)CC5	ZINC000000587938	C5CCN(CCOc4ccc(c3cnc2n(c1ccccc1)cnc2c3)cc4)CC5
C3CN=C(NCCc2ccc1OCOc1c2)N3	ZINC000000017382	C3CN=C(NCCc2ccc1OCOc1c2)N3
NCc1ccc(F)cc1C(F)(F)F	ZINC000000157362	c1ccccc1
Cc4ccc(c2nnc(N1CCCCCC1)c3ccccc23)cc4	ZINC000000038136	C4CCCN(c2nnc(c1ccccc1)c3ccccc23)CC4
CN(C)CCCNCc2cccc(OCc1ccc(F)cc1)c2	ZINC000008373889	C(Oc1ccccc1)c2ccccc2
Cc2cc(C)cc(C(=O)NCc1ccncc1)c2	ZINC000000001942	O=C(NCc1ccncc1)c2ccccc2
NNc2nnc(Cc1ccncc1)c3ccccc23	ZINC000000001943	C(c1ccncc1)c2nncc3ccccc23
CC(C)(C)Nc4c(c2c1ccccc1c(NCCCCCCCCN)c3ccccc23)nc5ccccn45	ZINC000095558752	c5ccc4c(c2cn1ccccc1n2)c3ccccc3cc4c5
CC[C@@]23CCC[N@]1CC[C@@]5([C@@H]12)C(=C(C(=O)OC)C3)Nc4ccccc45	ZINC000000525687	C3CC4CC=C2Nc1ccccc1C25CCN(C3)C45
CCOc1ccccc1N3CCN(C2CCN(C)CC2)CC3	ZINC000000279943	C3CC(N2CCN(c1ccccc1)CC2)CCN3
Cc1n[nH]c(C)c1NC=O	ZINC000000039521	c1cn[nH]c1
CCn1cc(N(=O)=O)nc1C	ZINC000000039522	c1c[nH]cn1
C[N+](C)(C)CC1CC1	ZINC000001699083	C1CC1
CC[n+]2ccc1c(O)cccc1c2	ZINC000000410125	c2ccc1cnccc1c2
OC(=O)CNS(=O)(=O)c1c(Cl)cccc1Cl	ZINC000000074725	c1ccccc1
CN4CCN(c2nc(N1CCN(CCO)CC1)nc3ccccc23)CC4	ZINC000000784869	C4CN(c3nc(N1CCNCC1)c2ccccc2n3)CCN4
Fc5ccc(N4CCN(C(=O)C[C@@H]1CCNC[C@@H]1Cc3cc(CN2CCCCC2)on3)CC4)cc5	ZINC000012482542	O=C(CC1CCNCC1Cc3cc(CN2CCCCC2)on3)N5CCN(c4ccccc4)CC5
CN4CCC(N(C)C(=O)CC[C@@H]3CCC[N@@](Cc2ccc(C1CCCC1)s2)C3)CC4	ZINC000012713179	O=C(CCC3CCCN(Cc2ccc(C1CCCC1)s2)C3)NC4CCNCC4
NCc1ccccc1F	ZINC000000161604	c1ccccc1
C[C@@H](N)c1nnc(C)o1	ZINC000011586026	c1nnco1
CO/N=c1\c(=O)n(C)c2ccccc12	ZINC000000086530	N=c1c(=O)[nH]c2ccccc12
O[C@H](C[N@]1C[C@H]3C[C@@H](C1)c2cccc(=O)n2C3)c4ccccc4	ZINC000000489165	O=c4cccc3C2CC(CN(CCc1ccccc1)C2)Cn34
CN(C)Cc1ccccc1c2cncnc2Nc3ccncc3	ZINC000004239215	N(c1ccncc1)c2ncncc2c3ccccc3
NCCNc2ccc(NCCN)c3c(=O)c1cnccc1c(=O)c23	ZINC000001535903	O=c2c1ccccc1c(=O)c3cnccc23
COc1ccccc1[C@@H](CCN)[C@@H]2CCOC(C)(C)C2	ZINC000000206867	C2CC(Cc1ccccc1)CCO2
CN(c1ccc([N@@](C)C(C)(C)C)cc1)C(C)(C)C	ZINC000000345936	c1ccccc1
Cc2ccc1[nH]cc(CCN)c1c2	ZINC000000066085	c2ccc1[nH]ccc1c2
C[C@@]4(O)CC[C@H]3[C@@H]2CCC1=CC(=O)C=C[C@]1(C)[C@H]2[C@H](O)C[C@@]34C	ZINC000000000554	O=C4C=CC3C2CCC1CCCC1C2CCC3=C4
CCOC(=O)N4CCN(CCN1CCn2c1nc3ccccc23)CC4	ZINC000000203818	C4CN(CCN1CCn2c1nc3ccccc23)CCN4
CN(C)c2ccc(\C=C\C[N@@](CCO)Cc1ccccc1)cc2	ZINC000000214388	C(NCc1ccccc1)C=Cc2ccccc2
COc3ccc(CC[C@@H]1NCCn2cccc12)cc3OC	ZINC000000214200	C3Cn1cccc1C(CCc2ccccc2)N3
COC(=O)[C@@H](C)NC(=O)C3CCN(C2CCN(CCCc1ccccc1)CC2)CC3	ZINC000011874178	C3CCN(C2CCN(CCCc1ccccc1)CC2)CC3
CN(C)CCN(Cc1ccsc1)c2ccccn2	ZINC000000002149	C(Nc1ccccn1)c2ccsc2
C[C@@H](NC(=O)CSc1nc(N)cc(N)n1)c2ccccc2	ZINC000000377122	O=C(CSc1ncccn1)NCc2ccccc2
CNC[C@@](C)(O)c1ccccc1	ZINC000001321394	c1ccccc1
CCN3CCC(N(CCCN1CCC(C)CC1)C(=O)Nc2cc(Cl)ccc2Cl)CC3	ZINC000009151176	O=C(Nc1ccccc1)N(CCCN2CCCCC2)C3CCNCC3
C[C@H](OC[C@H](O)CNCCCN1CCCCCC1)c2ccc(Cl)cc2	ZINC000006051591	C2CCCN(CCCNCCCOCc1ccccc1)CC2
CCn3c(SCc1ccccn1)nc2ccccc2c3=O	ZINC000000003949	O=c2[nH]c(SCc1ccccn1)nc3ccccc23
CCCc2nc1ccc(Br)cn1c2NC(C)(C)C	ZINC000000320197	c2ccn1ccnc1c2
CN2CCN(c1cc(C)ncn1)CC2	ZINC000000239976	C2CN(c1ccncn1)CCN2
CN(C)CC(=O)N3c1ccccc1CCc4ccc(NC(=O)c2ccccc2)cc34	ZINC000000755077	O=C(Nc3ccc2CCc1ccccc1Nc2c3)c4ccccc4
Cc2[nH]c1ccc(F)cc1c2SC3CCNCC3	ZINC000000018495	C3CC(Sc1c[nH]c2ccccc12)CCN3
CC[n+]2cc(N)nc(c1ccc(Br)cc1)n2	ZINC000000506409	c2ccc(c1nccnn1)cc2
O[C@@H]1CSC2=[N+]1CCS2	ZINC000004972322	C1C[N+]2=C(S1)SCC2
Cc1ccsc1c4nc(c2ccccc2)c(c3ccccc3)[nH]4	ZINC000000053004	c4ccc(c2nc(c1cccs1)[nH]c2c3ccccc3)cc4
O=C2NCCN1CCCC[C@H]12	ZINC000000005323	O=C2NCCN1CCCCC12
COC(=O)C1=CN(C)C=C(C(=O)OC)C1c2ccc(OC)cc2OC	ZINC000000028989	N2C=CC(c1ccccc1)C=C2
CC[n+]1ccc(C)c2cc([S@@](=O)C(F)(F)F)ccc12	ZINC000000241495	c2ccc1ncccc1c2
CN(C)CCCN(CCCN(C)C)CC(/C)=C/c1ccccc1	ZINC000004987931	c1ccccc1
COc4ccc(Nc2nc(N1CCN(CCO)CC1)nc3ccccc23)c(OC)c4	ZINC000000792217	C4CN(c3nc(Nc1ccccc1)c2ccccc2n3)CCN4
COc3cc(c2cc(=O)c1ccccc1o2)ccc3O	ZINC000000038941	O=c2cc(c1ccccc1)oc3ccccc23
CN3CCN(C(=O)Cn2ccc1ccccc1c2=O)CC3	ZINC000000211604	O=C(Cn2ccc1ccccc1c2=O)N3CCNCC3
C[C@H](CN(C)C)Cn2c1ccccc1sc3ccccc23	ZINC000000000808	c3ccc2sc1ccccc1[nH]c2c3
COc1cc(C=O)ccc1OCC(O)=O	ZINC000000054592	c1ccccc1
CN(C)C(=O)N2CCC(C(=O)NCCN1CCCC1)CC2	ZINC000000262335	O=C(NCCN1CCCC1)C2CCNCC2
CCC[C@@H](C)NC(=O)N1CCOCC1	ZINC000000030377	C1COCCN1
CCc2n(C)c1ccccc1[n+]2C[C@H](O)COc3cccc(C)c3	ZINC000000307215	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
COc1ccccc1[C@H]3[C@H]2CCCC[C@@]2(O)CC[N@]3CC(N)=O	ZINC000000490432	C1CCC2C(C1)CCNC2c3ccccc3
CCC(=O)O[C@]2(c1ccccc1)C[C@@H](C)[N@@](C)C[C@@H]2C	ZINC000000000807	C2CC(c1ccccc1)CCN2
CCC(=O)NCCN	ZINC000005855693	nonring
COc1ccccc1O[P@](C)(=O)Nc2ccc(Cl)c(Cl)c2	ZINC000000326092	O=P(Nc1ccccc1)Oc2ccccc2
C[C@@]1(CC(O)=O)SC(=O)NC1=O	ZINC000001255066	O=C1CSC(=O)N1
Cc2oc(C(C)(C)C)c(CN1CCOCC1)c2C(O)=O	ZINC000000033624	C2CN(Cc1ccoc1)CCO2
CC2(C)CC(NC(=O)c1cccc(F)c1)CC(C)(C)N2	ZINC000000217330	O=C(NC1CCNCC1)c2ccccc2
Cc1cc(Br)ccc1NS(C)(=O)=O	ZINC000000029684	c1ccccc1
Brc1ccn(=O)cc1	ZINC000000051190	O=n1ccccc1
CN3CCN(CCN[C@H]2CC(=O)N(c1ccc(F)cc1)C2=O)CC3	ZINC000020220163	O=C2CC(NCCN1CCNCC1)C(=O)N2c3ccccc3
CC(C)N[C@H]([C@H](O)c1ccccc1)c2ccccc2	ZINC000000057004	C(Cc1ccccc1)c2ccccc2
CNCCc1ccc(O)cc1	ZINC000001529432	c1ccccc1
CCN(CC)CC(=O)Nc1c(C#N)cnn1c2ccccc2	ZINC000000159845	c2ccc(n1cccn1)cc2
C4CCN(C3CCN(Cc2ccc1OCOc1c2)CC3)CC4	ZINC000000200646	C4CCN(C3CCN(Cc2ccc1OCOc1c2)CC3)CC4
O=c2n(CN1CCCCC1)nnc3ccccc23	ZINC000000067676	O=c2n(CN1CCCCC1)nnc3ccccc23
Cc3ccc(NC(=S)[C@@H](C#N)c2nc1cccnc1n2C)cc3	ZINC000000026616	S=C(Cc2nc1cccnc1[nH]2)Nc3ccccc3
CCN4CCN(c2nc(c1cccnc1)nc3ccccc23)CC4	ZINC000000038303	C4CN(c2nc(c1cccnc1)nc3ccccc23)CCN4
CN(C)CCC[C@@H]3C(=O)[C@H](c1ccccc1)N(c2ccccc2)C3=O	ZINC000000394152	O=C2CC(=O)N(c1ccccc1)C2c3ccccc3
CN(C)[C@@H]1CCCC[C@H]1NC(=O)c2ccc(Br)cc2	ZINC000000001048	O=C(NC1CCCCC1)c2ccccc2
O=C(C[n+]1cccc2ccccc12)c6ccc(c5ccc(C(=O)C[n+]3cccc4ccccc34)cc5)cc6	ZINC000001559949	O=C(C[n+]1cccc2ccccc12)c6ccc(c5ccc(C(=O)C[n+]3cccc4ccccc34)cc5)cc6
CCN(CC)CCCNCc1cccc(OC)c1	ZINC000002933140	c1ccccc1
O=C2CSc1ccccc1N2	ZINC000000050222	O=C2CSc1ccccc1N2
CSc3nc(c2cc1ccccc1oc2=O)cn3c4ccccc4	ZINC000000067679	O=c2oc1ccccc1cc2c4cn(c3ccccc3)cn4
CC(C)(C)CC(=O)NCc1ccccn1	ZINC000000030437	c1ccncc1
CCN(CC)CC(=O)N4CCC(c3nc2C[N@](Cc1ccccc1)CCc2c(=O)[nH]3)CC4	ZINC000019526320	O=c4[nH]c(C1CCNCC1)nc3CN(Cc2ccccc2)CCc34
COc1ccccc1NC(=O)c2ccc[n+](C)c2	ZINC000000364608	O=C(Nc1ccccc1)c2cccnc2
Br[C@@]12CCCC[C@@H]1CNCC2	ZINC000000158431	C2CCC1CNCCC1C2
CCCN2CCC(Nc1cc(OC)cc(OC)c1)CC2	ZINC000000182396	C2CC(Nc1ccccc1)CCN2
CCN(CC)c3ccc(Nc2cc(N(CCCN(C)C)C(=O)Nc1c(C)cccc1Cl)ncn2)cc3	ZINC000053159854	O=C(Nc1ccccc1)Nc3cc(Nc2ccccc2)ncn3
COc2cc(CNC1CCC(O)CC1)cc(OC)c2O	ZINC000000016141	C2CCC(NCc1ccccc1)CC2
Clc4ccc3nc(N1CCNCC1)nc(c2ccccc2)c3c4	ZINC000000275717	C4CN(c3nc(c1ccccc1)c2ccccc2n3)CCN4
Cc2nc1c(C)c(C)c(C)c(C)c1[nH]2	ZINC000000138543	c2ccc1[nH]cnc1c2
CN(C)Cc1ccc(F)cc1Sc2cc(Cl)ccc2Cl	ZINC000000346858	S(c1ccccc1)c2ccccc2
Cc4ccc([n+]3cc(c1ccc(Br)cc1)n2CCCc23)cc4	ZINC000000622953	C1Cc3n(C1)c(c2ccccc2)c[n+]3c4ccccc4
NC(=N)Cc1cccs1	ZINC000001442838	c1ccsc1
CCOc1cc(=O)oc2cc(C)ccc12	ZINC000000058024	O=c2ccc1ccccc1o2
CC(=O)n1c(=O)oc2cc(N(=O)=O)ccc12	ZINC000000347853	O=c2[nH]c1ccccc1o2
COc2cccc3oc(c1ccccc1)cc(=O)c23	ZINC000000005954	O=c2cc(c1ccccc1)oc3ccccc23
COc4ccc(CCN3CCC(C[N@@](C)Cc1cccn1c2cccnc2)CC3)cc4	ZINC000011821503	C2CN(CCc1ccccc1)CCC2CNCc3cccn3c4cccnc4
CCOC(=O)[C@@H]2CCCN(C1CCN(CC)CC1)C2	ZINC000000221270	C2CCN(C1CCNCC1)CC2
COc2ccc(Cc1cnc(N)nc1N)cc2	ZINC000000380804	C(c1ccccc1)c2cncnc2
C[N@]4CCC[C@@H](n3nc(Cc1ccc(Cl)cc1)c2ccccc2c3=O)CC4	ZINC000000601229	O=c3n(C1CCCNCC1)nc(Cc2ccccc2)c4ccccc34
C3CCN(CC(CN1CCCC1)OCc2ccccc2)C3	ZINC000000218672	C3CCN(CC(CN1CCCC1)OCc2ccccc2)C3
Fc1ccccc1N3CCN(CCc2ccccc2)CC3	ZINC000000218187	C2CN(c1ccccc1)CCN2CCc3ccccc3
CCN(CC)CCn2c(=N)n(CCOc1ccccc1)c3ccccc23	ZINC000000980126	N=c2[nH]c1ccccc1n2CCOc3ccccc3
FC(F)Oc2ccc(C[N+](=O)c1ccccc1)cc2	ZINC000000084388	O=[N+](Cc1ccccc1)c2ccccc2
Clc3ccc(N2C[C@@H]1CCNC[C@@H]12)cn3	ZINC000000027328	C3CC2CN(c1cccnc1)C2CN3
Cc4ccc(N1C(=O)CS[C@]13C(=O)Nc2ccccc23)c(C)c4	ZINC000000053329	O=C1CSC4(N1c2ccccc2)C(=O)Nc3ccccc34
CC(=O)NC2=NN(C(C)=O)[C@@H](c1ccc(C)cc1)S2	ZINC000000072779	N1N=CSC1c2ccccc2
Cc4cccc(n3c(C)nc2n(c1ccccc1)ncc2c3=O)c4	ZINC000000055462	O=c3n(c1ccccc1)cnc4n(c2ccccc2)ncc34
N[C@H]2[C@@H]1C[C@@H](C=C1)[C@H]2C(N)=O	ZINC000002380040	C1CC2CC1C=C2
NNc3cc(N1CCOCC1)nc(OCCc2ccccn2)n3	ZINC000000033983	C3CN(c2ccnc(OCCc1ccccn1)n2)CCO3
C[N+]13CCC(CC1)[C@@H](C(=O)c2cccs2)C3	ZINC000000204023	O=C(C1CN2CCC1CC2)c3cccs3
O[C@@H](CN2CCC([C@H](O)c1ccccc1)CC2)c3ccc(F)cc3	ZINC000000010549	C2CN(CCc1ccccc1)CCC2Cc3ccccc3
CCOC(=O)Cn3c2cccc1cccc(c12)[n+]4nc5c(cc34)c7cccc6cccc5c67	ZINC000000629052	c2cc1cccc5c1c(c2)[nH]c4cc3c7cccc6cccc(c3n[n+]45)c67
COc1ccccc1N4CCN(C3CCN(Cc2ccccc2)CC3)CC4	ZINC000000757713	C2CN(Cc1ccccc1)CCC2N4CCN(c3ccccc3)CC4
CCC[N+](C)(CCc1ccccc1)CC[N+](C)(CC)CC	ZINC000005432118	c1ccccc1
COc2ccc(\C=N\c1ccc(Cl)c(N(=O)=O)c1)cc2Cl	ZINC000000059990	C(=Nc1ccccc1)c2ccccc2
N[C@@H](Cc1ccccc1)C=O	ZINC000003581226	c1ccccc1
COc3cc(CNc2nc1ccccc1n2C)cc(OC)c3OC	ZINC000000068015	C(Nc2nc1ccccc1[nH]2)c3ccccc3
C[N@@](CC2CCN(Cc1ccc(C)o1)CC2)Cc3c[nH]nc3c4ccc(F)cc4	ZINC000011817214	C2CN(Cc1ccco1)CCC2CNCc3c[nH]nc3c4ccccc4
CN1CCCN=C1COC(=O)[C@](O)(C2CCCCC2)c3ccccc3	ZINC000000020260	O=C(OCC1=NCCCN1)C(C2CCCCC2)c3ccccc3
O[C@H]3[C@@H](N2CCC(O)(c1ccc(F)cc1)CC2)COc4cc(O)ccc34	ZINC000000601447	C3CN(C2COc1ccccc1C2)CCC3c4ccccc4
CNCCOCC1CC1	ZINC000014628596	C1CC1
NCCOCC1CC1	ZINC000014628595	C1CC1
Fc5ccc(N4CCN(CCCN3c1cccc2cccc(c12)S3(=O)=O)CC4)cc5	ZINC000000597400	O=S3(=O)N(CCCN2CCN(c1ccccc1)CC2)c4cccc5cccc3c45
Oc1cccc2cccnc12	ZINC000000008492	c2ccc1ncccc1c2
Clc2cc(NC(=O)COc1ccccc1)ccc2N4CCN(C(=O)c3cccs3)CC4	ZINC000000624073	O=C(COc1ccccc1)Nc4ccc(N3CCN(C(=O)c2cccs2)CC3)cc4
CN[C@H]3CCc2[nH]c1ccc(C(N)=O)cc1c2C3	ZINC000000008496	C1CCc2c(C1)[nH]c3ccccc23
CN[C@@]13CC=CC[C@H]1COc2ccccc23	ZINC000000012944	C2Oc1ccccc1C3CC=CCC23
Cc1ccccc1N2CCNCC2	ZINC000000066076	C2CN(c1ccccc1)CCN2
C[C@@H]1CCc2c(C1)sc3[nH]cnc(=O)c23	ZINC000000048678	O=c2nc[nH]c3sc1CCCCc1c23
CC(=O)NC2CC(C)(C)N(OC(=O)c1ccco1)C(C)(C)C2	ZINC000000036870	O=C(ON1CCCCC1)c2ccco2
Oc2ccc(\C=N\n1cnnc1)cc2O	ZINC000000032460	C(=Nn1cnnc1)c2ccccc2
C[N+]14CCCC[C@@H]1[C@H](OC(=O)C3(c2ccccc2)CCCC3)CCC4	ZINC000000234102	O=C(OC1CCCN2CCCCC12)C4(c3ccccc3)CCCC4
CC[n+]1cccnc1N	ZINC000000392300	c1cncnc1
Cc3ccc(C(=O)N[C@@H](Nc1cccc(C)c1)C(=O)c2ccccc2)cc3	ZINC000000622970	O=C(NC(Nc1ccccc1)C(=O)c2ccccc2)c3ccccc3
CN3CCC(N(C)C(=O)CC[C@@H]2CCC[N@](C/C=C/c1ccco1)C2)CC3	ZINC000011699387	O=C(CCC2CCCN(CC=Cc1ccco1)C2)NC3CCNCC3
COc2cc(Cn1ccnc1)c(OC)cc2Cn3ccnc3	ZINC000000034262	C(c2ccc(Cn1ccnc1)cc2)n3ccnc3
COc1cc(C)c([S@@](C)=O)cc1OC	ZINC000000000791	c1ccccc1
CN(C)CCC[N@@](C)C[C@@H](O)CSc3c(c1cc(Cl)ccc1O)c2cc(C(F)(F)F)ccc2[nH]c3=O	ZINC000028389424	O=c3cc(c1ccccc1)c2ccccc2[nH]3
CN([C@@H]1CCNC1)C(C)=O	ZINC000002522721	C1CCNC1
C[C@@H]2CCC[N@@](CCC(=O)Nc1ccccc1)C2	ZINC000000176341	O=C(CCN1CCCCC1)Nc2ccccc2
CC[C@@]3(O)CC[N@]2CCc1ccc(C)cc1[C@@H]2C3	ZINC000000000795	C3CCN2CCc1ccccc1C2C3
C[N@]1C[C@H]2CC[C@@H]1C[C@@]23CC(C)=CC(=O)O3	ZINC000000001311	O=C1OC2(CC=C1)CC3CCC2CN3
Cn2nc(C(=O)NCc1ccccc1)cc2C(=O)NCc3ccccc3	ZINC000000027802	O=C(NCc1ccccc1)c3cc(C(=O)NCc2ccccc2)[nH]n3
CC1(C)NC(=N)NC(=N)N1c3cccc(OCc2cccc(N(=O)=O)c2)c3	ZINC000001701933	N=C3NCN(c2cccc(OCc1ccccc1)c2)C(=N)N3
C[C@@H]4Nc2nc(NC(=O)c1ccc[n+](C)c1)[nH]c(=O)c2N(C(=O)c3ccc[n+](C)c3)[C@@H]4C	ZINC000000719486	O=C(Nc3nc2NCCN(C(=O)c1cccnc1)c2c(=O)[nH]3)c4cccnc4
C1CC[C@H]2[C@@H](C1)CCC[N@@]2CCNCCC(c3ccccc3)c4ccccc4	ZINC000035013463	C1CCC2C(C1)CCCN2CCNCCC(c3ccccc3)c4ccccc4
COC(=O)\C=C\c1ccccc1OC[C@H](O)CNC(C)C	ZINC000000000150	c1ccccc1
C[C@@H]1CC(C)(C)N=C(C(C)=C)O1	ZINC000000040201	C1COC=NC1
CN(C(C)=O)c2ccc(NC(=O)[C@@H]1CCCC[C@@H]1C(O)=O)cc2	ZINC000000038609	O=C(Nc1ccccc1)C2CCCCC2
OC1=NC(=S)NC(=O)C1CC=C	ZINC000000247619	O=C1CC=NC(=S)N1
CCCC[N@@](C)CC3CCN(Cc2csc(c1cnn(C)c1)n2)CC3	ZINC000052442197	C3CCN(Cc2csc(c1cn[nH]c1)n2)CC3
CN(C)[C@@H]1CCCCC1=O	ZINC000000346217	O=C1CCCCC1
CCN(CC)CCOc1c(CC=C)cccc1OC	ZINC000000000158	c1ccccc1
C[N@@](CC2CCN(Cc1ccc(C)o1)CC2)Cc4cnc(c3ccccc3)s4	ZINC000011872960	C2CN(Cc1ccco1)CCC2CNCc4cnc(c3ccccc3)s4
CCCN2CCC([N@@](C)C1CCN(C)CC1)CC2	ZINC000000221721	C2CC(NC1CCNCC1)CCN2
NC[C@@H](c1ccccc1)c3ccc2OCCOc2c3	ZINC000000085167	C3COc2cc(Cc1ccccc1)ccc2O3
CCN(CC)Cc1c(O)c(CC)cc2c(C)cc(=O)oc12	ZINC000000137921	O=c2ccc1ccccc1o2
Oc3ccc(C[C@@H]1CC2CCN1CC2)cc3O	ZINC000000092972	C1CN2CCC1CC2Cc3ccccc3
CCCCNCc3ccc(c2nc(CN(Cc1ccc(Cl)c(Cl)c1)C(=O)CN(C)C)cs2)cc3	ZINC000045302264	C(NCc2csc(c1ccccc1)n2)c3ccccc3
O=C(Nc2ccc(C1=NCCCN1)cc2)c5ccc(C(=O)Nc4ccc(C3=NCCCN3)cc4)nc5	ZINC000001596508	O=C(Nc2ccc(C1=NCCCN1)cc2)c5ccc(C(=O)Nc4ccc(C3=NCCCN3)cc4)nc5
Clc4ccc(N3CCCN([C@H](CN1CCCC1)c2ccccc2)C3=O)cc4Cl	ZINC000000598524	O=C3N(C(CN1CCCC1)c2ccccc2)CCCN3c4ccccc4
Cc2ccc(OCC(=O)Nc1cccc(C(O)=O)c1)cc2	ZINC000000098469	O=C(COc1ccccc1)Nc2ccccc2
NC(=N)c1cc(Cl)nc(Cl)c1	ZINC000000163105	c1ccncc1
CC(=O)Nc1ccc(F)c(C#N)c1	ZINC000000078987	c1ccccc1
CC3(C)CC(N2CN(C1CCCCC1)CC2=O)CC(C)(C)N3	ZINC000000141619	O=C2CN(C1CCCCC1)CN2C3CCNCC3
C(=N\c2cccc3c(/N=C/c1cccs1)cccc23)/c4cccs4	ZINC000000046226	C(=Nc2cccc3c(N=Cc1cccs1)cccc23)c4cccs4
C[C@@]1(N)CCS(=O)(=O)C1	ZINC000003866007	O=S1(=O)CCCC1
C[C@H](CCC1=C(C)CCCC1(C)C)NCc2ccc(OCCCN(C)C)cc2	ZINC000001758945	C2CCC(CCCNCc1ccccc1)=CC2
CC[C@@H](c2ccc1cc(OC)ccc1c2)C(C)(C)C(O)=O	ZINC000000000478	c2ccc1ccccc1c2
NC12CC3(F)CC(F)(C1)CC(F)(C2)C3	ZINC000000007410	C1C2CC3CC1CC(C2)C3
O=N(=O)c2ccc([C@@H]1NNC(=S)S1)cc2	ZINC000000114499	S=C2NNC(c1ccccc1)S2
FC(F)(F)C(=O)Nc2ccc(C(=O)OC1CCCCC1)cc2	ZINC000000037871	O=C(OC1CCCCC1)c2ccccc2
Cc2cc(C)[n+]1c(C)csc1n2	ZINC000000247196	c2cnc1scc[n+]1c2
NCc1ccccc1N5CCN(C(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H]4Cc3ccccc3CN4)CC5	ZINC000013586739	O=C(NC(Cc1ccccc1)C(=O)N3CCN(c2ccccc2)CC3)C5Cc4ccccc4CN5
CCN(CC)CCS	ZINC000000388480	nonring
CC(C)n3c(=O)n(Cc2nc1ccccc1n2CCN(C)C)c4ccccc34	ZINC000000594344	O=c2[nH]c1ccccc1n2Cc4nc3ccccc3[nH]4
CC[N@]1CCC[C@@H]1CNC(=O)c3ccc(N2CCCC2=O)cc3	ZINC000000429214	O=C1CCCN1c3ccc(C(=O)NCC2CCCN2)cc3
