CN(C)CCN2C(=O)N[C@@](C)(c1ccc(N(=O)=O)cc1)C2=O	ZINC000000181425	O=C2NC(c1ccccc1)C(=O)N2
Nc2cc(SCc1cccnc1)nc(N)n2	ZINC000000125124	C(Sc1ccncn1)c2cccnc2
Fc1cccc(Cl)c1CSc2ccccc2C3=NCCCN3	ZINC000000139184	C3CNC(c1ccccc1SCc2ccccc2)=NC3
COc1ccccc1CNc3ccc2n(C)cnc2c3	ZINC000000170024	C(Nc2ccc1[nH]cnc1c2)c3ccccc3
C[C@@H](Cc1ccccc1)NC(O)=NS(=O)(=O)c2ccc(C)cc2	ZINC000000002199	O=S(=O)(N=CNCCc1ccccc1)c2ccccc2
C3CCCN(C2CCN(Cc1ccccn1)CC2)CC3	ZINC000000207669	C3CCCN(C2CCN(Cc1ccccn1)CC2)CC3
CCOC(=O)COc2c(Br)cc(C=c1c(=O)[nH]c(=S)n(C)c1=O)cc2OCC	ZINC000001097014	O=c1[nH]c(=S)[nH]c(=O)c1=Cc2ccccc2
COc3cccc(C(=O)N2CCC(N1CCCCC1)(C(N)=O)CC2)c3	ZINC000000153848	O=C(N2CCC(N1CCCCC1)CC2)c3ccccc3
CCOC(=O)c1cc(C)sc1NC(=O)c2cccc(OC)c2N(=O)=O	ZINC000000575814	O=C(Nc1cccs1)c2ccccc2
CCN(CC)c3ccc([C@@H]2NC(=O)c1ccccc1N2)cc3	ZINC000000035056	O=C2NC(c1ccccc1)Nc3ccccc23
Nc2ccc(N1CCCCC1)cc2	ZINC000000152886	C2CCN(c1ccccc1)CC2
CCCN(CCC)C(=O)Cc2c(c1ccc(Cl)cc1)nc3ccc(Cl)cn23	ZINC000000599598	c3ccc(c2cn1ccccc1n2)cc3
COc2ccc(C(=O)OCC(=O)Nc1ccc(Cl)cc1)cc2OC	ZINC000000131828	O=C(COC(=O)c1ccccc1)Nc2ccccc2
N#Cc2ccc(N1CCNCC1)nc2	ZINC000000127156	C2CN(c1ccccn1)CCN2
COc2ccc(Nc1nc(NN)nc(OCC(F)(F)F)n1)cc2	ZINC000000032710	N(c1ccccc1)c2ncncn2
CNCc4ccc(c1[nH]c3cc(F)cc2C(=O)NCCc1c23)cc4	ZINC000000025958	O=C2NCCc3c(c1ccccc1)[nH]c4cccc2c34
Cc1ccccc1N4CCN(CCc3nnc2CCCCn23)CC4	ZINC000000001246	C1CCn2c(C1)nnc2CCN4CCN(c3ccccc3)CC4
NC(=O)C3(N1CCCCC1)CCN(C(=O)N2CCOCC2)CC3	ZINC000000109525	O=C(N1CCOCC1)N3CCC(N2CCCCC2)CC3
COc3ccc2[nH]c1nc(SCCN(C)C)nnc1c2c3	ZINC000000175145	c1ccc2c(c1)[nH]c3ncnnc23
C[C@@H](N)Cc1cn(C)c2ccccc12	ZINC000000204378	c2ccc1[nH]ccc1c2
CC(C)CN(CC(C)C)Cn1c(=O)oc2ccccc12	ZINC000000174948	O=c2[nH]c1ccccc1o2
C[C@@H](Oc2ccc(c1ccccc1)cc2)C(=O)Nc4ccc(S(=O)(=O)Nc3ccccn3)cc4	ZINC000000935607	O=C(COc2ccc(c1ccccc1)cc2)Nc4ccc(S(=O)(=O)Nc3ccccn3)cc4
COc3ccc(C[C@H]1NCC[C@@]2(O)CCCC[C@H]12)cc3	ZINC000000191928	C1CCC2C(C1)CCNC2Cc3ccccc3
CC(C)(C)NCC(=O)Nc1nccs1	ZINC000000326260	c1cscn1
CNc1nc(N(C)C)nc(N(C)C)n1	ZINC000000001900	c1ncncn1
NC(=O)c1ccc[n+](CC#N)c1	ZINC000000401939	c1ccncc1
O=C2CS[C@@H](c1cccc(N(=O)=O)c1)N2CCN3CCCCC3	ZINC000000208069	O=C2CSC(c1ccccc1)N2CCN3CCCCC3
C3CNCc2cc1ccccc1n2C3	ZINC000000000983	C3CNCc2cc1ccccc1n2C3
Cc2ccc(NC(=O)CN1CCC(C(N)=O)CC1)cc2	ZINC000000299685	O=C(CN1CCCCC1)Nc2ccccc2
O=C2NCCn3c(c1ccccc1)nc4cccc2c34	ZINC000000026816	O=C2NCCn3c(c1ccccc1)nc4cccc2c34
CN(OC(C)(C)C)C(=O)[C@@H](CO[P@@](O)(=O)OC[C@H](O)CO)NC(=O)OC(C)(C)C	ZINC000026522611	nonring
COc2cc(NC(=O)CCS(=O)(=O)c1ccccc1)cc(OC)c2	ZINC000000223711	O=C(CCS(=O)(=O)c1ccccc1)Nc2ccccc2
CC2(C)CC(NCC(=O)OC1CCCCC1)CC(C)(C)N2	ZINC000000052222	O=C(CNC1CCNCC1)OC2CCCCC2
COC(=O)C1CC(C(=O)OC)CC(C(=O)OC)C1	ZINC000000056800	C1CCCCC1
NC(=N)N3CCC([C@@H](NS(=O)(=O)Cc1ccccc1)C(=O)NCC(=O)N[C@H]2CCCN(C(N)=N)[C@@H]2O)CC3	ZINC000027857754	O=C(CNC(=O)C(NS(=O)(=O)Cc1ccccc1)C2CCNCC2)NC3CCCNC3
COc4ccc3n(=O)ccc([C@@H](O)[C@@H]1C[C@@H]2CC[N@@]1C[C@H]2C=C)c3c4	ZINC000000398047	O=n3ccc(CC1CC2CCN1CC2)c4ccccc34
COc2ccc1n(CO)c(=O)n(CO)c1c2	ZINC000000033998	O=c2[nH]c1ccccc1[nH]2
CN3CCN(c2ccc(C(=O)c1ccc(F)cc1)cc2)CC3	ZINC000000129115	O=C(c1ccccc1)c3ccc(N2CCNCC2)cc3
CC(C)(C)OC(=O)N1CC[C@@H](N)C1	ZINC000000403623	C1CCNC1
COc1ccccc1c3nnc(SCCN2CCCCC2)n3C	ZINC000000411947	C3CCN(CCSc2nnc(c1ccccc1)[nH]2)CC3
Brc3ccc2nc1CCCCc1n2c3	ZINC000000115904	C1CCc2c(C1)nc3ccccn23
CC(C)O[C@H]3C[C@@H]1CCCC[N+]1(Cc2ccccc2)O3	ZINC000000164095	C3CC[N+]2(Cc1ccccc1)OCCC2C3
CCOC(=O)CC(=O)N1CCS[C@H]1COc2ccccc2OC	ZINC000000003986	C2CSC(COc1ccccc1)N2
CN3CCN(c2ccc(NC(=O)COc1ccc(C)cc1)cc2)CC3	ZINC000000360000	O=C(COc1ccccc1)Nc3ccc(N2CCNCC2)cc3
CC(C)(C)NC[C@@H](O)c1cc(Cl)c(N)c(Cl)c1	ZINC000000057262	c1ccccc1
Cc1nccn1CCCN2C(=O)CNC2=S	ZINC000000481630	O=C1CNC(=S)N1CCCn2ccnc2
Clc5ccc([C@@]4(Cn1ccnc1)OC[C@H](COc3ccc(c2ccccc2)cc3)O4)c(Cl)c5	ZINC000000607832	C(Oc2ccc(c1ccccc1)cc2)C5COC(Cn3ccnc3)(c4ccccc4)O5
CC(C)c1cc(I)ccc1NC(=O)CSc2nc(N)cc(N)n2	ZINC000000622458	O=C(CSc1ncccn1)Nc2ccccc2
CC(=O)Nn2cc1n(C)c(=O)n(C)c(=O)c1c2	ZINC000000189009	O=c2[nH]c(=O)c1c[nH]cc1[nH]2
CC(C)(CO)NCc1cccs1	ZINC000000359877	c1ccsc1
CC(C)(CO)NCc1ccc(F)cc1	ZINC000000359878	c1ccccc1
O=C(CCN1CCCC1)NC[C@@H]2OCCc3ccccc23	ZINC000000118778	O=C(CCN1CCCC1)NCC2OCCc3ccccc23
Cc2cc(=O)oc3cc(NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)CCC(O)=O)ccc23	ZINC000013523034	O=C(Nc2ccc1ccc(=O)oc1c2)C3CCCN3
C[C@@H](NCCn2c(=O)n(C)c1ncn(C)c1c2=O)c3ccccc3	ZINC000000033849	O=c2[nH]c1nc[nH]c1c(=O)n2CCNCc3ccccc3
Cc2ccc(S(=O)(=O)NCCc1ccc(Cl)cc1)cc2	ZINC000000036016	O=S(=O)(NCCc1ccccc1)c2ccccc2
Cc1cc(C(F)(F)F)cc(NN)n1	ZINC000000159611	c1ccncc1
Clc2ccc(CCNC(=O)c1ccc(Cl)cc1Cl)cc2	ZINC000000036010	O=C(NCCc1ccccc1)c2ccccc2
CCOC(=O)N1CCN(C[C@@H](C)CCC=C(C)C)CC1	ZINC000000218858	C1CNCCN1
CN(C)CC(=O)Nc1ccc(Cl)cc1	ZINC000000310609	c1ccccc1
CC(C)(C)c3nc(CN1CCCCC1)cc(CN2CCCCC2)c3O	ZINC000000186649	C3CCN(Cc2ccnc(CN1CCCCC1)c2)CC3
Nc2nc(S(=O)(=O)c1ccccc1)c(Cl)s2	ZINC000000039779	O=S(=O)(c1ccccc1)c2cscn2
Cc2cc(=O)oc3cc(NC(=O)[C@@H](N)Cc1ccccc1)ccc23	ZINC000000391857	O=C(CCc1ccccc1)Nc3ccc2ccc(=O)oc2c3
O=C(Cn2c(=O)c1ccc(N(=O)=O)cc1c2=O)N3CCCCC3	ZINC000000069861	O=C(Cn2c(=O)c1ccccc1c2=O)N3CCCCC3
COc3ccc(S(=O)(=O)Nc1cccnc1Nc2ccc(O)cc2)cc3	ZINC000000598089	O=S(=O)(Nc1cccnc1Nc2ccccc2)c3ccccc3
CN(C)c3nc(NCn2c(=O)c1ccccc1c2=O)nc(N(C)C)n3	ZINC000000495150	O=c2n(CNc1ncncn1)c(=O)c3ccccc23
C4Cc1c([nH]c2ccccc12)C3(CCNCC3)N4	ZINC000000156252	C4Cc1c([nH]c2ccccc12)C3(CCNCC3)N4
Cc3cc2c(=N)[nH]c1ccccc1[nH]c2s3	ZINC000000058203	N=c2[nH]c1ccccc1[nH]c3sccc23
CN(C)CCn1c(C#N)cc2ccccc12	ZINC000000129803	c2ccc1[nH]ccc1c2
COC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc2cn(Sc1ccccc1N(=O)=O)c3ccccc23	ZINC000026815790	S(c1ccccc1)n2ccc3ccccc23
Cc2cc(C)c(S(=O)(=O)NC1CC(C)(C)NC(C)(C)C1)cc2C	ZINC000000079781	O=S(=O)(NC1CCNCC1)c2ccccc2
CC(C)(C)OC(=O)N1C[C@@H]2C[C@H]1CN2	ZINC000000403198	C1NC2CNC1C2
Cc3cc(C)n2nc(c1ccccc1)cc2[n+]3c4ccccc4	ZINC000000124373	c4ccc(c3cc2[n+](c1ccccc1)cccn2n3)cc4
CN4CCN(c3cc(C)c2cc(NC(=O)CCC(=O)NCCCN1CCCC1)ccc2n3)CC4	ZINC000020136285	O=C(CCC(=O)Nc3ccc2nc(N1CCNCC1)ccc2c3)NCCCN4CCCC4
CC(C)N3CCC(n1nnc2ccccc12)CC3	ZINC000000171249	C3CC(n1nnc2ccccc12)CCN3
CNc2cc(C)nc(NCc1ccccc1)n2	ZINC000000073447	C(Nc1ncccn1)c2ccccc2
CN2[C@@H]([N+](=O)Cc1ccccc1)C(C)(C)SC2=S	ZINC000000070542	O=[N+](Cc1ccccc1)C2CSC(=S)N2
Cc3cccc(NC(=O)CCN2CCN(c1ccccc1F)CC2)c3	ZINC000000255177	O=C(CCN2CCN(c1ccccc1)CC2)Nc3ccccc3
Cc3ccc(OCC(=O)N2CCC(N1CCCC1)CC2)cc3	ZINC000000316569	O=C(COc1ccccc1)N3CCC(N2CCCC2)CC3
COC(=O)[C@@H](Cc1ccc(O)c(O)c1)/N=C/c2ccc(N(C)C)cc2	ZINC000000517863	C(Cc1ccccc1)N=Cc2ccccc2
Clc2cccc(NC(=O)CN1CCCC1)c2	ZINC000000050238	O=C(CN1CCCC1)Nc2ccccc2
CN(C)CCNC(=O)[C@@H]3C[C@H](COc1cccc(C(F)(F)F)c1)C[N@](Cc2nccn2C)C3	ZINC000014752317	C3CC(COc1ccccc1)CN(Cc2ncc[nH]2)C3
O=[N+](Cc1c[nH]c2ccccc12)c3ccccc3	ZINC000000079148	O=[N+](Cc1c[nH]c2ccccc12)c3ccccc3
CC(=O)OC(C)(C)C#CCN1CCCC1	ZINC000000080635	C1CCNC1
COc2ccc(\C=N\NC(=O)c1cc(O)c(O)c(O)c1)cc2Cn3cnc(N(=O)=O)n3	ZINC000008873231	O=C(NN=Cc2cccc(Cn1cncn1)c2)c3ccccc3
CN(C)\C=N\c2ccn(Cc1ccccc1)c(=O)c2C#N	ZINC000000208480	O=c1ccccn1Cc2ccccc2
CC[N@]1CCc2c(C1)sc(N)c2C(=O)OC	ZINC000000265910	C2Cc1ccsc1CN2
NCCc2ccc1OCOc1c2	ZINC000000259006	C2Oc1ccccc1O2
CCOc2ccc(S(=O)(=O)NCc1ccncc1)cc2	ZINC000000038956	O=S(=O)(NCc1ccncc1)c2ccccc2
N[C@@H](Cc1ccc(O)cc1)C(=O)NO	ZINC000000009568	c1ccccc1
COc2ccc(C[C@@H]1NC[C@@H](O)[C@@H]1OC(C)=O)cc2	ZINC000000402718	C2CNC(Cc1ccccc1)C2
Clc2ccc(CCNC1=NCCS1)cc2	ZINC000000100334	C(Cc1ccccc1)NC2=NCCS2
COc2nc(Nc1ccc(Cl)cc1)nc(OC)n2	ZINC000000033069	N(c1ccccc1)c2ncncn2
CNC(=O)[C@H]2O[C@H](OCc1ccccc1)[C@H](NC(C)=O)[C@@H](O[C@@H](C)C(O)=O)[C@@H]2OC(C)=O	ZINC000012652941	C2CCC(OCc1ccccc1)OC2
Nc3c(Cl)cc(C(=O)N[C@H]1CN2CCC1CC2)c4OCCc34	ZINC000000005108	O=C(NC1CN2CCC1CC2)c4cccc3CCOc34