CN(C)CCNC(=O)c2ccc1nc(C)c(C)nc1c2	ZINC000000217453	c2ccc1nccnc1c2
CC3(C)CC(NC(=O)CC(c1ccccc1)c2ccccc2)CC(C)(C)N3	ZINC000000800341	O=C(CC(c1ccccc1)c2ccccc2)NC3CCNCC3
C[N+](C)(C)CCOc2ccc1nc(N)sc1c2	ZINC000000216108	c2ccc1scnc1c2
COc2ccc(CN[C@@H]1CCSC1)c(OC)c2	ZINC000000217456	C2CC(NCc1ccccc1)CS2
C[C@@H]1CCCCN1C(=O)Cc2ccc(Cl)cc2	ZINC000000030698	O=C(Cc1ccccc1)N2CCCCC2
COc4ccc([N+]3=C1CCCCN1[C@@](O)(c2ccccc2)C3)cc4	ZINC000000425737	C4CCC3=[N+](c1ccccc1)CC(c2ccccc2)N3C4
CN(C)C[C@@H](O)C=C	ZINC000001733915	nonring
Cc4cccc([N+]3=C1SCCCN1[C@@](O)(c2cccs2)C3)c4	ZINC000000425731	C4CSC3=[N+](c1ccccc1)CC(c2cccs2)N3C4
CCN2CCN(c1ccc(NC(=O)C(C)C)cc1Cl)CC2	ZINC000000342348	C2CN(c1ccccc1)CCN2
COc1ccccc1\C=c3/c(=O)[nH]c(=O)n(c2cccc(C)c2)c3=O	ZINC000000063169	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)n2c3ccccc3
Cc2nn(C(=O)c1ccc(Cl)cc1)c(C)c2Sc3ncccn3	ZINC000000123562	O=C(c1ccccc1)n3cc(Sc2ncccn2)cn3
CCn3c(=N)c(C(=O)N1CCN(C)CC1)cc4c(=O)n2cccc(C)c2nc34	ZINC000000788815	N=c3[nH]c2nc1ccccn1c(=O)c2cc3C(=O)N4CCNCC4
CC[C@]4(c1cccs1)Oc2ccccc2n3cccc3C4=O	ZINC000000024170	O=C3C(c1cccs1)Oc2ccccc2n4cccc34
Cc3cccc(C(=O)N1CCc2ccccc12)c3	ZINC000000101306	O=C(N1CCc2ccccc12)c3ccccc3
CCCN(CCC)S(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000000029135	c1ccccc1
O=C1CCC(=O)N1c3ccc(Oc2ccc(C#N)cc2)cc3	ZINC000000034282	O=C1CCC(=O)N1c3ccc(Oc2ccccc2)cc3
COC(=O)c2cc(Br)c(=O)n(CCN1CCCCC1)c2	ZINC000000536063	O=c1ccccn1CCN2CCCCC2
C[C@H]2N(CCCN(C)C)c1ccccc1Sc3sccc23	ZINC000000346667	C2Nc1ccccc1Sc3sccc23
Cn2c[n+](N=Cc1ccco1)cn2	ZINC000000283576	C(=N[n+]1cn[nH]c1)c2ccco2
CC[C@@H](CCN)N1CCN(CC(=O)N(C)CC)CC1	ZINC000037223162	C1CNCCN1
Brc3ccc2OCc1noc(=O)n1c2c3	ZINC000000007253	O=c3onc2COc1ccccc1n23
CCCNC[C@@H](O)C=C	ZINC000004773627	nonring
Cn1cncc1CN	ZINC000004262677	c1c[nH]cn1
O[C@@H](COc1c(F)cc(Br)cc1F)CN2CCCC2	ZINC000000230599	C2CCN(CCCOc1ccccc1)C2
CN(C)Cc2cc(C(C)(C)c1cc(CN(C)C)c(O)c(CN(C)C)c1)cc(CN(C)C)c2O	ZINC000004257717	C(c1ccccc1)c2ccccc2
Nc4nccc(c2c(c1ccc(F)cc1)ncn2C3CCNCC3)n4	ZINC000000007258	C4CC(n2cnc(c1ccccc1)c2c3ccncn3)CCN4
Cc2c(NC1=NCCN1)ccc3OCCNc23	ZINC000000006307	C3COc2ccc(NC1=NCCN1)cc2N3
CC(C)N3CCC(N(C(=O)Cc1ccccc1)c2ccc(Cl)cc2)CC3	ZINC000000537935	O=C(Cc1ccccc1)N(C2CCNCC2)c3ccccc3
C[C@@H](O)CN1CCC(C[N@@](C)CCS(C)(=O)=O)CC1	ZINC000069658859	C1CCNCC1
Cc4cccc(n2c(N)c(C#N)c3nc1ccccc1nc23)c4	ZINC000000044181	c4ccc(n2ccc3nc1ccccc1nc23)cc4
O=C4CN(C(=O)C3CCN(C2CCN(CCCc1ccccc1)CC2)CC3)CCN4	ZINC000012048871	O=C4CN(C(=O)C3CCN(C2CCN(CCCc1ccccc1)CC2)CC3)CCN4
O=c1[nH]ccc2ccsc12	ZINC000000081731	O=c1[nH]ccc2ccsc12
CN4CCC(N(C)c2nc(c1ccccc1)nc3ccccc23)CC4	ZINC000000132601	C4CC(Nc2nc(c1ccccc1)nc3ccccc23)CCN4
COc5cccc(c3cn(c2ccc(CCN1CCC(O)CC1)cc2)c4ncnc(N)c34)c5	ZINC000001488120	C5CCN(CCc4ccc(n2cc(c1ccccc1)c3cncnc23)cc4)CC5
CC[N@@](CCCNc1ccnc2cc(Cl)ccc12)CCNS(=O)(=O)c3cccc4c(N(C)C)cccc34	ZINC000044388006	O=S(=O)(NCCNCCCNc1ccnc2ccccc12)c3cccc4ccccc34
CN(C)CCCNc2c1ccccc1nc3ccc(F)cc23	ZINC000004991171	c3ccc2nc1ccccc1cc2c3
CC(C)COc1ccccc1OCC(=O)Nc2c(C)cccc2C	ZINC000000061956	O=C(COc1ccccc1)Nc2ccccc2
COc4ccc(C3=C(CN(C)C)[C@@H](c1ccccc1)c2ccccc2O3)cc4	ZINC000000708911	O3C(c1ccccc1)=CC(c2ccccc2)c4ccccc34
O[C@H](Cn1c(=O)sc2ccccc12)C[n+]3ccccc3	ZINC000000405483	O=c2sc1ccccc1n2CCC[n+]3ccccc3
CN1CCN(C(N)=O)CC1	ZINC000001641438	C1CNCCN1
CN(C)C(=O)c3cccc(NC(=O)NCc2cccc(N1C(=N)NC(=N)NC1(C)C)c2)c3	ZINC000001728479	N=C3NCN(c2cccc(CNC(=O)Nc1ccccc1)c2)C(=N)N3
COc2cccc(NC(=O)N(CCN(C)C)[C@@H](C)c1cccnc1)c2	ZINC000000262112	O=C(NCc1cccnc1)Nc2ccccc2
CCOC(=O)c2cnc1c(C)cc(C)cc1c2Nc3ccccc3C	ZINC000000071908	N(c1ccccc1)c2ccnc3ccccc23
Cn3c([n+]1ccccc1)c(C=O)n(c2ccccc2)c3=O	ZINC000000042621	O=c2[nH]c([n+]1ccccc1)cn2c3ccccc3
COc1cc(CN)cc(OC)c1OC	ZINC000000389604	c1ccccc1
C[C@@H](NC(=O)C1CCOCC1)c5nnc4CC[N@@](Cc3ccc(CN2CCCCC2)s3)CCn45	ZINC000011872046	O=C(NCc4nnc3CCN(Cc2ccc(CN1CCCCC1)s2)CCn34)C5CCOCC5
C[N+](=O)Cc1ccc(Br)cc1	ZINC000000084684	c1ccccc1
Nc2nc(Cc1ccc(F)cc1)no2	ZINC000000066214	C(c1ccccc1)c2ncon2
Cn3nc(O[C@@H]2c1cc(C#N)ccc1OC(C)(C)[C@@]2(C)O)ccc3=O	ZINC000000012426	O=c3ccc(OC1CCOc2ccccc12)n[nH]3
Oc1c(CC=C)cccc1\C=N\c3nc2ccccc2n3CCN4CCCCC4	ZINC000000722100	C4CCN(CCn2c(N=Cc1ccccc1)nc3ccccc23)CC4
COc2ccc(\C=C/c1cc(OC)c(OC)c(OC)c1)cc2N	ZINC000000007280	C(=Cc1ccccc1)c2ccccc2
Cc1nnsc1c2onc(C)c2C(=O)NC(=O)Nc3ccccc3	ZINC000000122489	O=C(NC(=O)c1cnoc1c2cnns2)Nc3ccccc3
Cc3nc(CCNCc2cccc(OC[C@@H](O)CN1CCC(O)CC1)c2)sc3C	ZINC000012440072	C3CCN(CCCOc2cccc(CNCCc1nccs1)c2)CC3
CO[C@@H]1C[C@@H](N)[C@@H](O)[C@@H](C)O1	ZINC000002568057	C1CCOCC1
O=c2[nH]cnc3c(Cc1ccccc1)c[nH]c23	ZINC000000006234	O=c2[nH]cnc3c(Cc1ccccc1)c[nH]c23
CCN5CCN(C(=O)c4ccc(N3CCC([N@]2CCC[C@@H](OCc1ccccc1)C2)CC3)cc4)CC5	ZINC000012213853	O=C(N1CCNCC1)c5ccc(N4CCC(N3CCCC(OCc2ccccc2)C3)CC4)cc5
COc4ccc(C(=O)[C@@H](C[C@@H](CN1CCCCC1)C(=O)c2ccc(OC)cc2)CN3CCCCC3)cc4	ZINC000020036348	O=C(C(CC(CN1CCCCC1)C(=O)c2ccccc2)CN3CCCCC3)c4ccccc4
CN(C)CCCNCc1cc(Cl)ccc1OC[C@@H](O)CN2CCCCCC2	ZINC000011770575	C2CCCN(CCCOc1ccccc1)CC2
OC(=O)CCCn3c(=O)c1ccccc1c4c(=O)c2ccccc2c34	ZINC000000025697	O=c3[nH]c2c1ccccc1c(=O)c2c4ccccc34
Cc2cc1scc(C)[n+]1cc2C	ZINC000000386976	c2cc[n+]1ccsc1c2
CC(C)(C)NC(=O)c2ccc1nccnc1c2	ZINC000000045669	c2ccc1nccnc1c2
CN(C)[C@@H]1CCCCNC1=O	ZINC000000388584	O=C1CCCCCN1
Cc2n(CCO)c1cc(Cl)c(Cl)cc1[n+]2CCO	ZINC000000370117	c2ccc1[nH]cnc1c2
Cc1cc(=O)oc4c1ccc3o\c(=C/c2ccc(Cl)cc2)c(=O)c34	ZINC000000034737	O=c4ccc3ccc2oc(=Cc1ccccc1)c(=O)c2c3o4
CCN(CC)CCOC(=O)c1ccc(OC)cc1OCCN(CC)CC	ZINC000004872253	c1ccccc1
Clc3ccc(CCNC2CCN(Cc1ccccc1)CC2)cc3	ZINC000000181945	C(Cc1ccccc1)NC3CCN(Cc2ccccc2)CC3
COc4ccc3c(ccc2[nH]c1c(C)cnc(NCCCN(C)C)c1c23)c4	ZINC000001639364	c1ccc4c(c1)ccc3[nH]c2ccncc2c34
Cc4ccc3c(nc2s\c(=C/c1ccc(F)cc1F)c(=O)n23)c4C	ZINC000000034732	O=c3c(=Cc1ccccc1)sc4nc2ccccc2n34
CC[C@@H](C)C(=O)Nc1ccc(Cl)cc1	ZINC000000030453	c1ccccc1
CN4CCN(C(=O)c3ccc([C@@H]1SCC(=O)N1Cc2ccco2)cc3)CC4	ZINC000000802867	O=C3CSC(c2ccc(C(=O)N1CCNCC1)cc2)N3Cc4ccco4
c2cnc1nccc[n+]1c2	ZINC000000390799	c2cnc1nccc[n+]1c2
Cc1ccccc1NC(=O)[C@@H]2CC(=O)OC23CCCCC3	ZINC000000034608	O=C3CC(C(=O)Nc1ccccc1)C2(CCCCC2)O3
Cc3ccc(NC2=NC1(CCCC1)NC(=N)N2)cc3	ZINC000000203776	N=C3NC(Nc1ccccc1)=NC2(CCCC2)N3
OC[C@@H]2CCC[N@](C1CCCCCC1)C2	ZINC000000220055	C2CCCC(N1CCCCC1)CC2
CC2(C)CC(NC(=S)Nc1ccccc1)CC(C)(C)N2	ZINC000000173688	S=C(NC1CCNCC1)Nc2ccccc2
OC(=O)[C@@H](Oc3ccc2c1CCCc1c(=O)oc2c3)c4ccccc4	ZINC000000091033	O=c4oc2cc(OCc1ccccc1)ccc2c3CCCc34
COc1ccc(Cl)cc1NS(=O)(=O)c2ccc(C)cc2	ZINC000000102668	O=S(=O)(Nc1ccccc1)c2ccccc2
CN(C)CCCC(C)(C)Cl	ZINC000000162332	nonring
CC[C@@H]2CSC(Nc1c(C)cccc1C)=N2	ZINC000000071831	C2CN=C(Nc1ccccc1)S2
Cc3ccc(S(=O)(=O)C[C@@H](N1CCCC1)c2ccccc2)cc3	ZINC000000467587	O=S(=O)(CC(N1CCCC1)c2ccccc2)c3ccccc3
CCN(CC)CCOc1cc(C)ccc1C(C)C	ZINC000000002125	c1ccccc1
C[n+]1ccc(C#N)c2ccccc12	ZINC000000405024	c2ccc1ncccc1c2
CC(=O)Nc3ccc([C@@H]2NN=C(c1ccc(C(F)(F)F)cn1)N2)cc3	ZINC000000127276	N2N=C(c1ccccn1)NC2c3ccccc3
O=C1CNC(=S)N1CCc2cnc[nH]2	ZINC000000076829	O=C1CNC(=S)N1CCc2cnc[nH]2
CCOc2cc(CN)c(n1cccc1)cc2OCC	ZINC000000056345	c2ccc(n1cccc1)cc2
COc4ccc(S(=O)(=O)Nc2cc(C(=O)N1CCC[N@@](C)CC1)ccc2N3CCNCC3)cc4OC	ZINC000033033248	O=C(N1CCCNCC1)c4ccc(N2CCNCC2)c(NS(=O)(=O)c3ccccc3)c4
O=c2oc1ccccc1cc2C5=NO[C@@H](c4ccc3OCOc3c4)C5	ZINC000000031985	O=c2oc1ccccc1cc2C5=NOC(c4ccc3OCOc3c4)C5
CCOCCNC	ZINC000014628659	nonring
Clc6ccc(OCc4c(C(=O)CN2CCC(N1CCCCC1)CC2)c3ccccc3n4CCC[C@@H]5CCCNC5)cc6	ZINC000026649493	O=C(CN2CCC(N1CCCCC1)CC2)c5c(COc3ccccc3)n(CCCC4CCCNC4)c6ccccc56
O[C@H](CO/N=C(\Cl)c1cccnc1)CN2CCCCC2	ZINC000000006126	C2CCN(CCCON=Cc1cccnc1)CC2
COc1cc(CNCC(C)(C)CO)ccc1OC[C@@H](O)CN2CCSCC2	ZINC000011838672	C(COc1ccccc1)CN2CCSCC2
CC(C)(C)[C@H](N)Cn1ccnc1	ZINC000000111472	c1c[nH]cn1
CC[N+](C)(C)CCC#N	ZINC000001720071	nonring
N=C1SCCN1CC(=O)c2ccccc2	ZINC000000190006	N=C1SCCN1CC(=O)c2ccccc2
Cc2cc1c(=O)n(N)c(C)nc1s2	ZINC000000059003	O=c1[nH]cnc2sccc12
CCN(CC)CCC[C@@H](C)Nc1cc(Cl)cc2nc5c(cc12)n(CCN3CCCC3)c4ccccc45	ZINC000299871370	C5CCN(CCn3c1ccccc1c4nc2ccccc2cc34)C5
COC(=O)c2oc1ccccc1c2NC(=O)c3ccccc3O	ZINC000000087140	O=C(Nc1coc2ccccc12)c3ccccc3
COc2ccc(n1c(C)c[nH]c1=O)cc2	ZINC000000000472	O=c1[nH]ccn1c2ccccc2
Clc3ccc(NC(=O)NCc2ccc(c1csnn1)cc2)cc3	ZINC000000106462	O=C(NCc2ccc(c1csnn1)cc2)Nc3ccccc3
Fc1ccccc1S(=O)(=O)CC#N	ZINC000000096269	c1ccccc1
CC[N@](CCO)CCn2c(Cc1ccccc1)nc3n(C)c(=O)n(C)c(=O)c23	ZINC000000608191	O=c3[nH]c(=O)c2[nH]c(Cc1ccccc1)nc2[nH]3
CN(C)CCNC(=O)c3ccc(CSc2nc(N1CCN(C)CC1)cc(C(F)(F)F)n2)cc3	ZINC000036045208	C3CN(c2ccnc(SCc1ccccc1)n2)CCN3
CC(=O)c2nn(c1ccc(F)cc1F)c(=O)[nH]c2=O	ZINC000001383276	O=c2cnn(c1ccccc1)c(=O)[nH]2
C[N+]3(C/C=C/c1ccccc1)CC[N+](C)(Cc2ccc(C(F)(F)F)cc2)CC3	ZINC000004109894	C2CN(Cc1ccccc1)CCN2CC=Cc3ccccc3
CCN(CC)CCOc2ccc1ccccc1c2[C@@H](Cc3ccccc3)NCCO	ZINC000006382326	C(Cc1cccc2ccccc12)c3ccccc3
Fc2cccc(C(=O)NCCN1CCCC1)c2	ZINC000000383054	O=C(NCCN1CCCC1)c2ccccc2
NNc1nc(N)c3c(n1)c2ccccc2CC34CCCC4	ZINC000000078979	C1CCC4(C1)Cc2ccccc2c3ncncc34
CCOc2ccc(S(=O)(=O)NCc1ccccc1)cc2C(O)=O	ZINC000000042772	O=S(=O)(NCc1ccccc1)c2ccccc2
O=C(Oc2ccc(C1SCCS1)cc2)c3ccc(N(=O)=O)cc3	ZINC000000031527	O=C(Oc2ccc(C1SCCS1)cc2)c3ccccc3
Nc4cccc(c1nc3cccc2cccc([nH]1)c23)c4	ZINC000000051935	c4ccc(c1nc3cccc2cccc([nH]1)c23)cc4
COCCN4CCC(C[N@](Cc1ccncc1)Cc2c[nH]nc2c3cc(C)ccc3C)CC4	ZINC000011663482	C4CC(CN(Cc1ccncc1)Cc2c[nH]nc2c3ccccc3)CCN4
Clc3ccc(c2noc(CSC1=NCCN1)n2)cc3	ZINC000000137811	C3CN=C(SCc2nc(c1ccccc1)no2)N3
Cn2c(SCCN1CCCCC1)nnc2c3ccccc3	ZINC000000422190	C3CCN(CCSc2nnc(c1ccccc1)[nH]2)CC3
CSCCN	ZINC000001692565	nonring
COc1cc(C)[n+](C)c(C)c1	ZINC000000392664	c1ccncc1
O[C@@H]([C@H](N1CCCCC1)c2ccccc2)c3ccc(Cl)cc3	ZINC000000346081	C3CCN(C(Cc1ccccc1)c2ccccc2)CC3
Cc1ccc(C)n1Nc3ccc(N2CCOCC2)nn3	ZINC000000001749	C3CN(c2ccc(Nn1cccc1)nn2)CCO3
C[C@@H]1C[C@H](NC(=O)/C=C/C(O)=O)CC(C)(C)C1	ZINC000000096730	C1CCCCC1
CCN(CC)Cc2ccc(NC(=O)c1ccc(C#N)cc1F)cc2	ZINC000000568300	O=C(Nc1ccccc1)c2ccccc2
CCOC(=O)[C@@H]2CCC[N@@](C1CCN(C)CC1)C2	ZINC000000248228	C2CCN(C1CCNCC1)CC2
CCCCCN(CCCCC)CCC(=N)NOC(=O)c1ccccc1	ZINC000004427487	c1ccccc1
CCOC(=O)[C@@]2(c1ccccc1)CCC=C[C@@H]2N(C)C	ZINC000000001268	C2CC(c1ccccc1)CC=C2
CCOC(=O)[C@@H]2CCCN(C(=O)N1CCOCC1)C2	ZINC000000031701	O=C(N1CCCCC1)N2CCOCC2
CC(C)N1CC(=O)[O+]=N1	ZINC000001687618	O=C1CNN=[O+]1
COc1ccccc1N5CCN(C[C@@H]2CN=c3n2c(=O)[nH]c4ccccc34)CC5	ZINC000000601766	O=c4[nH]c1ccccc1c5=NCC(CN3CCN(c2ccccc2)CC3)n45
OC(=O)CC2=C(c1cccs1)CCC2=O	ZINC000000054522	O=C2CCC(c1cccs1)=C2
CCOc5ccc(c4cn(c1ccc(OC)cc1)c3CCc2ccccc2[n+]34)cc5	ZINC000000622951	C4Cc3n(c1ccccc1)cc(c2ccccc2)[n+]3c5ccccc45
CN([C@@H]2CC[C@]1(CCCO1)C[C@H]2N3CCCC3)C(=O)Cc4cccc5occc45	ZINC000000597356	O=C(Cc1cccc2occc12)NC4CCC3(CCCO3)CC4N5CCCC5
CN2C[C@H](c1cccc(O)c1)O[C@H]2C(C)(C)C	ZINC000000003796	C2NCC(c1ccccc1)O2
O=c3n(CN1CCCCC1)cnc4n(CCN2CCCCC2)cnc34	ZINC000000074880	O=c3n(CN1CCCCC1)cnc4n(CCN2CCCCC2)cnc34
CC(O)=C3[C@@H](c1ccc(F)cc1)N(c2ccc(F)cc2)C(=O)C3=O	ZINC000000035068	C=C3C(c1ccccc1)N(c2ccccc2)C(=O)C3=O
OC1(C#CBr)CCCCC1	ZINC000000078195	C1CCCCC1
O[C@H](CN(CC=C)CC=C)Cn2c1ccccc1sc3ccccc23	ZINC000000706987	c3ccc2sc1ccccc1[nH]c2c3
CCCN(c1ccncc1)n2cccn2	ZINC000000010546	N(c1ccncc1)n2cccn2
Cc1cc(C)n(CCO)c(=O)n1	ZINC000000033566	O=c1nccc[nH]1
Cc2n(C)c1ccccc1[n+]2C[C@@H](O)COc3ccc(F)cc3	ZINC000000316280	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
CCOc3ccc(c2cc(OCC)c1c(C)oc(C)c1c(=O)c2)cc3	ZINC000000111958	O=c2cc(c1ccccc1)ccc3cocc23
C1CN3CCC1C(c2ccsc2)=C3	ZINC000000017165	C1CN3CCC1C(c2ccsc2)=C3
CCN(CC)CCC[C@H](C)NCc2nnc(c1ccc(Cl)cc1)o2	ZINC000006552426	c2ccc(c1nnco1)cc2
CN2CCc3c(N)c1cc(C)cc(C)c1nc23	ZINC000000104448	C3Cc2cc1ccccc1nc2N3
C[C@@H]([C@@H](O)c1ccccc1)[N+](C)(C)Cc2ccccc2	ZINC000000156772	C(Cc1ccccc1)NCc2ccccc2
C3CN(c2nccc(OCc1ccccc1)n2)CCN3	ZINC000000003314	C3CN(c2nccc(OCc1ccccc1)n2)CCN3
Cc2cc(N1CCCC1=O)cc(C)c2Cn4c(=O)c3ccccc3c4=O	ZINC000000111381	O=C1CCCN1c4ccc(Cn3c(=O)c2ccccc2c3=O)cc4
OC[C@@H]1COCCN1	ZINC000004202897	C1COCCN1
Cc3ccc([C@@H]1SCC(=O)N1CCN2CCCCC2)cc3	ZINC000000072762	O=C2CSC(c1ccccc1)N2CCN3CCCCC3
CN(C)CCCN2CCN(c1ccc(NC(C)=O)cc1)CC2	ZINC000000001951	C2CN(c1ccccc1)CCN2
C[C@@]13NCC[C@@]1(C)c2ccccc2N3	ZINC000000270800	C1CC2C(N1)Nc3ccccc23
CCc4ccc(OCc1ccccc1C(=O)Nc3ccc2nc(C)cc(N)c2c3)cc4	ZINC000000602902	O=C(Nc2ccc1ncccc1c2)c3ccccc3COc4ccccc4
C[C@H](N)c1cnn(C)c1	ZINC000002559653	c1cn[nH]c1
COc5ccc([n+]3c2CCc1ccccc1n2cc3c4ccc(C)cc4)cc5	ZINC000000636621	C4Cc2n(cc(c1ccccc1)[n+]2c3ccccc3)c5ccccc45
Brc1ccc(C=O)cc1	ZINC000000039555	c1ccccc1
CN(C)CCc2c[nH]c3ccc(C[C@@H]1COC(=O)N1)cc23	ZINC000000005298	O=C3NC(Cc2ccc1[nH]ccc1c2)CO3
CCOc2ccc(NC(=O)CSc1nc(C)cc(C)c1C#N)cc2	ZINC000000375435	O=C(CSc1ccccn1)Nc2ccccc2
C[N@@](CCn1cccn1)Cc5cc3cc2OCOc2cc3n(CCN4CCCCC4)c5=O	ZINC000014991900	O=c4c(CNCCn1cccn1)cc3cc2OCOc2cc3n4CCN5CCCCC5
N=C1NCCN1c2ccccc2	ZINC000000139150	N=C1NCCN1c2ccccc2
NNc2ncnc3n(Cc1ccccc1)ncc23	ZINC000000045342	C(c1ccccc1)n2ncc3cncnc23
O/N=C/c3cc[n+](C\C=C\Cn1ccc(=N)c2ccccc12)cc3	ZINC000005184166	N=c2ccn(CC=CC[n+]1ccccc1)c3ccccc23
Cn2cnc1ccc(N(=O)=O)cc1c2=O	ZINC000000032144	O=c1[nH]cnc2ccccc12
C[S@@](=O)Cc1ccccc1	ZINC000000013561	c1ccccc1
C[C@@H](COC(=O)CCCCCCC(=O)OC[C@H](C)[N+](C)(C)C)[N+](C)(C)C	ZINC000004763359	nonring
NCc1csc2ccc(Cl)cc12	ZINC000000165951	c2ccc1sccc1c2
CC(=O)Oc2ccc(C(=O)Nc1cccc(C(F)(F)F)c1)cc2	ZINC000000049661	O=C(Nc1ccccc1)c2ccccc2
CN(C)CCCc3cc(C(=O)Nc2ccc(c1ccncc1)cc2)ccc3O	ZINC000000599925	O=C(Nc2ccc(c1ccncc1)cc2)c3ccccc3
COc3ccnc(N2CCN(C(=O)c1sccc1F)CC2)n3	ZINC000000017606	O=C(N2CCN(c1ncccn1)CC2)c3cccs3
OC(=O)CNC(=O)Nc1ccccc1	ZINC000000039439	c1ccccc1
C[C@@H](CN1CCCC1)OC(=O)c2ccccc2Br	ZINC000000210675	O=C(OCCN1CCCC1)c2ccccc2
OCC[N@@](Cc1ccccc1)Cc2ccccc2Br	ZINC000000759112	C(NCc1ccccc1)c2ccccc2
CN(C)CCOC(=O)Nc1ccc(C)c(NC(=O)OCCN(C)C)c1	ZINC000004489101	c1ccccc1
CN5CCN(c3nnc4c1ccccc1sc2ccc(Cl)cc2n34)CC5	ZINC000000717621	C5CN(c3nnc4c1ccccc1sc2ccccc2n34)CCN5
FC(F)(F)c1ccc(Cl)c(C=O)c1	ZINC000000056837	c1ccccc1
CN(C)CCCN2C[C@@H](COc1ccccc1)O[C@@H]2c3ccccc3	ZINC000000517202	C2NC(c1ccccc1)OC2COc3ccccc3
C1CC1N[C@@H]3CC[C@H]2C[C@H]23	ZINC000002020282	C1CC1NC3CCC2CC23
Nc2ncnc3n(CCN1CCCCC1)cnc23	ZINC000000490333	C3CCN(CCn1cnc2cncnc12)CC3
NCCn1cccn1	ZINC000000873902	c1cn[nH]c1
COc4cc3nc(N2CCN(C(=O)C(C)(C)Oc1ccccc1)CC2)nc(N)c3cc4OC	ZINC000000638486	O=C(COc1ccccc1)N4CCN(c3ncc2ccccc2n3)CC4