COc1ccccc1N2C(=N)NC(=N)NC23CCCCC3	ZINC000000146413	N=C3NC(=N)N(c1ccccc1)C2(CCCCC2)N3
COc3ccc2[nH]cc(C[C@@H]1CCC[N@]1C)c2c3	ZINC000000005452	C3CNC(Cc1c[nH]c2ccccc12)C3
NC(=O)CC[n+]1cccc(C#N)c1	ZINC000000393985	c1ccncc1
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
CN(C)CCc2c[nH]c3ccc(C[C@@H]1COC(=O)N1)cc23	ZINC000000005298	O=C3NC(Cc2ccc1[nH]ccc1c2)CO3
C4CCN(CCn2c(/N=C/c1cccs1)nc3ccccc23)CC4	ZINC000000196168	C4CCN(CCn2c(N=Cc1cccs1)nc3ccccc23)CC4
COc3ccc(C(=O)OC1C[C@@H]2CC[C@H](C1)N2)cc3OC	ZINC000000086170	O=C(OC1CC2CCC(C1)N2)c3ccccc3
CCN(CC)CCNc2ncnc3sc1COC(C)(C)Cc1c23	ZINC000000550138	C1Cc2c(CO1)sc3ncncc23
COc3ccc(NC(=O)c2ccc(c1ccncc1)cc2)cc3N4CCN(C)CC4	ZINC000000606494	O=C(Nc2cccc(N1CCNCC1)c2)c4ccc(c3ccncc3)cc4
Cc2nnc(SCC(=O)N1CCOCC1)s2	ZINC000000036120	O=C(CSc1nncs1)N2CCOCC2
CC(=O)Cn2c(=O)c1ccccc1c2=O	ZINC000000036650	O=c1[nH]c(=O)c2ccccc12
CC(C)(C)[N@]2CCO[C@H](c1ccc(N)nc1)C2	ZINC000000005293	C2COC(c1cccnc1)CN2
CCOC(=O)c1c(CNC(C)C)oc2ccc(OC)cc12	ZINC000000036656	c2ccc1occc1c2
NC(=N)NCCC(=O)N4CCN(C(=O)[C@H](Cc1cccc(C(N)=N)c1)NS(=O)(=O)c2cccc3ccccc23)CC4	ZINC000034689223	O=C(C(Cc1ccccc1)NS(=O)(=O)c2cccc3ccccc23)N4CCNCC4
C[C@H]2[C@H]3Cc1ccc(O)cc1[C@]2(C)CCN3	ZINC000000005296	C3CC1CC(Cc2ccccc12)N3
CCOC(=O)Cc1csc2=NCCn12	ZINC000000091663	C2Cn1ccsc1=N2
CN(C)[C@@H]1CCC[C@@H]1OC(=O)C(O)(c2ccccc2)c3ccccc3	ZINC000000536434	O=C(OC1CCCC1)C(c2ccccc2)c3ccccc3
CC(C)(C)OC(=O)NC1CCNCC1	ZINC000000129481	C1CCNCC1
CN(C)CCc1c[nH]c2ncccc12	ZINC000000010101	c2cnc1[nH]ccc1c2
CN(C)CCNS(=O)(=O)c1ccc(N)cc1	ZINC000000392584	c1ccccc1
CCN3CCC(N2CCN(c1ccc(F)cc1)CC2)CC3	ZINC000000279502	C3CC(N2CCN(c1ccccc1)CC2)CCN3
C[C@@H](O)CN(CCO)C[C@@H](C)O	ZINC000000393564	nonring
CCOC(=O)N2CCN(C1CCN(CC)CC1)CC2	ZINC000000280529	C2CC(N1CCNCC1)CCN2
Cn1cccc1c2ccccc2NCC3=NCCN3	ZINC000000026363	C3CN=C(CNc1ccccc1c2ccc[nH]2)N3
Clc2ccc(Cn1ccc(=N)cc1)c(Cl)c2	ZINC000000221944	N=c2ccn(Cc1ccccc1)cc2
CS(=O)(=O)N(CC(=O)Nc2ccc(S(=O)(=O)N1CCCCC1)cc2)c3ccc(F)cc3	ZINC000000622211	O=C(CNc1ccccc1)Nc3ccc(S(=O)(=O)N2CCCCC2)cc3
O=C(Cn1cncc1c2ccc(N(=O)=O)cc2)N3CCOCC3	ZINC000000036238	O=C(Cn1cncc1c2ccccc2)N3CCOCC3
COc1ccccc1OCc3nnc(SCC(=O)N2CCCC2)o3	ZINC000000418540	O=C(CSc2nnc(COc1ccccc1)o2)N3CCCC3
O[C@@H](CNCc1ccccc1C(F)(F)F)C(F)(F)F	ZINC000000170280	c1ccccc1
COc3ccc(CN2CCN(c1ccccc1)CC2)cc3O	ZINC000000292277	C2CN(c1ccccc1)CCN2Cc3ccccc3
O=C3NC(=O)[C@]2(CCc1ccccc1C2)N3	ZINC000000000754	O=C3NC(=O)C2(CCc1ccccc1C2)N3
O=C(NCc1ccco1)c2ccc(=O)[nH]c2	ZINC000000036230	O=C(NCc1ccco1)c2ccc(=O)[nH]c2
Cc1ccccc1CNCc3ccc2OCOc2c3	ZINC000000267284	C3Oc2ccc(CNCc1ccccc1)cc2O3
OCC(CO)(CO)NC(=O)Nc1cccc(Cl)c1	ZINC000000140788	c1ccccc1
CCOC(=O)c3oc2cc1c(C)c(C(=O)OCC)oc1cc2c3C	ZINC000000050401	c3cc2cc1occc1cc2o3
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
NCc2ccc(c1ccccn1)s2	ZINC000000158564	c2ccc(c1cccs1)nc2
OCC[N@]1CCCC[C@@H]1c2cccnc2	ZINC000000035451	C2CCC(c1cccnc1)NC2
Clc1cccc(Cl)c1N(CC=C)C2=NCCN2	ZINC000000003723	C2CN=C(Nc1ccccc1)N2
COc3cccc(n2c(=S)[nH]c(=O)c(=Cc1ccc[nH]1)c2=O)c3	ZINC000000045633	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc3ccc[nH]3
CCCn2c(=O)n(C)c1[nH]cnc1c2=O	ZINC000000014162	O=c2[nH]c(=O)c1nc[nH]c1[nH]2
Cc4cc(\C=c3\sc2nc1ccccc1n2c3=O)c(C)n4C	ZINC000000029099	O=c3c(=Cc1cc[nH]c1)sc4nc2ccccc2n34
O=C(Nc1ccccn1)c3nc2ccccc2[nH]3	ZINC000000009612	O=C(Nc1ccccn1)c3nc2ccccc2[nH]3
Cc3nc2n(C)c1ccccc1n2c3C(=O)OCCN4CCCCC4	ZINC000000255157	O=C(OCCN1CCCCC1)c3cnc4[nH]c2ccccc2n34
O=c3ccc2[nH]cc(C1=CCNCC1)c2[nH]3	ZINC000000004439	O=c3ccc2[nH]cc(C1=CCNCC1)c2[nH]3
Nc3c2CC1CC(C1)c2nc4cccc(F)c34	ZINC000000004438	C1C4CC1c3nc2ccccc2cc3C4
CC(=O)Oc1cccccc1=O	ZINC000000003736	O=c1cccccc1
CCCN3CCC(N2C[C@@H](NCc1ccc(C(F)(F)F)cc1)C[C@H]2C(=O)NCCOC)CC3	ZINC000020906326	C3CC(N2CCC(NCc1ccccc1)C2)CCN3
CC2CCN(CCC(=O)Nc1ccc(F)cc1)CC2	ZINC000000176619	O=C(CCN1CCCCC1)Nc2ccccc2
COC(=O)C1=CN(C(C)C)C=C(C(=O)OC)C1c2cccc(Cl)c2	ZINC000000264521	N2C=CC(c1ccccc1)C=C2
C=Cc2noc([C@@H]1CNC=NC1)n2	ZINC000000021241	C1NC=NCC1c2ncno2
NC(=N)NN=Cc1ccc(O)cc1	ZINC000000240526	c1ccccc1
COc3ccc(CN2CCN(c1ccc(F)cc1)CC2)cc3C	ZINC000000234520	C2CN(c1ccccc1)CCN2Cc3ccccc3
COc3ccc(NC(=O)CC[N@]2CCc1ccccc1C2)cc3	ZINC000000176614	O=C(CCN2CCc1ccccc1C2)Nc3ccccc3
CC2(C)CC(Nc1c(Cl)cc(Cl)cn1=O)CC(C)(C)N2	ZINC000000036908	O=n1ccccc1NC2CCNCC2
NC(=N)SCc1cccc(Cl)c1	ZINC000000096804	c1ccccc1
Clc3ccc(Oc1ccccc1C2=NCCN2)cc3	ZINC000000007981	C3CN=C(c1ccccc1Oc2ccccc2)N3
CC(C)[N@]2CCC[C@H](c1cccc(C#N)c1)C2	ZINC000000007986	C2CNCC(c1ccccc1)C2
NCc2cc1ccccc1s2	ZINC000000064943	c2ccc1sccc1c2
O[C@]24N=C(c1ccccc1)S[C@H]2Cc3cc(Cl)ccc34	ZINC000000008690	C3C2SC(c1ccccc1)=NC2c4ccccc34
COc1ccc(NNC(N)=S)cc1	ZINC000000069511	c1ccccc1
N#Cc2cccc([C@H]1CCCNC1)c2	ZINC000000007988	C2CNCC(c1ccccc1)C2
CC3(C)CC(NC(=O)c2scc1OCCOc12)CC(C)(C)N3	ZINC000000098738	O=C(NC1CCNCC1)c3scc2OCCOc23
Nc3ccc(N2CCN(Cc1ccccc1)CC2)cc3	ZINC000000166223	C2CN(c1ccccc1)CCN2Cc3ccccc3
CSc1ccc([C@@H](O)[C@@H](N)CO)cc1	ZINC000000056799	c1ccccc1
CCOC(=O)c1sc(NC(=O)CC(C)=O)c(C(=O)OCC)c1C	ZINC000000102293	c1ccsc1
C[C@@H](C(=O)NN1CCN(C)CC1)c2ccc(N(=O)=O)cc2	ZINC000000471721	O=C(Cc1ccccc1)NN2CCNCC2
CN(C)CCNC(=O)c2cc(c1ccco1)nn2c3ccccc3	ZINC000000254874	c3ccc(n2ccc(c1ccco1)n2)cc3
COc3ccc(OC)c(C[N@]2CCC[C@@H](C(=O)N1CCCCC1)C2)c3	ZINC000000212301	O=C(C2CCCN(Cc1ccccc1)C2)N3CCCCC3
Cc2c(c1ccccc1)[nH]c(=O)n2C4CCN(CCc3ccccc3)CC4	ZINC000000592274	O=c2[nH]c(c1ccccc1)cn2C4CCN(CCc3ccccc3)CC4
CN(C)c2nc1ccccc1n2N	ZINC000000052962	c2ccc1[nH]cnc1c2
O=C(NCc1ccco1)[C@@H]3COc2ccccc2O3	ZINC000000048549	O=C(NCc1ccco1)C3COc2ccccc2O3
COCCNC(=O)Cn3cc(\C=c2/c(=O)[nH]c(=O)n(c1cccc(OC)c1)c2=O)c4ccccc34	ZINC000006136187	O=c3[nH]c(=O)c(=Cc1c[nH]c2ccccc12)c(=O)n3c4ccccc4
CCN(CC)CC(=O)Nc3ccc2CCc1ccccc1Nc2c3	ZINC000000275611	C2Cc1ccccc1Nc3ccccc23
Clc1ccccc1OCc3nc(c2ccc(N(=O)=O)cc2)cs3	ZINC000000113967	C(Oc1ccccc1)c3nc(c2ccccc2)cs3
CN(C)S(=O)(=O)Nc2ccc(NS(=O)(=O)N(C)C)c(S(=O)(=O)c1ccccc1)c2	ZINC000002260655	O=S(=O)(c1ccccc1)c2ccccc2
COc3cc(OC)cc(C(=O)Nc2ccc(S(=O)(=O)Nc1cccc(Cl)c1)cc2)c3	ZINC000000665520	O=C(Nc2ccc(S(=O)(=O)Nc1ccccc1)cc2)c3ccccc3
CC(C)Nc1cccnc1N4CCN(C(=O)c3cc2ccccc2[nH]3)CC4	ZINC000000587534	O=C(N2CCN(c1ccccn1)CC2)c4cc3ccccc3[nH]4
COc4ccc(CNC2C1CC3CC(C1)CC2C3)cc4C	ZINC000000183460	C(NC2C1CC3CC(C1)CC2C3)c4ccccc4
CCNc1cccnc1N4CCN(C(=O)c3cc2cc(F)ccc2[nH]3)CC4	ZINC000000587537	O=C(N2CCN(c1ccccn1)CC2)c4cc3ccccc3[nH]4
NCCc1c[nH]c2c(Cl)ccc(Cl)c12	ZINC000000185700	c2ccc1[nH]ccc1c2
CC2(C)OC(=O)N(c1ccccc1)/C2=C\C[N+](C)(C)C	ZINC000000123420	C=C1COC(=O)N1c2ccccc2
NC(=N)NC(=N)Nc1ccccc1Br	ZINC000000406677	c1ccccc1
C[C@@H](O)[C@@H]4[C@H]3[C@@H](C)C(S[C@@H]2CN[C@H](C(=O)Nc1cccc(C(O)=O)c1)C2)=C(C(O)=O)N3C4=O	ZINC000003918453	O=C4CC3CC(SC2CNC(C(=O)Nc1ccccc1)C2)=CN34
COc3ccc(N2C[C@@H](NC(=O)Nc1ccc(S(=O)(=O)NC(C)=O)cc1)CC2=O)cc3OC	ZINC000016047672	O=C(NC2CN(c1ccccc1)C(=O)C2)Nc3ccccc3
COc1ccc(Cl)cc1c3nc(N)nc(NN2CCCCC2)n3	ZINC000000407473	C3CCN(Nc2ncnc(c1ccccc1)n2)CC3
O=N(=O)c3cccc(c2noc(CSC1=NCCN1)n2)c3	ZINC000000150608	C3CN=C(SCc2nc(c1ccccc1)no2)N3
COc2ccc(NC[C@@H](O)COc1ccc(Cl)cc1Cl)cc2	ZINC000000074228	C(CNc1ccccc1)COc2ccccc2
CCn2c[n+](C[C@@H](O)COC1CCCCC1)c3cc(C)c(C)cc23	ZINC000000089056	C3CCC(OCCC[n+]1c[nH]c2ccccc12)CC3
OCCNCCCNCc1ccc(OCC=C)cc1	ZINC000013732685	c1ccccc1
CCN(C(=O)Cc1ccccc1OC)c2ccccc2	ZINC000000030161	O=C(Cc1ccccc1)Nc2ccccc2
O=C2CCC[C@H]1[C@H]4C[C@@H](CN12)[C@@H]3CCCC[N@]3C4	ZINC000000265451	O=C2CCCC1C4CC(CN12)C3CCCCN3C4
O=C(CN3CCC(c1c[nH]c2ccccc12)CC3)Nc4ccccn4	ZINC000000024307	O=C(CN3CCC(c1c[nH]c2ccccc12)CC3)Nc4ccccn4
Nc1nonc1C(=O)OCC(=O)Nc2ccccc2	ZINC000000051434	O=C(COC(=O)c1cnon1)Nc2ccccc2
Cc2cn(Cc1ccccn1)c(C)n2	ZINC000000008506	C(c1ccccn1)n2ccnc2
CCN3C(=O)C[C@@]1(C[N+]2(C)CCC1CC2)C3=O	ZINC000000346794	O=C3CC1(CN2CCC1CC2)C(=O)N3
COc1ccc(CN)cc1OC	ZINC000000392018	c1ccccc1
CN2CCC(N(C)Cc1ccccc1C(F)(F)F)CC2	ZINC000000241257	C2CC(NCc1ccccc1)CCN2
CNc1ccc(Cl)cc1S(=O)(=O)c2ccccc2N(=O)=O	ZINC000000006769	O=S(=O)(c1ccccc1)c2ccccc2
CC(C)[C@@](C)(NC(=O)c1cccnc1Oc2ccc(F)cc2)C(N)=O	ZINC000000052207	O(c1ccccc1)c2ccccn2
Clc3cccc(c2nnc(SCC(=O)NCc1ccco1)o2)c3	ZINC000000417677	O=C(CSc2nnc(c1ccccc1)o2)NCc3ccco3
Fc3ccc(C(=O)CCCN2CCC(C(=O)c1ccc(F)cc1)CC2)cc3	ZINC000000537887	O=C(CCCN2CCC(C(=O)c1ccccc1)CC2)c3ccccc3
CNS(=O)(=O)c2ccc(C[N@@](C)CCN1CCNCC1)cc2	ZINC000662246151	C2CN(CCNCc1ccccc1)CCN2
COC(=O)[C@@H](C)On2c(=O)c1ccccc1c2=O	ZINC000000040609	O=c1[nH]c(=O)c2ccccc12
CC(=O)c2ccc(NC(=O)COc1ccc(Cl)c(C)c1)cc2	ZINC000000043156	O=C(COc1ccccc1)Nc2ccccc2
Cn2c(c1ccc(NS(C)(=O)=O)cc1)c[n+]3ccccc23	ZINC000000387330	c3ccc(c2c[n+]1ccccc1[nH]2)cc3
Cc2ccc(NC(=O)C[C@@H](NCc1ccccc1)C(O)=O)cc2Cl	ZINC000000195689	O=C(CCNCc1ccccc1)Nc2ccccc2
Cc3ccc(C(=O)O[C@@H]1CN2CCC1CC2)cc3	ZINC000000135989	O=C(OC1CN2CCC1CC2)c3ccccc3
Nc3nc(N)c2c(Oc1ccc(F)cc1)cccc2n3	ZINC000000172625	O(c1ccccc1)c2cccc3ncncc23
Cc3n[nH]c(SCC(=O)Nc2nc(c1ccccc1)cs2)n3	ZINC000000051943	O=C(CSc1ncn[nH]1)Nc3nc(c2ccccc2)cs3
CC(=O)N4CCN(C(=O)[C@@H](Cc1cccc(C(N)=N)c1)NS(=O)(=O)NC[C@@H]2CCC[N@]2Cc3ccccc3)CC4	ZINC000026145364	O=C(C(Cc1ccccc1)NS(=O)(=O)NCC2CCCN2Cc3ccccc3)N4CCNCC4
CCOC(=O)C[C@@H](N)c1ccccc1Cl	ZINC000000043551	c1ccccc1
Oc2c(CN1CCCCC1)ccc3ccccc23	ZINC000000158003	C3CCN(Cc2ccc1ccccc1c2)CC3
CNC(=S)NCCN1CCCCC1	ZINC000000414894	C1CCNCC1
C[C@H](C(=O)NC1CC1)S(=O)(=O)c2ccccc2Br	ZINC000000015175	O=C(CS(=O)(=O)c1ccccc1)NC2CC2
C[N@@](Cc1ccccc1)Cc2cccnc2	ZINC000000042821	C(NCc1cccnc1)c2ccccc2
C[N@@](C[C@@H](O)CO)Cc1ccccc1	ZINC000000405287	c1ccccc1
Nc2ncnc3n(C1CCCCC1)cnc23	ZINC000000012513	C3CCC(n1cnc2cncnc12)CC3
O=C(NCC[n+]2ccc1ccccc1c2)c3ccccc3	ZINC000000028223	O=C(NCC[n+]2ccc1ccccc1c2)c3ccccc3
CC(=O)OC[C@@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H](OC(C)=O)C(=O)Nc1ccc(C(O)=O)cc1	ZINC000012658987	c1ccccc1
COc2ccc3C[N+](C)(C)CC[C@@]14C=CC[C@@H](O)[C@H]1Oc2c34	ZINC000000487786	C2CC14C=CCCC1Oc3cccc(CN2)c34
COC(=O)c1ccccc1NC(=S)N(N)CCO	ZINC000000145203	c1ccccc1
COc1ccc(CN)c(OC)c1	ZINC000000119693	c1ccccc1
CC(C)(C)[C@@H](O)CN1CCCC1	ZINC000000106421	C1CCNC1
COc2cc[n+](OC(=O)N1CCCCC1)c(C)c2	ZINC000000172287	O=C(O[n+]1ccccc1)N2CCCCC2
CC1(C)NC(=N)NC(=N)N1c2ccc(Cl)cc2	ZINC000000001233	N=C2NCN(c1ccccc1)C(=N)N2
CC(=O)c3c(C)nn4c1ccccc1n(CCN2CCCCC2)c34	ZINC000000268640	C4CCN(CCn2c1ccccc1n3nccc23)CC4
CCOc2cc(C(=O)NCc1cccnc1)cc(OCC)c2OCC	ZINC000000030219	O=C(NCc1cccnc1)c2ccccc2
Cc2ccc(NCc1cc(Br)ccc1O)nc2	ZINC000000031566	C(Nc1ccccn1)c2ccccc2
CC1(C)NCC[C@@]14C(=O)N(Cc2ccccc2)c3ccccc34	ZINC000000103654	O=C3N(Cc1ccccc1)c2ccccc2C34CCNC4
CCN(CC)CCN=C2CCCc1ccccc1N2	ZINC000000196628	N=C2CCCc1ccccc1N2
O=N(=O)c3cccc(c2nc1ccccc1c(=O)o2)c3	ZINC000000031562	O=c2oc(c1ccccc1)nc3ccccc23
COc2cc(CN1CCCCCC1)c(N(=O)=O)cc2OC	ZINC000000239065	C2CCCN(Cc1ccccc1)CC2
CC[N@]1CCC[C@H]1CNc3ncnc4c2cc(OC)ccc2[nH]c34	ZINC000000539022	C4CNC(CNc2ncnc3c1ccccc1[nH]c23)C4
CCN(CC)CCc2c(C)c1ccc(O)cc1oc2=O	ZINC000000032923	O=c2ccc1ccccc1o2
Cc2ccnc3c(=O)c1c(Cl)ccnc1c(=O)c23	ZINC000000024231	O=c2c1cccnc1c(=O)c3cccnc23
CCOC(=O)c3cc(c2coc(\C=N/n1cnnc1)c2)ccc3Cl	ZINC000000033999	C(=Nn1cnnc1)c3cc(c2ccccc2)co3
CN(C)CCNc2cnn(c1ccccc1)c(=O)c2Cl	ZINC000000118611	O=c1cccnn1c2ccccc2
CCCN(CCC)[C@@H](C)C(=O)N1CCNCC1	ZINC000019478903	C1CNCCN1
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
CSc3ccc(NC(=O)N(C[C@H]1CCCO1)Cc2ccco2)cc3	ZINC000000257747	O=C(Nc1ccccc1)N(CC2CCCO2)Cc3ccco3
CN[C@@H](C)C(=O)N[C@@H](C1CCOCC1)C(=O)N3C[C@H]2CCC[N@]2C[C@H]3C(=O)N[C@@H]4CCOc5ccccc45	ZINC000095596375	O=C(CC1CCOCC1)N3CC2CCCN2CC3C(=O)NC4CCOc5ccccc45
Cc2nn(C)c3NCCN=C(c1cccc(Cl)c1)c23	ZINC000000002263	C3CN=C(c1ccccc1)c2cn[nH]c2N3
CCOC(=O)C1=C(C)NC(=O)NC1	ZINC000000101724	O=C1NCC=CN1
COc2ccc(S(=O)(=O)N(Cc1ccccc1)[C@H](C(C)C)C(=O)NO)cc2	ZINC000000581375	O=S(=O)(NCc1ccccc1)c2ccccc2
Cc2n(C)c1ncccc1[n+]2C	ZINC000000444791	c2cnc1[nH]cnc1c2
CCOC(=O)N2CCN(C[C@H]1CCC=CC1)CC2	ZINC000000278281	C2CN(CC1CCC=CC1)CCN2
COc2cc(Cn1cnnn1)ccc2O	ZINC000000060396	C(c1ccccc1)n2cnnn2
COC(=O)C[C@@H](N)c1ccccc1	ZINC000000286961	c1ccccc1
Clc4ccc3NC(NCC1CC1)=C[N+](=O)C(c2ccccc2)c3c4	ZINC000000001238	O=[N+]3C=C(NCC1CC1)Nc2ccccc2C3c4ccccc4
O=c3n(c1ccccc1)c(C[n+]2ccccc2)nc4ccccc34	ZINC000000175086	O=c3n(c1ccccc1)c(C[n+]2ccccc2)nc4ccccc34
C[C@@H]2C[C@](O)(C#C)[C@@H]1CCCC[C@@H]1N2	ZINC000000202062	C2CCC1NCCCC1C2
CCOc2cc(NS(=O)(=O)c1ccc(Cl)cc1)c(OCC)cc2NC(=O)CC(C)C	ZINC000000881478	O=S(=O)(Nc1ccccc1)c2ccccc2
CCN(CC)[N+](\O)=N\OC	ZINC000000015795	nonring
CN(C)CCC(=O)c1ccc(C)o1	ZINC000000268396	c1ccoc1
CCCN2[C@@H]([N+](=O)Cc1ccc(Cl)cc1)C(C)(C)SC2=S	ZINC000000268465	O=[N+](Cc1ccccc1)C2CSC(=S)N2
C[N@@](CCNc1ncnc2[nH]cnc12)Cc3ccccc3	ZINC000000213922	C(CNc1ncnc2[nH]cnc12)NCc3ccccc3
NC(=O)[C@H]2[C@H](c1ccccc1)C2(C#N)C#N	ZINC000000049843	C1CC1c2ccccc2
CC[N@]1CCC[C@@H]1CNC(=O)c2cc(N)ccc2OC	ZINC000000347683	O=C(NCC1CCCN1)c2ccccc2
CN3CCN(c2ccc(NC(=O)c1ccco1)cc2)CC3	ZINC000000360001	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccco3
Cc4cc(N1CCNCC1)n3c2ccccc2nc3c4C#N	ZINC000000135322	C4CN(c2cccc3nc1ccccc1n23)CCN4
COc3ccc(CC1=NCCc2cc(OC)c(OC)cc12)cc3	ZINC000000006201	C3Cc1ccccc1C(Cc2ccccc2)=N3
CCN3CCN(c2ccc(/N=C/c1ccc(N(=O)=O)cc1)cc2)CC3	ZINC000000353102	C3CN(c2ccc(N=Cc1ccccc1)cc2)CCN3
CCOC(=O)C2[C@@H](c1ccc(OC)cc1OC)NC(=S)N=C2C	ZINC000000039353	S=C2NC(c1ccccc1)CC=N2
CN(C)c2ccc(\C=N\NC(=O)c1ccc(O)cc1)cc2	ZINC000000083917	O=C(NN=Cc1ccccc1)c2ccccc2
C2CN=C(CNc1ccccc1)N2	ZINC000000001918	C2CN=C(CNc1ccccc1)N2
CNc1cc(C)nc(NN)n1	ZINC000000175409	c1cncnc1
C2CCC(=Nn1cnnc1)CC2	ZINC000000061067	C2CCC(=Nn1cnnc1)CC2
O=C3CS[C@@]1(CN2CCC1CC2)N3	ZINC000000191477	O=C3CSC1(CN2CCC1CC2)N3
Cc1nccn1C[C@@H](O)COc2ccc(Cl)cc2Cl	ZINC000000074255	C(COc1ccccc1)Cn2ccnc2
OC[C@@H]1CCC[N@]1Cc2ccccc2	ZINC000000120477	C2CCN(Cc1ccccc1)C2
NCCNCc1ccccc1N5CCN(C(=O)[C@@H](Cc2ccc(Cl)cc2)NC(=O)[C@H]4Cc3ccccc3CN4)CC5	ZINC000028380288	O=C(NC(Cc1ccccc1)C(=O)N3CCN(c2ccccc2)CC3)C5Cc4ccccc4CN5
CCc3cc2c(=O)n([C@@H](C)C(=O)OCc1ccccc1)cnc2s3	ZINC000000148833	O=C(Cn2cnc1sccc1c2=O)OCc3ccccc3
OC(=O)c5ccc(COc2ccc1ccccc1c2\C=c4/[nH]c(=O)n(Cc3ccc(F)cc3)c4=O)cc5	ZINC000000638688	O=c4[nH]c(=Cc2c(OCc1ccccc1)ccc3ccccc23)c(=O)n4Cc5ccccc5
COc3ccc(C(=O)N2CCC(N1CCC(C)CC1)CC2)cc3	ZINC000000207726	O=C(N2CCC(N1CCCCC1)CC2)c3ccccc3
NCc2csc(c1cccs1)n2	ZINC000000158694	c2csc(c1nccs1)c2
COc3cccc(\C=N\N=c1/c(=O)[nH]c2ccccc12)c3OC	ZINC000000032100	O=c2[nH]c1ccccc1c2=NN=Cc3ccccc3
CN3CCN(C(=O)[C@H]2[C@@H]1C[C@@H](C=C1)[C@@H]2C(O)=O)CC3	ZINC000000032101	O=C(C1CC2CC1C=C2)N3CCNCC3
COc1ccccc1C[N@]2C[C@@H]4C[C@H](C2)c3cccc(=O)n3C4	ZINC000000228620	O=c4cccc3C2CC(CN(Cc1ccccc1)C2)Cn34
Cn2c(=O)n(C)c1ncn(CC#N)c1c2=O	ZINC000000033452	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
CCN(CC)c1ccc(N)c(C)c1	ZINC000000056876	c1ccccc1
Cc2ccc(NC(=O)COc1cc(C)cc(C)c1)c(Br)c2	ZINC000000043954	O=C(COc1ccccc1)Nc2ccccc2
CNC(=O)c2cccc(NCC(=O)NCCc1ccc(OC)c(OC)c1)c2	ZINC000000608336	O=C(CNc1ccccc1)NCCc2ccccc2
COC(=O)[C@@H]1SCC[C@H]1N	ZINC000000016593	C1CCSC1
C[C@@H](O)CNCc1ccc(C)s1	ZINC000000360078	c1ccsc1
NCc1nccn1Cc2ccsc2	ZINC000000002910	C(c1ccsc1)n2ccnc2
COc3ccc(NS(=O)(=O)c2cc(C(=O)Nc1ccccc1)ccc2OC)cc3	ZINC000000705296	O=C(Nc1ccccc1)c3cccc(S(=O)(=O)Nc2ccccc2)c3
C[C@@H]3CN(S(=O)(=O)c1cccc2cnccc12)CCN3	ZINC000000391115	O=S(=O)(N1CCNCC1)c2cccc3cnccc23
C2CN(c1ccccc1)CCN2	ZINC000000120271	C2CN(c1ccccc1)CCN2
CN4CCN(c2c1CCCc1nc3ncnn23)CC4	ZINC000000156088	C4Cc3nc1ncnn1c(N2CCNCC2)c3C4
COc2ccc([C@@H]1NC(=O)NC(C)=C1C(=O)OC(C)C)cc2	ZINC000000064594	O=C2NC=CC(c1ccccc1)N2
C[N@](c1ccncc1)n2ccc3ccccc23	ZINC000000003997	N(c1ccncc1)n2ccc3ccccc23
CN2CCN(c1ccc(C(F)(F)F)cc1N)CC2	ZINC000000065173	C2CN(c1ccccc1)CCN2