Cc2[nH]c1ccc(N(=O)=O)cc1c2CCN	ZINC000000032541	c2ccc1[nH]ccc1c2
CCCC[N@@](C)CC(=O)OC	ZINC000020360942	nonring
NC3=NC[C@@]1(CN2CCC1CC2)O3	ZINC000000014867	C1CN3CCC1C2(CN=CO2)C3
CN(C)CCNC(=O)CN1C(=O)CSc2ccccc12	ZINC000000218715	O=C2CSc1ccccc1N2
COC(=O)c2cc(N1CCNCC1)nc3ccccc23	ZINC000000033812	C3CN(c2ccc1ccccc1n2)CCN3
CCN(CC)CCOc2cc1oc(=O)cc(C)c1cc2OCCN(CC)CC	ZINC000000538134	O=c2ccc1ccccc1o2
CCN(CC)C[C@@H](O)COc1ccc(CNCC(C)C)cc1OC	ZINC000011661651	c1ccccc1
C5CO[C@H](C[N@](C/C=C/c1ccco1)CC4CCN(C3Cc2ccccc2C3)CC4)C5	ZINC000012756959	C5COC(CN(CC=Cc1ccco1)CC4CCN(C3Cc2ccccc2C3)CC4)C5
CS(=O)(=O)C=C(O)c1ccccc1	ZINC000000395147	c1ccccc1
CC(C)Cn1cc(C)c(=O)[nH]c1=O	ZINC000000052447	O=c1cc[nH]c(=O)[nH]1
O[C@@H]1CCC[C@H]1[N@]2CCCOCC2	ZINC000061920678	C2CCC(N1CCCOCC1)C2
OC3CCN(C[C@H](O)COc2cccc(C[N@]1CCCCC1(CC=C)CC=C)c2)CC3	ZINC000012583106	C3CCN(CCCOc2cccc(CN1CCCCC1)c2)CC3
CN(C[C@@H]2CCC[N@@](CCc1ccccc1C)C2)Cc3c[nH]nc3c4ccccc4	ZINC000012305093	C4CC(CNCc1c[nH]nc1c2ccccc2)CN(CCc3ccccc3)C4
C2Oc1ccccc1O[C@@H]2CSc4nc3ccccc3[nH]4	ZINC000000053136	C2Oc1ccccc1OC2CSc4nc3ccccc3[nH]4
COC(=O)c1c(C)scc1NC(C)=O	ZINC000000082677	c1ccsc1
CN6CCN(c3cc(NCCN1CCCC1)c5c(=O)c2ccccc2c4onc3c45)CC6	ZINC000009641242	O=c4c1ccccc1c6onc5c(N2CCNCC2)cc(NCCN3CCCC3)c4c56
CCc1ccccc1N3CCN(CCc2cc(OC)c(OC)c(OC)c2)CC3	ZINC000000625024	C2CN(c1ccccc1)CCN2CCc3ccccc3
CN(C)CCOC(=O)C25CC4C[C@](c1ccccc1)(C2)C[C@@](c3ccccc3)(C4)C5	ZINC000000758177	C2C4CC5(c1ccccc1)CC2CC(c3ccccc3)(C4)C5
Clc4cccc(N3CCN(CCCn2nc1ccccn1c2=O)CC3)c4	ZINC000000538483	O=c3n(CCCN2CCN(c1ccccc1)CC2)nc4ccccn34
CC3CCN([C@@H]2CC(=O)N(c1ccc(F)cc1)C2=O)CC3	ZINC000000059892	O=C2CC(N1CCCCC1)C(=O)N2c3ccccc3
CCOC(=O)C1=C(CN(CC)CC)N(C)C(=O)N[C@@H]1c2ccccc2	ZINC000000033404	O=C2NC=CC(c1ccccc1)N2
Clc4ccc(C(=O)Cn2c1=NCCn1c3ccccc23)cc4	ZINC000000017113	O=C(Cn2c1=NCCn1c3ccccc23)c4ccccc4
N[C@H]2CCc1[nH]cnc1C2	ZINC000003647886	C2CCc1[nH]cnc1C2
CC(=O)c2cc(c1ccc(Cl)cc1)oc2C	ZINC000000113383	c2ccc(c1ccco1)cc2
CCN(CC)CCn2nc4c1ccccc1sc3c(CN)ccc2c34	ZINC000000838518	c1ccc2c(c1)sc4cccc3[nH]nc2c34
Cc4cc(C)c3c(N)c(C1=NC(C)(C)Cc2ccccc12)sc3n4	ZINC000000100030	C4Cc1ccccc1C(c3cc2cccnc2s3)=N4
CCN5CCN([C@@H](CN3CCN(CCCCc1cccc2ccccc12)CC3)c4ccc(F)cc4)CC5	ZINC000028646147	C(CCc1cccc2ccccc12)CN5CCN(CC(N3CCNCC3)c4ccccc4)CC5
NCC23C[C@H]1C[C@H](CC(Cl)(C1)C2)C3	ZINC000000226065	C1C2CC3CC1CC(C2)C3
CC(C)(C)NC(=O)C2CCN(Cc1ccccc1Cl)CC2	ZINC000000299305	C2CCN(Cc1ccccc1)CC2
Cc2cc(C)n(C(=O)c1c(N(=O)=O)cnn1C)n2	ZINC000000033406	O=C(c1ccn[nH]1)n2cccn2
Cc2cc(=O)oc3ccc(OC\C(=N\O)c1ccc(Cl)cc1)cc23	ZINC000000036282	N=C(COc2ccc1oc(=O)ccc1c2)c3ccccc3
COC(=O)Cc1c[nH]c2ccc(OC[C@@H](O)CNC(C)C)cc12	ZINC000000192525	c2ccc1[nH]ccc1c2
CN(C)CCc1ccc(O)cc1	ZINC000000160784	c1ccccc1
Cc2cccc(NC(=O)\C=C\c1ccccc1)n2	ZINC000000033146	O=C(Nc1ccccn1)C=Cc2ccccc2
CCOC(=O)CCc3ccc2O[C@@H](c1ccc(N(C)C)cc1)Nc2c3	ZINC000000094519	N2C(c1ccccc1)Oc3ccccc23
OC(=O)CC3(CC(=O)Nc1ccccc1n2cccn2)CCCCC3	ZINC000000129855	O=C(CC1CCCCC1)Nc2ccccc2n3cccn3
Cc1cccc2cc(C=O)c(Cl)nc12	ZINC000000058233	c2ccc1ncccc1c2
O=C(CN2N=C(c1ccccc1)CCC2=O)NCCN3CCCC3	ZINC000000219594	O=C(CN2N=C(c1ccccc1)CCC2=O)NCCN3CCCC3
COc3ccc(C[N@@](C)Cc1ccccc1OC[C@@H](O)CN2CCCCC2)c4cccnc34	ZINC000012026917	C4CCN(CCCOc1ccccc1CNCc2cccc3ncccc23)CC4
CNCCCNCc2cn(Cc1ccc(Cl)cc1Cl)c3ccccc23	ZINC000010315401	C(c1ccccc1)n2ccc3ccccc23
CCN(CC)C[C@@H](CC[C@H](CN(CC)CC)C(=O)c1ccc(OC)cc1)C(=O)c2ccc(OC)cc2	ZINC000008387046	O=C(CCCCC(=O)c1ccccc1)c2ccccc2
CC(=NNC(=O)CCc1ccccc1)c2cccc(N)c2	ZINC000000125107	O=C(CCc1ccccc1)NN=Cc2ccccc2
COc2cc(OC)c(C(=O)NC1CC(C)(C)NC(C)(C)C1)cc2OC	ZINC000000808369	O=C(NC1CCNCC1)c2ccccc2
CC(C)(C)OC(=O)N1CCC[C@@H]1CO	ZINC000000057019	C1CCNC1
CCCN(CCC)CCc1cccc2NC(=O)Cc12	ZINC000000002041	O=C2Cc1ccccc1N2
CCN(CC)CCOc1ccccc1O/C(=C/c2ccccc2)C(C)=O	ZINC000000538552	O(C=Cc1ccccc1)c2ccccc2
Cc1ccccc1OC[C@@H]3CN(CN2CCCCC2)C(=O)O3	ZINC000000090378	O=C2OC(COc1ccccc1)CN2CN3CCCCC3
Cn2c(=O)[nH]c3cc1nn[nH]c1cc23	ZINC000000002428	O=c3[nH]c2cc1nn[nH]c1cc2[nH]3
O=c2[nH]c1ccccc1n3cccc23	ZINC000000110639	O=c2[nH]c1ccccc1n3cccc23
CC(C)C[C@@H](NS(=O)(=O)c1ccccc1N(=O)=O)C(O)=O	ZINC000000084645	c1ccccc1
C[N+](C)(C)CCC[n+]1ccccc1CCc2cccc3ccccc23	ZINC000003620892	C(Cc1cccc2ccccc12)c3ccccn3
CC(C)N[C@@H](C)C(=O)c1ccc(O)c(O)c1	ZINC000000000608	c1ccccc1
CN(C)CCn3c1c(CCCn2cnnc12)c4ccccc34	ZINC000000052653	C4Cc1c([nH]c2ccccc12)c3nncn3C4
CCOC(=O)Cc2csc(NC(=O)COc1c(C)cccc1C)n2	ZINC000000118047	O=C(COc1ccccc1)Nc2nccs2
Cc4ccc(n2ncc3c(NCc1ccccn1)ncnc23)c(C)c4	ZINC000000074320	C(Nc2ncnc3n(c1ccccc1)ncc23)c4ccccn4
NC[C@@H](F)CON	ZINC000001492791	nonring
N[C@H](C(=O)N2[C@@H](C#N)C[C@@H]1C[C@@H]12)C3(CO)CCC3	ZINC000000027201	O=C(CC1CCC1)N3CCC2CC23
COc2ccc(CCNC(=O)c1cccc(Cl)c1)cc2OC	ZINC000000037540	O=C(NCCc1ccccc1)c2ccccc2
CCN1C[C@H]2C[N@@](C)C[C@@H](C1)C2OC(=O)c3ccc(Cl)cc3	ZINC000000001034	O=C(OC1C2CNCC1CNC2)c3ccccc3
Oc2ccc1[n+](CC#C)cccc1c2	ZINC000000270705	c2ccc1ncccc1c2
CC23OC1CC(CC(C1)O2)O3	ZINC000000039729	C1C2CC3CC1OC(O2)O3
C[N+](C)(C)C[C@@H]1CCCC1=O	ZINC000001616604	O=C1CCCC1
C[N@]3CC[C@]2(OC(=O)c1ccc(N(=O)=O)cc1)CCCC[C@@H]2C3	ZINC000000161306	O=C(OC12CCCCC1CNCC2)c3ccccc3
Cc3cc[n+](CC(=O)CCc2ccc(C(=O)C[n+]1ccc(C)cc1)cc2)cc3	ZINC000001559970	O=C(CCc2ccc(C(=O)C[n+]1ccccc1)cc2)C[n+]3ccccc3
C[N+](C)(C)c4ccc(CNC(=O)c2cc1cc(S(C)(=O)=O)ccc1n2Cc3cccc(C(N)=N)c3)cc4	ZINC000013474324	O=C(NCc1ccccc1)c3cc2ccccc2n3Cc4ccccc4
CCN2C=C(C(=O)OC)C(c1ccccc1Cl)C(C(=O)OC)=C2	ZINC000000036516	N2C=CC(c1ccccc1)C=C2
CCN(CC)CCC(=O)OC	ZINC000001555284	nonring
OC(=O)Cn2c1CCCCc1c(=S)nc2c3cccc(N(=O)=O)c3	ZINC000000079483	S=c3nc(c1ccccc1)[nH]c2CCCCc23
CN2CCN(c1ncc(C#N)c(N)n1)CC2	ZINC000000159647	C2CN(c1ncccn1)CCN2
CCC(=O)OC2(CC#C)CCN(CCc1ccccc1)CC2	ZINC000000001992	C2CCN(CCc1ccccc1)CC2
Clc4cccc([C@H]2C1C(=O)CCCC1=Nc3ncnn23)c4Cl	ZINC000000071128	O=C3CCCC4=Nc1ncnn1C(c2ccccc2)C34
Cc1ccc(C(O)(C(F)(F)F)C(F)(F)F)c(O)c1C	ZINC000000033810	c1ccccc1
CC2(C)SC(=N)NC1=CC(=O)CC12	ZINC000000120883	N=C2NC1=CC(=O)CC1CS2
CCn1c(SC)nc2n(C)c(=O)[nH]c(=O)c12	ZINC000000039894	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
CCN(C[C@@H]2CCC[N@@](CCc1cccc(F)c1)C2)Cc3cccn3c4nccs4	ZINC000020542620	C4CC(CNCc1cccn1c2nccs2)CN(CCc3ccccc3)C4
C[N@]1C[C@@H](C=O)CC=C1	ZINC000001595510	C1CNC=CC1
C[C@@H](c2cccc(C(=O)c1ccccc1)c2)c3cc(N)on3	ZINC000000002928	O=C(c1ccccc1)c3cccc(Cc2ccon2)c3
CC(=O)c2ccc(NC(=S)NC(=O)c1cccc(C)c1)cc2	ZINC000000038922	O=C(NC(=S)Nc1ccccc1)c2ccccc2
COc3cc(NCc2ccc1nc(N)nc(N)c1c2C)cc(OC)c3OC	ZINC000000598852	C(Nc1ccccc1)c3ccc2ncncc2c3
CONC(=O)Nc1ccccc1	ZINC000000039704	c1ccccc1
C[N@]1[C@H]4CC[C@@H]1C=C(N(C(=O)c2ccc(Cl)cc2)c3ccccc3)C4	ZINC000000755209	O=C(N(C1=CC2CCC(C1)N2)c3ccccc3)c4ccccc4
Clc1ccccc1NC(=O)c3cc[n+](Cc2ccc(N(=O)=O)cc2)cc3	ZINC000000859286	O=C(Nc1ccccc1)c3cc[n+](Cc2ccccc2)cc3
NCCn1ccnc1	ZINC000001563631	c1c[nH]cn1
C1CC4(CCN1Cc2ccccn2)CCc3ccccc34	ZINC000000014944	C1CC4(CCN1Cc2ccccn2)CCc3ccccc34
C[C@@H](N)[C@@H](C)CON	ZINC000000019198	nonring
CNC1CCOCC1	ZINC000001529122	C1CCOCC1
C[N@]4CCC[C@H](C(=O)n2c1ccccc1[nH]c(=O)c3cccnc23)C4	ZINC000000004265	O=C(C1CCCNC1)n3c2ccccc2[nH]c(=O)c4cccnc34
Cn2c(c1ccc(Cl)cc1Cl)[n+](C)c3ccccc23	ZINC000000279156	c3ccc(c2nc1ccccc1[nH]2)cc3
CCN(CC)Cc2ccc(NC(=O)Cc1ccc(Cl)cc1)cc2	ZINC000000557473	O=C(Cc1ccccc1)Nc2ccccc2
CNc2ncnc3cc(C1=NNC(=O)C[C@@H]1C)ccc23	ZINC000000004260	O=C3CCC(c2ccc1cncnc1c2)=NN3
CC(C)NC(=N)CCn1cnc2n(C)c(=O)n(C)c(=O)c12	ZINC000000054273	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
COCc3cc(C[N@@](C)CC2CCN(CCc1ccc(F)cc1)CC2)ccc3OC	ZINC000012595983	C2CN(CCc1ccccc1)CCC2CNCc3ccccc3
CCN(CC)CCNc2nc1n(C)c(=O)n(C)c(=O)c1n2CC	ZINC000000079001	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
N=C(Nc1ccccc1)SCCCSC(=N)Nc2ccccc2	ZINC000001667613	N=C(Nc1ccccc1)SCCCSC(=N)Nc2ccccc2
Brc2cccc(C(=O)OCCN1CCCCC1)c2	ZINC000000210696	O=C(OCCN1CCCCC1)c2ccccc2
FC(F)(F)C(=O)Nc1ccccc1C(=O)NCc2cccs2	ZINC000000041211	O=C(NCc1cccs1)c2ccccc2
CN(C)CCCN2c1ccccc1CCc3ccc(C#N)cc23	ZINC000000001141	C2Cc1ccccc1Nc3ccccc23
O[C@@H]2[C@H]1CC[C@H](C1)[C@@H]2CN3CCCCC3	ZINC000000394562	C3CCN(CC1CC2CCC1C2)CC3
FC(F)(F)c2cc(NCC[C@@H]1CCCCN1)cc(C(F)(F)F)c2	ZINC000000068075	C2CCC(CCNc1ccccc1)NC2
CC(C)Cn1cnc2n(C)c(=O)n(C)c(=O)c12	ZINC000000004317	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
Cc1oc(C)c(C(O)=O)c1CN	ZINC000000054479	c1ccoc1
COc2ccc(C(=O)CCN1CCCCC1)cc2	ZINC000000128630	O=C(CCN1CCCCC1)c2ccccc2
Cc2nc1ccccc1cc2C(N)=O	ZINC000000036600	c2ccc1ncccc1c2
ClC1=CC[C@@H]3[C@H](C1)C(=O)N(CCN2CCCCC2)C3=O	ZINC000000139734	O=C2C1CC=CCC1C(=O)N2CCN3CCCCC3
CCN(CC)CC[C@@H](C)O	ZINC000001646250	nonring
CCc1ccccc1N3C(=O)C[C@H](Sc2nc(C)cc(C)n2)C3=O	ZINC000000075698	O=C2CC(Sc1ncccn1)C(=O)N2c3ccccc3
Oc1ccccc1\C=N\n4c(c2ccccc2)nc3ccccc3c4=O	ZINC000000049119	O=c3n(N=Cc1ccccc1)c(c2ccccc2)nc4ccccc34
CC[N+](CC)(CCO)CCCN2C(=O)[C@@H]1CC=C(Cl)C[C@H]1C2=O	ZINC000000107352	O=C2NC(=O)C1CC=CCC12
COc2ccc(N1CCCC1=O)cc2	ZINC000000050369	O=C1CCCN1c2ccccc2
CN4CCN(CCCNC(=S)Nc3ccc2nc(N1CCN(C)CC1)cc(C)c2c3)CC4	ZINC000022932049	S=C(NCCCN1CCNCC1)Nc4ccc3nc(N2CCNCC2)ccc3c4
CN(C)CCOC(=O)c2oc1ccccc1c2C	ZINC000000177171	c2ccc1occc1c2
CCc2ccc(OC(=O)COc1ccc(N(=O)=O)cc1)cc2	ZINC000000038631	O=C(COc1ccccc1)Oc2ccccc2
COc3ccc(\C=N\CC[C@@]2(c1ccccc1)C[C@@H](C)[N@@](C)C[C@@H]2C)cc3OC	ZINC000013510132	C3CC(CCN=Cc1ccccc1)(c2ccccc2)CCN3
CN(C)Cc2c(O)ccc3occ([C@@H](O)c1ccccc1)c23	ZINC000000196731	C(c1ccccc1)c2coc3ccccc23
CCCNC[C@@H](C)O	ZINC000002572898	nonring
CN4CCC(c3cc(c1ccncc1)c(c2ccc(F)cc2)[nH]3)CC4	ZINC000000009158	C4CC(c3cc(c1ccncc1)c(c2ccccc2)[nH]3)CCN4
CNCc1ccc(N(C)C)cc1	ZINC000000576153	c1ccccc1
CCCc3nc(c1ccccn1)c(c2ccccc2C)s3	ZINC000000005807	c3ccc(c1scnc1c2ccccn2)cc3
Cc3cc[n+](CCOn2c(=O)c1ccccc1c2=O)cc3	ZINC000000406269	O=c2n(OCC[n+]1ccccc1)c(=O)c3ccccc23
Clc2cnn(C(=O)c1cccc(N(=O)=O)c1)c2	ZINC000000037160	O=C(c1ccccc1)n2cccn2
CC(C)n3c(=O)[n+](C)c(c1ccccc1)c4cc2OCOc2cc34	ZINC000000398993	O=c4nc(c1ccccc1)c3cc2OCOc2cc3[nH]4
Brc4cc(C(=O)N[C@@H]1CN2CCC1CC2)c3[nH]cnc3c4	ZINC000000385643	O=C(NC1CN2CCC1CC2)c3cccc4nc[nH]c34
COc1cc(C)ccc1S(=O)(=O)NC2CC(C)(C)NC(C)(C)C2	ZINC000000384609	O=S(=O)(NC1CCNCC1)c2ccccc2
C\C(=C/C(=O)NCc1ccccc1)C(O)=O	ZINC000000215646	c1ccccc1
COc3ccc([C@@H]2N(O)C(C)(C)C(c1ccccc1)[N+]2=O)cc3	ZINC000000300185	O=[N+]2C(c1ccccc1)CNC2c3ccccc3
Clc2ccc(C(=O)NC(=S)Nc1cccc(N(=O)=O)c1)cc2	ZINC000000063566	O=C(NC(=S)Nc1ccccc1)c2ccccc2
O=C(CNC1CCCCC1)n3c2ccccc2ccc4ccccc34	ZINC000000184329	O=C(CNC1CCCCC1)n3c2ccccc2ccc4ccccc34
C[C@@H](N)C(=O)Nc1c(C)cccc1C	ZINC000000000786	c1ccccc1
CSc1ccccc1OC[C@H](O)CNC(C)C	ZINC000000000781	c1ccccc1
CC(=O)c3ccc(N2CCN(CCC1=C(C)CCCC1(C)C)CC2)cc3	ZINC000000756634	C3CCC(CCN2CCN(c1ccccc1)CC2)=CC3
Cc2cccc(OCC(=O)Nc1ccc(Br)cn1)c2C	ZINC000000036265	O=C(COc1ccccc1)Nc2ccccn2
CCCn4nc(C(=O)N(C)C)c3C[C@H](NC2CCN(Cc1ccccc1)CC2)CCc34	ZINC000014743197	C2CN(Cc1ccccc1)CCC2NC4CCc3[nH]ncc3C4
CCN(CC)C[C@H]1OC1(C)C	ZINC000000586500	C1CO1
COc4ccc(C3=[N+]1CCCCN1[C@@](O)(c2ccc(OC)cc2)C3)cc4	ZINC000000637382	C4CC[N+]3=C(c1ccccc1)CC(c2ccccc2)N3C4
Nc2cc(N)nc(SCc1ccc(Cl)cc1Cl)n2	ZINC000000287603	C(Sc1ncccn1)c2ccccc2
COCc1cc(=O)oc2cc(OC(C)=O)c(Cl)cc12	ZINC000000093772	O=c2ccc1ccccc1o2
C[C@H](N)C(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)C[N+]#N	ZINC000040405789	c1ccccc1
Oc1ccccc1NC(=O)C4CCN(CC(=O)N[C@@H]3CC[N@@](Cc2ccccc2)C3)CC4	ZINC000025058669	O=C(CN2CCC(C(=O)Nc1ccccc1)CC2)NC4CCN(Cc3ccccc3)C4
Oc3ccc2c(CNC1CCCCC1)c(O)ccc2c3CNC4CCCCC4	ZINC000045334621	C4CCC(NCc2cccc3c(CNC1CCCCC1)cccc23)CC4
CCN3CCN(c2nc1n(C)c(=O)[nH]c(=O)c1n2CC(C)=C)CC3	ZINC000000551596	O=c3[nH]c(=O)c2[nH]c(N1CCNCC1)nc2[nH]3
CC(=O)Nc3ccc(N2C(=O)C[C@H](N1CCCC1)C2=O)cc3	ZINC000000121686	O=C2CC(N1CCCC1)C(=O)N2c3ccccc3
Cc2sc(=[N+]1CCCCC1)sc2C	ZINC000000164078	C2CC[N+](=c1sccs1)CC2
CC2=CC(C)(C)N(Cc1ccc(N(=O)=O)cc1)c3ccccc23	ZINC000000044758	C2C=Cc1ccccc1N2Cc3ccccc3
CN(C)C(=O)N1CCNCC1	ZINC000000106329	C1CNCCN1
Cn1nccc1NC(=O)NC(=O)c2c(F)cccc2F	ZINC000000116378	O=C(NC(=O)c1ccccc1)Nc2ccn[nH]2
Cn2c([C@@H](O)c1ccccc1)[n+](C)c3ccccc23	ZINC000000231567	C(c1ccccc1)c3nc2ccccc2[nH]3
Cn1c(N)nc2ccccc12	ZINC000000163724	c2ccc1[nH]cnc1c2
Cc1cccnc1NC[C@@H](O)COc2ccccc2	ZINC000000141824	C(CNc1ccccn1)COc2ccccc2
CCOc2cc(CN1CCC(C(=O)N(CC)CC(C)=C)CC1)ccc2O	ZINC000000795476	C2CCN(Cc1ccccc1)CC2
Fc2cccc(N1CCOCC1)c2C#N	ZINC000000138979	C2CN(c1ccccc1)CCO2
O=C(N3CCN(C(c1ccccc1)c2ccccc2)CC3)c5cn(CN4CCCC4)c6ccccc56	ZINC000020648082	O=C(N3CCN(C(c1ccccc1)c2ccccc2)CC3)c5cn(CN4CCCC4)c6ccccc56
COc1ccccc1C(=O)N2CCN(C(C)C)CC2	ZINC000000300506	O=C(N1CCNCC1)c2ccccc2
C/C(=C/c1ccc(C)cc1)N(=O)=O	ZINC000000050752	c1ccccc1
COc1ccc(OC(=O)N(C)CCN(C)C)cc1	ZINC000000025027	c1ccccc1
CCOc3ccc2n(CCN(CC)CC)c1ccccc1sc2c3	ZINC000000114623	c3ccc2sc1ccccc1[nH]c2c3
Cc1c(N(=O)=O)ccc2nsnc12	ZINC000000039557	c2ccc1nsnc1c2
CCN(CC)CCCNCc1ccc(N(=O)=O)cc1	ZINC000002933146	c1ccccc1
NC(=N)c4cccc(N[C@H](C(=O)Nc2ccc(N1CCCCC1=O)cc2)c3ccccc3)c4	ZINC000000596520	O=C1CCCCN1c4ccc(NC(=O)C(Nc2ccccc2)c3ccccc3)cc4
OC(=O)c2ccc(Sc1ccccn1)c(N(=O)=O)c2	ZINC000000086591	S(c1ccccc1)c2ccccn2
CCOC(=O)COc2ccc1c(C)c(CCN(CC)CC)c(=O)oc1c2Cl	ZINC000000576842	O=c2ccc1ccccc1o2
Nc2nsc(c1ccccc1)n2	ZINC000000041925	c2ccc(c1ncns1)cc2
CCOc3ccc2nc(C)cc(Nc1ccc(OC)cc1)c2c3	ZINC000000071857	N(c1ccccc1)c2ccnc3ccccc23
C[C@@H]2CN(C1CCNCC1)C[C@@H](C)O2	ZINC000000299478	C2CC(N1CCOCC1)CCN2
CCN1CCC2(CC1)NC(CO)(CO)CO2	ZINC000000214770	C2COC1(CCNCC1)N2
CN(C)Cc2cc(OCc1ccccc1)cc(CN(C)C)c2O	ZINC000001717653	C(Oc1ccccc1)c2ccccc2
CN4CCN(c2nc(c1ccc(F)cc1)nnc2c3ccc(Cl)cc3)CC4	ZINC000000721138	C4CN(c2nc(c1ccccc1)nnc2c3ccccc3)CCN4
C(c3ccc(C[n+]2ccc(c1ccncc1)cc2)cc3)[n+]5ccc(c4ccncc4)cc5	ZINC000001090547	C(c3ccc(C[n+]2ccc(c1ccncc1)cc2)cc3)[n+]5ccc(c4ccncc4)cc5
Cc1nc(C(N)=N)cs1	ZINC000000166456	c1cscn1
CCC(=O)NCN(C)C	ZINC000001717654	nonring
C3Cc2cccc(NC1=NCCN1)c2C3	ZINC000000001563	C3Cc2cccc(NC1=NCCN1)c2C3
c2csc(=c1sccs1)s2	ZINC000000032315	c2csc(=c1sccs1)s2
COc2cccc(C(=O)Nc1cc(OC)c(Cl)cc1OC)c2	ZINC000000035616	O=C(Nc1ccccc1)c2ccccc2
CN(C)CCCNc3nc(c1ccc(Cl)cc1NC(=O)CCCN2CCCCC2)nc4ccccc34	ZINC000095563875	O=C(CCCN1CCCCC1)Nc2ccccc2c4ncc3ccccc3n4
CCN(CC2CCN(C1CCN(C)CC1)CC2)C(=O)c4cc(c3ccc(C)s3)n[nH]4	ZINC000012447065	O=C(NCC2CCN(C1CCNCC1)CC2)c4cc(c3cccs3)n[nH]4
COc1cc(N)ccc1NC(=O)c2cccs2	ZINC000000039403	O=C(Nc1ccccc1)c2cccs2