CCC[N@](c1ccncc1F)n2cc(C)c3cc(OC(=O)NC)ccc23	ZINC000000598070	N(c1ccncc1)n2ccc3ccccc23
O=Cc1sc(=O)[nH]c1[n+]2ccccc2	ZINC000000039766	O=c2[nH]c([n+]1ccccc1)cs2
CN(C)CC(=O)c1c(C)[nH]c2cc(C)ccc12	ZINC000000117507	c2ccc1[nH]ccc1c2
Cn3c(=O)n(C)c2nc1[nH][nH]ccn1c2c3=O	ZINC000000285928	O=c3[nH]c(=O)c2c(nc1[nH][nH]ccn12)[nH]3
CCN(CC)CC(=O)c1c(C)[nH]c2ccccc12	ZINC000000117502	c2ccc1[nH]ccc1c2
CN(C)CCN(Cc1ccccc1)c3nc2ccccc2o3	ZINC000000001857	C(Nc2nc1ccccc1o2)c3ccccc3
COCCN5C(=O)NC(=O)[C@@]4(Cc1cc(N(=O)=O)ccc1N3CCN(c2ccc(OC)cc2)C[C@@H]34)C5=O	ZINC000008974942	O=C5NC(=O)C4(Cc1ccccc1N3CCN(c2ccccc2)CC34)C(=O)N5
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
Cc2cccc(NC(=O)CCCC(=O)Nc1cccc(C)c1C)c2C	ZINC000000082175	O=C(CCCC(=O)Nc1ccccc1)Nc2ccccc2
CCCN2CCC(Cc1ccc(F)cc1)CC2	ZINC000000017153	C2CC(Cc1ccccc1)CCN2
CCOc2nc(NC(=O)NS(=O)(=O)c1c(OC)ncc(Cl)c1OC)nc(N(C)C)n2	ZINC000006489576	O=C(Nc1ncncn1)NS(=O)(=O)c2cccnc2
Cc2nc1ccccn1c(=O)c2CCN4CCC(C(=O)c3ccc(F)cc3)CC4	ZINC000000538194	O=C(C3CCN(CCc2cnc1ccccn1c2=O)CC3)c4ccccc4
NC(=O)c5cc(NC(=O)c3ccc(C(=O)Nc2cc(C(N)=O)cc(C1=NCCN1)c2)cc3)cc(C4=NCCN4)c5	ZINC000001662465	O=C(Nc2cccc(C1=NCCN1)c2)c5ccc(C(=O)Nc4cccc(C3=NCCN3)c4)cc5
O=C(Cc1cccs1)Nc4ccc(c3nc2ccccc2o3)cc4	ZINC000000051300	O=C(Cc1cccs1)Nc4ccc(c3nc2ccccc2o3)cc4
C3CC(COCc1ccccc1)(c2ccccc2)CCN3	ZINC000000018461	C3CC(COCc1ccccc1)(c2ccccc2)CCN3
C[N+]14CCC(CC1)[C@@H]([C@@](O)(c2ccccc2)c3cccs3)C4	ZINC000000204030	C1CN4CCC1C(C(c2ccccc2)c3cccs3)C4
CSC[C@@H](O)Cn2ncc1ccccc1c2=O	ZINC000000069811	O=c1[nH]ncc2ccccc12
CCCC(=O)NCc3cc(c1nn(C)c(=O)c2ccccc12)ccc3C	ZINC000000204037	O=c2[nH]nc(c1ccccc1)c3ccccc23
Nc2ccc(S(=O)(=O)c1ccc(N)cn1)cc2	ZINC000000002008	O=S(=O)(c1ccccc1)c2ccccn2
CC[C@@H]1NC(=O)NC(C)=C1C(C)=O	ZINC000000052776	O=C1NCC=CN1
Cc2csc(NC(=O)CNC1CC1)n2	ZINC000000325404	O=C(CNC1CC1)Nc2nccs2
O/N=C/C(=O)NCCCNCCCNCc1ccccc1	ZINC000002245651	c1ccccc1
CCOP(=S)(OCC)Oc2ccc(=O)n(c1ccccc1)n2	ZINC000000002006	O=c1cccnn1c2ccccc2
Cc1ccccc1C(=O)NC[C@@H]2CCC[N@]3CCCC[C@@H]23	ZINC000000055271	O=C(NCC1CCCN2CCCCC12)c3ccccc3
O=N(=O)c3cccc([C@@H]2CN1CCSC1=N2)c3	ZINC000000000547	C3CN2CC(c1ccccc1)N=C2S3
COc3cccc(CNCc2ccc1OCOc1c2)c3	ZINC000000200703	C3Oc2ccc(CNCc1ccccc1)cc2O3
CC(=O)Nc2nc(N)nc(N1CCCCC1)n2	ZINC000000082886	C2CCN(c1ncncn1)CC2
COc1ccccc1NC(=S)N(CCC(C)C)[C@@H](C)c2ccco2	ZINC000000263075	S=C(NCc1ccco1)Nc2ccccc2
COC(=O)c2[nH]c1ccccc1c2NC(=O)C[N@@](C)C3CCCCC3	ZINC000000522387	O=C(CNC1CCCCC1)Nc2c[nH]c3ccccc23
Oc3ccc(c2cncc(c1ccc(O)cc1)c2)cc3	ZINC000000006514	c3ccc(c2cncc(c1ccccc1)c2)cc3
CCOC(=O)c1c(CC(C)C)csc1NC(=O)Cc2ccccc2	ZINC000000227397	O=C(Cc1ccccc1)Nc2cccs2
CC(C)[C@@H](N)C(=O)N1CCOCCOCCOCC1	ZINC000000244260	C1COCCOCCOCCN1
CN(C)S(=O)(=O)c4ccc(CC1=C(C(O)=O)N3[C@H](SC1)[C@H](NC(=O)[C@H](N)c2ccccc2)C3=O)cc4	ZINC000169319001	O=C(Cc1ccccc1)NC4C3SCC(Cc2ccccc2)=CN3C4=O
CC3CCN(CCNS(=O)(=O)c1cccc2cccnc12)CC3	ZINC000000423539	O=S(=O)(NCCN1CCCCC1)c2cccc3cccnc23
CCN2CCC(N(CCO)Cc1ccccc1)CC2	ZINC000000227139	C2CC(NCc1ccccc1)CCN2
Oc3ccc(NC(=O)C(=C/c2ccc(N1CCOCC1)cc2)\C#N)cc3	ZINC000000561559	O=C(Nc1ccccc1)C=Cc3ccc(N2CCOCC2)cc3
Cc3nn2cc(C(=O)NCc1ccccc1)sc2nc3=O	ZINC000000113504	O=C(NCc1ccccc1)c3cn2ncc(=O)nc2s3
O=C(NCCN1CCCCC1)c2ccccc2N(=O)=O	ZINC000000027770	O=C(NCCN1CCCCC1)c2ccccc2
C[C@@H](CCN(C)C)NS(=O)(=O)N(C)CCCN	ZINC000049558237	nonring
Cn2c[n+](C[C@@H](O)COc1ccccc1)c3ccccc23	ZINC000000273019	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
COc2ccc(C(=O)NCc1ccc(Cl)cc1)cc2OC	ZINC000000033183	O=C(NCc1ccccc1)c2ccccc2
CN4CCN(CCC(=O)N[C@H]3[C@@H]2Oc1cc(C)ccc1[C@]2(C)CCC3=O)CC4	ZINC000000538425	O=C(CCN1CCNCC1)NC4C3Oc2ccccc2C3CCC4=O
O=C2[C@@H](Cc1cnc[nH]1)NC(=S)N2c3ccccc3	ZINC000000403544	O=C2C(Cc1cnc[nH]1)NC(=S)N2c3ccccc3
CN(C)CCOC(=O)[C@@]2(C#N)CC3c1ccccc1C2c4ccccc34	ZINC000000052332	C2CC3c1ccccc1C2c4ccccc34
CCOC(=O)c2cnc1c(C)c(Cl)ccc1c2NCCN(C)C	ZINC000000132709	c2ccc1ncccc1c2
CN(C)c1nc(NC(C)=O)nc(N(C)C)n1	ZINC000000243669	c1ncncn1
CCn1c(NCCN(C)C)nc2n(C)c(=O)n(C)c(=O)c12	ZINC000000067718	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
N[C@@H](C(=O)N[C@H]3[C@H]2SCC(CSc1c[nH]nn1)=C(C(O)=O)N2C3=O)c4ccc(O)cc4	ZINC000003830404	O=C(Cc1ccccc1)NC4C3SCC(CSc2c[nH]nn2)=CN3C4=O
CC1(C)[C@@H](C=C(Cl)Cl)[C@H]1C(=O)Nc2cccc(N(=O)=O)c2	ZINC000000041381	O=C(Nc1ccccc1)C2CC2
CCOC(=O)c2c(C[N@]1CCCC[C@H]1C)oc3ccc(OC)cc23	ZINC000000054437	C3CCN(Cc2cc1ccccc1o2)CC3
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
C4CCN(C3CCN(Cc2ccc1OCOc1c2)CC3)CC4	ZINC000000200646	C4CCN(C3CCN(Cc2ccc1OCOc1c2)CC3)CC4
CN(C)CCNC(=O)c3sc2nc(c1ccccc1)cn2c3C	ZINC000000251335	c3ccc(c2cn1ccsc1n2)cc3
CCn3c1ccccc1c4cc(C[N@@](C)CCc2ccccn2)ccc34	ZINC000000271507	C(Cc1ccccn1)NCc4ccc3[nH]c2ccccc2c3c4
N[C@@H](c1ccccc1)P(O)(=O)[C@@H](N)c2ccccc2	ZINC000000186743	O=P(Cc1ccccc1)Cc2ccccc2
C[N+]2(CCc1ccccc1)CCOCC2	ZINC000000245432	C2CN(CCc1ccccc1)CCO2
CCN2CCN(C(=O)NC(C)(C)c1cccc(C(C)=C)c1)CC2	ZINC000000205644	O=C(NCc1ccccc1)N2CCNCC2
CN(C)CCCC(C)=O	ZINC000000158398	nonring
Cc2ccc(S(=O)(=O)N1CCOCC1)cc2C(=O)NC(=S)NNS(=O)(=O)c3ccccc3	ZINC000003275438	O=C(NC(=S)NNS(=O)(=O)c1ccccc1)c3cccc(S(=O)(=O)N2CCOCC2)c3
COC(=O)[C@@H](C)Oc2cc(C)cc3oc(=O)cc(c1ccccc1)c23	ZINC000000044944	O=c3cc(c1ccccc1)c2ccccc2o3
Fc2cccc(NC(=O)CCN1CCCCCC1)c2	ZINC000000178114	O=C(CCN1CCCCCC1)Nc2ccccc2
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
C4Oc3ccc(C[N@]2CCc1ccccc1C2)cc3O4	ZINC000000237196	C4Oc3ccc(CN2CCc1ccccc1C2)cc3O4
CN2CCC([N@]1CCC[C@@H](CO)C1)CC2	ZINC000000221550	C2CCN(C1CCNCC1)CC2
COC(=O)c3ccc(NC=C2C(=O)CC(c1ccccc1)CC2=O)cc3	ZINC000000177132	O=C2CC(c1ccccc1)CC(=O)C2=CNc3ccccc3
CCN3C(=O)C[C@]1(CN2CCC1CC2)C3=O	ZINC000000346523	O=C3CC1(CN2CCC1CC2)C(=O)N3
C[C@H](CN[C@H]2CC(=O)N(c1ccc(C)cc1)C2=O)c3ccccc3	ZINC000000183104	O=C2CC(NCCc1ccccc1)C(=O)N2c3ccccc3
CCCN3CCC(N2CCN(c1ccccn1)CC2)CC3	ZINC000000219953	C3CC(N2CCN(c1ccccn1)CC2)CCN3
Cc3cc2C1CCC(CC1)c2cc3CC4=NCCN4	ZINC000000001725	C4CN=C(Cc3ccc2C1CCC(CC1)c2c3)N4
CC[C@@H](C)N2CCN(C(=O)c1ccc(OC)cc1)CC2	ZINC000000300471	O=C(N1CCNCC1)c2ccccc2
Cc2sc1ccccc1c2CC3=NCCN3	ZINC000000001721	C3CN=C(Cc1csc2ccccc12)N3
CCC(O)(CC)C#CCN1CCCC1	ZINC000000068193	C1CCNC1
CC3(C)CC(NC(=O)c2scc1CCCCc12)CC(C)(C)N3	ZINC000000140798	O=C(NC1CCNCC1)c3scc2CCCCc23
Cc3cc(C)n(c2ccc(Cl)c(C(=O)OCc1ccccc1)c2)n3	ZINC000000029055	O=C(OCc1ccccc1)c3cccc(n2cccn2)c3
C[C@H](N1CCCC1)C(=O)Nc2cc(Cl)cc(Cl)c2	ZINC000000110415	O=C(CN1CCCC1)Nc2ccccc2
CCCN3CCC([N@]2CCC[C@@H](C(=O)N1CCCCCC1)C2)CC3	ZINC000000212627	O=C(C2CCCN(C1CCNCC1)C2)N3CCCCCC3
COC(=O)CSc1cc(N(=O)=O)ccc1C#N	ZINC000000034862	c1ccccc1
C[C@@H]3C[C@@](O)(CC(O)(c1ccccc1)c2ccccc2)[C@@H](C)C[N@]3C	ZINC000000036733	C3CC(CC(c1ccccc1)c2ccccc2)CCN3
CC(C)c1ccc(C)cc1OCC(=O)Nc3ccc2OCOc2c3	ZINC000000037913	O=C(COc1ccccc1)Nc3ccc2OCOc2c3
CN4CCN(c2nnc(c1ccccc1)c3ccccc23)CC4	ZINC000000126549	C4CN(c2nnc(c1ccccc1)c3ccccc23)CCN4
Oc2ccc(C(=O)c1ccccc1)cc2CNC(=O)CSc3ccccn3	ZINC000000643297	O=C(CSc1ccccn1)NCc3cccc(C(=O)c2ccccc2)c3
CNC(=O)c2ccc[n+](Cc1ccccc1)c2	ZINC000000393171	C(c1ccccc1)[n+]2ccccc2
C[N+]3(CCO)CCN(c2nc1ccccc1o2)CC3	ZINC000000019138	C3CN(c2nc1ccccc1o2)CCN3
CN3CCN(c1cccc2[nH]c(=O)oc12)CC3	ZINC000000008736	O=c3[nH]c2cccc(N1CCNCC1)c2o3
C[N@@](CCO)Cc1ccccc1	ZINC000000389763	c1ccccc1
Cc3cc(C)cc(NS(=O)(=O)c2ccc(NC(=S)NC(=O)CCc1ccccc1)cc2)c3	ZINC000000675632	O=C(CCc1ccccc1)NC(=S)Nc3ccc(S(=O)(=O)Nc2ccccc2)cc3
Clc2cccc(Nc1ccncc1)c2	ZINC000000004152	N(c1ccccc1)c2ccncc2
NC(=N)c5ccc4oc(C(=O)N3CCN(C(=O)COc2ccc(OCC(=O)N1CCNCC1)cc2)CC3)cc4c5	ZINC000026974036	O=C(COc4ccc(OCC(=O)N3CCN(C(=O)c2cc1ccccc1o2)CC3)cc4)N5CCNCC5
CN1CC(=O)NC1=NC(=O)Nc2cccc(Cl)c2	ZINC000000001436	O=C2CNC(=NC(=O)Nc1ccccc1)N2
NC[C@H](C=C)c1ccc(O)cc1	ZINC000000009714	c1ccccc1
NC(=O)C(CCN1CCCCC1)(c2ccccc2)c3ccccc3	ZINC000000001438	C3CCN(CCC(c1ccccc1)c2ccccc2)CC3
C[N+]3(CCC(C(N)=O)(c1ccccc1)c2ccccc2)CCCCC3	ZINC000000001439	C3CCN(CCC(c1ccccc1)c2ccccc2)CC3