Clc3ccc2sc(SCC(=O)Nc1ccccc1)nc2c3	ZINC000000088659	O=C(CSc2nc1ccccc1s2)Nc3ccccc3
CN1CCCCC/C1=N\CCn2cnc3n(C)c(=O)n(C)c(=O)c23	ZINC000000090157	O=c3[nH]c(=O)c2n(CCN=C1CCCCCN1)cnc2[nH]3
Cc1ccc(\C=C(/C#N)C(N)=O)o1	ZINC000000043635	c1ccoc1
CCOC(=O)n1cc(F)c(=O)[nH]c1=O	ZINC000000007889	O=c1cc[nH]c(=O)[nH]1
c2cc[n+](c1ccncc1)cc2	ZINC000000155884	c2cc[n+](c1ccncc1)cc2
CN1CCC4(CC1)NC(=O)N(CN3CCC[N@@](Cc2ccc(C(F)(F)F)cc2)CC3)C4=O	ZINC000023257108	O=C2NC1(CCNCC1)C(=O)N2CN4CCCN(Cc3ccccc3)CC4
CCc2cc1nc(C)cc(C)n1[o+]2	ZINC000000408852	c2cnc1cc[o+]n1c2
CCOC(=O)C4(Cc1ccccc1)CCN(Cc3ccc(CN2CCCC2)s3)CC4	ZINC000011816289	C4CCN(Cc3ccc(CN2CCC(Cc1ccccc1)CC2)s3)C4
Clc3ccc(S(=O)(=O)Nc2cccc(c1nnco1)c2)cc3	ZINC000000107122	O=S(=O)(Nc2cccc(c1nnco1)c2)c3ccccc3
OCCN(CCO)CC=C	ZINC000000157975	nonring
FC(F)(F)c1cc(N(=O)=O)ccc1SCc2ccc(Cl)cc2	ZINC000000090396	C(Sc1ccccc1)c2ccccc2
CC(=O)Nc4ccc(c3c[n+]2cc(Sc1ccccc1)ccc2n3C)cc4	ZINC000000631626	S(c1ccccc1)c4ccc3[nH]c(c2ccccc2)c[n+]3c4
Cc4ccc(S(=O)(=O)Nc3ccc(c2c[n+]1ccccc1n2C)cc3)cc4	ZINC000000631627	O=S(=O)(Nc3ccc(c2c[n+]1ccccc1[nH]2)cc3)c4ccccc4
CN[C@@H](C)[C@@H](O)c1ccccc1	ZINC000000020259	c1ccccc1
Clc2ccc(OC(=O)c1ccccc1)cc2	ZINC000000037286	O=C(Oc1ccccc1)c2ccccc2
Cc4ccc3n2CCN[C@@H]1CCc(c12)c(=O)c3c4	ZINC000000131411	O=c3c2CCC1NCCn(c12)c4ccccc34
COc3ccc(n1cccc1\C=c2\[nH]c(=O)[nH]c2=O)cc3	ZINC000000072223	O=c3[nH]c(=O)c(=Cc1cccn1c2ccccc2)[nH]3
OCCN4CCN([C@@H]1CC[C@@H]2CC[C@H]1c3ccccc23)CC4	ZINC000000015038	C4CN(C1CCC2CCC1c3ccccc23)CCN4
Cc3ccc(N(CC1=NCCN1)c2cccc(O)c2)cc3	ZINC000000020251	C3CN=C(CN(c1ccccc1)c2ccccc2)N3
CC(C)C[N@@]3CCC[C@H](c2ccnc(SCCN1CCCC1)n2)C3	ZINC000011787934	C3CNCC(c2ccnc(SCCN1CCCC1)n2)C3
CC[C@@H]3CSC4=[N+](c1ccccc1)[C@@](O)(c2ccc(OC)cc2)CN34	ZINC000000623116	C4CN3CC(c1ccccc1)[N+](c2ccccc2)=C3S4
CC(=O)NCC[N+](C)(C)C	ZINC000000369936	nonring
Cc2ccc1nonc1c2N(=O)=O	ZINC000000029107	c2ccc1nonc1c2
Cc1cc(NC(=O)CC(C)(C)C)no1	ZINC000000116301	c1cnoc1
C[C@H](O)CSCCN	ZINC000001700291	nonring
Cc3nc(c1ccccn1)n2nnnc2c3Cl	ZINC000000074690	c3ccc(c1nccc2nnnn12)nc3
Cc2cc(NC(=O)CCN1CCCCC1)no2	ZINC000000141003	O=C(CCN1CCCCC1)Nc2ccon2
C[C@@H](C[N+](C)(C)C)OC(=O)C(c1ccccc1)c2ccccc2	ZINC000000379365	C(c1ccccc1)c2ccccc2
CC(=O)Nc2ccc1n(C)cc[n+]1c2	ZINC000000387367	c2cc[n+]1cc[nH]c1c2
NCCNC(=O)C=C	ZINC000005157529	nonring
CS(=O)(=O)c2n[nH]c(c1ccccc1)n2	ZINC000000339449	c2ccc(c1ncn[nH]1)cc2
Clc3ccc2nc1ccccc1c(=O)n2n3	ZINC000000036433	O=c2c1ccccc1nc3cccnn23
Cc2cc(C)c(NC(=O)[C@@H]1CCC[N@]1CCO)c(C)c2	ZINC000000185814	O=C(Nc1ccccc1)C2CCCN2
OCC[N+]4(Cc1ccccc1)CCC(C3CC[N+](CCO)(Cc2ccccc2)CC3)CC4	ZINC000004683885	C2CN(Cc1ccccc1)CCC2C4CCN(Cc3ccccc3)CC4
COC(=O)C3=C(C)N=C(C)N(CCCCCN2CCC(c1ccccc1)CC2)[C@@H]3c4ccc(F)c(F)c4	ZINC000013802262	C(CCN2CCC(c1ccccc1)CC2)CCN3C=NC=CC3c4ccccc4
CCc3ccc([C@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2)s3	ZINC000000043743	O=C1CCCC3=C1C(c2cccs2)C=CO3
OC6(CCCc2ccc(c1nn[nH]n1)cc2)CCN(C[C@H]4C[N@@](CC3CCCCC3)C[C@@H]4c5ccccc5)CC6	ZINC000026752204	C6CCC(CN5CC(CN3CCC(CCCc2ccc(c1nn[nH]n1)cc2)CC3)C(c4ccccc4)C5)CC6
OCCN(CCO)C[C@@H](O)C23CC1CC(CC(C1)C2)C3	ZINC000000135319	C1C2CC3CC1CC(C2)C3
CC2=C(NC(=S)NC(=O)c1ccccc1)NCc3ccccc23	ZINC000000031959	O=C(NC(=S)NC2=Cc1ccccc1CN2)c3ccccc3
Cc2cc(Cl)c(N1CCNCC1)cc2S(C)(=O)=O	ZINC000000154110	C2CN(c1ccccc1)CCN2
CCCc2n(C)c1ccccc1[n+]2C[C@@H](O)COCc3ccccc3	ZINC000000098631	C(COCc1ccccc1)C[n+]2c[nH]c3ccccc23
O[C@H](COc1ccccc1CNCCN2CCOC2=O)C[N@]4CCc3ccccc3C4	ZINC000012459123	O=C1OCCN1CCNCc2ccccc2OCCCN4CCc3ccccc3C4
CC(C)[C@H](N)C(=O)N1CCN(C(=O)C[C@@H](C)CC(C)(C)C)[C@H](C)C1	ZINC000000252099	C1CNCCN1
CC(C)(C)n1cn[n+](CC=C)n1	ZINC000000052204	c1nnn[nH]1
Cc1n[n+](C(C)(C)C)nn1C=C	ZINC000000052203	c1nnn[nH]1
C[C@H]1CN([C@H](C)C#N)C[C@@H](C)N1	ZINC000225178939	C1CNCCN1
Cc3cccc(CN2CCN(c1ccc(F)cc1)CC2)c3	ZINC000000237136	C2CN(c1ccccc1)CCN2Cc3ccccc3
Cc4cc(Nc2ccc1OCCOc1c2)c3ccc(Cl)cc3n4	ZINC000000120848	C4COc3cc(Nc1ccnc2ccccc12)ccc3O4
CN[C@@H](C)[C@@H](O)c1ccc(NS(C)(=O)=O)cc1	ZINC000000000465	c1ccccc1
O=c2[nH]c1ccccc1n2C3CCNCC3	ZINC000000119391	O=c2[nH]c1ccccc1n2C3CCNCC3
Cc2[nH]c1ccccc1c2[C@H](N4CCC(Cc3ccccc3)CC4)c5cccnc5	ZINC000000646180	C4CN(C(c1cccnc1)c2c[nH]c3ccccc23)CCC4Cc5ccccc5
Cc3ccc(S(=O)(=O)N2CCC(N1CCCCCC1)CC2)cc3	ZINC000000317257	O=S(=O)(N2CCC(N1CCCCCC1)CC2)c3ccccc3
FC(F)(F)c3cccc(NC(=O)[C@@H]2COc1ccccc1O2)c3	ZINC000000053957	O=C(Nc1ccccc1)C3COc2ccccc2O3
COc1c(Cl)cnc(Cl)c1C(N)=O	ZINC000000053482	c1ccncc1
CN(C)CNC(C)=O	ZINC000001679156	nonring
Cc2cccc(NC(=O)c1ccccc1Cl)n2	ZINC000000037538	O=C(Nc1ccccn1)c2ccccc2
Nc2nc(c1ccccc1)cn2N	ZINC000000240649	c2ccc(c1c[nH]cn1)cc2
Clc6cc5nc(C1CCNCC1)n(Cc4ccc(CNCCc3cc2ccccc2[nH]3)cc4)c5cc6Cl	ZINC000026980032	C6CC(c2nc1ccccc1n2Cc5ccc(CNCCc4cc3ccccc3[nH]4)cc5)CCN6
COc2cc(CN1CCSCC1)cc(OC)c2O	ZINC000000200332	C2CN(Cc1ccccc1)CCS2
Nc2nc(c1ccccc1)cn2/N=C/c3cccc(N(=O)=O)c3	ZINC000000240640	C(=Nn2cnc(c1ccccc1)c2)c3ccccc3
OC[C@@H]1CCCC[N@]1Cc2cc(Br)cs2	ZINC000000209884	C2CCN(Cc1cccs1)CC2
CN(C)c3nc2ccc(OCCN1CCCCC1)cc2s3	ZINC000000275257	C3CCN(CCOc2ccc1ncsc1c2)CC3
NC(=O)c1cccc2ccccc12	ZINC000000036677	c2ccc1ccccc1c2
CCCN1CCC4(CC1)NC(=O)N([C@@H]3CCN(C(=O)Cn2ccnc2C(C)C)C3)C4=O	ZINC000019700743	O=C(Cn1ccnc1)N4CCC(N3C(=O)NC2(CCNCC2)C3=O)C4
CCOC(=O)c1c(C)nc(C)cc1Nc2ccccc2N	ZINC000000243014	N(c1ccccc1)c2ccncc2
NC[C@H](O)C(F)(F)F	ZINC000003883382	nonring
CC1(C)[C@H]3CC[C@]1(C)[C@H](NC(=O)CC[N+](C)(C)Cc2ccccc2)C3	ZINC000000206512	O=C(CCNCc1ccccc1)NC2CC3CCC2C3
CCNC(=S)NN1CCOCC1	ZINC000000034635	C1COCCN1
Oc3c(CNCc1ccccc1)cc(CNCc2ccccc2)c(O)c3CNCc4ccccc4	ZINC000001679808	C(NCc3cc(CNCc1ccccc1)cc(CNCc2ccccc2)c3)c4ccccc4
FC(F)(F)c3ccnc(N2CCC(NC(=S)NC1CC1)CC2)n3	ZINC000000066536	S=C(NC1CC1)NC3CCN(c2ncccn2)CC3
Oc2c(Br)cc(CN1CCOCC1)c3cccnc23	ZINC000000033431	C3CN(Cc1cccc2ncccc12)CCO3
CC(C)C(=O)Oc3ccc(NC1=NS(=O)(=O)c2ccccc12)cc3	ZINC000000077279	O=S3(=O)N=C(Nc1ccccc1)c2ccccc23
Clc3ccc(\C=C\c2cc[n+](C(=O)N1CCOCC1)cc2)cc3	ZINC000000173476	O=C(N1CCOCC1)[n+]3ccc(C=Cc2ccccc2)cc3
CCN2CCN(C(=O)NC(C)(C)c1cccc(C(C)=C)c1)CC2	ZINC000000205644	O=C(NCc1ccccc1)N2CCNCC2
Cc3cnc2c(ccc1c(C)c(C)cnc12)c3C	ZINC000000119661	c1cnc3c(c1)ccc2cccnc23
CCN4CCN(c3ccc(NC(=O)CN2CCC(C(=O)N1CCCCCC1)CC2)cc3)CC4	ZINC000008779815	O=C(CN2CCC(C(=O)N1CCCCCC1)CC2)Nc4ccc(N3CCNCC3)cc4
CC[C@@H](C)[C@@H](N)CO	ZINC000000402999	nonring
C(Cc2nnc(n1cccc1)s2)c3ccccc3	ZINC000000034382	C(Cc2nnc(n1cccc1)s2)c3ccccc3
CCN(CC)CCC[C@@H](Nc2c1ccccc1nc3ccccc23)c4ccccc4	ZINC000029555643	C(Nc2c1ccccc1nc3ccccc23)c4ccccc4
Cc3ccc(Nc1cc(C)nc2ccc(Cl)cc12)cc3	ZINC000000143864	N(c1ccccc1)c2ccnc3ccccc23
NNc1ccccn1	ZINC000000404420	c1ccncc1
CN(C)CC(=O)N1C[C@@H]4C[C@H](C1)c3ccc(c2ccccc2CN(C)C)c(=O)n3C4	ZINC000004237219	O=c4c(c1ccccc1)ccc3C2CNCC(C2)Cn34
CCS(=O)(=O)N2CCC[C@@H](C(=O)NCCN1CCCC1)C2	ZINC000000220603	O=C(NCCN1CCCC1)C2CCCNC2
CCN(CC)C(=O)c1cccnc1	ZINC000000001814	c1ccncc1
CCOc2ccc(S(=O)(=O)NC1CC(C)(C)NC(C)(C)C1)c3ccccc23	ZINC000000802674	O=S(=O)(NC1CCNCC1)c2cccc3ccccc23
Cc3ccc(C=c2sc(Nc1cccc(C)c1C)nc2=O)o3	ZINC000000090972	O=c2nc(Nc1ccccc1)sc2=Cc3ccco3
NC(=N)c2ccc(c1ccccc1N(=O)=O)o2	ZINC000000001818	c2ccc(c1ccco1)cc2
CN(C)CCC(=O)Nc2nc(c1ccc(Cl)cc1)cs2	ZINC000000073771	c2ccc(c1cscn1)cc2
CN(Cc3cccc(OC[C@@H](O)C[N@@]2CCc1ccccc1C2)c3)Cc4nccs4	ZINC000011840625	C(COc2cccc(CNCc1nccs1)c2)CN4CCc3ccccc3C4
Cn2cc1CNCCc1n2	ZINC000034764688	C2Cc1n[nH]cc1CN2
CN2CCN(c1ccc(CN)cc1)CC2	ZINC000000158909	C2CN(c1ccccc1)CCN2
CN4CCC(N[C@H]1CC(C)(C)[C@@H]2C[C@@](C)(O)CC[C@]12CCC(=O)N3CCOCC3)CC4	ZINC000012531485	O=C(CCC12CCCCC1CCC2NC3CCNCC3)N4CCOCC4
CC(C)Cc1ccc(OCCCNCCCN)cc1	ZINC000005384338	c1ccccc1
CN(C)c4ccc(C(=C1CN2CCC1CC2)c3ccc(N(C)C)cc3)cc4	ZINC000000762972	C1CN4CCC1C(=C(c2ccccc2)c3ccccc3)C4
O=S(=O)(NC#N)c1ccccc1	ZINC000001703100	c1ccccc1
CCOC(=O)c3[nH]c(C)c(c2csc(NC(=O)C1CC1)n2)c3C	ZINC000000034411	O=C(Nc2nc(c1cc[nH]c1)cs2)C3CC3
CC(=O)Nc2ccc(CN1CCSCC1)cc2	ZINC000000199508	C2CN(Cc1ccccc1)CCS2
C[N+](C)(C)C[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000000236833	c1ccccc1
O=C(Cn1nnc2ccccc12)NCCN3CCCC3	ZINC000000383118	O=C(Cn1nnc2ccccc12)NCCN3CCCC3
CC(=O)O[C@@]2(c1ccccc1)C[C@H](C(C)(C)C)C[N@](C(C)(C)C)C2	ZINC000000049434	C2CNCC(c1ccccc1)C2
CC(C)CCN3CCC([C@H](Cc1ccccc1F)[N@@](C)Cc2cn(C)nc2C)CC3	ZINC000011868108	C3CC(C(Cc1ccccc1)NCc2cn[nH]c2)CCN3
CCN(CC)CCCNc3nc1ccccc1c4[nH]c2ccc(OC)cc2c34	ZINC000001639179	c1ccc3c(c1)ncc4c2ccccc2[nH]c34
Fc2ccc(NC(=O)CSc1ccccn1)cc2	ZINC000000031551	O=C(CSc1ccccn1)Nc2ccccc2
COc1ccccc1[C@@H](O)Cc2cc[n+](C)cc2	ZINC000000369332	C(Cc1ccncc1)c2ccccc2
NC(=O)CSc2nc1ccccc1n2C(=O)Oc3ccccc3	ZINC000000034705	O=C(Oc1ccccc1)n2cnc3ccccc23
Cc3ccc(c2nc(NC(=O)c1cccs1)sc2C)cc3Cl	ZINC000000119245	O=C(Nc2nc(c1ccccc1)cs2)c3cccs3
Cc1ccc(C)n1c2ccncc2	ZINC000000198129	c2ccn(c1ccncc1)c2
CN4CCN(c2ncnc3n(Cc1ccccc1)ncc23)CC4	ZINC000000175728	C4CN(c2ncnc3n(Cc1ccccc1)ncc23)CCN4
C[C@H](C(=O)Oc1ccc(Cl)cc1C)n3c(=O)c2ccccc2c3=O	ZINC000000122589	O=C(Cn2c(=O)c1ccccc1c2=O)Oc3ccccc3
CN(c1ccccc1)c6cc[n+](Cc5cccc(c4cccc(C[n+]3ccc(N(C)c2ccccc2)cc3)c4)c5)cc6	ZINC000028457537	C(c4cccc(c3cccc(C[n+]2ccc(Nc1ccccc1)cc2)c3)c4)[n+]6ccc(Nc5ccccc5)cc6
O=S(=O)(N(C1CCNCC1)C2CC2)c3ccccc3	ZINC000000154345	O=S(=O)(N(C1CCNCC1)C2CC2)c3ccccc3
CN(C)CCNc2ncnc3n(c1ccccc1)ncc23	ZINC000000487759	c3ccc(n1ncc2cncnc12)cc3
CCN1CCC3(CC1)C[C@@H]2C[C@@H]4O[C@@]2(CN3C(C)=O)C=C4	ZINC000000444298	C1CC3(CCN1)CC2CC4OC2(CN3)C=C4
CCc2c(C)nc(SCC(=O)c1ccc(Cl)cc1)c(C#N)c2C	ZINC000000079954	O=C(CSc1ccccn1)c2ccccc2
CC(=O)c2ccc(n1c(=O)ccc1=O)cc2	ZINC000000097536	O=c1ccc(=O)n1c2ccccc2
CN(C)CCCN1CCC[C@H]1C(=O)Nc2c(C)cc(C)cc2C	ZINC000000214209	O=C(Nc1ccccc1)C2CCCN2
CCOC(=O)[C@@H]4CCc3[nH]c2ccc(OCc1ccccc1)cc2c3C4	ZINC000000339664	C1CCc3c(C1)[nH]c4ccc(OCc2ccccc2)cc34
C[N+](C)(C)CCCCCCCCC[N+](C)(C)C	ZINC000001730256	nonring
Oc2ccc(c1cccc(=O)o1)cc2	ZINC000000294837	O=c2cccc(c1ccccc1)o2
CCN4CCN(C(=O)Cn2c1CC[N@@](C(C)C)Cc1c3ccccc23)CC4	ZINC000007450220	O=C(Cn2c1CCNCc1c3ccccc23)N4CCNCC4
CC(=O)Nc1cc(N(=O)=O)ccc1C	ZINC000000066986	c1ccccc1
Cc1ccccc1CN4CCC(N3CCC(C(=O)N[C@H]2CCCCNC2=O)CC3)CC4	ZINC000015068408	O=C1NCCCCC1NC(=O)C4CCN(C3CCN(Cc2ccccc2)CC3)CC4
Cc3cc(C)nc(NC(=N)N1CCCc2ccccc12)n3	ZINC000000069457	N=C(Nc1ncccn1)N2CCCc3ccccc23
CN(C)CCNC(=O)N2CCN(c1ccccc1Cl)CC2	ZINC000000024590	C2CN(c1ccccc1)CCN2
O=C(N2CCC(c1cnc[nH]1)CC2)c3ccccc3	ZINC000000017073	O=C(N2CCC(c1cnc[nH]1)CC2)c3ccccc3
CS(=O)(=O)C=C(O)c1ccccn1	ZINC000000153866	c1ccncc1
COc1ccccc1\C=C\C[N@]2CCC[C@@H]2CO	ZINC000000229914	C2CCN(CC=Cc1ccccc1)C2
Cc1cccc[n+]1[C@@H]3[C@@H](c2ccc(N(=O)=O)cc2)C(C#N)=C(C(=C=N)C#N)N[C@@]3(O)C4CC4	ZINC000033385429	C1CC1C3NC=CC(c2ccccc2)C3[n+]4ccccc4
CC2(C)[C@@H]3CC=C(CN1CCC(O)CC1)[C@H]2C3	ZINC000000277703	C3CCN(CC1=CCC2CC1C2)CC3
N#Cc1cccc2cnccc12	ZINC000000054756	c2ccc1cnccc1c2
OC(=O)[C@@H](Cc1ccccc1)NS(=O)(=O)c2cccs2	ZINC000000087734	O=S(=O)(NCCc1ccccc1)c2cccs2
CC(C)NC(=O)NC[C@H]1C[C@@H]2CCN1C[C@@H]2C[N@@](C)CCc3ccccn3	ZINC000008636208	C(Cc1ccccn1)NCC2CN3CCC2CC3
CC2(C)OC(=O)N(c1ccccc1)C2=C	ZINC000000050654	C=C1COC(=O)N1c2ccccc2
Cc1nn(C)cc1CNCc3cccc(OC[C@@H](O)CN2CCCCCC2)c3	ZINC000011874133	C3CCCN(CCCOc2cccc(CNCc1cn[nH]c1)c2)CC3
Cc2nn1cc[nH]c1c2c3ccccc3	ZINC000000011610	c3ccc(c1cnn2cc[nH]c12)cc3
O=C([C@@H]1CN2CCC1CC2)c3ccccc3	ZINC000000051654	O=C(C1CN2CCC1CC2)c3ccccc3
Cc1occc1C(=O)Nc2ccc(Br)cn2	ZINC000000033559	O=C(Nc1ccccn1)c2ccoc2
Nc2c(C(=O)C1CC1)oc3ccccc23	ZINC000000050025	O=C(C1CC1)c3cc2ccccc2o3
COc3ccc2ccc1cccc[n+]1c2c3	ZINC000000384108	c1ccc3c(c1)ccc2cccc[n+]23
N=C2N[C@H](c1ccccc1)Nc3ccccc23	ZINC000000022225	N=C2NC(c1ccccc1)Nc3ccccc23
CC(=O)c2cccc(NC(=O)COc1ccc(Cl)c(C)c1)c2	ZINC000000063633	O=C(COc1ccccc1)Nc2ccccc2
Nc2ncc(Br)c(N1CCOCC1)n2	ZINC000000015508	C2CN(c1ccncn1)CCO2
COc1ccc(Br)cc1CNC2CCCCCC2	ZINC000000293230	C2CCCC(NCc1ccccc1)CC2
O=N(=O)c1c[nH]nc1c3cnn(c2ccccc2)c3	ZINC000000032774	c3ccc(n2cc(c1cc[nH]n1)cn2)cc3
COc2cc(OC)cc(C(=O)Nc1ccc(F)c(F)c1)c2	ZINC000000029933	O=C(Nc1ccccc1)c2ccccc2
CCOC(=O)[C@H]1CCCC[C@@H]1N3CCN(C(=O)[C@@H](Cc2ccc(Cl)cc2Cl)NC(=O)CCN)CC3	ZINC000013983245	O=C(CCc1ccccc1)N3CCN(C2CCCCC2)CC3
CC1(C)[C@H](C=C(Cl)Cl)[C@H]1C(=O)Nc2ccccc2F	ZINC000000041379	O=C(Nc1ccccc1)C2CC2
O=N(=O)c2ccc(\C=c1\[nH]c(=O)[nH]c1=O)cc2	ZINC000000073083	O=c2[nH]c(=O)c(=Cc1ccccc1)[nH]2
CNC(=O)c4ccc3cc([C@]2(O)CCn1cncc12)ccc3c4	ZINC000000003322	C2Cn1cncc1C2c4ccc3ccccc3c4
Oc2cc1ccccc1cc2C(=O)OCC(=O)c3ccc(Cl)cc3	ZINC000000072774	O=C(COC(=O)c2ccc1ccccc1c2)c3ccccc3
C[N@]3CCc2oc1ccc(N)cc1c2C3	ZINC000000300804	C3Cc2oc1ccccc1c2CN3
COc4ccc(C[N@]3C[C@@H](CN1CCCC1)C[C@@H](C(=O)NC[C@@H]2CCCO2)C3)cc4OC	ZINC000014742186	O=C(NCC1CCCO1)C4CC(CN2CCCC2)CN(Cc3ccccc3)C4
Cc3cccc(N2C(=O)C[C@H](N1CCC(C(N)=O)CC1)C2=O)c3	ZINC000000181377	O=C2CC(N1CCCCC1)C(=O)N2c3ccccc3
O[C@@H](COc1ccc(Br)cc1)CN3CCN(Cc2ccc(Cl)cc2)CC3	ZINC000000703741	C(COc1ccccc1)CN3CCN(Cc2ccccc2)CC3
CO[C@H]1CNCC[C@H]1NC(=O)c2cc(Cl)c(N)cc2OC	ZINC000000404160	O=C(NC1CCNCC1)c2ccccc2
C3CCN(CCSc1nnnn1c2ccccc2)CC3	ZINC000000188469	C3CCN(CCSc1nnnn1c2ccccc2)CC3
CN2C(C)(C)CC(=NOC(=O)c1ccccc1)CC2(C)C	ZINC000000053007	O=C(ON=C1CCNCC1)c2ccccc2
Cc1ccsc1CN	ZINC000000165948	c1ccsc1
CC(C)CC(=O)c2ccc[n+](COC[n+]1ccccc1C/C=N/O)c2	ZINC000005360230	C(OC[n+]1ccccc1)[n+]2ccccc2
COc4ccc([C@@H]2CC(c1cccs1)=NN2C(=O)CN3CCCC3)cc4	ZINC000000883476	O=C(CN1CCCC1)N3N=C(c2cccs2)CC3c4ccccc4
CC(C)NCCCN(C)C	ZINC000003643522	nonring
CC(C)(C)CC(C)(C)C(=O)OCCC[N+]1(C)CC[N+](C)(C)CC1	ZINC000003608203	C1CNCCN1
CCN(CC)CCN(CCN(CC)CC)c1ccccc1	ZINC000001683227	c1ccccc1
CN(C)CCn2c1ccccc1n3cc(C(C)(C)C)nc23	ZINC000000208041	c1ccc2c(c1)[nH]c3nccn23
CC1(C)CC(CC(O)=O)=CC(C)(C)N1	ZINC000000105337	C1CC=CCN1
COc2ccc(/C=C/C(=O)C1CC1)cc2COc3c(C)cccc3C	ZINC000000193607	O=C(C=Cc2cccc(COc1ccccc1)c2)C3CC3
COC(=O)C12CCC(CC1)N2	ZINC000002524295	C1CC2CCC1N2
Cc1cc(C)c(CN)c(=O)[nH]1	ZINC000003888524	O=c1cccc[nH]1
COc3ccc(Nc1ncnc2[nH]cnc12)cc3	ZINC000000032156	N(c1ccccc1)c2ncnc3[nH]cnc23
COCc2cc(C)nc3sc(C(=O)Nc1ccccc1)c(N)c23	ZINC000000049849	O=C(Nc1ccccc1)c3cc2cccnc2s3
CC1(C)CC(O)(C(O)=O)CC(C)(C)N1	ZINC000000056821	C1CCNCC1
COc4ccc([C@@]2(O)CN1CCSCC1=[N+]2c3ccc(C)cc3)cc4	ZINC000000639524	C4CN3CC(c1ccccc1)[N+](c2ccccc2)=C3CS4
O=C(Nc2ccc(S(=O)(=O)N1CCCCC1)cc2)c3ccccn3	ZINC000000082039	O=C(Nc2ccc(S(=O)(=O)N1CCCCC1)cc2)c3ccccn3
CN4CCN(c2nc(c1ccc(C)cc1)nc3ccccc23)CC4	ZINC000000307454	C4CN(c2nc(c1ccccc1)nc3ccccc23)CCN4