Cc2cc(=O)oc3cc(OCc1ccc(F)cc1)c(Cl)cc23	ZINC000000037999	O=c3ccc2ccc(OCc1ccccc1)cc2o3
CCOc1cc(CO)ccc1OCC(=O)Nc2ccc(C)c(Cl)c2	ZINC000000610376	O=C(COc1ccccc1)Nc2ccccc2
Nc2nc(c1ccccc1)cn2N	ZINC000000240649	c2ccc(c1c[nH]cn1)cc2
CCN(CC)Cc1nonc1C	ZINC000000327620	c1cnon1
C[C@H](Cc1ccccc1)NC(=O)c2ccccc2NC(=O)c3ccco3	ZINC000000433601	O=C(NCCc1ccccc1)c2ccccc2NC(=O)c3ccco3
O=C(Cc1ccc(N(=O)=O)cc1)N/N=C/c2ccc(C#N)cc2	ZINC000000061722	O=C(Cc1ccccc1)NN=Cc2ccccc2
C/C=C1\[C@H]3CCC[C@]1(N)c2ccc(=O)[nH]c2C3	ZINC000000007990	C=C1C3CCCC1c2ccc(=O)[nH]c2C3
CCOC(=O)Nc3cc2N[C@@H](C)C(c1ccccc1)=Nc2c(N)n3	ZINC000000004088	C2Nc1ccncc1N=C2c3ccccc3
COc4cc3CCN(c2cc(N)c1cc(OC)c(OC)cc1n2)Cc3cc4OC	ZINC000000596947	C2Cc1ccccc1CN2c4ccc3ccccc3n4
CCn2c1SC[C@H](O)C[n+]1c3ccccc23	ZINC000000439704	C3CSc2[nH]c1ccccc1[n+]2C3
COc3ccc(CSc2nc(c1ccccc1)c[nH]2)cc3N(=O)=O	ZINC000000062527	C(Sc2nc(c1ccccc1)c[nH]2)c3ccccc3
CC(=O)Nc2n[n+]1c(C)cc(C)nc1c3ccccc23	ZINC000000041891	c1ccc2c(c1)cn[n+]3cccnc23
COc1ccccc1N3CCN(C(=O)c2ccc(N(=O)=O)o2)CC3	ZINC000000038980	O=C(N2CCN(c1ccccc1)CC2)c3ccco3
COc1ccc(C)cc1S(=O)(=O)N(CC(=O)NN)c2ccccc2	ZINC000000583262	O=S(=O)(Nc1ccccc1)c2ccccc2
COc3cc(OC)cc(C(=O)Nc2ccc(Cc1ccncc1)cc2)c3	ZINC000000051057	O=C(Nc2ccc(Cc1ccncc1)cc2)c3ccccc3
O=S(=O)(NCCN1CCCC1)c2cccc3nsnc23	ZINC000000174933	O=S(=O)(NCCN1CCCC1)c2cccc3nsnc23
CCOC(=O)c3ccc2[n+](c1ccccc1)c(C)n(CC)c2c3	ZINC000000243470	c3ccc([n+]1c[nH]c2ccccc12)cc3
C[C@@H]1CCCC[C@@H]1NCc2ccc(N(=O)=O)cc2	ZINC000000183582	C2CCC(NCc1ccccc1)CC2
CCOc3cc(CN2CCN(c1ccccn1)CC2)ccc3O	ZINC000000291961	C2CN(c1ccccn1)CCN2Cc3ccccc3
CC(C)NS(=O)(=O)C[C@@H](C)c1ccccc1	ZINC000000008641	c1ccccc1
O=S(=O)(N/N=C/c1cccs1)c3ccc(c2ccccn2)s3	ZINC000000126133	O=S(=O)(NN=Cc1cccs1)c3ccc(c2ccccn2)s3
O=C(Nc2ccc(Cc1ccncc1)cc2)c3nc[nH]n3	ZINC000000056274	O=C(Nc2ccc(Cc1ccncc1)cc2)c3nc[nH]n3
CC3CCC(N2CCN(c1ccc(F)cc1)CC2)CC3	ZINC000000182015	C3CCC(N2CCN(c1ccccc1)CC2)CC3
Cc2ccc(NC(=O)COc1ccc(Cl)cc1C)c(C)c2	ZINC000000038405	O=C(COc1ccccc1)Nc2ccccc2
CN(C)CCNC(=O)C13CC2C[C@@](C)(C1)C[C@](C)(C2)C3	ZINC000000247106	C1C2CC3CC1CC(C2)C3
COc2ccc([C@@H](N)c1ccccc1)cc2	ZINC000000074815	C(c1ccccc1)c2ccccc2
COc3ccc(CCN[C@@H]2CC(=O)N(c1ccccc1)C2=O)cc3	ZINC000000182016	O=C2CC(NCCc1ccccc1)C(=O)N2c3ccccc3
COc2cc(CN1CCC(O)CC1)cc(OC)c2	ZINC000000042942	C2CCN(Cc1ccccc1)CC2
C[C@H](N1C(=O)CCC1=O)C(=O)Nc2ccc(S(N)(=O)=O)cc2	ZINC000000062254	O=C(CN1C(=O)CCC1=O)Nc2ccccc2
CNCc1ccc(OC)cc1	ZINC000000161978	c1ccccc1
Cn3[nH]c2nn(c1ccc(Br)cc1)[nH]c2c3N	ZINC000000031868	c3ccc(n2nc1[nH][nH]cc1[nH]2)cc3
C[N@]1[C@H]3CC[C@@H]1CC(=NOC(=O)c2ccc(F)cc2)C3	ZINC000000191120	O=C(ON=C1CC2CCC(C1)N2)c3ccccc3
COc3c1OCOc1cc2CC[N+](C)(C)[C@H](NC(N)=O)c23	ZINC000000488688	C3Cc2cc1OCOc1cc2CN3
Fc3cccc(S(=O)(=O)NCC(=O)Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c3	ZINC000009130201	O=C(CNS(=O)(=O)c1ccccc1)Nc3ccc(S(=O)(=O)Nc2ncccn2)cc3
COc3ccc(OC)c(Nc2cc(c1ccccc1)nc(N)n2)c3	ZINC000000092771	N(c1ccccc1)c3cc(c2ccccc2)ncn3
CCC[C@@H](C)NC(=O)c1ccc(OC)c(OC)c1	ZINC000000030371	c1ccccc1
Nc4ccc(CN3CCN(c2ccc1ccccc1n2)CC3)cc4	ZINC000000110981	C3CN(c2ccc1ccccc1n2)CCN3Cc4ccccc4
CCOC(=O)c2[nH]c1ccc(C)cc1c2NC(=O)\C=C\c3ccccc3	ZINC000000325885	O=C(Nc1c[nH]c2ccccc12)C=Cc3ccccc3
Cc1ccccc1C2(O)CCNCC2	ZINC000000347518	C2CC(c1ccccc1)CCN2
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
Cc3cccc(N1C(=N)NC(=N)NC12CCCCC2)c3	ZINC000000203634	N=C3NC(=N)N(c1ccccc1)C2(CCCCC2)N3
CCOC(=O)c2c(NC(=O)CNC(C)C)sc1CCCCc12	ZINC000000131692	C2CCc1sccc1C2
CCOc2ccc(CC(=O)Nc1ccc(C(N)=O)cc1)cc2OCC	ZINC000000072317	O=C(Cc1ccccc1)Nc2ccccc2
COc3ccc(OC)c(C(=O)c2oc1ccccc1c2NC(C)=O)c3	ZINC000000051446	O=C(c1ccccc1)c3cc2ccccc2o3
CC(=O)Oc1ccccc1OCc2nn(C(C)=O)c3ccccc23	ZINC000000035277	C(Oc1ccccc1)c2n[nH]c3ccccc23
COC(=O)c1cc(OC)c(OC)c(OC)c1	ZINC000000057165	c1ccccc1
CCCC(=O)NCCc2nc1ccccc1n2CC(=O)c3ccccc3	ZINC000000201047	O=C(Cn1cnc2ccccc12)c3ccccc3
COc1ccccc1NS(=O)(=O)c3ccc2ccccc2c3	ZINC000000024337	O=S(=O)(Nc1ccccc1)c3ccc2ccccc2c3
CN2CCC([N@@](C)Cc1ccccc1)CC2	ZINC000000202093	C2CC(NCc1ccccc1)CCN2
COc2ccc(C[N@]1CCC[C@@H](O)C1)cc2C	ZINC000000199278	C2CCN(Cc1ccccc1)CC2
COc2nc(NCc1cccnc1)nc(OC)n2	ZINC000000034188	C(Nc1ncncn1)c2cccnc2
CC(=O)Oc4cccc(N3C(=O)[C@H]2[C@H]1C[C@H](C=C1)[C@H]2C3=O)c4	ZINC000000043129	O=C3C2C1CC(C=C1)C2C(=O)N3c4ccccc4
Cn2nnc(C1=CCCNC1)n2	ZINC000000004001	C2CC=C(c1nn[nH]n1)CN2
CCOC(=O)N2CCC(NCc1ccc(F)cc1)CC2	ZINC000000220176	C2CC(NCc1ccccc1)CCN2
CCN4CCN(c3ccc(Nc1ccnc2ccccc12)cc3)CC4	ZINC000000034183	C4CN(c3ccc(Nc1ccnc2ccccc12)cc3)CCN4
COCCC[N@@](CCNC(=O)c3sc2ncnc(N1CCN(C)CC1)c2c3C)Cc4ccco4	ZINC000033266114	O=C(NCCNCc1ccco1)c4cc3c(N2CCNCC2)ncnc3s4
CCOc2cc(C(=O)N1CCN(C)CC1)cc(OCC)c2OCC	ZINC000000263712	O=C(N1CCNCC1)c2ccccc2
CNS(=O)(=O)c1cnccc1N2CCN(C(C)C)CC2	ZINC000000481271	C2CN(c1ccncc1)CCN2
CC(C)NC(=O)c2ccc(N1CCN(C(C)C)CC1)nc2	ZINC000000480516	C2CN(c1ccccn1)CCN2
COc4ccc([C@H]3COc2cc1OCOc1cc2C3)cc4	ZINC000000002773	C4Oc3cc2CC(c1ccccc1)COc2cc3O4
CC(=O)N[C@@H]2[C@H](O)C[C@](Oc1ccc(N(=O)=O)cc1)(C(O)=O)O[C@@H]2[C@H](O)[C@H](O)CO	ZINC000004557184	C2CCC(Oc1ccccc1)OC2
CCc3ccc(NC(=O)NCC[N@]2CCc1ccccc1C2)cc3	ZINC000000249989	O=C(NCCN2CCc1ccccc1C2)Nc3ccccc3
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
CC1=[N+](C)C(C)(C)N(O)C1(C)C	ZINC000000389545	C1NCN=C1
Cn2nc(C(=O)Nc1ccccc1)cc2C(=O)Nc3ccccc3	ZINC000000044289	O=C(Nc1ccccc1)c3cc(C(=O)Nc2ccccc2)[nH]n3
CCOC(=O)c1cc(C#N)c(C)nc1N2CCNCC2	ZINC000000066372	C2CN(c1ccccn1)CCN2
CC(NNc1nncc2ccccc12)=C3C(=O)CC(C)(C)CC3=O	ZINC000000268723	O=C1CCCC(=O)C1=CNNc2nncc3ccccc23
NC(=O)c2nc(c1ccccc1)cn(=O)c2N	ZINC000000331354	O=n2ccnc(c1ccccc1)c2
CN2CCC(N(C)S(=O)(=O)c1ccc(F)cc1)CC2	ZINC000000111161	O=S(=O)(NC1CCNCC1)c2ccccc2
COc2ccc(C(=S)N1CCN(C)CC1)cc2Br	ZINC000000313662	S=C(N1CCNCC1)c2ccccc2
CCOc2ccc(N(CC(=O)NC1CCCC1)S(C)(=O)=O)cc2	ZINC000000036562	O=C(CNc1ccccc1)NC2CCCC2
O=c2[nH]cc(N=Cc1cccnc1)c(=O)[nH]2	ZINC000000186985	O=c2[nH]cc(N=Cc1cccnc1)c(=O)[nH]2
COc3ccc(CC(=O)Nc2sc1CCCCc1c2C#N)cc3	ZINC000000052013	O=C(Cc1ccccc1)Nc3cc2CCCCc2s3
CCN2CCC(N[C@@H](C)c1ccc(F)cc1)CC2	ZINC000000213540	C2CC(NCc1ccccc1)CCN2
Clc3ccc(NC(=O)N2CCC[N@@](Cc1ccccc1)CC2)cc3	ZINC000000066413	O=C(Nc1ccccc1)N3CCCN(Cc2ccccc2)CC3
O=C(OC(CN1CCCCC1)CN2CCCCC2)c3ccccc3	ZINC000000173906	O=C(OC(CN1CCCCC1)CN2CCCCC2)c3ccccc3
CCN(CC)S(=O)(=O)c3ccc(O)c(NC(=O)Cn2[nH]c(=O)c1ccccc1c2=O)c3	ZINC000012848496	O=C(Cn2[nH]c(=O)c1ccccc1c2=O)Nc3ccccc3
N=C1NC[C@H]3N1c2ccccc2Cc4ccccc34	ZINC000000006157	N=C1NCC3N1c2ccccc2Cc4ccccc34
C[C@@](Cc1ccccc1)(NC(=O)CN)c2ccccc2	ZINC000000228297	C(Cc1ccccc1)c2ccccc2
COC(=O)c2ccc(C[N+](=O)c1ccccc1)cc2	ZINC000000080322	O=[N+](Cc1ccccc1)c2ccccc2
CC(=O)NCCc3ccc(S(=O)(=O)Nc2ccc(C)c(S(=O)(=O)N1CCOCC1)c2)cc3	ZINC000009289318	O=S(=O)(Nc2cccc(S(=O)(=O)N1CCOCC1)c2)c3ccccc3
Cc4cccc(N3C(=O)C[C@@H]([N@]2CCc1ccccc1C2)C3=O)c4	ZINC000000382553	O=C3CC(N2CCc1ccccc1C2)C(=O)N3c4ccccc4
CSC1=NCCN1CC(=O)c2ccc(C)cc2	ZINC000000167185	O=C(CN1CCN=C1)c2ccccc2
CN(C)CCNC(=O)c3cccc4c(Nc1ccc(S(=O)(=O)NC(N)=N)cc1)c2ccccc2nc34	ZINC000005616074	N(c1ccccc1)c3c2ccccc2nc4ccccc34
CCN4CCN(c2ncnc3sc1CCCc1c23)CC4	ZINC000000127392	C4Cc3sc2ncnc(N1CCNCC1)c2c3C4
C[N@]2CC[C@@](OC(C)=O)(c1ccccc1)C(C)(C)C2	ZINC000000097856	C2CC(c1ccccc1)CCN2
CN(Cc1ccccc1)C(=O)c3ccc2OCOc2c3	ZINC000000030208	O=C(NCc1ccccc1)c3ccc2OCOc2c3
O=C(NCc1ccccn1)\C=C\C(=O)c2cccc(N(=O)=O)c2	ZINC000000035258	O=C(NCc1ccccn1)C=CC(=O)c2ccccc2
CC3(C)CC(Nc2noc(c1ccccc1)n2)CC(C)(C)N3	ZINC000000092195	C3CC(Nc2noc(c1ccccc1)n2)CCN3
CN(CCNC(N)=N)c1ccccc1	ZINC000000112939	c1ccccc1
Cn1ccnc1SCC(=O)Nc2cccc(Cl)c2Cl	ZINC000000040594	O=C(CSc1ncc[nH]1)Nc2ccccc2
CC24CN1CC[N@@](CC(C1)/C2=N/N=C/c3ccc(N(=O)=O)cc3)C4	ZINC000000027973	C1CN2CC3CN1CC(C2)C3=NN=Cc4ccccc4
Clc2cccc(NC(=O)c1cccnc1)c2Cl	ZINC000000029320	O=C(Nc1ccccc1)c2cccnc2