CC(C)NC(=N)c4ccc(OCc2ccc(COc1ccc(C(=N)NC(C)C)cc1)c3ccccc23)cc4	ZINC000034417764	C(Oc1ccccc1)c3ccc(COc2ccccc2)c4ccccc34
CCOC(=O)c1c(C)csc1NC(=O)C(Cl)(Cl)Cl	ZINC000000080325	c1ccsc1
CCOC(=O)N2CCC(NCc1cccc(C(F)(F)F)c1)CC2	ZINC000000220280	C2CC(NCc1ccccc1)CCN2
COc3ccc(CCN2CCN(c1ccc(C)c(C)c1)CC2)cc3OC	ZINC000000625015	C2CN(c1ccccc1)CCN2CCc3ccccc3
CN4CCC(N(C)c2ncnc3sc1CCCCc1c23)CC4	ZINC000000098649	C1CCc3c(C1)sc4ncnc(NC2CCNCC2)c34
OCCN(CCO)CC(=O)N(C1CCCCC1)C2CCCCC2	ZINC000000251383	C2CCC(NC1CCCCC1)CC2
CC[C@@]2(C)C[C@@](CCN)(c1ccccc1OC)CCO2	ZINC000000171730	C2CC(c1ccccc1)CCO2
CC(=O)Oc1ccccc1OCc2nn(C(C)=O)c3ccccc23	ZINC000000035277	C(Oc1ccccc1)c2n[nH]c3ccccc23
Nc1ccccc1c2n[nH]c(=O)[nH]c2=O	ZINC000000039808	O=c2[nH]nc(c1ccccc1)c(=O)[nH]2
CCC[N@@](CCCCN2CCN(c1cccc(Cl)c1Cl)CC2)Cc5ccc4c(Cc3ccccc34)c5	ZINC000071319438	C(CCN2CCN(c1ccccc1)CC2)CNCc5ccc4c(Cc3ccccc34)c5
Cn2c(c1ccccc1)[n+](C)c3ccccc23	ZINC000000225674	c3ccc(c2nc1ccccc1[nH]2)cc3
CC[N+](CC)(CC)CCOCC[N+](CC)(CC)CC	ZINC000005469435	nonring
CCN3CCN(C(=O)c2ccc(N1CCC(NCCCOC(C)C)CC1)cc2)CC3	ZINC000012452570	O=C(N1CCNCC1)c3ccc(N2CCCCC2)cc3
CC(=O)c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1	ZINC000000067665	c1ccccc1
O[C@H](CN1CCCCC1)Cn2cc(N(=O)=O)cn2	ZINC000000331816	C2CCN(CCCn1cccn1)CC2
CC[N@@](CCO)Cc1csc2ccc(I)cc12	ZINC000000689831	c2ccc1sccc1c2
CCc3ccc2[nH]c(C(=O)NCCN1CCCCC1)cc2c3	ZINC000000171607	O=C(NCCN1CCCCC1)c3cc2ccccc2[nH]3
CCOc3cc2ncc(C#N)c(Nc1ccc(F)c(Cl)c1)c2cc3NC(=O)\C=C\CN(C)C	ZINC000000602803	N(c1ccccc1)c2ccnc3ccccc23
CCCN3CCC(N2CCN(c1ccc(F)cc1)CC2)CC3	ZINC000000279851	C3CC(N2CCN(c1ccccc1)CC2)CCN3
O=C(N1CCOCC1)c3nc2ccccn2c3CNC[C@@H]5CC[N@@](Cc4ccccc4)C5	ZINC000012306726	O=C(N1CCOCC1)c3nc2ccccn2c3CNCC5CCN(Cc4ccccc4)C5
C[C@H]1CCCC[N@]1Cc3nc2ccccc2c(=O)n3c4ccc(F)cc4	ZINC000000644237	O=c3n(c1ccccc1)c(CN2CCCCC2)nc4ccccc34
CCCc2c(O)nc1ccccn1c2=O	ZINC000000163497	O=c1ccnc2ccccn12
CN(C)CCCN(CCCN(C)C)Cc1cc(Br)cs1	ZINC000002498598	c1ccsc1
FC(F)(F)c2cnc(C[n+]1ccccc1)c(Cl)c2	ZINC000000160166	C(c1ccccn1)[n+]2ccccc2
O=C(NCCCN2CCC(N1CCCCC1)CC2)c3cccn3c5nnc(N4CCCC4)s5	ZINC000009269463	O=C(NCCCN2CCC(N1CCCCC1)CC2)c3cccn3c5nnc(N4CCCC4)s5
C[N@]1[C@H]4CCC[C@@H]1CC(NC(=O)c3cc(C)n(c2ccccc2)n3)C4	ZINC000000005650	O=C(NC1CC2CCCC(C1)N2)c4ccn(c3ccccc3)n4
CC(C)(C)C(=O)Nc2nnc(Cc1ccc(Cl)cc1Cl)s2	ZINC000000103539	C(c1ccccc1)c2nncs2
Clc3ccc(C2(Cn1cncn1)OCCO2)c(Cl)c3	ZINC000000000975	C3COC(Cn1cncn1)(c2ccccc2)O3
CN(C(=O)CN1CCCCC1)C(C)(C)C(=O)c2ccccc2Cl	ZINC000000395796	O=C(CN1CCCCC1)NCC(=O)c2ccccc2
Nc1cccc(/C=C/C(O)=O)c1	ZINC000000080855	c1ccccc1
COc2ccc([C@@H](CC=C)NCc1ccco1)c(OC)c2	ZINC000000250556	C(NCc1ccco1)c2ccccc2
COc3ccc(Nc2nc(N)nc(C[N@@](C)C1CCCCC1)n2)cc3	ZINC000000200068	C3CCC(NCc2ncnc(Nc1ccccc1)n2)CC3
Clc3ccc([C@@H](CC(=O)c1ccco1)SCc2ccco2)cc3	ZINC000000239421	O=C(CC(SCc1ccco1)c2ccccc2)c3ccco3
Nc1ccccc1N2CCCCC2	ZINC000000037777	C2CCN(c1ccccc1)CC2
CCN(CC)CCCNCc1ccc(OC(C)C)c(OC)c1	ZINC000002933161	c1ccccc1
C3CCN(C2CCN(C1CCCC1)CC2)CC3	ZINC000000245374	C3CCN(C2CCN(C1CCCC1)CC2)CC3
Cc2cc(CN1CCCC1)cc(C)c2O	ZINC000000152736	C2CCN(Cc1ccccc1)C2
Cc2c(c1cccs1)nn3cc[nH]c23	ZINC000000011609	c3csc(c2cc1[nH]ccn1n2)c3
CN3CCN(c1cc(C(F)(F)F)nc2ccc(F)cc12)CC3	ZINC000000171498	C3CN(c1ccnc2ccccc12)CCN3
COC(=O)c1ccc(NC(=O)C(C)C)cc1	ZINC000000029807	c1ccccc1
O=N(=O)c3ccc(CN2CCN(C1CCCCC1)CC2)cc3	ZINC000000178723	C3CCC(N2CCN(Cc1ccccc1)CC2)CC3
Cc2ccc(S(=O)(=O)c1ccccc1)cc2S	ZINC000000050208	O=S(=O)(c1ccccc1)c2ccccc2
CCCN(CCC)[C@H]1Cc2c[nH]c3ccc(OC)c(C1)c23	ZINC000000004696	C1Cc2cccc3[nH]cc(C1)c23
Cc2ccc(C(=O)c1ccccc1Cl)c(O)c2	ZINC000000058227	O=C(c1ccccc1)c2ccccc2
CC1(C)NCCNC1=O	ZINC000003617595	O=C1CNCCN1
COc2ccc([C@@H](C(=O)OCCN(C)C)c1ccccc1)cc2	ZINC000000454621	C(c1ccccc1)c2ccccc2
COc2cc(NC(=S)N1CCN(C)CC1)cc(OC)c2	ZINC000000307233	S=C(Nc1ccccc1)N2CCNCC2
O=c2n(CC[n+]1ccccc1)cnc3ccccc23	ZINC000000389296	O=c2n(CC[n+]1ccccc1)cnc3ccccc23
CCN(CC)CCOc1ccc4c(c1)c(=NNC(=O)c2ccccn2)c3cc(OCCN(CC)CC)ccc34	ZINC000008721886	O=C(NN=c2c1ccccc1c3ccccc23)c4ccccn4
CN(C)C[C@@H](O)CO	ZINC000000407010	nonring
C2C[C@@H](c1cnccn1)CN2	ZINC000002513100	C2CC(c1cnccn1)CN2
COc1ccccc1[C@@H]2SCCN2S(=O)(=O)c3cccc(C)c3	ZINC000000068865	O=S(=O)(N1CCSC1c2ccccc2)c3ccccc3
C[C@]34CN(Cc1ccccc1Br)C[C@](C)(C[N@](Cc2ccccc2)C3)C4	ZINC000000674510	C2C4CN(Cc1ccccc1)CC2CN(Cc3ccccc3)C4
CN(C)C[C@@H](O)COc1c(Cl)cc(Cl)cc1Cl	ZINC000000303733	c1ccccc1
COc2nc1ccccc1n2C	ZINC000000135830	c2ccc1[nH]cnc1c2
COc4cccc(NC(=O)NC[C@@H](CCN2CCC(N1CCCCC1)CC2)c3ccc(Cl)c(Cl)c3)c4	ZINC000028115762	O=C(NCC(CCN2CCC(N1CCCCC1)CC2)c3ccccc3)Nc4ccccc4
CC[C@@H]3C(c1ccccc1)[N+](=O)[C@@](C)(c2ccc(F)cc2)N3O	ZINC000000469196	O=[N+]2C(c1ccccc1)CNC2c3ccccc3
C[n+]1ccccc1C(N)=O	ZINC000000331924	c1ccncc1
CC3=C[C@@](O)(C(F)(F)F)N(c2nc1ccccc1s2)N3	ZINC000000174524	C1C=CNN1c3nc2ccccc2s3
NC1=C(C#N)C(C(F)(F)F)(C(F)(F)F)NN1c2ccccc2	ZINC000000032574	C2NN(c1ccccc1)C=C2
Cc2ccc(S(=O)(=O)NCc1ccc(C(O)=O)o1)c(C)c2C	ZINC000000033735	O=S(=O)(NCc1ccco1)c2ccccc2
Fc1ccccc1c4ccc(\C=c3/c(=O)[nH]n(c2ccccc2)c3=O)o4	ZINC000000094257	O=c2[nH]n(c1ccccc1)c(=O)c2=Cc4ccc(c3ccccc3)o4
CN(C)c2ccc(C(=S)N1CCOCC1)cc2Br	ZINC000000052087	S=C(N1CCOCC1)c2ccccc2
COc3ccc([C@](CCC[N@]2CCc1cc(OC)c(OC)cc1C2)(C#N)C(C)C)cc3OC	ZINC000000638635	C(CCc1ccccc1)CN3CCc2ccccc2C3
CC3(C)Cc2c(C#N)c(/N=C/N1CCCCC1)sc2C(C)(C)N3	ZINC000000181700	C3CCN(C=Nc2cc1CCNCc1s2)CC3
C[N@@](CCCCN1CCOCC1)Cc3c(C(=O)N2CCCCCC2)nc4cc(C)ccn34	ZINC000011819507	O=C(N1CCCCCC1)c3nc2ccccn2c3CNCCCCN4CCOCC4
Cc3ccc(CN2CCN(Cc1ccccc1N(=O)=O)CC2)cc3	ZINC000000121067	C2CN(Cc1ccccc1)CCN2Cc3ccccc3
CC1(C)CC2(CC(C)(C)N1)OC(=O)OC2=C	ZINC000000053017	C=C1OC(=O)OC12CCNCC2
CC[C@@H](C)N3CCN(C(=O)c2ccc(CN1CCCC1)cc2)CC3	ZINC000003949253	O=C(N1CCNCC1)c3ccc(CN2CCCC2)cc3
C[N+](C)(CCOc1ccccc1)Cc2ccccc2	ZINC000000001023	C(COc1ccccc1)NCc2ccccc2
CC(=O)N2CCC(Cc1ccccc1)CC2	ZINC000000030087	C2CC(Cc1ccccc1)CCN2
C[N+](=O)Cc1ccc[nH]1	ZINC000000337385	c1cc[nH]c1
Cc2cc(C(=O)NCCN1CCCCC1)no2	ZINC000000128537	O=C(NCCN1CCCCC1)c2ccon2
CCCC[C@@H](CC)CNCc1cccn1CCN2CCOCC2	ZINC000004681296	C2CN(CCn1cccc1)CCO2
COc2ccc1n(C)c(C)c(C(=O)CN(C)C)c1c2	ZINC000000117550	c2ccc1[nH]ccc1c2
CNC(=O)c1n[nH]sc1=NC(=O)OC	ZINC000001416844	N=c1cn[nH]s1
C4Cc1ccccc1[C@@H](CNC[C@@H]3COc2ccccc2O3)O4	ZINC000000186665	C4Cc1ccccc1C(CNCC3COc2ccccc2O3)O4
COC(=O)c1ccc(NN)cc1	ZINC000000039711	c1ccccc1
COc4ccc(n1ccnc1C[N@@](C)CC3CCN(CCc2ccc(F)cc2)CC3)cc4	ZINC000011819888	C2CN(CCc1ccccc1)CCC2CNCc3nccn3c4ccccc4
CN(C1CC(C)(C)N(C)C(C)(C)C1)C(=O)c2ccc(N)cc2	ZINC000000082342	O=C(NC1CCNCC1)c2ccccc2
C/C=C/C(=O)Nc2ccc(N1CCN(C)CC1)cc2	ZINC000000128589	C2CN(c1ccccc1)CCN2
C[C@@H]2CC(=O)c1cc(Cl)ccc1S2	ZINC000000105990	O=C1CCSc2ccccc12
CCN(CC)CCOC(=O)CCC(=O)OCCN(CC)CC	ZINC000005453480	nonring
CCN(CC)CCNC(=O)c2c(C)oc3cc1c(C(=O)NCCN(CC)CC)c(C)oc1cc23	ZINC000006511867	c3cc2cc1occc1cc2o3
C[C@@H](NC(=O)C1CCN(C)CC1)c4nnc3CC[N@@](Cc2cc(C)ccc2C)CCn34	ZINC000011972030	O=C(NCc3nnc2CCN(Cc1ccccc1)CCn23)C4CCNCC4
CCN(CC)CCC[C@@H](C)N=C(Nc1ccccc1)c2ccc(Cl)cc2	ZINC000005839425	N=C(Nc1ccccc1)c2ccccc2
CC[C@@H](CO)NC[C@@H](O)Cn1c(C)c(C)c2ccccc12	ZINC000000106240	c2ccc1[nH]ccc1c2
OC(=O)c4ccc(\C=N\n1c(=O)c3cccc2cccc(c1=O)c23)cc4	ZINC000000033043	O=c2n(N=Cc1ccccc1)c(=O)c4cccc3cccc2c34
CCOC(=O)Nc3ccc2CCc1ccccc1N(C(=O)CN)c2c3	ZINC000000303643	C2Cc1ccccc1Nc3ccccc23
C2CN=C(Cc1ccccc1)N2	ZINC000000125006	C2CN=C(Cc1ccccc1)N2
Clc2cccc3c(S(=O)(=O)N1CCCNCC1)cccc23	ZINC000000402771	O=S(=O)(N1CCCNCC1)c2cccc3ccccc23
Cc3ccc(CNc2ccc1n(C)c(C)nc1c2)cc3	ZINC000000170069	C(Nc2ccc1[nH]cnc1c2)c3ccccc3
COc3cc(c2n(C)c1ccccc1[n+]2C)cc(OC)c3OC	ZINC000000279146	c3ccc(c2nc1ccccc1[nH]2)cc3
Fc2cccc3C=C(CCN1CCCC1)CCc23	ZINC000000021689	C3CCN(CCC2=Cc1ccccc1CC2)C3
CN(C)CC/C=C2/c1ccccc1CS(=O)(=O)c3ccccc23	ZINC000000346582	C=C2c1ccccc1CS(=O)(=O)c3ccccc23
O=C(COc1ccccc1)N(Cc5ccc(c4ccc(CNC3Cc2ccccc2C3)cc4)cc5)C6CCNCC6	ZINC000049777001	O=C(COc1ccccc1)N(Cc5ccc(c4ccc(CNC3Cc2ccccc2C3)cc4)cc5)C6CCNCC6
CCOC=C(C(=O)OC1CC(C)(C)NC(C)(C)C1)C(=O)OC2CC(C)(C)NC(C)(C)C2	ZINC000002532330	C=C(C(=O)OC1CCNCC1)C(=O)OC2CCNCC2
CN2CCC(N(C)Cc1ccc(N(=O)=O)s1)CC2	ZINC000000237437	C2CC(NCc1cccs1)CCN2
OC(=O)[C@H]2N1[C@@H](CC1=O)O/C2=C\C=O	ZINC000000896338	C=C2CN1C(CC1=O)O2
Fc3ccc(N2C(=O)C[C@@H](NCc1ccccn1)C2=O)cc3	ZINC000000250377	O=C2CC(NCc1ccccn1)C(=O)N2c3ccccc3
Cc3cccc(CNCc1ccccc1OC[C@H](O)CN2CCSCC2)c3	ZINC000011816526	C(COc1ccccc1CNCc2ccccc2)CN3CCSCC3
COc1ccccc1N4CCC([N@]3CCN(C2CCN(C(C)C)CC2)[C@@H](CCO)C3)CC4	ZINC000019884635	C4CC(N3CCN(C2CCN(c1ccccc1)CC2)CC3)CCN4
COc3ccc(C(=O)\C=C\c2cc(c1cc(C)cc(C)c1)ccc2OCC[N+](C)(C)C)c(C[N+](C)(C)C)c3	ZINC000040747311	O=C(C=Cc2cccc(c1ccccc1)c2)c3ccccc3
O[C@@H]([C@H]1C[C@@H]2CC[N@]1C[C@H]2C=C)c3ccnc4ccccc34	ZINC000000001153	C1CN2CCC1CC2Cc3ccnc4ccccc34
Cc2cc1cc(C)nn1c(N)n2	ZINC000000038197	c2cc1ccnn1cn2
CNC(=O)c1ccc(CN(C(C)C)C(C)C)o1	ZINC000000186795	c1ccoc1
CN4CCC(c2n[nH]c3ccc(NC(=O)c1ccc(F)cc1)cc23)CC4	ZINC000000587656	O=C(Nc3ccc2[nH]nc(C1CCNCC1)c2c3)c4ccccc4
COc1cc(N)c(Cl)cc1C(=O)NCC[N@@](C)C2CC2	ZINC000000004300	O=C(NCCNC1CC1)c2ccccc2
CC(C)N(C(=O)C[n+]3ccc(c2cc[n+](CC(=O)N(C(C)C)c1ccccc1)cc2)cc3)c4ccccc4	ZINC000002597197	O=C(C[n+]3ccc(c2cc[n+](CC(=O)Nc1ccccc1)cc2)cc3)Nc4ccccc4
COc2ccc1[nH]c(C)c(C(O)=O)c1c2	ZINC000000036675	c2ccc1[nH]ccc1c2
O=c3c1ccccc1c4nc2ccccc2n34	ZINC000000041118	O=c3c1ccccc1c4nc2ccccc2n34
NCc1ccccc1OC(F)(F)F	ZINC000000165237	c1ccccc1
C[N@]1CCC[C@@H]1c2cccnc2	ZINC000000001798	C2CNC(c1cccnc1)C2
O=C2O[C@H](CCN1CCCCC1)OC2(c3ccccc3)c4ccccc4	ZINC000000608027	O=C2OC(CCN1CCCCC1)OC2(c3ccccc3)c4ccccc4
Clc3cccc(n2c(=O)c1cccc(N(=O)=O)c1c2=O)c3	ZINC000000041111	O=c2n(c1ccccc1)c(=O)c3ccccc23
CC(C)(Oc1ccc(Cl)cc1)C(=O)OCc2cccnc2	ZINC000000001796	O=C(COc1ccccc1)OCc2cccnc2
Cc3csc4c(N2CCN(C(=S)NCC1CC1)CC2)ncnc34	ZINC000000082924	S=C(NCC1CC1)N4CCN(c2ncnc3ccsc23)CC4
CCc1ccc(C)[n+](N)c1	ZINC000001680219	c1ccncc1
C[C@@H](NCCn1cnc2c(N)ncnc12)c3ccccc3	ZINC000000158697	C(Cn1cnc2cncnc12)NCc3ccccc3
C[N@@](CCc1ccccc1)Cc3c(C)n(C)n(c2ccccc2)c3=O	ZINC000000218983	O=c2c(CNCCc1ccccc1)c[nH]n2c3ccccc3
CC(=O)C1=C(O)C(=O)N(CC(O)=O)[C@@H]1c2cccc(F)c2	ZINC000000053604	O=C2NC(c1ccccc1)C=C2
CCOC(=O)C4CCN(C3CCN(c2ccc(C(=O)N1CCN(CC)CC1)cc2)CC3)CC4	ZINC000015002572	O=C(N1CCNCC1)c4ccc(N3CCC(N2CCCCC2)CC3)cc4
CCN3CCN(c2ccc(/N=C/c1cccc(Br)c1)cc2)CC3	ZINC000000880881	C3CN(c2ccc(N=Cc1ccccc1)cc2)CCN3
Cn1ccc2c(N)ncnc12	ZINC000001674697	c2ncc1cc[nH]c1n2
CN4CCN(C(=O)N2c1ccccc1CCc3ccccc23)CC4	ZINC000000199727	O=C(N1CCNCC1)N3c2ccccc2CCc4ccccc34
CC3(C)CC(NC(=O)c2cc1ccccc1oc2=O)CC(C)(C)N3	ZINC000000067265	O=C(NC1CCNCC1)c3cc2ccccc2oc3=O
CCOC(=O)c1nnn4c1nc(N2CCN(C)CC2)c3ccccc34	ZINC000000159244	C4CN(c2nc1cnnn1c3ccccc23)CCN4
O[C@@H](COC[C@H]2COc1ccccc1O2)CN3CCCCC3	ZINC000000351432	C3CCN(CCCOCC2COc1ccccc1O2)CC3
COc3ccc2S[C@H]1CC(=O)N(CCN(C)C)C1=Nc2c3	ZINC000000480330	O=C3CC2Sc1ccccc1N=C2N3
COc1cccc(OC)c1OC[C@@H](O)CN2CCCCC2	ZINC000000166973	C2CCN(CCCOc1ccccc1)CC2
FC(F)(F)S(=O)(=O)c2cccc(NC1CCNCC1)c2	ZINC000000154322	C2CC(Nc1ccccc1)CCN2
Cn2c(SCCN1CCCCC1)nnc2C4CCN(CC(/Cl)=C/c3ccccc3)CC4	ZINC000011813277	C4CCN(CCSc3nnc(C2CCN(CC=Cc1ccccc1)CC2)[nH]3)CC4
CC(C)(C)c1ccc(OCC(N)=N)cc1	ZINC000000124316	c1ccccc1
CC[N@]1CCC[C@H]1CN(CC2CCN(CCOC)CC2)C(=O)c3ccccn3	ZINC000011766276	O=C(N(CC1CCNCC1)CC2CCCN2)c3ccccn3
CC[N+]1=C(C)OCC1(COC(C)=O)COC(C)=O	ZINC000000394220	C1CN=CO1
Clc4ccc(C(=O)Nc3cccc(CNCc1ccccc1CN2CCOCC2)c3)cc4	ZINC000024828931	O=C(Nc3cccc(CNCc1ccccc1CN2CCOCC2)c3)c4ccccc4
Fc1ccccc1N4CCN(CC(c2ccccc2)c3ccccc3)CC4	ZINC000000753460	C2CN(c1ccccc1)CCN2CC(c3ccccc3)c4ccccc4
Cc4cccc5cc(CNCCCN1CCCC1=O)c(N3CC[N@]2CCC[C@@H]2C3)nc45	ZINC000012130112	O=C1CCCN1CCCNCc3cc2ccccc2nc3N5CCN4CCCC4C5
CCN1CCC(NC(=O)[C@@H](N)CCS(C)(=O)=O)CC1	ZINC000038098288	C1CCNCC1
C[n+]1ccccc1CC(=O)c2ccc(Br)cc2	ZINC000000026307	O=C(Cc1ccccn1)c2ccccc2
CN(C)CCOC(=O)c1ccccc1	ZINC000000301115	c1ccccc1
O=[S@](Cc1ccccn1)c3nc2ccccc2[nH]3	ZINC000000000778	O=S(Cc1ccccn1)c3nc2ccccc2[nH]3
COC(=O)c3ccc(\C=c2\nc(c1ccc(Cl)cc1)oc2=O)cc3	ZINC000000063376	O=c2oc(c1ccccc1)nc2=Cc3ccccc3
CSc3nc2c1ccccc1n(C(C)=O)c2n3Cc4ccccc4	ZINC000000054277	C(c1ccccc1)n3cnc4c2ccccc2[nH]c34
Fc2ccc(C=c1[nH]c(=S)[nH]c1=O)cc2	ZINC000000039973	O=c1[nH]c(=S)[nH]c1=Cc2ccccc2
CCCC(=O)NOCc1cccc2ccc(OC)cc12	ZINC000000021040	c2ccc1ccccc1c2
CC[C@@H](C)NC(=O)C2CCN(Cc1cccc(OC)c1O)CC2	ZINC000000299327	C2CCN(Cc1ccccc1)CC2
Fc3ccc(NC(=O)CCc2nc(c1ccc(Cl)cc1)no2)cc3	ZINC000000150192	O=C(CCc2nc(c1ccccc1)no2)Nc3ccccc3
O=C(NCCc2nc1ccccc1[nH]2)[C@@H]4COc3ccccc3O4	ZINC000000031850	O=C(NCCc2nc1ccccc1[nH]2)C4COc3ccccc3O4
CN(C)CCOC(C)=O	ZINC000001683612	nonring
CCCCN(CCCC)CCCN3[C@@H](c1ccccc1[N+](C)=O)C(C(=O)c2ccc(C)cc2)=C(O)C3=O	ZINC000035164507	O=C3NC(c1ccccc1)C(C(=O)c2ccccc2)=C3
CO[C@@H]3CC(=C(c1cccs1)c2cccs2)C[N+](C)(C)C3	ZINC000000000776	C3CNCC(=C(c1cccs1)c2cccs2)C3
Clc1ccc4c(c1)C(c2ccccc2)=NCc3nncn34	ZINC000000001370	C3N=C(c1ccccc1)c2ccccc2n4cnnc34
CCN(CC)CCOc4ccc(c3c(c1ccc(OCCN(CC)CC)cc1)c2ccccc2oc3=O)cc4	ZINC000103267545	O=c3oc1ccccc1c(c2ccccc2)c3c4ccccc4
CS(=O)(=O)N2CCN(C1CCCCCC1)CC2	ZINC000000300586	C2CCCC(N1CCNCC1)CC2
CNC(=O)N2CC(Oc1cccc(C(F)(F)F)c1)C2	ZINC000000001482	C1NCC1Oc2ccccc2
CC2CCC([N@]1CCC[C@@H]1CO)CC2	ZINC000000217509	C2CCC(N1CCCC1)CC2
Cc1ncc(CN)c(N)n1	ZINC000000336542	c1cncnc1
CC4(C)CC(=O)c3cc(c1ccccc1)n(c2ccc(F)cc2)c3C4	ZINC000000059882	O=C1CCCc3c1cc(c2ccccc2)n3c4ccccc4
Cc5nc(N3CCN(Cc2ccc1OCOc1c2)CC3)c4c(C)c(C)sc4n5	ZINC000000753862	C5Oc4ccc(CN3CCN(c1ncnc2sccc12)CC3)cc4O5
C[N+]3=C(c1ccccc1)c2c(Br)cc(Br)n2CC3	ZINC000000629149	C3Cn1cccc1C(c2ccccc2)=N3
CN(C)CCN(Cc2cc1cccc(C)c1[nH]c2=O)C(=S)NCCCN3CCOCC3	ZINC000006443403	O=c2[nH]c1ccccc1cc2CNC(=S)NCCCN3CCOCC3
CC3CCN(CC(=O)Nc2sc1CCCc1c2C(N)=O)CC3	ZINC000000090014	O=C(CN1CCCCC1)Nc3cc2CCCc2s3
CNc1oncc1C2=CCC[N@@](C)C2	ZINC000000021868	C2CC=C(c1cnoc1)CN2
COc1cc(OC)c(CN)c(OC)c1	ZINC000000056681	c1ccccc1
CCN4CCN(Cc3ccc(NC(=O)CCc2nc(C1=CC[N@@](C)CC1)no2)cc3)CC4	ZINC000020467439	O=C(CCc2nc(C1=CCNCC1)no2)Nc4ccc(CN3CCNCC3)cc4
CCN3CCN(C(=O)CCC2CCN([C@@H](C)Cc1cccc(C)n1)CC2)CC3	ZINC000011821302	O=C(CCC2CCN(CCc1ccccn1)CC2)N3CCNCC3
CCN1CCC(O)(CC(C)=C)CC1	ZINC000000335495	C1CCNCC1
FC(F)(F)C(F)(F)c2nnc3ccc(N1CCCCCC1)nn23	ZINC000000103125	C3CCCN(c2ccc1nncn1n2)CC3
CCOC(=O)N2CCN(C(=S)NC(=O)c1ccc(F)cc1)CC2	ZINC000000052838	O=C(NC(=S)N1CCNCC1)c2ccccc2
CSc2nc1ccccc1[nH]2	ZINC000000081371	c2ccc1[nH]cnc1c2
CCOC(=O)c1cnc(CN)c2c(OC)cc(OC)cc12	ZINC000000008765	c2ccc1cnccc1c2
Cc1nccn1C[C@@H]2CCc3c(C2=O)c5cccc4CCCn3c45	ZINC000000001149	O=C2C(Cn1ccnc1)CCc3c2c5cccc4CCCn3c45
Cc3ccc2c(C(=O)c1c(C)cc(O)cc1[C@]2(C)O)c3O	ZINC000000005909	O=C2c1ccccc1Cc3ccccc23
NCCc1n[nH]c(CO)n1	ZINC000000262697	c1nc[nH]n1
CCOc2ccc(Cn1ccnc1)cc2N(=O)=O	ZINC000000122006	C(c1ccccc1)n2ccnc2
CC2(C)C(C(=O)N[C@H](C(N)=O)c1ccccc1)C2(C)C	ZINC000000020318	O=C(NCc1ccccc1)C2CC2
O=C(Nc2ccc(C1=NCCN1)cc2)c5cccc(C(=O)Nc4ccc(C3=NCCN3)cc4)c5	ZINC000000537872	O=C(Nc2ccc(C1=NCCN1)cc2)c5cccc(C(=O)Nc4ccc(C3=NCCN3)cc4)c5
Cn2cc(OC[C@H](O)CNC(C)(C)C)c1ccccc1c2=O	ZINC000000004698	O=c1[nH]ccc2ccccc12
COc3ccc(CN2CCN(c1ccccn1)CC2)c(C)c3C	ZINC000000239311	C2CN(c1ccccn1)CCN2Cc3ccccc3
CNc1nccn1C	ZINC000002548457	c1c[nH]cn1
Cc3cccc(OCC(=O)O[C@@H]1CN2CCC1CC2)c3	ZINC000000203536	O=C(COc1ccccc1)OC2CN3CCC2CC3
CC2(C)COC(c1ccc(N)cc1)=N2	ZINC000000099534	C2CN=C(c1ccccc1)O2
CCN3CCN(c2ccc(NC(=O)Cc1ccccc1)cc2)CC3	ZINC000000587395	O=C(Cc1ccccc1)Nc3ccc(N2CCNCC2)cc3
CCOc3ccc(N2C(=O)C[C@H](NCc1cccnc1)C2=O)cc3	ZINC000000062422	O=C2CC(NCc1cccnc1)C(=O)N2c3ccccc3
COc1cccc(C=O)c1OCC(O)=O	ZINC000000168206	c1ccccc1
CC1(C)C(C(=O)NCC(N)=O)C1(C)C	ZINC000000020315	C1CC1
C4CN(CCn2c(NCc1ccco1)nc3ccccc23)CCO4	ZINC000000350258	C4CN(CCn2c(NCc1ccco1)nc3ccccc23)CCO4
CNC3(c1nnnn1CCOC(=O)Nc2ccc(Cl)cc2)CCCC3	ZINC000000792647	O=C(Nc1ccccc1)OCCn2nnnc2C3CCCC3
CNc3nc(c1ccccc1)[n+](c2ccccc2)s3	ZINC000000041847	c3ccc(c1ncs[n+]1c2ccccc2)cc3
COc3ccc(CC/N=C(\C)c2ccc1ccccc1c2)cc3OC	ZINC000000099159	C(Cc1ccccc1)N=Cc3ccc2ccccc2c3
Cc4ccc([n+]2c1CCCn1cc2c3ccc(Br)cc3)cc4	ZINC000000637284	C1Cc3n(C1)cc(c2ccccc2)[n+]3c4ccccc4
CC2(C)CC(NC(=O)c1ccn[nH]1)CC(C)(C)N2	ZINC000000092959	O=C(NC1CCNCC1)c2ccn[nH]2
COc1cc(C(C)=O)ccc1OCCCN4CCC(C(N)(c2ccc(F)cc2)c3ccc(F)cc3)CC4	ZINC000013824939	C(COc1ccccc1)CN4CCC(C(c2ccccc2)c3ccccc3)CC4
O=C(N([C@@H]1CN2CCC1CC2)c3ccccn3)c4ccccc4	ZINC000000330919	O=C(N(C1CN2CCC1CC2)c3ccccn3)c4ccccc4
N(c4ccc(c3ccc(Nc2nc1ccccc1[nH]2)cc3)cc4)c6nc5ccccc5[nH]6	ZINC000000640468	N(c4ccc(c3ccc(Nc2nc1ccccc1[nH]2)cc3)cc4)c6nc5ccccc5[nH]6
CC[n+]1c(SCC(=O)OC(C)C)sc2ccccc12	ZINC000000407634	c2ccc1scnc1c2
Clc2cc(Cl)c(NC(=O)NCc1ccco1)c(Cl)c2	ZINC000000040530	O=C(NCc1ccco1)Nc2ccccc2
Fc4ccc(C(=O)C3CCN(CCn2c(=O)[nH]c1ccccc1c2=O)CC3)cc4	ZINC000000537877	O=C(C3CCN(CCn2c(=O)[nH]c1ccccc1c2=O)CC3)c4ccccc4
CN1C[C@H]2C[C@@H]1CN2c3cnccn3	ZINC000000020795	C1NC3CC1N(c2cnccn2)C3
CN(C)CCCN2[C@@H](c1cccc(Cl)c1)SCC2=O	ZINC000000196396	O=C2CSC(c1ccccc1)N2
Cc3ccnc(NS(=O)(=O)c2ccc(n1cccc1)cc2)n3	ZINC000000085343	O=S(=O)(Nc1ncccn1)c3ccc(n2cccc2)cc3
COc2cc4CC[N+](C)(C)[C@H]3CC1(C=CC(=O)C=C1)c(c2OC)c34	ZINC000000296272	O=C4C=CC1(CC2NCCc3cccc1c23)C=C4
Nc2nnc(CCN1CCCCC1)s2	ZINC000000098442	C2CCN(CCc1nncs1)CC2
COC(=O)C3[C@H](c1cccc(N(=O)=O)c1)C(C(=O)OCC[N@@](C)Cc2ccccc2)C(=C)NC3=C	ZINC000000601265	C=C3CC(c1ccccc1)C(C(=O)OCCNCc2ccccc2)C(=C)N3
C[C@H](O)CNC1CCCC1	ZINC000005762940	C1CCCC1
Nn1cc(C(F)(F)F)ccc1=[N+]2CCNCC2	ZINC000000157900	C2C[N+](=c1cccc[nH]1)CCN2
Cc2cc(C)[n+]1ccccc1n2	ZINC000000040083	c2cc[n+]1cccnc1c2
CCN(CC)CCn2c(C)nn3c1ccccc1nc23	ZINC000000085349	c1ccc2c(c1)nc3[nH]cnn23
CCN(CC)CC(=O)Nc2scc3c1ccccc1oc(=O)c23	ZINC000000131405	O=c2oc1ccccc1c3cscc23
CC(=O)OCC[N+](C)(C)CCCCCCCCCC[N+](C)(C)CCOC(C)=O	ZINC000005046563	nonring
COc1ccccc1c3nc(C)c(c2cccnc2)[nH]3	ZINC000000009824	c3ccc(c2ncc(c1cccnc1)[nH]2)cc3
COCc3cc(C)c(C#N)c(SCc2nc1ccccc1[nH]2)n3	ZINC000000050012	C(Sc1ccccn1)c3nc2ccccc2[nH]3
O=C(Cc1ccccc1N(=O)=O)Oc2cc(=O)oc3ccccc23	ZINC000000042972	O=C(Cc1ccccc1)Oc2cc(=O)oc3ccccc23
CN3CCN(C(=O)c2ccc(CNS(=O)(=O)c1cccc(Cl)c1)cc2)CC3	ZINC000000630924	O=C(N1CCNCC1)c3ccc(CNS(=O)(=O)c2ccccc2)cc3
COc3cc(CNCc1ccc(OC)c2ccccc12)cc(OC)c3	ZINC000000172243	C(NCc1cccc2ccccc12)c3ccccc3
C5COc4cc(c2c[n+]1ccccc1n2c3ccccc3)ccc4O5	ZINC000000392103	C5COc4cc(c2c[n+]1ccccc1n2c3ccccc3)ccc4O5
CS(=O)(=O)c2noc(c1cccs1)c2C#N	ZINC000000095725	c2csc(c1ccno1)c2
Clc1ccccc1CNCC3CCC(CNCc2ccccc2Cl)CC3	ZINC000001548798	C2CC(CNCc1ccccc1)CCC2CNCc3ccccc3
C[C@H]2C\C(=N\OC(=O)c1ccc(Br)cc1)[C@H](C)C[N@]2C	ZINC000000235781	O=C(ON=C1CCNCC1)c2ccccc2
CNc4ncc(CN3CCC([C@@H]2C[C@@H](C(=O)Nc1ccc(F)cc1)C[N@]2C)CC3)cn4	ZINC000019592376	O=C(Nc1ccccc1)C4CNC(C3CCN(Cc2cncnc2)CC3)C4
C7CCN(Cc6ccc(c5ncc(c4cccc(c3cnc(c2ccc(CN1CCCC1)cc2)o3)c4)o5)cc6)C7	ZINC000084688374	C7CCN(Cc6ccc(c5ncc(c4cccc(c3cnc(c2ccc(CN1CCCC1)cc2)o3)c4)o5)cc6)C7
CCN(CC)CCN(CCC(=O)N1CCNCC1)C(=O)c2ccc(Br)cc2	ZINC000035421556	O=C(CCNC(=O)c1ccccc1)N2CCNCC2
COc3ccc(\C=c2/c(c1ccccc1)noc2=O)c(OC)c3	ZINC000000043602	O=c2onc(c1ccccc1)c2=Cc3ccccc3
COc2ccc(OC[C@@H](O)C[N@]1CCCC[C@H]1C)cc2	ZINC000000167003	C2CCN(CCCOc1ccccc1)CC2
COc2ccc(C1(CN)CCCC1)cc2	ZINC000000186783	C2CCC(c1ccccc1)C2
CNC(=O)OCc1nc(SC)n(C)c1COC(=O)NC	ZINC000000003975	c1c[nH]cn1
CC(C)OC(=O)c2ccc(NC(=O)c1c(C)cc(C)cc1C)cc2	ZINC000000048289	O=C(Nc1ccccc1)c2ccccc2
CCOc3ccc(N2[C@@H](c1ccc(N(=O)=O)cc1)SCC2=O)cc3	ZINC000000180273	O=C2CSC(c1ccccc1)N2c3ccccc3
Cc2nc1ccccc1n2S(C)(=O)=O	ZINC000000030383	c2ccc1[nH]cnc1c2
COc1ccccc1OC(=O)Oc2ccccc2OC	ZINC000000000350	O=C(Oc1ccccc1)Oc2ccccc2
CC(=O)Nc2ccc(C(=O)Nc1c(C)cc(C)cc1C)cc2	ZINC000000030386	O=C(Nc1ccccc1)c2ccccc2
NC(=N)NC[C@H]2COc1ccccc1O2	ZINC000000000357	C2COc1ccccc1O2
CN5CCCN(C(=O)CC[C@H]3C[N@@](Cc1cccc2ccccc12)CC[C@H]3N4CCOCC4)CC5	ZINC000014993074	O=C(CCC3CN(Cc1cccc2ccccc12)CCC3N4CCOCC4)N5CCCNCC5
CN(C)CCNC(C)=c2c(=O)[nH]c(=O)n(Cc1ccccc1)c2=O	ZINC000000529587	C=c2c(=O)[nH]c(=O)n(Cc1ccccc1)c2=O
O=C([C@@H]1CCCN1)N4CCN(C(c2ccccc2)c3ccccc3)CC4	ZINC000000252085	O=C(C1CCCN1)N4CCN(C(c2ccccc2)c3ccccc3)CC4
NC1CCN(C(N)=O)CC1	ZINC000002046882	C1CCNCC1
CC(C)Cc4ccc(C[N@]3CCC[C@@H](NC(=O)C2CCN(Cc1ccco1)CC2)C3)cc4	ZINC000012709362	O=C(NC2CCCN(Cc1ccccc1)C2)C4CCN(Cc3ccco3)CC4
CCN(CC)CCC[C@@H](C)NC(=N)NC(=O)c1ccsc1CCc2cc(Br)ccc2OC	ZINC000036284556	C(Cc1cccs1)c2ccccc2
N=C3N[C@H](c1ccccc1)N(c2ccccc2)C(=N)N3	ZINC000000063592	N=C3NC(c1ccccc1)N(c2ccccc2)C(=N)N3
CCNC(=O)N(CCCN(C)C)C(=O)[C@H]4C[C@H]1[C@H](Cc2c[nH]c3cccc1c23)[N@@](CC=C)C4	ZINC000003830351	C2CNC1Cc3c[nH]c4cccc(C1C2)c34
COCc2nc1nccnc1c(=O)[nH]2	ZINC000000012984	O=c1[nH]cnc2nccnc12
CC[C@@H](C)C(=O)N2CCN(c1ccccc1)CC2	ZINC000000030417	C2CN(c1ccccc1)CCN2
CC(NC1CC(C)(C)NC(C)(C)C1)=CC(=O)OC2CC(C)(C)NC(C)(C)C2	ZINC000001229546	O=C(OC1CCNCC1)C=CNC2CCNCC2
C3CN=C(NCC(c1ccccc1)c2ccccc2)N3	ZINC000000012989	C3CN=C(NCC(c1ccccc1)c2ccccc2)N3
CN(C)CCCN(CCCN(C)C)C/C=C/c1ccc(N(C)C)cc1	ZINC000002479882	c1ccccc1
Cc1ccc(NC(=O)CSC(N)=O)cc1C	ZINC000000034131	c1ccccc1
COC[C@@H]4CCC[N@@](Cc3ccc2OCCN(C(=O)CN1CCCCC1)Cc2c3)C4	ZINC000012162051	O=C(CN1CCCCC1)N4CCOc3ccc(CN2CCCCC2)cc3C4
COC(=O)c2ccc(\C=c1\c(C(=O)OC)c(C)n(CC=C)c1=O)cc2	ZINC000000068755	O=c1[nH]ccc1=Cc2ccccc2
CCOC(=O)c1c(C)c(C(C)=O)sc1n2cccc2	ZINC000000034395	c2ccn(c1cccs1)c2
CNc4nc(C1CCNCC1)nc3C[N@](CCC(=O)N2CCOCC2)CCc34	ZINC000019711293	O=C(CCN3CCc2cnc(C1CCNCC1)nc2C3)N4CCOCC4
CC3(C)CCCN(c1ncnc2[nH]ccc12)C3	ZINC000000024367	C3CCN(c1ncnc2[nH]ccc12)CC3
O=C(NCCC(c1ccccc1)c2ccccc2)c3cccs3	ZINC000000035407	O=C(NCCC(c1ccccc1)c2ccccc2)c3cccs3
O=C(Nc1ccc(CC#N)cc1)c2ccco2	ZINC000000034399	O=C(Nc1ccccc1)c2ccco2
C[C@@H](C[N+](C)(C)C)OC(=O)c1ccc(S(=O)(=O)N(C)C)o1	ZINC000000180497	c1ccoc1
CN(C)CCOC(=O)c1ccc(S(=O)(=O)N(C)C)o1	ZINC000000180494	c1ccoc1
CC(=O)\C=C\c1cc[n+](C)cc1	ZINC000000134877	c1ccncc1
COc4ccc([C@@H]2Nc1ccccc1C(=O)N2Cc3ccco3)cc4	ZINC000000070098	O=C3N(Cc1ccco1)C(c2ccccc2)Nc4ccccc34
COc2ccc(CNCCc1cccnc1)cc2OC[C@@H](O)C[N@@](C)Cc3ccccc3	ZINC000011937656	C(CNCc1ccccc1)COc3cccc(CNCCc2cccnc2)c3
CC(C)(C)COc2ccc(n1cc(C(O)=O)cn1)cc2C#N	ZINC000000007343	c2ccc(n1cccn1)cc2
O=C(N[C@@H](CC1CCNCC1)C(=O)C(=O)NCc2ccccc2)[C@H]3CCCN3C(=O)[C@@H]5NCC[C@H]4CCCC[C@H]45	ZINC000028236316	O=C(NC(CC1CCNCC1)C(=O)C(=O)NCc2ccccc2)C3CCCN3C(=O)C5NCCC4CCCCC45
NC(=N)NCc1ccco1	ZINC000000494410	c1ccoc1
CCN(CC)CCNc1cc(Cl)cc2nc4c(cc12)n(CCN(CC)CC)c3ccc(Cl)cc34	ZINC000299869386	c2ccc1nc4c(cc1c2)[nH]c3ccccc34
CN(C)CCO	ZINC000001641058	nonring
Cc3cccc(N2CCC(/N=C/N1CCCCC1)=N2)c3	ZINC000000048140	C3CCN(C=NC2=NN(c1ccccc1)CC2)CC3
Cc2c[n+]1ccccc1cn2=O	ZINC000001760915	O=n2cc[n+]1ccccc1c2
CCOC(=O)c2ccc1n(CCO)c(C)[n+](CCO)c1c2	ZINC000000262673	c2ccc1[nH]cnc1c2
C5CN(Cc1ccccc1CNCc3cn(Cc2ccccc2)nc3c4ccccc4)CCO5	ZINC000013118089	C5CN(Cc1ccccc1CNCc3cn(Cc2ccccc2)nc3c4ccccc4)CCO5
O=N(=O)c1cccnc1Sc2ccccc2C3=NCCCN3	ZINC000000139953	C3CNC(c1ccccc1Sc2ccccn2)=NC3
CC(=O)Nc3ccc2[n+](c1ccccc1)c(C)n(C)c2c3	ZINC000000262676	c3ccc([n+]1c[nH]c2ccccc12)cc3
CCN1CCC[C@@H]1CNC(=O)Nc3ccc(C)c(NC(=O)NC[C@@H]2CCC[N@]2CC)c3	ZINC000011004701	O=C(NCC1CCCN1)Nc3cccc(NC(=O)NCC2CCCN2)c3
CCOC(=O)[C@@]3(CCOc1ccccc1)CCC[N@](C2CCN(C)CC2)C3	ZINC000011817634	C3CC(CCOc1ccccc1)CN(C2CCNCC2)C3
Cc2cc(Nc1ccc(F)c(Cl)c1)nc(N)n2	ZINC000000089184	N(c1ccccc1)c2ccncn2
COc4ccc(c3nc(c1ccc(F)cc1)c(c2ccccc2)[nH]3)cc4	ZINC000000051960	c4ccc(c3nc(c1ccccc1)c(c2ccccc2)[nH]3)cc4
Brc2cnc(N1CCCNCC1)nc2	ZINC000000154075	C2CNCCN(c1ncccn1)C2
FC(F)(F)c3ccc(CSc2nccc(c1cccnc1)n2)cc3	ZINC000000172391	C(Sc2nccc(c1cccnc1)n2)c3ccccc3
C[N+]14CCCC[C@H]1[C@H](Cn3c(=O)c2ccccc2c3=O)CCC4	ZINC000000265582	O=c3n(CC1CCCN2CCCCC12)c(=O)c4ccccc34
CN(C)CCNC(=O)c2scc1CCCCc12	ZINC000000119128	C2CCc1cscc1C2
CN(C)C(=O)[C@@H]3C[N@@](Cc2ccc(c1ccccc1S(N)(=O)=O)cc2)C[C@H]3c4cccc(C(N)=N)c4	ZINC000028223361	C3CN(Cc2ccc(c1ccccc1)cc2)CC3c4ccccc4
Cc4ccc3c(Cc2nc1ccccc1nc23)c4	ZINC000000051419	C3c1ccccc1c4nc2ccccc2nc34
NC(=N)NC[C@@H](O)CN1CCCc2ccccc12	ZINC000000309678	C2CNc1ccccc1C2
Cc1ccccc1[n+]3c2SCCCn2cc3c4ccc(Br)cc4	ZINC000000623159	C1CSc3n(C1)cc(c2ccccc2)[n+]3c4ccccc4
O=c3n(CN(c1ccccc1)c2ccccc2)c(=O)c4ccccc34	ZINC000000045076	O=c3n(CN(c1ccccc1)c2ccccc2)c(=O)c4ccccc34
Cc2ccc(C)c(S(=O)(=O)c1ccccc1)c2	ZINC000000050944	O=S(=O)(c1ccccc1)c2ccccc2
CC(C)(C)c2ccc(c1csc(N)n1)cc2	ZINC000000035861	c2ccc(c1cscn1)cc2
BrC3(c1ccccc1)C(=O)c2ccccc2C3=O	ZINC000000028309	O=C2C(c1ccccc1)C(=O)c3ccccc23
NC(=O)c1ccccc1NC(=O)COc3ccc(c2ccccc2)cc3	ZINC000000116604	O=C(COc2ccc(c1ccccc1)cc2)Nc3ccccc3
Fc3ccc(O[C@H](C1CCNCC1)c2ccccc2)cc3	ZINC000000025764	C3CC(C(Oc1ccccc1)c2ccccc2)CCN3
CC[N@@](CCO)Cc1csc2c(F)c(F)c(F)c(F)c12	ZINC000000339123	c2ccc1sccc1c2
COc1ccccc1NC(=O)N3CCN(CCc2ccccc2)CC3	ZINC000000146028	O=C(Nc1ccccc1)N3CCN(CCc2ccccc2)CC3
O=C1NCCN1N=Cc2ccc(N(=O)=O)o2	ZINC000000001803	O=C1NCCN1N=Cc2ccco2
C[C@H]1CCCC[N@]1Cc3c(C)n(C)n(c2ccccc2)c3=O	ZINC000000183148	O=c2c(CN1CCCCC1)c[nH]n2c3ccccc3
O[C@@H](Cn2c1=NCCn1c3ccccc23)c5ccc4OCOc4c5	ZINC000000548452	C5Oc4ccc(CCn2c1=NCCn1c3ccccc23)cc4O5
OC(Nc1ccccc1)=NS(=O)(=O)c2ccccc2	ZINC000000090943	O=S(=O)(N=CNc1ccccc1)c2ccccc2
CN(C)Cc2c(C#N)c1ccccc1n2C	ZINC000000054887	c2ccc1[nH]ccc1c2
CN1CCCC[C@H](N)C1=O	ZINC000012650501	O=C1CCCCCN1
O=C(N1CCOCC1)c2cc(N(=O)=O)n[nH]2	ZINC000000031168	O=C(N1CCOCC1)c2ccn[nH]2
CCOc4ccc(c3csc([C@@H]2COc1ccccc1O2)n3)cc4	ZINC000000209329	C2Oc1ccccc1OC2c4nc(c3ccccc3)cs4
Cn2ccc3c(NC(=O)Nc1cccnc1)cccc23	ZINC000000016405	O=C(Nc1cccnc1)Nc2cccc3[nH]ccc23
CSc1ccc(CN(CCO)CCO)cc1	ZINC000000041591	c1ccccc1
COc2cccc(NC(=O)CC[N@]1C[C@@H](C)C[C@@H](C)C1)c2	ZINC000000176488	O=C(CCN1CCCCC1)Nc2ccccc2
C[C@@H]1CNC[C@@H](NC(C)=O)C1	ZINC000138834124	C1CCNCC1
C(Sc2nc1ccccc1[nH]2)c4ccc3nonc3c4	ZINC000000034405	C(Sc2nc1ccccc1[nH]2)c4ccc3nonc3c4
O=C(OCc2ccc1nonc1c2)c4c3CCCc3nc5ccccc45	ZINC000000034404	O=C(OCc2ccc1nonc1c2)c4c3CCCc3nc5ccccc45
CN(C)CCNc2oc(COc1ccccc1)nc2C#N	ZINC000000108756	C(Oc1ccccc1)c2ncco2
CCN4CCN(c2c(CC)c(C)c(C#N)c3nc1ccccc1n23)CC4	ZINC000000521153	C4CN(c2cccc3nc1ccccc1n23)CCN4
O=C(CSc2nc1ccccc1o2)NC3=NC(=O)CS3	ZINC000000034241	O=C(CSc2nc1ccccc1o2)NC3=NC(=O)CS3
CC(C)CC(\C)=N\Nc3nc(c2cc1ccccc1oc2=O)cs3	ZINC000000195151	O=c2oc1ccccc1cc2c3cscn3
COc5cc(C(=O)N4CCN(C2C1CC3CC(C1)CC2C3)CC4)cc(OC)c5OC	ZINC000000652166	O=C(N4CCN(C2C1CC3CC(C1)CC2C3)CC4)c5ccccc5
CC(=O)Nc1cc3c(cn1)[nH]c2ccccc23	ZINC000000025307	c1ccc3c(c1)[nH]c2cnccc23
COC(=O)c1cc3c(cn1)[nH]c2ccccc23	ZINC000000025301	c1ccc3c(c1)[nH]c2cnccc23
Nc1cc3c(cn1)[nH]c2ccccc23	ZINC000000025302	c1ccc3c(c1)[nH]c2cnccc23
Cc2ccc(OC[C@@H](O)CN1CCC(C(N)=O)CC1)c(N(=O)=O)c2	ZINC000000119233	C2CCN(CCCOc1ccccc1)CC2
Clc2ccc(OCC(=O)NCCc1ccccc1)c(Cl)c2	ZINC000000047718	O=C(COc1ccccc1)NCCc2ccccc2
Cc2nn(Cc1ccccc1F)c(C)[n+]2N	ZINC000000405175	C(c1ccccc1)n2cncn2
O=S(=O)(Cc1ccccc1)NC2CCCC2	ZINC000000029842	O=S(=O)(Cc1ccccc1)NC2CCCC2
Cn2c(=O)c(C#N)c(c1ccccc1)n3cnnc23	ZINC000000053544	O=c3cc(c1ccccc1)n2cnnc2[nH]3
Cc1ccsc1C[N@]2CCC[C@@H](O)C2	ZINC000000238546	C2CCN(Cc1cccs1)CC2
C[N@@](Cc1ccccc1)[C@@H]3CC(=O)N(c2ccccc2)C3=O	ZINC000000207046	O=C2CC(NCc1ccccc1)C(=O)N2c3ccccc3
Fc1cccc(Cl)c1Cn4nnc(c3ccc2OCOc2c3)n4	ZINC000000053548	C4Oc3ccc(c2nnn(Cc1ccccc1)n2)cc3O4
C[N+]2(Cc1ccc(N(=O)=O)cc1)CCC[C@H]2c4ccc[n+](Cc3ccc(N(=O)=O)cc3)c4	ZINC000004804976	C4CC(c2ccc[n+](Cc1ccccc1)c2)N(Cc3ccccc3)C4
CCOC(=O)C(=C/c1ccc(Cl)cc1)/C#N	ZINC000000028243	c1ccccc1
CC(C)C[C@@H]1NC(=O)N(C)C1=O	ZINC000000079941	O=C1CNC(=O)N1
CCN(CC)C(=O)[C@@H]2CCC[N@@](Cc1cc(OC)ccc1OC)C2	ZINC000000240435	C2CCN(Cc1ccccc1)CC2
Cc2cc(C)n1n[s+]cc1n2	ZINC000000039573	c2cnc1c[s+]nn1c2
C[N@]2CCCN(Cc1ccc(N(=O)=O)s1)CC2	ZINC000000238896	C2CNCCN(Cc1cccs1)C2
C6CCc5c[n+](CCCc4ccc(c3ccc(CCC[n+]2ccc1CCCCc1c2)cc3)cc4)ccc5C6	ZINC000045389903	C6CCc5c[n+](CCCc4ccc(c3ccc(CCC[n+]2ccc1CCCCc1c2)cc3)cc4)ccc5C6
COc5ccc4n(C)c3ccc2cc[n+](CCN1CCCCC1)cc2c3c4c5	ZINC000005161530	C5CCN(CC[n+]4ccc3ccc2[nH]c1ccccc1c2c3c4)CC5
CN3CCN(c2ccc(NC(=O)c1ccc(Br)o1)cc2)CC3	ZINC000000679588	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccco3
COc2ccc(CC(=O)O[C@@H]1CCC[N@@](C)C1)cc2	ZINC000000250411	O=C(Cc1ccccc1)OC2CCCNC2
COc2ccc(CSC1=NCCN1)cc2N(=O)=O	ZINC000000179282	C2CN=C(SCc1ccccc1)N2
c3ccc(c2cn[n+]1ccccc1n2)cc3	ZINC000000401852	c3ccc(c2cn[n+]1ccccc1n2)cc3
CCOC(=O)[C@@H](C)Oc1cc(C)c3c(c1)oc(=O)c2ccccc23	ZINC000000101189	O=c2oc1ccccc1c3ccccc23
COc4ccc([C@@]2(O)CN1CCCCCC1=[N+]2c3ccccc3)c(F)c4	ZINC000000622937	C4CCN3CC(c1ccccc1)[N+](c2ccccc2)=C3CC4
Cc1c(CN)cnn1C	ZINC000000333395	c1cn[nH]c1
COC(=O)c4c(N[C@H](NC(=O)c1cccs1)C(=O)c2ccccc2)sc3CCCCc34	ZINC000000622931	O=C(NC(Nc2cc1CCCCc1s2)C(=O)c3ccccc3)c4cccs4
CNS(=O)(=O)c2cc(OC)c(OC)c(C(=O)NC[C@H]1CCC[N@]1C)c2	ZINC000000608086	O=C(NCC1CCCN1)c2ccccc2
Cc1ccc(N(=O)=O)c(C(=O)NCC(O)=O)c1	ZINC000000067860	c1ccccc1
CCOC(=O)c4ccc3n2CCN[C@@H]1CCCc(c12)c3c4	ZINC000000188857	C2CC1NCCn3c1c(C2)c4ccccc34