Cc1nnsc1C(=O)NC3CCN(Cc2ccccc2)CC3	ZINC000000119758	O=C(NC2CCN(Cc1ccccc1)CC2)c3cnns3
Cc3ccc(N2C(=O)C[C@H](NCCc1ccc(F)cc1)C2=O)cc3	ZINC000000084266	O=C2CC(NCCc1ccccc1)C(=O)N2c3ccccc3
COc3ccc(N2C(=O)C[C@H](NCc1ccncc1)C2=O)cc3	ZINC000000181404	O=C2CC(NCc1ccncc1)C(=O)N2c3ccccc3
CC(C)(C)c2cc(C[C@@H]1SCNC1=O)cc(C(C)(C)C)c2O	ZINC000000002274	O=C1NCSC1Cc2ccccc2
CC(C)C[C@@H](NC(=O)[C@@H]1CCC(=O)N1C(=O)OCc2ccccc2)C(=O)NCC(O)=O	ZINC000012296161	O=C1CCCN1C(=O)OCc2ccccc2
CCNC1(C(N)=O)CCNCC1	ZINC000000410143	C1CCNCC1
COc2cccc([C@@]1(O)CCCC[C@@H]1CN(C)C)c2	ZINC000000000853	C2CCC(c1ccccc1)CC2
NC(=N)c2cccc(c1ccnc(C(N)=N)n1)c2	ZINC000000011930	c2ccc(c1ccncn1)cc2
O=c3oc1ccccc1c(N2CCCC2)c3CN4CCCC4	ZINC000000236909	O=c3oc1ccccc1c(N2CCCC2)c3CN4CCCC4
OC[C@@H]2CCC[N@@](Cc1ccc(F)cc1F)C2	ZINC000000209445	C2CCN(Cc1ccccc1)CC2
CN2CCN(c1ccc(NC(=S)NC(C)=O)cc1)CC2	ZINC000000359981	C2CN(c1ccccc1)CCN2
CN(C)CCNC(=O)N2CCN(c1ccccc1Cl)CC2	ZINC000000024590	C2CN(c1ccccc1)CCN2
CCC[N@]2CC[C@@H](CNC(=O)NCCC(=O)N1CCN(C)CC1)C2	ZINC000054511216	O=C(NCCC(=O)N1CCNCC1)NCC2CCNC2
CCN(CC)C(=O)c1ccc[n+](CC)c1	ZINC000000286916	c1ccncc1
Cc3ccc(NCn2c(=O)c1ccc(N(=O)=O)cc1c2=O)nc3	ZINC000000179253	O=c2n(CNc1ccccn1)c(=O)c3ccccc23
C[n+]2cc(C(=O)NCC[N+](C)(C)Cc1ccccc1)ccc2\C=N\O	ZINC000000174443	O=C(NCCNCc1ccccc1)c2cccnc2
C[C@H]4CCC[N@@](Cn2c(=O)/c(=N/c1ccc(C)cc1)c3ccccc23)C4	ZINC000000202071	O=c3n(CN1CCCCC1)c2ccccc2c3=Nc4ccccc4
Cn2nnc([C@H](O)CN1CCCCC1)n2	ZINC000000248343	C2CCN(CCc1nn[nH]n1)CC2
CN(C)CCNC(=O)c2cccc3ccc(c1ccncc1)nc23	ZINC000000024932	c3ccc2nc(c1ccncc1)ccc2c3
CCOc1ccccc1N(CC(=O)NCc2ccc(OC)cc2)S(=O)(=O)c3ccc(C)cc3	ZINC000000622306	O=C(CN(c1ccccc1)S(=O)(=O)c2ccccc2)NCc3ccccc3
S=C(NC1CC1)N4CCC[N@@](Cc2cccc3ccccc23)CC4	ZINC000000066637	S=C(NC1CC1)N4CCCN(Cc2cccc3ccccc23)CC4
CCOC(=O)Nc1cccc2nsnc12	ZINC000000034329	c2ccc1nsnc1c2
O=C(N2CCN(C1CCCC1)CC2)c3ccco3	ZINC000000115855	O=C(N2CCN(C1CCCC1)CC2)c3ccco3
Nc3c(c1nnnn1c2ccccc2)cnc4ccccc34	ZINC000000119488	c4ccc(n1nnnc1c3cnc2ccccc2c3)cc4
O[C@](C#CCN1CCCC1)(C2CCCC2)c3ccccc3	ZINC000000198383	C3CCC(C(C#CCN1CCCC1)c2ccccc2)C3
CCOc2cccc(OCC)c3c(C)[n+](C[C@@H]1CCCO1)c(C)c23	ZINC000000198839	C3COC(C[n+]2cc1cccccc1c2)C3
C2Cc1ccccc1C5=C2[C@@H](c3cccs3)n4[nH]cnc4=N5	ZINC000000038307	C2Cc1ccccc1C5=C2C(c3cccs3)n4[nH]cnc4=N5
CCC[N@]1CC[C@@H]2[C@H]1CCc3cccc(C(N)=O)c23	ZINC000000005617	C3CC1C(CCc2ccccc12)N3
CCNc1nc(C)c(N)c(NCC)n1	ZINC000000330504	c1cncnc1
C3CCC(N2CCC(N1CCOCC1)CC2)CC3	ZINC000000207733	C3CCC(N2CCC(N1CCOCC1)CC2)CC3
CN(C(C)=O)c2ccc(NC(=O)c1ccco1)cc2	ZINC000000031645	O=C(Nc1ccccc1)c2ccco2
COC(=O)c1cccc(CN)c1	ZINC000000153955	c1ccccc1
CC(C)(C)OC(=O)NC1CCC(CN)CC1	ZINC000000153953	C1CCCCC1
NC(=O)C3CCN(Cc1c(O)ccc2ccccc12)CC3	ZINC000000032115	C3CCN(Cc1cccc2ccccc12)CC3
CN4CCN(c3nnc(c1ccccc1)c(c2ccccc2)n3)CC4	ZINC000000159566	C4CN(c3nnc(c1ccccc1)c(c2ccccc2)n3)CCN4
CCn1ncc5c1ncc4c(n2cnc(C(=O)NC)c2)nnc(NCc3ccc(OC)c(Cl)c3)c45	ZINC000000589513	C(Nc3nnc(n1ccnc1)c4cnc2[nH]ncc2c34)c5ccccc5
COc3ccc(C(=O)Cn2nc(Cc1ccccc1)oc2=S)c(F)c3	ZINC000000622874	O=C(Cn2nc(Cc1ccccc1)oc2=S)c3ccccc3
C3CCN(C[C@@H]2COC1(CCCC1)O2)C3	ZINC000000185903	C3CCN(CC2COC1(CCCC1)O2)C3
Cc1cccc(C)c1NC(=O)CN4CCN(C(=O)Cn3nc(C(O)=O)c2ccccc2c3=O)CC4	ZINC000010483692	O=C(CN3CCN(C(=O)Cn2ncc1ccccc1c2=O)CC3)Nc4ccccc4
Fc2ccc(NC(=O)Cn1ccc(N(=O)=O)n1)c(F)c2	ZINC000000033460	O=C(Cn1cccn1)Nc2ccccc2
N[C@H](CCOc3ccc(C(=O)C(=O)N[C@H]2CN([C@@H](C(O)=O)c1ccc(O)cc1)C2=O)cc3)C(O)=O	ZINC000014614221	O=C(NC2CN(Cc1ccccc1)C2=O)C(=O)c3ccccc3
COc2ccc([C@H](N1CCCC1)C(N)=O)cc2	ZINC000000393748	C2CCN(Cc1ccccc1)C2
COc1cccc(OC)c1C(=O)Nc3ccc(C(=O)Oc2ccccc2)c(O)c3	ZINC000000622478	O=C(Nc2ccc(C(=O)Oc1ccccc1)cc2)c3ccccc3
CC(C)[N@]1CCc2c(C1)sc(N)c2C#N	ZINC000000049943	C2Cc1ccsc1CN2
C2C[C@H](COc1cccnc1)N2	ZINC000000018377	C2CC(COc1cccnc1)N2
CS(=O)(=O)N4CCN(C2C1CC3CC(C1)CC2C3)CC4	ZINC000000285107	C4CN(C2C1CC3CC(C1)CC2C3)CCN4
C3CN=C(CN(Cc1ccccc1)c2ccccc2)N3	ZINC000000057204	C3CN=C(CN(Cc1ccccc1)c2ccccc2)N3
COc2ccc(NC(=O)CN1CCCCC1)cc2	ZINC000000124554	O=C(CN1CCCCC1)Nc2ccccc2
C[C@@H](N)Cc1ccc(Cl)cc1	ZINC000000120261	c1ccccc1
COc1cc(NC(=O)CCN)cc2ccccc12	ZINC000000057200	c2ccc1ccccc1c2
Cc4ccc([C@@]2(O)CN1CCCSC1=[N+]2Cc3ccccc3)cc4	ZINC000000239738	C4CSC3=[N+](Cc1ccccc1)C(c2ccccc2)CN3C4
C[C@@H](CN1CCCC1)OC(=O)c2ccccc2Cl	ZINC000000210709	O=C(OCCN1CCCC1)c2ccccc2
CN(CC(F)F)C(=O)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1	ZINC000668225720	C1CCC=CC1
COc3cccc(C(=O)N2CCN([C@@H]1CCC[C@@H](C)C1)CC2)c3OC	ZINC000000239661	O=C(N2CCN(C1CCCCC1)CC2)c3ccccc3
NC(=N)NN=C(C[n+]1ccccc1)c2ccc(N(=O)=O)cc2	ZINC000006567673	N=C(C[n+]1ccccc1)c2ccccc2
C1C[N+]3(CCO1)Cc2ccccc2C3	ZINC000000206959	C1C[N+]3(CCO1)Cc2ccccc2C3
CCc3cc2c(N1CCN(C)CC1)ncnc2s3	ZINC000000236050	C3CN(c1ncnc2sccc12)CCN3
O[C@@H](CNC[C@H]1CCCO1)Cn3c2ccccc2c4ccccc34	ZINC000000277126	C(CNCC1CCCO1)Cn3c2ccccc2c4ccccc34
NNS(=O)(=O)c1cccc2cccnc12	ZINC000000193260	c2ccc1ncccc1c2
COc2ccc1sc(C)[n+](CCO)c1c2	ZINC000000236058	c2ccc1scnc1c2
CC1(C)NC(=N)NC(=N)N1c2ccccc2C(F)(F)F	ZINC000000071375	N=C2NCN(c1ccccc1)C(=N)N2
CC(C)[C@@](O)([C@H](C)O)C(=O)OC[C@@H]1CC[N@]2CCC[C@@H]12	ZINC000000113464	C2CC1CCCN1C2
CC1(C)NC(=N)NC(=N)N1c2c(Cl)cccc2Cl	ZINC000000071371	N=C2NCN(c1ccccc1)C(=N)N2
COC(=O)c3c(OCCN1CCCCC1)cc(=O)n4CC[N@](Cc2ccc(OC)cc2)CCc34	ZINC000014882719	O=c4cc(OCCN1CCCCC1)cc3CCN(Cc2ccccc2)CCn34
COc3ccc(S(=O)(=O)NCc2ccc1OCOc1c2)c(C)c3C	ZINC000000079694	O=S(=O)(NCc2ccc1OCOc1c2)c3ccccc3
CC(C)[C@@H](CO)Nc3nc(Nc1cccc(Cl)c1)c2ncn(C(C)C)c2n3	ZINC000000582580	N(c1ccccc1)c2ncnc3[nH]cnc23
C[C@@H](N)[C@@H](O)c1cccc(O)c1	ZINC000000018079	c1ccccc1
Cc1ncccc1OC[C@@H]2CCCN2	ZINC000000006562	C2CNC(COc1cccnc1)C2
Cc2c(CCN)c1ccccc1n2Cc3ccccc3	ZINC000000188171	C(c1ccccc1)n2ccc3ccccc23
COc3cc2nc(N1CCN(CC=C)CC1)nc(N)c2cc3OC	ZINC000000002016	C3CN(c2ncc1ccccc1n2)CCN3
Cc2n(C)c1ccccc1[n+]2C[C@@H](O)COC3CCCCC3	ZINC000000110086	C3CCC(OCCC[n+]1c[nH]c2ccccc12)CC3
C[N@]2CC[C@@H]1CN3CCc4cccc([C@@H]1C2)c34	ZINC000000016077	C2CC1CN3CCc4cccc(C1CN2)c34
Cc1cccc(C)c1NC(=O)CN2CCCC2	ZINC000000002011	O=C(CN1CCCC1)Nc2ccccc2
CC(C)(CN1CCCCC1)NS(=O)(=O)c2ccc(Cl)cc2	ZINC000000284040	O=S(=O)(NCCN1CCCCC1)c2ccccc2
COc2cc1CC[N@](C)Cc1cc2O	ZINC000000338406	C2Cc1ccccc1CN2
Cn1c(=O)n(C)c2cc(CN)ccc12	ZINC000000215305	O=c2[nH]c1ccccc1[nH]2
C[C@H](N)CCCC(C)(C)O	ZINC000000402956	nonring
COc2cc(CNC1CCCCCC1)c(N(=O)=O)cc2OC	ZINC000000263064	C2CCCC(NCc1ccccc1)CC2
C[N@]3CC[C@@]15[C@H]2CCC(=O)[C@@H]1Oc4c(O)ccc(C[C@H]23)c45	ZINC000000402954	O=C1CCC2C3Cc4cccc5OC1C2(CCN3)c45
C4CN(c2ncnc3n(c1ccccc1)ncc23)CCN4	ZINC000000410942	C4CN(c2ncnc3n(c1ccccc1)ncc23)CCN4
Clc1cc(N(=O)=O)ccc1Oc3ccc(C2=NCCN2)cc3	ZINC000000349349	C3CN=C(c2ccc(Oc1ccccc1)cc2)N3
CC(C)NC(=O)c2nc1ncc(C=O)cn1n2	ZINC000000333665	c2cnc1ncnn1c2
C(NCc1ccccn1)c2cccnc2	ZINC000000333229	C(NCc1ccccn1)c2cccnc2
Cc4ccc(Cn2c1=NCCn1c3ccccc23)cc4	ZINC000000182195	C1Cn3c(=N1)n(Cc2ccccc2)c4ccccc34
COc2ccc1NC(NC(C)C)=NS(=O)(=O)c1c2	ZINC000000009291	O=S2(=O)N=CNc1ccccc12
C[N@]1CCC[C@@H]1CCSc2ccccn2	ZINC000000023860	C2CNC(CCSc1ccccn1)C2
CCOC(=O)c1c(C)c(C)sc1NC(=O)CN2CCCCCC2	ZINC000000027746	O=C(CN1CCCCCC1)Nc2cccs2
CCc2ccc(NC(=O)[C@@H](C)Oc1cccc(Br)c1)cc2	ZINC000000150379	O=C(COc1ccccc1)Nc2ccccc2
CC(C)(C)c1nc(N)c(N)c(N)n1	ZINC000000343427	c1cncnc1
CC[C@@H](C(=O)Nc1ccccc1NC(=O)c2ccco2)c3ccccc3	ZINC000000367915	O=C(Cc1ccccc1)Nc2ccccc2NC(=O)c3ccco3
COc1ccccc1CC(=O)NC2C[C@@H]3CC[C@H](C2)[N@]3C	ZINC000000132892	O=C(Cc1ccccc1)NC2CC3CCC(C2)N3
CCOc1ccc(CNC(N)=N)cc1Cl	ZINC000000343841	c1ccccc1
COc4cc3C[C@H](Cc2cc[n+](Cc1ccccc1)cc2)C(=O)c3cc4OC	ZINC000000603084	O=C3C(Cc2cc[n+](Cc1ccccc1)cc2)Cc4ccccc34
COc1ccccc1CNCCn3c(=O)c4ccc5c(=O)n(CCNCc2ccccc2OC)c(=O)c6ccc(c3=O)c4c56	ZINC000049723160	O=c3n(CCNCc1ccccc1)c(=O)c4ccc6c(=O)n(CCNCc2ccccc2)c(=O)c5ccc3c4c56
Cc3c(C(=O)Nc2ccc(CN1CCCC1)cc2)cccc3N(=O)=O	ZINC000000514896	O=C(Nc2ccc(CN1CCCC1)cc2)c3ccccc3