O=c3n(c1ccccn1)nc(c2ccccc2)c4ccccc34	ZINC000000049267	O=c3n(c1ccccn1)nc(c2ccccc2)c4ccccc34
CCN(CC)CCC[C@@H](C)Nc1cc(C)nc2cc(N(C)C)ccc12	ZINC000002031906	c2ccc1ncccc1c2
NC[C@H](O)c1cccs1	ZINC000001593001	c1ccsc1
CN(C)CCOC(=O)CCCCCCCCC(=O)OCCN(C)C	ZINC000004729916	nonring
Clc3ccc(Cl)c(S(=O)(=O)n1nnc2ccccc12)c3	ZINC000000049262	O=S(=O)(c1ccccc1)n2nnc3ccccc23
COc2cccc(Oc1ccc(NC(C)=O)cc1)c2	ZINC000000024149	O(c1ccccc1)c2ccccc2
Fc3ccc(C(=O)N2CCN(CCCc1ccccc1)CC2)cc3	ZINC000000285169	O=C(N2CCN(CCCc1ccccc1)CC2)c3ccccc3
CCN(CC)C(N)=C(N=Nc1ccc(C)cc1)C#N	ZINC000000067827	c1ccccc1
Cn3c(=O)sc4cc(CCN2CCC(Cc1ccccc1)CC2)ccc34	ZINC000000836242	O=c4[nH]c3ccc(CCN2CCC(Cc1ccccc1)CC2)cc3s4
C[N+]4(CC(=O)c3ccc(CCc2ccc(C(=O)C[N+]1(C)CCCCC1)cc2)cc3)CCCCC4	ZINC000005065279	O=C(CN1CCCCC1)c4ccc(CCc3ccc(C(=O)CN2CCCCC2)cc3)cc4
O=S(=O)(N[C@@H]1CCCC[C@@H]1N2CCCCC2)c3ccccc3	ZINC000000204580	O=S(=O)(NC1CCCCC1N2CCCCC2)c3ccccc3
O=[S@@](N1CCCCC1)c3ccc2ccccc2c3	ZINC000000070212	O=S(N1CCCCC1)c3ccc2ccccc2c3
CCc3ccc(C(=O)Nc1cccnc1Oc2ccc(OC)cc2)cc3	ZINC000000083930	O=C(Nc1cccnc1Oc2ccccc2)c3ccccc3
NCc1ccc(Br)cc1	ZINC000000404752	c1ccccc1
CC(=O)[C@]4(O)CC[C@H]3[C@@H]2CC[C@H]1CC(=O)CC[C@]1(C)[C@H]2CC[C@@]34C	ZINC000000086720	O=C4CCC2C(CCC3C1CCCC1CCC23)C4
Cn3nc2ncc1CCCCc1[n+]2n3	ZINC000000078041	C1CCc2c(C1)cnc3n[nH]n[n+]23
COc2ccc(S(=O)(=O)NC1CC(C)(C)NC(C)(C)C1)cc2C(C)C	ZINC000000811011	O=S(=O)(NC1CCNCC1)c2ccccc2
O=C1CCC(=O)N1OC[C@@H]2CCC[N@]3CCCC[C@H]23	ZINC000000035446	O=C1CCC(=O)N1OCC2CCCN3CCCCC23
C5CCN(CCn3c1ccccc1c4nc2ccccc2nc34)CC5	ZINC000000067762	C5CCN(CCn3c1ccccc1c4nc2ccccc2nc34)CC5
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c2cc(O)cc(O)c2	ZINC000000057321	C(Cc1ccccc1)NCCc2ccccc2
C[N@]3CCO[C@@H](c1ccccc1)c2ccccc2C3	ZINC000000120181	C3COC(c1ccccc1)c2ccccc2CN3
CCOC(=O)Nc1cccc2nsnc12	ZINC000000034329	c2ccc1nsnc1c2
CCOc3nn(c2cccc(OCc1ccccc1)c2)c(=O)o3	ZINC000000026832	O=c1ocnn1c3cccc(OCc2ccccc2)c3
Cc3c2C(c1ccccc1)=NCC(=O)Nc2cn3C	ZINC000000001975	O=C3CN=C(c1ccccc1)c2c[nH]cc2N3
Cc5ccc(n3cc(c1ccccc1)c4c(N2CCCC2)ncnc34)cc5	ZINC000000756786	C5CCN(c3ncnc4n(c1ccccc1)cc(c2ccccc2)c34)C5
COc3ccc([C@]2(C)N(O)[C@@H](C)C(c1ccccc1)[N+]2=O)cc3	ZINC000000454324	O=[N+]2C(c1ccccc1)CNC2c3ccccc3
CC(=O)n2c(SCC(=O)Nc1ccccc1)nc3ccccc23	ZINC000000053156	O=C(CSc2nc1ccccc1[nH]2)Nc3ccccc3
COc1nnc(OC)c2ccccc12	ZINC000000053157	c2ccc1cnncc1c2
C1C[n+]2c(S1)sc3ccccc23	ZINC000000053150	C1C[n+]2c(S1)sc3ccccc23
O=c2c(=CNCC1CCNCC1)c(=O)c3ccccc23	ZINC000000246940	O=c2c(=CNCC1CCNCC1)c(=O)c3ccccc23
CN3CCC([N@@](C)C[C@@H](O)CO[C@@H]1CCCc2ccccc12)CC3	ZINC000005887674	C(CNC1CCNCC1)COC2CCCc3ccccc23
CC(C)c3ccc(C(=O)Cn2nc(COc1cc(C)ccc1C(C)C)oc2=S)cc3	ZINC000000622842	O=C(Cn2nc(COc1ccccc1)oc2=S)c3ccccc3
CC(C)N1CCC(NN)CC1	ZINC000019273454	C1CCNCC1
Clc2ccc1c(Cl)cccc1n2	ZINC000000039758	c2ccc1ncccc1c2
CSCN1CCCCC1	ZINC000000159535	C1CCNCC1
OCCNC1CCCCC1	ZINC000001576864	C1CCCCC1
NCc2cc(c1ccccc1)no2	ZINC000000169750	c2ccc(c1ccon1)cc2
CC(C)N/C=N/C(C)C	ZINC000001603697	nonring
Cc4oc3nc1CCCCc1c(NC(=O)CN2CCCC2=O)c3c4C	ZINC000000004939	O=C(CN1CCCC1=O)Nc3c2CCCCc2nc4occc34
CCN(CC)CCN3C(=O)[C@@H]2C4c1ccccc1C([C@H]2C3=O)c5ccccc45	ZINC000000865042	O=C1NC(=O)C3C1C4c2ccccc2C3c5ccccc45
COC[C@@H](N)C(C)C	ZINC000019735457	nonring
C[n+]4cccc(NC(=O)c3ccc(NC(=O)c2ccc(C(=O)Nc1ccc(NC(N)=N)cc1)cc2)cc3)c4	ZINC000001714225	O=C(Nc1ccccc1)c4ccc(C(=O)Nc3ccc(C(=O)Nc2cccnc2)cc3)cc4
CC(C)C[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)N2CCCC2	ZINC000000014937	O=C(CNS(=O)(=O)c1ccccc1)N2CCCC2
COC(=O)c2ccc(NC(=O)CNc1cc(Cl)ccc1OC)cc2	ZINC000000128718	O=C(CNc1ccccc1)Nc2ccccc2
Cn2nc(CN)c1ccccc1c2=O	ZINC000000193381	O=c1[nH]ncc2ccccc12
COc4ccc(N3CCN([C@@H]2CCCN(C(=O)CCn1ccnc1C)C2)CC3)cc4	ZINC000011663866	O=C(CCn1ccnc1)N4CCCC(N3CCN(c2ccccc2)CC3)C4
Fc3ccc(COc1ccnc2cc(C(F)(F)F)ccc12)cc3	ZINC000000042969	C(Oc1ccnc2ccccc12)c3ccccc3
C[C@@H](Oc1ccccc1F)C(=O)NCCN2CCCCC2	ZINC000000194049	O=C(COc1ccccc1)NCCN2CCCCC2
CC(C)[N@]4CCC[C@@H](CNC3CCN(c2ccc(NC(=O)c1ccc(C)cc1C)cc2)CC3)C4	ZINC000011786084	O=C(Nc3ccc(N2CCC(NCC1CCCNC1)CC2)cc3)c4ccccc4
CC(=N)N4CCC(Oc3ccc(N(Cc2cc(c1cccc(C(N)=N)c1)no2)S(C)(=O)=O)cc3)CC4	ZINC000013487645	C4CC(Oc3ccc(NCc2cc(c1ccccc1)no2)cc3)CCN4
CCOC(=O)c1cccc(C(=O)OCC)n1	ZINC000000018737	c1ccncc1
C[N@]1CCC[C@H]1Cc3c[nH]c4ccc(CCS(=O)(=O)c2ccccc2)cc34	ZINC000000607845	O=S(=O)(CCc3ccc2[nH]cc(CC1CCCN1)c2c3)c4ccccc4
C4CCC(CC[N+]3(CCCC[N+]2(CCC1CCCCC1)CCCCC2)CCCCC3)CC4	ZINC000606421950	C4CCC(CC[N+]3(CCCC[N+]2(CCC1CCCCC1)CCCCC2)CCCCC3)CC4
CC(=O)N3CCN(c1ccnc2cc(Cl)ccc12)CC3	ZINC000000171631	C3CN(c1ccnc2ccccc12)CCN3
Cc3cc(NS(=O)(=O)c1ccc(N)cc1)n(c2ccccc2)n3	ZINC000000002112	O=S(=O)(Nc1ccnn1c2ccccc2)c3ccccc3
CCOc2ccc(NS(=O)(=O)c1ccc(N)cc1)nn2	ZINC000000002113	O=S(=O)(Nc1cccnn1)c2ccccc2
COC(=O)c1ccccc1CN	ZINC000001494942	c1ccccc1
COc2ccc(/C=C/C(=O)Nc1ccc(OC)c(Cl)c1)c(OC)c2	ZINC000000147378	O=C(Nc1ccccc1)C=Cc2ccccc2
CN(C)Cc2cc(CCNC(=O)c1ccc(Cl)cc1)ccc2O	ZINC000000210059	O=C(NCCc1ccccc1)c2ccccc2
CN2CCC[C@@]1(CCCNC1)C2	ZINC000000106624	C1CNCC2(C1)CCCNC2
OC4CCN(CCCn2c1ccccc1sc3ccc(C#N)cc23)CC4	ZINC000000538159	C4CCN(CCCn2c1ccccc1sc3ccccc23)CC4
C(CN(Cc1ccccc1)Cc2ccccc2)Oc5ccc(NC(=Nc3ccccc3)c4ccccc4)cc5	ZINC000096901236	C(CN(Cc1ccccc1)Cc2ccccc2)Oc5ccc(NC(=Nc3ccccc3)c4ccccc4)cc5
OC(=O)CSc2nccc(c1ccccc1)n2	ZINC000000128050	c2ccc(c1ccncn1)cc2
NCCCON	ZINC000002020238	nonring
CCC(=O)Nc2sc1C[C@H](C)CCc1c2C(=O)N3CCCCC3	ZINC000000061456	O=C(N1CCCCC1)c3csc2CCCCc23
C[C@H](O)C1CCNCC1	ZINC000001584638	C1CCNCC1
Nc2nn(=O)c1ccccc1n2	ZINC000000006099	O=n1ncnc2ccccc12
N[C@@H]1CCCC[C@@H]1O	ZINC000000152726	C1CCCCC1
COc1ccccc1Oc3ncnc4sc(c2ccccc2)cc34	ZINC000000091723	O(c1ccccc1)c3ncnc4sc(c2ccccc2)cc34
CS(=O)(=O)c2ccc(N1CCNCC1)c(F)c2	ZINC000000154119	C2CN(c1ccccc1)CCN2
Nc2ncc(S(=O)(=O)c1ccccn1)s2	ZINC000000004842	O=S(=O)(c1ccccn1)c2cncs2
Clc3ccc(N2CCN(CCCNC(=O)[C@@H]1CCCN1)CC2)cc3	ZINC000006276576	O=C(NCCCN2CCN(c1ccccc1)CC2)C3CCCN3
CN(C)Cc1cc(C)c(O)c(C)c1	ZINC000000152729	c1ccccc1
C1CN3CCC1C(c2ccccn2)=C3	ZINC000000004847	C1CN3CCC1C(c2ccccn2)=C3
CCOC(=O)c1ccc(N)c(N)c1	ZINC000000071497	c1ccccc1
CC(C)NC[C@H]1CCCN1C	ZINC000053648898	C1CCNC1
CCc1cccc(C)c1NC(=O)N2CCN(C(=O)OC(C)(C)C)CC2	ZINC000000066554	O=C(Nc1ccccc1)N2CCNCC2
NCc1ccncc1	ZINC000000158598	c1ccncc1
C[N+](C)(C)[C@@H]2[C@@H](O)O[C@H]1[C@@H](O)CO[C@H]12	ZINC000000039940	C2CC1OCCC1O2
Cc5nn(c1ccccc1)c6N=C(c2ccc(F)cc2)N(C3CC3)[C@H](c4ccccc4)c56	ZINC000014017540	C1CC1N5C(c2ccccc2)c4cnn(c3ccccc3)c4N=C5c6ccccc6
COc1ccccc1CN3CCC(N2CCCCC2)CC3	ZINC000000243796	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
CC(=O)Nc1c(C(C)=O)oc2ccccc12	ZINC000000054786	c2ccc1occc1c2
CCN(CC)CCN2C(=O)CCCc3sc1CCCCc1c23	ZINC000000192096	O=C3CCCc2sc1CCCCc1c2N3
C\C(=C\CCN1CCC3(CC1)N(c2ccccc2)CNC3=O)c4ccc(F)cc4	ZINC000000538370	O=C2NCN(c1ccccc1)C24CCN(CCC=Cc3ccccc3)CC4
C[N@@](CCCn1ccnc1)CCOc2ccc(Cl)cc2	ZINC000000019463	C(CNCCOc1ccccc1)Cn2ccnc2
Cc3ccc(c2noc(CN(Cc1ccco1)S(C)(=O)=O)n2)cc3	ZINC000000033617	C(NCc2nc(c1ccccc1)no2)c3ccco3
O=C1CNCCN1C2CCCC2	ZINC000000873818	O=C1CNCCN1C2CCCC2
CC[C@@]2(OC(=O)c1ccccc1)C[C@@H](C)[N@@](C)C[C@@H]2C	ZINC000000079792	O=C(OC1CCNCC1)c2ccccc2
CC(C)CCN1C(=O)N(CCN(C)C)C(=O)C14CCN(Cc2cn(C)c3ccccc23)CC4	ZINC000014531335	O=C4NC(=O)C3(CCN(Cc1c[nH]c2ccccc12)CC3)N4
CN3CCN(c2ccc(CNC(=O)c1snnc1C)cc2)CC3	ZINC000000130997	O=C(NCc2ccc(N1CCNCC1)cc2)c3cnns3
CCCC[C@H](CC)[C@H](C#C[C@H]([C@@H](CC)CCCC)N(C)C)N(C)C	ZINC000004409541	nonring
OC(=O)\C=C\c1cc(Br)ccc1F	ZINC000000057077	c1ccccc1
N[C@@H](c1ccccc1)c2c(O)ccc3ccccc23	ZINC000000189322	C(c1ccccc1)c2cccc3ccccc23
O=C3C[C@H](Nc2ccc(N1CCCCC1)cc2)C(=O)N3Cc4ccccc4	ZINC000000639860	O=C3CC(Nc2ccc(N1CCCCC1)cc2)C(=O)N3Cc4ccccc4
CC(C)[C@@H](C(=O)Nc1ccc(F)cc1)n3c(=O)c2ccccc2c3=O	ZINC000000045207	O=C(Cn2c(=O)c1ccccc1c2=O)Nc3ccccc3
COc4ccc3CN(CCC(=O)N2CCC[N@@](Cc1ccccc1F)CC2)C[C@@H](C)Oc3c4	ZINC000012328489	O=C(CCN2CCOc1ccccc1C2)N4CCCN(Cc3ccccc3)CC4
COC(=O)[C@H]1CC(C)(C)N(OC(C)=O)C1(C)C	ZINC000000009223	C1CCNC1
CN(\N=N\N(C)c1ccccc1)c2ccccc2	ZINC000000002069	N(N=NNc1ccccc1)c2ccccc2
Cc2n(C)c1ccccc1[n+]2C	ZINC000000160388	c2ccc1[nH]cnc1c2
C[C@H]1[C@H](O)CC[N@@](C)[C@@H]1c2ccccc2	ZINC000000270728	C2CCC(c1ccccc1)NC2
COc3cc(C[C@@H](C)[N@]2CCc1cc(OC)c(OC)cc1C2)ccc3O	ZINC000000756626	C(Cc1ccccc1)N3CCc2ccccc2C3
CCN(CC)CCCNc2nc1ccccc1n2CCC(C)C	ZINC000006869484	c2ccc1[nH]cnc1c2
CCN(CC)Cc2ccc(NC(=O)c1ccc(N(=O)=O)c(C)c1)cc2	ZINC000000568269	O=C(Nc1ccccc1)c2ccccc2
COc3ccc(CN2CCN(c1ccccc1F)CC2)c(OC)c3C	ZINC000000201623	C2CN(c1ccccc1)CCN2Cc3ccccc3
CCN(CC2CCN(C1CCN(C)CC1)CC2)C(=O)COc3ncnc4ccccc34	ZINC000012581922	O=C(COc1ncnc2ccccc12)NCC4CCN(C3CCNCC3)CC4
C[N@@](CC2CCN(CCc1ccc(F)cc1)CC2)Cc4cnc(N3CCOCC3)s4	ZINC000012439870	C4CN(c3ncc(CNCC2CCN(CCc1ccccc1)CC2)s3)CCO4
Cn1ccc(=N)cc1	ZINC000000330933	N=c1cc[nH]cc1
NC(=O)c3cc2c(Oc1ccc(Br)cc1)cncc2s3	ZINC000000026008	O(c1ccccc1)c2cncc3sccc23
CCOc4ccc(N3C(=O)C[C@@H](Nc2ccc(N1CCCCC1)cc2)C3=O)cc4	ZINC000000637035	O=C3CC(Nc2ccc(N1CCCCC1)cc2)C(=O)N3c4ccccc4
Clc3ccc(NC(=O)C[C@@H]2N[C@H]1CCCC[C@@H]1NC2=O)cc3	ZINC000000543825	O=C(CC2NC1CCCCC1NC2=O)Nc3ccccc3
CC[N@]3CCC[C@@H](OC(=O)C(O)(c1ccccc1)c2ccccc2)C3	ZINC000000390428	O=C(OC1CCCNC1)C(c2ccccc2)c3ccccc3
CC[C@H]1CCCC[N@]1Cc2c(O)ccc4c2oc(=O)c3ccccc34	ZINC000000045110	O=c3oc2c(CN1CCCCC1)cccc2c4ccccc34
CN4CCN(c3nc(NCc1ccco1)c2ccccc2n3)CC4	ZINC000000315706	C4CN(c3nc(NCc1ccco1)c2ccccc2n3)CCN4
Fc4ccc(OC[C@H]3CC[C@@H]2CN(c1ncc(F)cn1)CC[N@]2C3)cc4	ZINC000000601673	C3CC2CN(c1ncccn1)CCN2CC3COc4ccccc4
NC(=O)C3CCN(Cc1c(O)ccc2ccccc12)CC3	ZINC000000032115	C3CCN(Cc1cccc2ccccc12)CC3
CCN(CC)CCNc3ncc2Cc1ccccc1Nc2c3C#N	ZINC000000537068	C2c1ccccc1Nc3ccncc23
C[C@@H]3CN(C(=O)c1ccccc1)O[C@@H](c2ccc(N(=O)=O)cc2)O3	ZINC000000082379	O=C(N2CCOC(c1ccccc1)O2)c3ccccc3
C(c2ncc(c1ccccc1)o2)[n+]6ccc(c5cc[n+](Cc4ncc(c3ccccc3)o4)cc5)cc6	ZINC000000639642	C(c2ncc(c1ccccc1)o2)[n+]6ccc(c5cc[n+](Cc4ncc(c3ccccc3)o4)cc5)cc6
C[C@@H](CCCC(C)(C)O)NC2CCN(CCc1ccccc1)CC2	ZINC000004030555	C2CCN(CCc1ccccc1)CC2
CCc2[nH]c(=S)c(C#N)c(c1ccccc1)c2C(=O)OC	ZINC000000049306	S=c2cc(c1ccccc1)cc[nH]2
CC[C@@H](C(O)=O)n3cnc2scc(c1ccc(C)cc1)c2c3=O	ZINC000000098499	O=c2[nH]cnc3scc(c1ccccc1)c23
CN(C)CCCc1c(N(=O)=O)ccc(N(=O)=O)c(CCCN(C)C)n1C(F)(F)F	ZINC000005258424	c1ccc[nH]cc1
COc5ccc(c3cn2c1ccccc1nc2n3CCN4CCCC4)cc5	ZINC000000858822	C5CCN(CCn3c(c1ccccc1)cn4c2ccccc2nc34)C5
CCN(CC)CCc4ccc(Oc3ccc(C(=O)c2ccc(C[N@@](C)Cc1ccccc1)cc2)cc3)cc4	ZINC000071297013	O=C(c2ccc(CNCc1ccccc1)cc2)c4ccc(Oc3ccccc3)cc4
C[N+]2(C)CCc1ccc(Cl)cc12	ZINC000000021671	C2Cc1ccccc1N2
CN4CCN(CCNC(=O)C3CCN(Cc1cn(C)c2ccc(Cl)cc12)CC3)CC4	ZINC000035562284	O=C(NCCN1CCNCC1)C4CCN(Cc2c[nH]c3ccccc23)CC4
CN(C)CCN(Cc3ccc(c2ccc(CNCCc1ccccc1)cc2)cc3)S(=O)(=O)/C=C/c4ccccc4	ZINC000028464223	O=S(=O)(NCc3ccc(c2ccc(CNCCc1ccccc1)cc2)cc3)C=Cc4ccccc4
Oc1ccccc1n4c(c2ccccc2)nc3ccccc3c4=O	ZINC000000098141	O=c3n(c1ccccc1)c(c2ccccc2)nc4ccccc34
CN(C)CCCOc5ccc(c3nc1ccccc1c4c(=O)c2cc(OCCCN(C)C)ccc2c34)cc5	ZINC000045349333	O=c4c1ccccc1c5c(c2ccccc2)nc3ccccc3c45
N[C@@H](Cc1ccccc1)C(=O)N2CCCCC2	ZINC000000112476	O=C(CCc1ccccc1)N2CCCCC2
CCN(CC)c2ccc(\C=N\n1c(C)cc(C)cc1=O)cc2	ZINC000000038932	O=c1ccccn1N=Cc2ccccc2
COCCOC2CCN(Cc1cc(OC)ccc1OC[C@H](O)CN(C)C)CC2	ZINC000011842823	C2CCN(Cc1ccccc1)CC2
C=C4C[C@@](COc1cccc2cccnc12)(c3ccccc3)OC4=O	ZINC000000022499	C=C4CC(COc1cccc2cccnc12)(c3ccccc3)OC4=O
COc1ccccc1NC(=O)c3c(N)sc2C[N@](C)CCc23	ZINC000000235455	O=C(Nc1ccccc1)c3csc2CNCCc23
CN(C)CCNc2nc1n(C)c(=O)[nH]c(=O)c1n2CC=C	ZINC000000079570	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
OCCN(Cc1ccccc1)C(=O)C3CCN(CC2CCCCC2)CC3	ZINC000000795479	O=C(NCc1ccccc1)C3CCN(CC2CCCCC2)CC3
Cn3c(=S)[nH]c(=Cc2ccc(OCc1ccccc1F)cc2)c3=O	ZINC000000094069	O=c1[nH]c(=S)[nH]c1=Cc3ccc(OCc2ccccc2)cc3
CC(=O)SCC[N+](C)(C)C	ZINC000000163689	nonring
C[C@@H]2OC=C1C(=O)C(C(O)=O)C(=O)C(C)=C1[C@H]2C	ZINC000000001164	O=C2CC(=O)C1=COCCC1=C2
CC(C)(O)C#Cc3ccc(C(=O)N2CCC(N1CCCCC1)(C(N)=O)CC2)cc3	ZINC000000716700	O=C(N2CCC(N1CCCCC1)CC2)c3ccccc3
CN(\C=C\c3sc2ccc1ccccc1c2[n+]3C)c4ccccc4	ZINC000000352705	N(C=Cc3nc2c(ccc1ccccc12)s3)c4ccccc4
C3CN=C(COc1ccccc1C2CC2)N3	ZINC000000001160	C3CN=C(COc1ccccc1C2CC2)N3
NCCc1ccco1	ZINC000000873698	c1ccoc1
COc1ccccc1c3nn(Cc2ccccc2)cc3CNC4CC(C)(C)NC(C)(C)C4	ZINC000023907981	C4CC(NCc2cn(Cc1ccccc1)nc2c3ccccc3)CCN4
C[N@@](CC2CCN(CCc1ccc(F)cc1)CC2)Cc3ccc(C#CC(C)(C)O)s3	ZINC000012191817	C2CN(CCc1ccccc1)CCC2CNCc3cccs3
Fc4ccc(C(=O)Cn2c1=NCCCn1c3ccccc23)cc4	ZINC000000116373	O=C(Cn2c1=NCCCn1c3ccccc23)c4ccccc4
CN(C)C[C@@H](O)CC(N)=O	ZINC000001677403	nonring
OC[C@@H]1CCC[N@]1C3CCN(CCc2ccccc2)CC3	ZINC000000213744	C3CCN(C2CCN(CCc1ccccc1)CC2)C3
NC(=O)c2oc1ccccc1c2NC(=O)CN3CCCCC3	ZINC000000380743	O=C(CN1CCCCC1)Nc2coc3ccccc23
CCCOc1ccc(C(=N)NCCN(CC)CC)cc1	ZINC000002032167	c1ccccc1
NC2([C@@H]1CCCCC1=O)CCCCC2	ZINC000000322425	O=C1CCCCC1C2CCCCC2
CC(C)N5CCN([C@@H](CN3CCN(CCc1ccccc1c2ccccc2)CC3)c4ccc(F)cc4)CC5	ZINC000028646298	C5CN(C(CN3CCN(CCc1ccccc1c2ccccc2)CC3)c4ccccc4)CCN5
CCN(CC)[C@@H](C)C(=O)Nc3c1CCCc1cc2CCCc23	ZINC000000347601	C3Cc2cc1CCCc1cc2C3
C[N@@](CC2CCN(CCc1cccc(F)c1)CC2)Cc4ccc(Sc3nncn3C)o4	ZINC000011817958	C2CN(CCc1ccccc1)CCC2CNCc4ccc(Sc3nnc[nH]3)o4
C[C@H](O)CN(C)C	ZINC000000388589	nonring
Cn2c(Cc1ccsc1)nnc2SCc3ccc(N(=O)=O)cc3	ZINC000000120994	C(Sc2nnc(Cc1ccsc1)[nH]2)c3ccccc3
Cc1cc(C)c(NC(=O)CCC(O)=O)c(C)c1	ZINC000000113260	c1ccccc1
CN(C)CC(C)(C)C=O	ZINC000002168724	nonring
CC(C)NCC(=O)Nc2ccc(S(=O)(=O)c1ccc(NC(=O)CNC(C)C)cc1)cc2	ZINC000001580998	O=S(=O)(c1ccccc1)c2ccccc2
C3CN(c2nc1ccccc1[nH]2)CCO3	ZINC000000094717	C3CN(c2nc1ccccc1[nH]2)CCO3
Clc1ccccc1C(=O)NN3C(=O)[C@H]2[C@@H]4C=C[C@H]([C@H]2C3=O)C45CC5	ZINC000000063291	O=C(NN2C(=O)C1C3C=CC(C1C2=O)C34CC4)c5ccccc5
CC(C)(C)[N@@](C[C@@H](O)COc1ccccc1)Cc2ccc(N(=O)=O)cc2	ZINC000000753782	C(CNCc1ccccc1)COc2ccccc2
CCN2CCC(NC[C@@H](O)COc1ccccc1C(C)C)CC2	ZINC000006834848	C(CNC1CCNCC1)COc2ccccc2
CCCCN(CCCC)CCCNCc2cn(Cc1ccccc1Cl)c3ccccc23	ZINC000013733966	C(c1ccccc1)n2ccc3ccccc23
CN5CCN(c3ccnc4ccc(NC(=O)Nc2ccc(c1ccncc1)c(C(F)(F)F)c2)cc34)CC5	ZINC000003940532	O=C(Nc2ccc(c1ccncc1)cc2)Nc5ccc4nccc(N3CCNCC3)c4c5
CC(C)NCC(C)(C)O	ZINC000000409876	nonring
COC5=C[C@H]4N=C(N1CCCN(C)CC1)NC(NC3CCN(Cc2ccccc2)CC3)=C4C=C5OC	ZINC000045789204	C5CNCCN(C4=NC1C=CC=CC1=C(NC3CCN(Cc2ccccc2)CC3)N4)C5
COc3ccc([C@](CCCN2CCN(C(=O)c1ccco1)CC2)(C#N)C(C)C)cc3OC	ZINC000000627644	O=C(N2CCN(CCCCc1ccccc1)CC2)c3ccco3
O=C(OC[C@H]1CCC[N@]2CCCC[C@H]12)c4cc3ccccc3oc4=O	ZINC000000052742	O=C(OCC1CCCN2CCCCC12)c4cc3ccccc3oc4=O
CCOC(=O)N2CCC(NCCc1cccc(F)c1)CC2	ZINC000000221628	C2CC(NCCc1ccccc1)CCN2
CCCCc4nc(C[N@](CC2CCN(C1CCCC1)CC2)C[C@@H]3CCCO3)c[nH]4	ZINC000011819884	C4CCC(N3CCC(CN(CC1CCCO1)Cc2c[nH]cn2)CC3)C4
CC(C)NC[C@@H](O)c1ccc(O)c2ncccc12	ZINC000000000690	c2ccc1ncccc1c2
CN1CCC(OC(C)=O)CC1	ZINC000002583792	C1CCNCC1
CCOc3ccc(CN2CCC(C(=O)NC1CCCC1)CC2)cc3	ZINC000000455474	O=C(NC1CCCC1)C3CCN(Cc2ccccc2)CC3
CN(C)CCCN(CCCN(C)C)c1ccc(N(=O)=O)cc1N(=O)=O	ZINC000004859554	c1ccccc1
CC(C)CCN(CCC(C)C)C(=O)C[N+]12CC[N+](CC(=O)N(CCC(C)C)CCC(C)C)(CC1)CC2	ZINC000013131532	C1CN2CCN1CC2
C[N@]5CCCN(C(=O)c2nc1sccn1c2CN4CCC(Cc3ccccc3)CC4)CC5	ZINC000012306198	O=C(N1CCCNCC1)c3nc2sccn2c3CN5CCC(Cc4ccccc4)CC5
COc3cc2cc(c1ccc(OC)c(OC)c1C)nc(N)c2cc3OC	ZINC000000664885	c3ccc(c2cc1ccccc1cn2)cc3
S=c2[nH]c(c1cccs1)ccc2C#N	ZINC000000039962	S=c2cccc(c1cccs1)[nH]2
CC2(Br)C(=O)c1ccccc1C2=O	ZINC000000039965	O=C1CC(=O)c2ccccc12
COC(=O)CCCC(=O)N(CCN1CCCCC1)C[C@@H]3CCC[N@](C2CCCC2)C3	ZINC000012301894	C3CCN(CCNCC2CCCN(C1CCCC1)C2)CC3
CCN(CC)CCn3c1ccccc1n4c(C(=O)CC)c(c2ccccc2)nc34	ZINC000000759019	c4ccc(c1cn3c(n1)[nH]c2ccccc23)cc4
CCOC(=O)CCN	ZINC000000162643	nonring
Cc1ccc(N(=O)=O)cc1NC(=O)COc2ccccc2C	ZINC000000038897	O=C(COc1ccccc1)Nc2ccccc2
CC\C(=C\C)C(=O)NC(N)=O	ZINC000000001340	nonring
NC4=C(C#N)[C@@H](c1cccc(N(=O)=O)c1)c3ccc2ccccc2c3O4	ZINC000000038895	O3C=CC(c1ccccc1)c4ccc2ccccc2c34
CCN(CC)CCn2c(C)nc3c(=O)c1n(CCN(CC)CC)c(C)nc1c(=O)c23	ZINC000001691618	O=c2c1nc[nH]c1c(=O)c3nc[nH]c23
CN(C)CCOC(=O)[C@@H](c1ccccc1)C2(O)CCCC2	ZINC000000155531	C2CCC(Cc1ccccc1)C2
CC(=C)Cn3c(SCc1ccccc1)nc2ccccc2c3=O	ZINC000000045603	O=c2[nH]c(SCc1ccccc1)nc3ccccc23
CCn3cc2[nH]c(N1CCNCC1)ncc2c3=O	ZINC000000013627	O=c2[nH]cc3[nH]c(N1CCNCC1)ncc23
OC[C@@H]1CCCNC1	ZINC000000388342	C1CCNCC1
OC(=O)[C@H](C#N)[C@@H]1C(=O)Nc2ccccc12	ZINC000000040236	O=C2Cc1ccccc1N2
NC1(CO)CC=CC1	ZINC000002527635	C1CC=CC1
COc2ccc(CNC[C@@H](O)CSc1ccc(OC)cc1)cc2	ZINC000000108910	C(CNCc1ccccc1)CSc2ccccc2
Cc1ccc(C=C(C#N)C#N)o1	ZINC000000043639	c1ccoc1
OC(=O)C[C@@H]2SC1=NCCN1C2=O	ZINC000004553155	O=C1CSC2=NCCN12
CN(C)CCc2c[nH]c3ccc(c1ccc(C)s1)cc23	ZINC000000022997	c3csc(c2ccc1[nH]ccc1c2)c3
Oc2cc(C(=O)Cc1ccccc1)cc(N(=O)=O)c2O	ZINC000000008750	O=C(Cc1ccccc1)c2ccccc2
Clc1ccccc1NC(=O)CCSc3nc2ccccc2s3	ZINC000000616934	O=C(CCSc2nc1ccccc1s2)Nc3ccccc3
c3csc(c2cc1nccn1[nH]2)c3	ZINC000000004424	c3csc(c2cc1nccn1[nH]2)c3
Cc3ccc(S(=O)(=O)NC(=N)NCCCN2CCN(c1ccc(F)cc1)CC2)cc3	ZINC000020857140	N=C(NCCCN2CCN(c1ccccc1)CC2)NS(=O)(=O)c3ccccc3
NC(=O)C2CCN(C[C@@H](O)COc1ccc(F)cc1)CC2	ZINC000000118412	C2CCN(CCCOc1ccccc1)CC2
CC(C)c3c(C[N@@](C)[C@@H](C)Cc1ccccc1)n(C)n(c2ccccc2)c3=O	ZINC000000643070	O=c2cc(CNCCc1ccccc1)[nH]n2c3ccccc3
Clc1ccccc1COc3ccc(C(=O)Nc2cccnc2)cc3	ZINC000000141249	O=C(Nc1cccnc1)c3ccc(OCc2ccccc2)cc3
COC4=C[C@H]2[C@@H]3Cc1ccc(OC)c(O)c1[C@]2(CC[N@]3C)CC4=O	ZINC000000000181	O=C4CC23CCNC(Cc1ccccc12)C3C=C4
FC(F)(F)c1ccccc1n2n[o+]c(=O)[nH]2	ZINC000000063121	O=c2[nH]n(c1ccccc1)n[o+]2
C4CCN(CCNc2cc(c1ccccc1)nc3ccccc23)C4	ZINC000004541734	C4CCN(CCNc2cc(c1ccccc1)nc3ccccc23)C4
COc3c1OCOc1cc2CCN(C)[C@H](O)c23	ZINC000000000186	C3Cc2cc1OCOc1cc2CN3
CN(C)c3ccc([N+](=O)Cc1cccc2nsnc12)cc3	ZINC000000240910	O=[N+](Cc1cccc2nsnc12)c3ccccc3
CCC2CCC([N@@]1C[C@H](C)O[C@H](C)C1)CC2	ZINC000000214755	C2CCC(N1CCOCC1)CC2
CN(C)C[C@@H](O)[C@H]1CCOC(C)(C)C1	ZINC000000374801	C1CCOCC1
CCN(CC)CCCN[C@@H](C)C(=O)N1[C@@H](C)CCC[C@H]1C	ZINC000004969453	C1CCNCC1
COc2ccc(CNCc1ccccc1Cl)cc2OC[C@@H](O)CN3CCCC3	ZINC000011719446	C3CCN(CCCOc2cccc(CNCc1ccccc1)c2)C3
CN4CCN(c3ccc(c2nc1ccc(I)cc1s2)cc3)CC4	ZINC000000591049	C4CN(c3ccc(c2nc1ccccc1s2)cc3)CCN4
Cn2c(N)c(C(=O)CNC1CCCCC1)c(=O)n(C)c2=O	ZINC000000141334	O=C(CNC1CCCCC1)c2c[nH]c(=O)[nH]c2=O
CN1CC2(C)CN(C)CC(C)(C1)C2O	ZINC000000209546	C1NCC2CNCC1C2
CCOc4ccc(C[N@]3CC[C@@H](c1nn(CCN(C)C)c2ncccc12)C3)cc4	ZINC000019533197	C2CN(Cc1ccccc1)CC2c3n[nH]c4ncccc34
OC(=O)[C@@H]2CS[C@@H](c1cccnc1)N2	ZINC000000295209	C2CSC(c1cccnc1)N2
C3CN=C(C[C@@H](c1ccccc1)c2ccccn2)N3	ZINC000000000505	C3CN=C(CC(c1ccccc1)c2ccccn2)N3
CN(C)c3ccc([N+](=O)CC(=O)c2ccc(C(=O)C[N+](=O)c1ccc(N(C)C)cc1)cc2)cc3	ZINC000013402582	O=C(C[N+](=O)c1ccccc1)c3ccc(C(=O)C[N+](=O)c2ccccc2)cc3
FC(F)(F)c4cccc(N3CCN(CCn1c(=O)oc2cccnc12)CC3)c4	ZINC000000604423	O=c2oc1cccnc1n2CCN4CCN(c3ccccc3)CC4
CN(C)CCn1cnc2ccccc12	ZINC000000315185	c2ccc1[nH]cnc1c2
C[C@@H](O)CN(C[C@@H](C)O)Cc1ccc(Cl)cc1	ZINC000000279195	c1ccccc1
Fc3ccc(OCC2CCN(CC1CC1)CC2)cc3	ZINC000000013938	C1CC1CN3CCC(COc2ccccc2)CC3
COC(=O)c2ccc(CN1CCCC1)o2	ZINC000000315188	C2CCN(Cc1ccco1)C2
CCCCCCCCC[C@@H]1CC(=O)NCCCNCCCCNCCCN1	ZINC000008234352	O=C1CCNCCCNCCCCNCCCN1
CCC(=O)Nc1cccc(N(=O)=O)c1C	ZINC000000038762	c1ccccc1
Fc3ccc2c(C1CCNCC1)noc2c3	ZINC000000383926	C3CC(c1noc2ccccc12)CCN3
COc3cc2ncnc(N1CCN(C)CC1)c2cc3OC	ZINC000000116766	C3CN(c1ncnc2ccccc12)CCN3
Clc3ccc(C(=O)Nc2nnc(c1ccccc1)o2)cc3Cl	ZINC000000052227	O=C(Nc2nnc(c1ccccc1)o2)c3ccccc3
CN(C)CCSc1nnnn1c2ccccc2	ZINC000000090514	c2ccc(n1cnnn1)cc2
CC(C)(C)c2cc(C(=O)N1CCCNCC1)cc(C(C)(C)C)c2O	ZINC000000004734	O=C(N1CCCNCC1)c2ccccc2
COc4ccc(c3noc(CN2CCC(C(=O)NCCN1CCCC1)CC2)n3)cc4OC	ZINC000020940412	O=C(NCCN1CCCC1)C4CCN(Cc3nc(c2ccccc2)no3)CC4
C[C@H]2C[n+]1c(C)cc(C)nc1S2	ZINC000000247160	C2C[n+]1cccnc1S2
CCCn2c(N1CCNCC1)nc3n(C)c(=O)n(CCC)c(=O)c23	ZINC000000042960	O=c3[nH]c(=O)c2[nH]c(N1CCNCC1)nc2[nH]3
CC(C)OC(=O)c2ccc(NC(=O)Cc1ccc(Cl)cc1)cc2	ZINC000000048554	O=C(Cc1ccccc1)Nc2ccccc2
NN=c2c1ccccc1c3ccccc23	ZINC000000045244	N=c2c1ccccc1c3ccccc23
Nc2cc(Cl)c(NC1=NCCN1)c(Cl)c2	ZINC000000020231	C2CN=C(Nc1ccccc1)N2
CC(C)(C)NC[C@@H](O)c1ccc(O)c(CO)c1	ZINC000000020230	c1ccccc1
CCN(CC)CCNC(=O)c4ccc(Nc2ccnc3cc1ccccc1cc23)cc4	ZINC000035183257	N(c1ccccc1)c3ccnc4cc2ccccc2cc34
CCN(CC)Cc1cc(Cl)nc(Cl)c1	ZINC000000163067	c1ccncc1
CC(C)(C)c2cc[n+](Cc1cc(Cl)nc(Cl)c1)cc2	ZINC000000163060	C(c1ccncc1)[n+]2ccccc2
CCN(CC)CCOc2ccc(C[N@@](C)C[C@@H](C)CCC1=C(C)CCCC1(C)C)cc2	ZINC000008612747	C(CCC1=CCCCC1)CNCc2ccccc2
O=c4c(CN1CCC3(CC1)C=Cc2ccccc23)coc5ccccc45	ZINC000000217225	O=c4c(CN1CCC3(CC1)C=Cc2ccccc23)coc5ccccc45
CCOc1ccccc1NC(C)=O	ZINC000000030083	c1ccccc1
CC(=O)Nc2ccc(C(=O)Nn1cnnc1)cc2	ZINC000000030082	O=C(Nn1cnnc1)c2ccccc2
CC(=O)N(Cc1ccccc1)c2ccccn2	ZINC000000030085	C(Nc1ccccn1)c2ccccc2
CC(=O)N2CCN(c1ccccc1)CC2	ZINC000000030084	C2CN(c1ccccc1)CCN2
Cc2cccc(NC(=O)c1c(N)cnn1C)c2	ZINC000000040707	O=C(Nc1ccccc1)c2ccn[nH]2
NC(=N)N1CCSCC1	ZINC000000152859	C1CSCCN1
OC(=O)c1ccccc1NCN3C(=O)[C@@H]2CC=C(Cl)C[C@@H]2C3=O	ZINC000000099033	O=C2C1CC=CCC1C(=O)N2CNc3ccccc3
C[N+]3(C)CC[C@H](OC(=O)[C@@](O)(C1CCCC1)c2ccccc2)C3	ZINC000000000346	O=C(OC1CCNC1)C(C2CCCC2)c3ccccc3
CO[C@H]1CCCC[C@H]1NCc2cc(OC)c(OC)c(OC)c2	ZINC000000267281	C2CCC(NCc1ccccc1)CC2
CC2CCC([N@]1CCC[C@@H](O)C1)CC2	ZINC000000221483	C2CCC(N1CCCCC1)CC2
Cn2nc(c1ccccc1)[nH]c2=O	ZINC000000164637	O=c2[nH]nc(c1ccccc1)[nH]2
COc2cc(N1CCNCC1)cc(OC)c2OC	ZINC000000155446	C2CN(c1ccccc1)CCN2
Cc3cc(C)n2c(NC(C)(C)C)c(c1ccc(F)cc1)nc2c3	ZINC000000320298	c3ccc(c2cn1ccccc1n2)cc3
Clc3ccc(N1C[C@@H]2CC[C@H](C1)N2)nn3	ZINC000000007429	C2CC3CN(c1cccnn1)CC2N3
C[N@@](CC2CCN(CCc1ccc(Cl)cc1)CC2)Cc3c(C)nn(C)c3Cl	ZINC000012298051	C2CN(CCc1ccccc1)CCC2CNCc3cn[nH]c3
COC(=O)c1c[n+](C)ccc1SC	ZINC000000335004	c1ccncc1
CC1(C)OCO/C1=C\C[N+](C)(C)C	ZINC000000123406	C=C1COCO1
CN3CCC(OC(=O)c2cc1ccccc1oc2=O)CC3	ZINC000000108207	O=C(OC1CCNCC1)c3cc2ccccc2oc3=O
Cn4c3C(=O)N(CCCN2CCN(c1ccccc1)CC2)CCc3c5ccccc45	ZINC000000597292	O=C3N(CCCN2CCN(c1ccccc1)CC2)CCc4c3[nH]c5ccccc45
Clc1ccccc1C(=O)Nc2ccc(C#N)c(Cl)c2	ZINC000000030304	O=C(Nc1ccccc1)c2ccccc2
Cc1coc(CC[N+](C)(C)C)c1	ZINC000000123403	c1ccoc1
CC(C)CCNC(=O)c1ccc(NC(C)=O)cc1	ZINC000000030403	c1ccccc1
COc3ccc([C@H]2CC(c1cc(OC)cc(OC)c1)=NC(=N)N2)cc3	ZINC000000031979	N=C3NC(c1ccccc1)CC(c2ccccc2)=N3
Cc3c(N(=O)=O)c(C(=O)N2CC[N@]1CCC[C@@H]1C2)nn3C	ZINC000000371771	O=C(N2CCN1CCCC1C2)c3cc[nH]n3
CN(C)c6ccc(C5=NN(c3ccc(c2sc1ccccc1[s+]2)cc3)[C@@H](c4ccccc4)C5)cc6	ZINC000009244873	C5C(c1ccccc1)N(c4ccc(c3sc2ccccc2[s+]3)cc4)N=C5c6ccccc6
C4CCN(CCCNCc2cc(c1ccccc1)cn3nnnc23)CC4	ZINC000012224355	C4CCN(CCCNCc2cc(c1ccccc1)cn3nnnc23)CC4
CCCNC(=O)CN	ZINC000004205485	nonring
CN(C)CCOc3ccc2c(c1ccccc1)cc(=O)oc2c3	ZINC000000407228	O=c3cc(c1ccccc1)c2ccccc2o3
Nc5nc4cc3N(Cc2ccc(S(=O)(=O)c1ccccc1)cc2)CCCc3cc4[nH]5	ZINC000000605223	O=S(=O)(c1ccccc1)c5ccc(CN3CCCc4cc2[nH]cnc2cc34)cc5
O=C1CCn2cnc4cccc3ccc1c2c34	ZINC000000041157	O=C1CCn2cnc4cccc3ccc1c2c34
O[C@H]2C1CCN(CC1)[C@H]2C(c3ccc(F)cc3)c4ccc(F)cc4	ZINC000000401592	C1CN2CCC1CC2C(c3ccccc3)c4ccccc4
Cc3ccc(S(=O)(=O)Cc2sc1ccccc1[n+]2C)cc3	ZINC000000296885	O=S(=O)(Cc2nc1ccccc1s2)c3ccccc3
FC(F)(F)c4ccc3c(Nc1ccccc1C(=O)OCCN2CCCC2)ccnc3c4	ZINC000000537734	O=C(OCCN1CCCC1)c2ccccc2Nc3ccnc4ccccc34
NCCCN4C(=O)[C@@H](CN)N=C(c1ccccc1)c5cc(N(Cc2ccccc2)Cc3ccccc3)ccc45	ZINC000026485026	O=C5CN=C(c1ccccc1)c4cc(N(Cc2ccccc2)Cc3ccccc3)ccc4N5
NCCc3ccc(NC(=O)c2ccc(C(=O)Nc1ccc(CCN)cc1)c(N)c2)cc3	ZINC000001724329	O=C(Nc1ccccc1)c3ccc(C(=O)Nc2ccccc2)cc3
CCc2ccc(C1=NCCN1)cc2	ZINC000000007353	C2CN=C(c1ccccc1)N2
Oc3c(CNC1CCCCC1)cc(CNC2CCCCC2)cc3CNC4CCCCC4	ZINC000004706018	C4CCC(NCc3cc(CNC1CCCCC1)cc(CNC2CCCCC2)c3)CC4
Cc5cccc(N4CCN(C(=O)CC[N@]3C[C@H](c1ccccc1F)Oc2ccccc2C3)CC4)n5	ZINC000012042619	O=C(CCN3CC(c1ccccc1)Oc2ccccc2C3)N5CCN(c4ccccn4)CC5
CC[N+](C)(C)CCN(CC[N+](C)(C)CC)c1ccccc1	ZINC000005333376	c1ccccc1
COCCN3CCC(C[N@](Cc1ccncc1)Cc2ccoc2)CC3	ZINC000011816927	C3CC(CN(Cc1ccncc1)Cc2ccoc2)CCN3
CN(C)CCC[C@]3(O)c1ccccc1CSc2sccc23	ZINC000000347400	C2Sc1sccc1Cc3ccccc23
COc4cc3CC[C@@H]([N@@](C)Cc1ccccc1O)c2cc(=O)c(OC)ccc2c3c(OC)c4OC	ZINC000000689682	O=c1cccc4c(c1)C(NCc2ccccc2)CCc3ccccc34
CN(C)CCNC(=O)c4coc(CN3CCN(C(c1ccccc1)c2ccccc2)CC3)n4	ZINC000034684548	C3CN(C(c1ccccc1)c2ccccc2)CCN3Cc4ncco4
NC[C@@H](c1ccc[nH]1)C(F)(F)F	ZINC000000110298	c1cc[nH]c1
CC(=O)Nc3cccc(c2cc(=O)c1ccccc1o2)c3O	ZINC000000034370	O=c2cc(c1ccccc1)oc3ccccc23
C[C@H](CNC1CCCCC1)OC(=O)c2ccccc2	ZINC000000000365	O=C(OCCNC1CCCCC1)c2ccccc2
COc4ccc(CC[N@@](CC1CCN(C)CC1)Cc2cccn2c3ccccn3)cc4	ZINC000012436361	C4CC(CN(CCc1ccccc1)Cc2cccn2c3ccccn3)CCN4
CCOc1ccc(Br)cc1C[N+]2(C)CCOCC2	ZINC000000544622	C2CN(Cc1ccccc1)CCO2
CCOC(=O)c1c(C)c(C)sc1N	ZINC000000081475	c1ccsc1
C[C@H](N)Cn2ccc3ccc1cnccc1c23	ZINC000000025579	c3cc2c(ccc1cc[nH]c12)cn3
CCOc2cc(\C=N/c1ccc(NC(C)=O)cc1)cc(Cl)c2OC	ZINC000000359554	C(=Nc1ccccc1)c2ccccc2
Cc4ccc(C)c(N3CCN(Cc2ccc(c1ccc(Cl)cc1)o2)CC3)c4	ZINC000000756650	C2CN(c1ccccc1)CCN2Cc4ccc(c3ccccc3)o4
CCOC(=O)c1c(C)n(C)c2cc(CN(C)C)c(O)c(CN(C)C)c12	ZINC000000190254	c2ccc1[nH]ccc1c2
Clc1ccccc1NC(=O)CSc3nccc(c2ccco2)n3	ZINC000000172383	O=C(CSc2nccc(c1ccco1)n2)Nc3ccccc3
COCCNC1CC1	ZINC000019282257	C1CC1
CNC1(COC)CC1	ZINC000019092817	C1CC1
Cc4ccc(NC(=O)[C@@H](NCc2ccc(CN1CCCC1)cc2)c3ccccc3)cc4	ZINC000014199166	O=C(Nc1ccccc1)C(NCc3ccc(CN2CCCC2)cc3)c4ccccc4
CCCCNC1=NCCN1	ZINC000001668216	C1CN=CN1
NCCc2c[nH]c3ccc(Cc1nc(N)no1)cc23	ZINC000000014696	C(c2ccc1[nH]ccc1c2)c3ncno3
Cc3ccc(S(=O)(=O)N2CCN(C(=O)CN1CCCC1)C2)cc3	ZINC000000048959	O=C(CN1CCCC1)N3CCN(S(=O)(=O)c2ccccc2)C3
CN(N[C@@H]1OC(=O)c2ccccc12)c3cc(C(F)(F)F)cc(C)n3	ZINC000000142869	O=C2OC(NNc1ccccn1)c3ccccc23
COc3cc(\C=c1\c(=O)[nH]c2ccc(Br)cc12)ccc3O	ZINC000000086886	O=c2[nH]c1ccccc1c2=Cc3ccccc3
CN(C)CCNC(=O)NCC(CCCN2CCC(O)(c1ccc(Cl)cc1)CC2)(c3ccccc3)c4ccccc4	ZINC000027214553	C(CC(c1ccccc1)c2ccccc2)CN4CCC(c3ccccc3)CC4
CC(C)CC[N@@](C)C2CCN(S(=O)(=O)c1ccc(C)cc1)CC2	ZINC000000261601	O=S(=O)(N1CCCCC1)c2ccccc2
CCN(CC)c2nc1ccccc1n3cnnc23	ZINC000000012507	c1ccc3c(c1)ncc2nncn23
Nc2ccc(OC[C@@H](O)C[n+]1ccccc1)cc2	ZINC000000028255	C(COc1ccccc1)C[n+]2ccccc2
CCN(CC)Cc3cc(Nc1ccnc2cc(Cl)ccc12)ccc3O	ZINC000000608172	N(c1ccccc1)c2ccnc3ccccc23
O=C(CN1CCCCCC1)Nc2sccc2C#N	ZINC000000127954	O=C(CN1CCCCCC1)Nc2cccs2
C=CCN1CCC(=O)Nc2ccccc12	ZINC000000084330	O=C2CCNc1ccccc1N2
CC(=O)O[C@H]1C[C@H]2CCC[C@@H]1N2	ZINC000000012509	C1CC2CCC(C1)N2
CN(C)C(=O)Oc3ccc(OCc2c[n+]1ccccc1n2C)cc3	ZINC000000387385	C(Oc1ccccc1)c3c[n+]2ccccc2[nH]3
O=C2C[C@@H](N1CCCCC1)C=C2Nc3ccccc3	ZINC000000118195	O=C2CC(N1CCCCC1)C=C2Nc3ccccc3
CCSc1sc(CN(C)C)cc1\C=N\O	ZINC000000042380	c1ccsc1
OC(=O)c2cc(=O)c1ccsc1[nH]2	ZINC000000013110	O=c1cc[nH]c2sccc12
COc2cccc(CNCCCNCc1cccc(OC)c1O)c2O	ZINC000001760877	C(CNCc1ccccc1)CNCc2ccccc2
CC[C@H](C)[C@H](N)C(=O)Nc1ccncc1	ZINC000000025491	c1ccncc1
CC(=O)O[C@@H](CN1CCCC1)C(C)(C)C	ZINC000000106432	C1CCNC1
C[C@@H](CN(C)C)Oc2ccc(C[N@@](C)[C@H](C)CCC1=C(C)CCCC1(C)C)cc2	ZINC000004683514	C2CCC(CCCNCc1ccccc1)=CC2
OCCCNCCN(Cc1ccccc1)Cc4cccc(CN(Cc2ccccc2)Cc3ccccc3)n4	ZINC000027763434	C(NCc3cccc(CN(Cc1ccccc1)Cc2ccccc2)n3)c4ccccc4
Cn3c(=O)n(C)c4cc(CNCc1ccccc1OC[C@@H](O)CN2CCCCC2)ccc34	ZINC000014952646	O=c4[nH]c3ccc(CNCc1ccccc1OCCCN2CCCCC2)cc3[nH]4
Oc1ccccc1[C@H](CC(=O)N2CCCCC2)N3CCCCC3	ZINC000000191028	O=C(CC(N1CCCCC1)c2ccccc2)N3CCCCC3
Cc3cc(C)c(S(=O)(=O)N2CCN(c1ccccc1)CC2)c(C)c3	ZINC000000101517	O=S(=O)(N2CCN(c1ccccc1)CC2)c3ccccc3
CCCCc1nc(C)cc(NCCCCCCN)n1	ZINC000008731077	c1cncnc1
O[C@@]12CCCC[C@@H]1CNCC2	ZINC000000103395	C2CCC1CNCCC1C2
CCN(CC)CCOc1ccccc1C=O	ZINC000000153440	c1ccccc1
Clc3ccc(NC(=O)CN1CCCc2ccccc12)cc3Cl	ZINC000000031570	O=C(CN1CCCc2ccccc12)Nc3ccccc3
CCNC(=O)CN(CC)CC	ZINC000034549410	nonring
Brc1cccc(C(=O)N(CC#N)CC#N)c1	ZINC000000029877	c1ccccc1
COc1cccc(OC)c1C(=O)N(CC#N)CC#N	ZINC000000029308	c1ccccc1
C[C@H]2N(CC1=NCCN1)Cc3ccccc23	ZINC000000024559	C3CN=C(CN2Cc1ccccc1C2)N3
Cn3c(CN(C(=O)CN1CCCC1)c2ccccc2)c(C#N)c4ccccc34	ZINC000000862822	O=C(CN1CCCC1)N(Cc3cc2ccccc2[nH]3)c4ccccc4
Cc2cc(S(N)(=O)=O)c1ncccc1c2	ZINC000000032956	c2ccc1ncccc1c2
Cc1ccccc1C(=O)N2CCCC[C@@H]2CO	ZINC000000029301	O=C(N1CCCCC1)c2ccccc2
CC[C@@H](C)NCC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000000174588	c1ccccc1
C[C@@H]3CCC[C@@H](N2CCN(C(=O)c1ccccc1)CC2)C3	ZINC000000316986	O=C(N2CCN(C1CCCCC1)CC2)c3ccccc3
CCN(CC)CCCNCC[C@H]([C@@H]1CCOC(C)(C)C1)c2ccccc2	ZINC000005347810	C2CC(Cc1ccccc1)CCO2
CN5CCN(c3c1CCCc1c(C#N)c4nc2ccccc2n34)CC5	ZINC000000135264	C5Cc4cc2nc1ccccc1n2c(N3CCNCC3)c4C5
CN(C)CCCNC(=O)CSc2nc1ccccc1n2CC(=O)CCCN(C)C	ZINC000005333804	c2ccc1[nH]cnc1c2
O=C(Cn1c(=O)sc2ccccc12)O[C@@H](C(=O)c3ccccc3)c4ccccc4	ZINC000000626173	O=C(Cn1c(=O)sc2ccccc12)OC(C(=O)c3ccccc3)c4ccccc4