CN3CCN(C(=S)c2ccc(OCc1ccccc1)cc2)CC3	ZINC000000573513	S=C(N1CCNCC1)c3ccc(OCc2ccccc2)cc3
NCCc2nc(c1ccccc1)n[nH]2	ZINC000000262700	c2ccc(c1nc[nH]n1)cc2
COc1ccc(Cl)cc1N(CC(=O)Nc2ccc(C)c(Cl)c2)S(=O)(=O)c3ccccc3	ZINC000000621919	O=C(CN(c1ccccc1)S(=O)(=O)c2ccccc2)Nc3ccccc3
O=C(NCCNc3ccc(NCCNC(=O)[C@@H]1CCCN1)c4c(=O)c2ccccc2c(=O)c34)[C@@H]5CCCN5	ZINC000005542841	O=C(NCCNc3ccc(NCCNC(=O)C1CCCN1)c4c(=O)c2ccccc2c(=O)c34)C5CCCN5
CN(C)C[C@H](c1ccc(O)cc1)C2(O)CCCCC2	ZINC000000009342	C2CCC(Cc1ccccc1)CC2
CN(C)c1ccncc1C(=O)Nc2ccc(F)cc2F	ZINC000000078582	O=C(Nc1ccccc1)c2cccnc2
Cn1cccc1C(=O)NC(=O)COC(=O)CNS(=O)(=O)c2ccc(F)c(F)c2F	ZINC000010898252	O=C(COC(=O)CNS(=O)(=O)c1ccccc1)NC(=O)c2ccc[nH]2
COC5=C[C@]14CCC[N@]1CCc3cc2OCOc2cc3[C@@H]4[C@H]5O	ZINC000000402821	C5CN4CCc2cc1OCOc1cc2C3CC=CC34C5
CC(C)n1c(N(C)C)nc2n(C)c(=O)[nH]c(=O)c12	ZINC000000322270	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
NC(N)=NOCCOc3ccc2[nH]c(C(=O)NC[C@@H](NS(=O)(=O)c1ccccc1)C(O)=O)cc2c3	ZINC000028391363	O=C(NCCNS(=O)(=O)c1ccccc1)c3cc2ccccc2[nH]3
C5CCN(CCn3c1ccccc1c4nc2ccccc2nc34)CC5	ZINC000000067762	C5CCN(CCn3c1ccccc1c4nc2ccccc2nc34)CC5
CC(C)[C@@](O)(C#CCN1CCCCCC1)c2ccccc2	ZINC000000198373	C2CCCN(CC#CCc1ccccc1)CC2
OCNc4nc3c1ccccc1nc(CCN2CCCCC2)n3n4	ZINC000000357612	C4CCN(CCc2nc1ccccc1c3ncnn23)CC4
C[C@@H]2C[N@](C(C)(C)C)C[C@](O)(c1ccccc1)C2	ZINC000000051110	C2CNCC(c1ccccc1)C2
CCNc1ccc(S(=O)(=O)N(C)C)cc1NS(=O)(=O)c2cc(C(=O)OC)cc(C(=O)OC)c2	ZINC000010512550	O=S(=O)(Nc1ccccc1)c2ccccc2
COc3ccc(C(=O)Nc2sc1CCCCc1c2CN(C)C)cc3	ZINC000000189997	O=C(Nc2cc1CCCCc1s2)c3ccccc3
C[C@H]2C\C(=N\OC(=O)COc1ccc(Cl)cc1)[C@@H](C)C[N@]2C	ZINC000000189999	O=C(COc1ccccc1)ON=C2CCNCC2
COc3ccc(C(=O)Nc1sc(C)c(C)c1CN2CCCC2)cc3	ZINC000000082238	O=C(Nc1sccc1CN2CCCC2)c3ccccc3
O=C(c1ccccc1)n2cc(N(=O)=O)cn2	ZINC000000037183	O=C(c1ccccc1)n2cccn2
CCCN(CCC)C(=O)c1ccc(OC)cc1	ZINC000000029527	c1ccccc1
NCc3ccc(CNC(=O)CC(=O)NCc2ccc(CNC(=O)CC(=O)NCc1ccc(CN)cc1)cc2)cc3	ZINC000026397546	O=C(CC(=O)NCc2ccc(CNC(=O)CC(=O)NCc1ccccc1)cc2)NCc3ccccc3
COC(=O)c1ccc([C@@H](C)N(C)C)o1	ZINC000000182990	c1ccoc1
Cc2c(c1ccccc1)n(C)c(=O)n2C4CCN(Cc3ccccc3)CC4	ZINC000000592273	O=c2[nH]c(c1ccccc1)cn2C4CCN(Cc3ccccc3)CC4
C[C@@H](Cc1ccc(F)cc1)N2CCC(C(N)=O)CC2	ZINC000000213302	C2CCN(CCc1ccccc1)CC2
CN3C(=O)C[C@H](N2CCC(N1CCCCC1)(C(N)=O)CC2)C3=O	ZINC000000127739	O=C3CC(N2CCC(N1CCCCC1)CC2)C(=O)N3
COC(=O)CNS(=O)(=O)c1ccc(F)cc1	ZINC000000183462	c1ccccc1
Oc3c([C@H](N1CCCC1)c2ccc(Cl)cc2)ccc4cccnc34	ZINC000000038269	C4CCN(C(c1ccccc1)c3ccc2cccnc2c3)C4
CN(C)C(=O)c2ccc(CC1CCNCC1)cc2	ZINC000000008347	C2CC(Cc1ccccc1)CCN2
CCCc2nn(c1ccc(F)cc1)c(=O)c2=CNCC3CCNCC3	ZINC000000054352	O=c2n(c1ccccc1)ncc2=CNCC3CCNCC3
COc1ccccc1CN[C@@H]2CCCC[C@@H]2C	ZINC000000183464	C2CCC(NCc1ccccc1)CC2
CCOc2ccc(NC(=O)NCC[N@]1[C@@H](C)CCC[C@H]1C)cc2	ZINC000000250022	O=C(NCCN1CCCCC1)Nc2ccccc2
COC(=O)[C@H](Cc1cnc[nH]1)NCc2ccccc2	ZINC000000402730	C(Cc1cnc[nH]1)NCc2ccccc2
CCN(CC)CCOc1ccccc1n2c(C)ccc2c3ccccc3	ZINC000000001603	c3ccc(c1cccn1c2ccccc2)cc3
NCC(O)(c1ccc(Cl)cc1)c2ccc(Cl)cc2	ZINC000000053230	C(c1ccccc1)c2ccccc2
OC[C@H]2O[C@@H](n1cc(Br)c(=O)n(CCCCCCCC[P@@](O)(O)=O)c1=O)[C@H](O)[C@@H]2O	ZINC000045357386	O=c2ccn(C1CCCO1)c(=O)[nH]2
OC1C[C@@H]2CC[C@H](C1)[N@]2CCc3ccccc3	ZINC000000027584	C1CC2CCC(C1)N2CCc3ccccc3
CN1[C@H]3CC[C@@H]1CC(NCCc2ccccc2)C3	ZINC000000027586	C(Cc1ccccc1)NC2CC3CCC(C2)N3
Cc1nccn1Cc2ccncc2	ZINC000000008508	C(c1ccncc1)n2ccnc2
CC4(C)C(=O)Nc3cc2[nH]c(c1ccncc1)nc2cc34	ZINC000000000883	O=C4Cc3cc2nc(c1ccncc1)[nH]c2cc3N4
Cn3c(SCC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(O)=O)nnc3[C@@H]4CCS(=O)(=O)C4	ZINC000013405542	O=C(CSc2nnc(C1CCS(=O)(=O)C1)[nH]2)NCCc3c[nH]c4ccccc34
COCc2cc(C)c1c(N)c(C(N)=O)sc1n2	ZINC000000036747	c2cnc1sccc1c2
NC(N)=NN2Cc1c(Cl)ccc(Cl)c1C2	ZINC000000000886	C1NCc2ccccc12
Cc2cc(CN1CCCCC1)cc(C)c2O	ZINC000000036218	C2CCN(Cc1ccccc1)CC2
C[C@@H]2C[C@@H](Nc1ccc(C(C)=O)cc1)NC(=S)N2	ZINC000000037344	S=C2NCCC(Nc1ccccc1)N2
NC(=N)NC(=N)Nc1ccc(SC(F)F)cc1	ZINC000000351509	c1ccccc1
Cc2[nH]c(N)nc3nc(=O)n(c1ccccc1)c(=O)c23	ZINC000000301212	O=c2nc1nc[nH]cc1c(=O)n2c3ccccc3
CC(=O)N2CCC(NCCc1ccccc1)CC2	ZINC000000212327	C2CC(NCCc1ccccc1)CCN2
CN(C)C(=O)Oc1cc(OC(=O)N(C)C)cc([C@@H](O)CNC(C)(C)C)c1	ZINC000000597556	c1ccccc1
OCCN(CCO)Cc1cc(F)ccc1F	ZINC000000213230	c1ccccc1
CC(=O)NCCc2cccc3ccc1OCC=Cc1c23	ZINC000000020591	C3Oc2ccc1ccccc1c2C=C3
CCN(C)C(=O)Oc1cccc([C@H](C)N(C)C)c1	ZINC000000004413	c1ccccc1
CN2CCC(N(C)S(=O)(=O)c1ccccc1N(=O)=O)CC2	ZINC000000125679	O=S(=O)(NC1CCNCC1)c2ccccc2
Cn3c(NCc1c[nH]c2ccccc12)nc4ccccc34	ZINC000000099267	C(Nc2nc1ccccc1[nH]2)c3c[nH]c4ccccc34
CC(C)CC[n+]1ccc(C(N)=O)cc1	ZINC000000394263	c1ccncc1
Oc2ccc(C=Nc1nnc[nH]1)c(O)c2	ZINC000000039805	C(=Nc1nnc[nH]1)c2ccccc2
COc3ccc(N(CC(=O)NCc1ccc(Cl)cc1)S(=O)(=O)c2ccccc2)cc3OC	ZINC000000622310	O=C(CN(c1ccccc1)S(=O)(=O)c2ccccc2)NCc3ccccc3
Cc4ccc3n2CCN[C@H]1CCCc(c12)c3c4	ZINC000000000641	C2CC1NCCn3c1c(C2)c4ccccc34
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC[C@@H](O)[C@H](Cc2ccccc2)NC(=O)OC(C)(C)CN	ZINC000027523247	C(CCc1ccccc1)CNCCCCc2ccccc2
C[C@H](NC(=O)[C@@H](N)CCCCNC(=O)Cc2c(C)c1cc(S(O)(=O)=O)c(N)cc1oc2=O)C(O)=O	ZINC000029053949	O=c2ccc1ccccc1o2
O=C(OCCN1CCCCC1)[C@H]2CC2(c3ccccc3)c4ccccc4	ZINC000000000647	O=C(OCCN1CCCCC1)C2CC2(c3ccccc3)c4ccccc4
CCC[N@]1CCC[C@H]2[C@H]1COc3ccc(O)cc23	ZINC000000004090	C3CNC2COc1ccccc1C2C3
CC(C)=C[C@@H]2[C@H](C(=O)O[C@H]1CC(=O)C(CC=C)=C1C)C2(C)C	ZINC000000000088	O=C2CC(OC(=O)C1CC1)C=C2
COc3ccc(C[C@@H](C)N[C@H](C)c1cccc2ccccc12)cc3OC	ZINC000000217435	C(Cc1ccccc1)NCc2cccc3ccccc23
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
CN2CCC(N(C)Cc1ccc(C)s1)CC2	ZINC000000217927	C2CC(NCc1cccs1)CCN2
Cc2nnc(Nc1ccc(OC(F)(F)Cl)cc1)c3ccccc23	ZINC000000039058	N(c1ccccc1)c2nncc3ccccc23
O=c2c1CCNCCc1on2Cc3ccccc3	ZINC000000011254	O=c2c1CCNCCc1on2Cc3ccccc3
Cc1cc(=O)oc(C)c1C(=O)NC2CC(C)(C)NC(C)(C)C2	ZINC000000521842	O=C(NC1CCNCC1)c2ccc(=O)oc2
COc2noc1CCNCCc12	ZINC000000011259	C2Cc1cnoc1CCN2
NC(=N)Nc3ccc(C(=O)NCCCC[C@@H]2NC(=O)[C@H](CC(=O)Nc1ccc(C(N)=N)cc1)NC2=O)cc3	ZINC000028130807	O=C(CC2NC(=O)C(CCCCNC(=O)c1ccccc1)NC2=O)Nc3ccccc3
Clc2c(C(=O)OCC(=O)NCc1ccco1)sc3ccccc23	ZINC000000483644	O=C(COC(=O)c2cc1ccccc1s2)NCc3ccco3
COc3ccc(c2cs\c(=N/N1CCN(C)CC1)n2CC=C)cc3	ZINC000000392145	C3CN(N=c2[nH]c(c1ccccc1)cs2)CCN3
Clc2cc(C[n+]1ccccc1)cc(Cl)n2	ZINC000000163059	C(c1ccncc1)[n+]2ccccc2
CCN(CC)C(=O)[C@@H]2CCC[N@@](Cc1ccc(OC)c(C)c1C)C2	ZINC000000240814	C2CCN(Cc1ccccc1)CC2
Nn2c(SCC(=O)Nc1cccc(Cl)c1)nnc2c3ccco3	ZINC000000529632	O=C(CSc2nnc(c1ccco1)[nH]2)Nc3ccccc3
CC(C)n3c(=O)n(Cc2nc1ccccc1n2CCN(C)C)c4ccccc34	ZINC000000594344	O=c2[nH]c1ccccc1n2Cc4nc3ccccc3[nH]4
C=CC(=O)N1CN(C(=O)C=C)CN(C(=O)C=C)C1	ZINC000000062264	C1NCNCN1
Oc1ccccc1[C@@H](CC(=O)NC2CCCCC2)NC3CCCCC3	ZINC000000191003	O=C(CC(NC1CCCCC1)c2ccccc2)NC3CCCCC3
CN[C@@H](C)[C@@H](O)c1ccc(NS(C)(=O)=O)cc1	ZINC000000000465	c1ccccc1
CCC(=O)N(Cc2cc1cc(OC)ccc1nc2Cl)C3CCCC3	ZINC000000412375	C3CCC(NCc2cnc1ccccc1c2)C3
COC(=O)[C@@H](CN)c1c[nH]c2ccc(OC)cc12	ZINC000000000392	c2ccc1[nH]ccc1c2
CCC[N@]2CCC[C@H](c1cccc(O)c1)C2	ZINC000000000393	C2CNCC(c1ccccc1)C2
NCCc1c[nH]c2c(O)cc(O)cc12	ZINC000000388557	c2ccc1[nH]ccc1c2
CN(C)c2nc(Cl)c(c1ccccc1)c(NN)n2	ZINC000000332000	c2ccc(c1cncnc1)cc2
NCCC[C@H](N)C(=O)N[C@@H](CCCN)C(O)=O	ZINC000002561080	nonring
COC(=O)c2ccc(C[N@]1CCCC[C@@H]1C)cc2	ZINC000000213125	C2CCN(Cc1ccccc1)CC2
C[N+](C)(C)c1cnc(=O)[nH]c1	ZINC000000039052	O=c1nccc[nH]1
C4CCN(CNc2ncnc3n(CN1CCCCC1)cnc23)CC4	ZINC000000077342	C4CCN(CNc2ncnc3n(CN1CCCCC1)cnc23)CC4
CNc2nc(NN)nc(Nc1ccccc1)n2	ZINC000000310278	N(c1ccccc1)c2ncncn2
NCc1c(Cl)cc(C(F)(F)F)cc1Cl	ZINC000000110953	c1ccccc1
Cc2cc(C)n(c1nn[nH]n1)n2	ZINC000000051450	c2cnn(c1nn[nH]n1)c2
CC(C)[N+]1(C)CC[C@H](O)N1C=O	ZINC000000024324	C1CNNC1
COc3ccc(C(=O)c2cccc(C(=O)c1ccc(OC)cc1)c2)cc3	ZINC000000062606	O=C(c1ccccc1)c3cccc(C(=O)c2ccccc2)c3
CCOC(=O)c2cnc1c(CC)cccc1c2N3CCN(C)CC3	ZINC000000131539	C3CN(c1ccnc2ccccc12)CCN3
CCOc1cc(C=O)ccc1OC(=O)C2CC2	ZINC000000035829	O=C(Oc1ccccc1)C2CC2
Cc2ccc(NNC=c1c(C)c(C#N)c(=O)n(C)c1=O)cc2C	ZINC000000482688	O=c2ccc(=CNNc1ccccc1)c(=O)[nH]2
OC2CCN(Cc1cc(Br)cs1)CC2	ZINC000000040751	C2CCN(Cc1cccs1)CC2
NC2CCC(OC(=O)CNC(=O)OCc1ccccc1)CC2	ZINC000000332312	O=C(CNC(=O)OCc1ccccc1)OC2CCCCC2
O=C3C[C@@H](C(=O)Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)CN3c5ccc4OCCOc4c5	ZINC000009254176	O=C3CC(C(=O)Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)CN3c5ccc4OCCOc4c5
CN3CCC(CNC(=O)Nc1csc2ccccc12)CC3	ZINC000000159390	O=C(NCC1CCNCC1)Nc2csc3ccccc23
NC(=O)c2sc(=S)n(c1ccccc1)c2N	ZINC000000040024	S=c1sccn1c2ccccc2
CC(C)Oc3ccc(Cc2ccc(NC1=NCCN1)cc2)cc3	ZINC000000007547	C3CN=C(Nc2ccc(Cc1ccccc1)cc2)N3
CCCn2c(SCc1ccc(C)cc1)nc3n(C)c(=O)[nH]c(=O)c23	ZINC000000044051	O=c3[nH]c(=O)c2[nH]c(SCc1ccccc1)nc2[nH]3
O=C3N([C@H]1CN2CCC1CC2)C[C@@H]4CCCc5cccc3c45	ZINC000000006363	O=C3N(C1CN2CCC1CC2)CC4CCCc5cccc3c45
CO[C@H]1CNCC[C@H]1NC(=O)c2cc(Cl)c(N)cc2OC	ZINC000000404160	O=C(NC1CCNCC1)c2ccccc2
Cc2cc(N)c(=O)n(c1ccccc1)n2	ZINC000000001693	O=c1cccnn1c2ccccc2
Cc2ccc(S(=O)(=O)N/N=C/c1cccc(N(=O)=O)c1)cc2	ZINC000000028349	O=S(=O)(NN=Cc1ccccc1)c2ccccc2
NC(=O)[C@H](CCC(O)=O)NC(=O)C2=C[C@@H](NC(=O)Nc1ccc(OC(F)(F)F)cc1)[C@@H](O)[C@H](O)C2	ZINC000004221828	O=C(NC1CCCC=C1)Nc2ccccc2
CC[N@@](CCO)Cc1csc2c(Br)cccc12	ZINC000000338987	c2ccc1sccc1c2
COc3ccc(OC(=O)Nc2csc(Cc1ccsc1)n2)cc3	ZINC000000172354	O=C(Nc2csc(Cc1ccsc1)n2)Oc3ccccc3
Clc2ccc(S(=O)(=O)CCNC1CCCCC1)cc2	ZINC000000165485	O=S(=O)(CCNC1CCCCC1)c2ccccc2
NC(=O)CN4CCC(n2cc(c1cccc(O)c1)c3c(N)ncnc23)CC4	ZINC000000590741	C4CC(n2cc(c1ccccc1)c3cncnc23)CCN4
C[C@H](N)Cn1ccc3c1c2cc(C)ccc2C3(C)C	ZINC000000006387	C2c1ccccc1c3[nH]ccc23
CN(C)C(=O)c3cccc(COc2ccc(N1C(=N)NC(=N)NC1(C)C)cc2Cl)c3	ZINC000000538490	N=C3NCN(c2ccc(OCc1ccccc1)cc2)C(=N)N3
COc2ccc(NC(=O)C(C)(C)Oc1ccc(Cl)cc1)c(OC)c2	ZINC000000462011	O=C(COc1ccccc1)Nc2ccccc2
Cn1cccc1CNC[C@@H]2CCCO2	ZINC000000360271	C2COC(CNCc1ccc[nH]1)C2
CN(C)CCn2cnc3n(Cc1ccccc1)c(=O)[nH]c(=O)c23	ZINC000000485621	O=c2[nH]c(=O)c1[nH]cnc1n2Cc3ccccc3
Clc4ccc3nc(CSc2nc1ccccn1n2)cn3c4	ZINC000000084651	C(Sc2nc1ccccn1n2)c4cn3ccccc3n4
C[N@@](C[C@@H]1COCCO1)Cc2ccccc2c3nc(CN)cc(=O)[nH]3	ZINC000023541980	O=c3ccnc(c1ccccc1CNCC2COCCO2)[nH]3
Cc2ccc(CNS(=O)(=O)c1ccc(C(C)(C)C)cc1)n2C	ZINC000000033690	O=S(=O)(NCc1ccc[nH]1)c2ccccc2
O=C(NC1CC1)c3cc(C(=O)NC2CC2)cc(N(=O)=O)c3	ZINC000000031341	O=C(NC1CC1)c3cccc(C(=O)NC2CC2)c3
O=C(CN1CCCC1)NC[C@H]3COc2ccccc2O3	ZINC000000366617	O=C(CN1CCCC1)NCC3COc2ccccc2O3
Clc1cc(N(=O)=O)ccc1SC2=NCCN2	ZINC000000145426	C2CN=C(Sc1ccccc1)N2
CC(C)(O)C1CC[N+](C)(C)CC1	ZINC000000162284	C1CCNCC1
CC1(C)CNC(=O)CC(C)(C)N1	ZINC000000243136	O=C1CCNCCN1
CC(C)(C)NCC(=O)Nc3c1CCCc1nc2CCCc23	ZINC000000198574	C3Cc2cc1CCCc1nc2C3
Clc5ccc(C3CCN(CCN1C(=O)COc2ccccc12)CC3)c(C(=O)NCCN4CCNCC4)c5	ZINC000028826541	O=C2COc1ccccc1N2CCN5CCC(c3ccccc3C(=O)NCCN4CCNCC4)CC5
CCOC(=O)COc3c(Br)cc(\C=c2\nc(c1ccc(OC)cc1)oc2=O)cc3OC	ZINC000000623286	O=c2oc(c1ccccc1)nc2=Cc3ccccc3
O=C(Cn1cc(N(=O)=O)cn1)NC[C@@H]2CCCO2	ZINC000000053502	O=C(Cn1cccn1)NCC2CCCO2
NC(=O)C2(NC1CCCCC1)CCCCC2	ZINC000000066771	C2CCC(NC1CCCCC1)CC2
C[N+](C)(C)c3nc(N1CCOCC1)nc(N2CCOCC2)n3	ZINC000000054244	C3CN(c2ncnc(N1CCOCC1)n2)CCO3
COC[C@@H](N)[C@@H](O)c1ccccc1	ZINC000000409382	c1ccccc1
CCCN2CCC(N1CCCC1)CC2	ZINC000000182052	C2CCN(C1CCNCC1)C2
C3CN(Cc2ccc(c1nn[nH]n1)cc2)CCO3	ZINC000000419922	C3CN(Cc2ccc(c1nn[nH]n1)cc2)CCO3
Cc3cc(C)n2nn[n+](Cc1ccccc1)c2n3	ZINC000000040970	C(c1ccccc1)[n+]2nnn3cccnc23
CCOC(=O)c2c(N)nn(C(=O)Cc1ccccc1)c2c3ccccc3	ZINC000000612056	O=C(Cc1ccccc1)n2nccc2c3ccccc3
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c3cccc(Oc2ccccc2)c3	ZINC000000623267	N3C=CC(c2cccc(Oc1ccccc1)c2)C=C3
CCN(CC)c3ccc(NC(=O)c1c(C)onc1c2ccccc2)cc3	ZINC000000205125	O=C(Nc1ccccc1)c2conc2c3ccccc3
O=S2(=O)CC(c1ccccc1)CS(=O)(=O)C2	ZINC000000086696	O=S2(=O)CC(c1ccccc1)CS(=O)(=O)C2
Cc2ccc(C)c(COc1ccc(C)nc1N)c2	ZINC000000083201	C(Oc1cccnc1)c2ccccc2
CC2(C)CC(N1C(=O)OC(C)(C)[C@@]1(C)O)CC(C)(C)N2	ZINC000000127761	O=C1OCCN1C2CCNCC2
CC(C)N(C)S(=O)(=O)c3ccc(NC(=O)CCc2c(C)nc(N1CCOCC1)[nH]c2=O)cc3	ZINC000014417126	O=C(CCc2cnc(N1CCOCC1)[nH]c2=O)Nc3ccccc3
O=C(Nc1ccc2NS(=O)(=O)c3cccc1c23)c4ccccc4	ZINC000000034330	O=C(Nc1ccc2NS(=O)(=O)c3cccc1c23)c4ccccc4
CCO[C@H](Nc1ccc(C(O)=O)cc1)C(=O)c3ccc(c2ccccc2)cc3	ZINC000000608131	O=C(CNc1ccccc1)c3ccc(c2ccccc2)cc3
COc3ccc2N[C@@H](c1ccccc1)C(C)(C)[C@@H](OC(C)=O)c2c3	ZINC000000035134	C2Cc1ccccc1NC2c3ccccc3
CN(C)Cc2cc(C)cc(C1(C)CCCCC1)c2O	ZINC000000109660	C2CCC(c1ccccc1)CC2
CCOC(=O)c1ccc(CN)o1	ZINC000000031836	c1ccoc1
COc2ccc(N(CC(=O)Nc1cccc(Cl)c1C)S(C)(=O)=O)c(OC)c2	ZINC000000622249	O=C(CNc1ccccc1)Nc2ccccc2
COc1ccc(Cl)cc1NCCC(=O)c2ccc(OC)c(OC)c2	ZINC000000409542	O=C(CCNc1ccccc1)c2ccccc2
CCS(=O)(=O)N1CCNCC1	ZINC000000356407	C1CNCCN1
C[C@H](NC1CCC2(CC1)OCCO2)c3ccccc3	ZINC000000163524	C3COC2(CCC(NCc1ccccc1)CC2)O3
CCS(=O)(=O)N(CC(=O)N1CCCC1)c2ccc(OC)cc2	ZINC000000039333	O=C(CNc1ccccc1)N2CCCC2
CC1(C)CC4(CC(C)(C)N1)OC(=O)N3CCc2ccccc2[C@@]34C	ZINC000000105572	O=C2OC1(CCNCC1)C3N2CCc4ccccc34
COc3ccc([C@@H](O)[C@@H](CN1CCCCC1)c2ccccc2)cc3	ZINC000000353226	C3CCN(CC(Cc1ccccc1)c2ccccc2)CC3
C[C@@H](N)C(=O)Nc2ccc1ccccc1c2	ZINC000000057184	c2ccc1ccccc1c2
CN(C)CCn3c(C)cc(=c2c(=O)c1ccccc1c2=O)cc3C	ZINC000000073584	O=c2c(=c1cc[nH]cc1)c(=O)c3ccccc23
COc2cccc(NC(=O)c1cc[n+](C)cc1)c2	ZINC000000364617	O=C(Nc1ccccc1)c2ccncc2
CC[C@@]1(C)Cc3c(CO1)c(N2CCOCC2)[nH]c(=S)c3C#N	ZINC000000266623	S=c3cc1CCOCc1c(N2CCOCC2)[nH]3
Nc1nonc1n3nnc(C(=O)NCCc2ccncc2)c3CN4CCCCC4	ZINC000000594687	O=C(NCCc1ccncc1)c3nnn(c2cnon2)c3CN4CCCCC4
CN(C)c1cc(C)nc(N)c1C#N	ZINC000000192637	c1ccncc1
CCN(CC)c3ccc(n2cc1n(C)c(=O)n(C)c(=O)c1c2)cc3	ZINC000000530561	O=c3[nH]c(=O)c2cn(c1ccccc1)cc2[nH]3
CCOC(=O)C2CCN(c1ccc(N)cc1)CC2	ZINC000000169809	C2CCN(c1ccccc1)CC2
Cn1cccc1CNCc2cccnc2	ZINC000000360294	C(NCc1ccc[nH]1)c2cccnc2
CCOC(=O)CSc2nc1CCCCc1n2C(=O)c3ccc(OC)cc3	ZINC000000623463	O=C(c1ccccc1)n3cnc2CCCCc23
Cc3ccc(OC[C@H](O)CN(Cc1ccccc1)c2ccccc2)cc3	ZINC000000072611	C(COc1ccccc1)CN(Cc2ccccc2)c3ccccc3
Fc1ccccc1CN3CCN(Cc2cccc(N(=O)=O)c2)CC3	ZINC000000169372	C2CN(Cc1ccccc1)CCN2Cc3ccccc3
O=C(CSc1ncnc2[nH]cnc12)NC[C@@H]3CCCO3	ZINC000000033507	O=C(CSc1ncnc2[nH]cnc12)NCC3CCCO3
CC2(C)SC(=S)N(Cc1ccccc1)[C@@H]2[N+](=O)Cc3ccco3	ZINC000000268285	O=[N+](Cc1ccco1)C2CSC(=S)N2Cc3ccccc3
NC(=O)[C@@H]3CCC[N@@](Cc1cccn1CCN2CCOCC2)C3	ZINC000010037950	C3CCN(Cc1cccn1CCN2CCOCC2)CC3
CC3(C)CC(NC(=O)c2ccc(n1cnnn1)cc2)CC(C)(C)N3	ZINC000000036884	O=C(NC1CCNCC1)c3ccc(n2cnnn2)cc3
C[N@]2C[C@@]3(C=C)[C@@H]1C[C@H]4OC[C@@H]1[C@@H]2[C@@H]3[C@@]46C(=O)Nc5ccccc56	ZINC000000033878	O=C2Nc1ccccc1C26C4CC3C5CNC(C3CO4)C56
CN(C)c2nc(N)nc(CN(C)S(=O)(=O)c1ccccc1)n2	ZINC000000039247	O=S(=O)(NCc1ncncn1)c2ccccc2
CC(=O)N1CCCC[C@@H]1c2ccc[n+](C)c2	ZINC000000174820	C2CCC(c1cccnc1)NC2
Cc1ccsc1CNC(C)(C)CO	ZINC000000359840	c1ccsc1
CN(C)CCNS(=O)(=O)Cc1ccc(CN)cc1	ZINC000021507268	c1ccccc1
C[C@@H]([C@@H](O)c1ccccc1)[N@@](C)CC(=O)N2CCOCC2	ZINC000000525526	O=C(CNCCc1ccccc1)N2CCOCC2
CC[C@@]2(C)C[C@](CCN)(c1ccc(C)cc1)CCO2	ZINC000000171675	C2CC(c1ccccc1)CCO2
O=C(NC[n+]1ccccc1)c2ccccc2	ZINC000000408574	O=C(NC[n+]1ccccc1)c2ccccc2
C3CN(c2nc(c1ccccc1)cs2)CCN3	ZINC000000105414	C3CN(c2nc(c1ccccc1)cs2)CCN3
COc1nn(C[C@H](C)N)c3c1ccc2occc23	ZINC000000017686	c3cc2c(ccc1cn[nH]c12)o3
CN5CCN(C(=O)c4cc3c(NCCNC(N)=N)c2c(=O)c1ccccc1c(=O)c2c(NCCNC(N)=N)c3o4)CC5	ZINC000653808745	O=C(N1CCNCC1)c5cc4cc3c(=O)c2ccccc2c(=O)c3cc4o5
NCc1csc2ccccc12	ZINC000000158714	c2ccc1sccc1c2
NC(=N)c1csc2ccccc12	ZINC000000158717	c2ccc1sccc1c2
CCNc3nc(NCC)n2nc(SCC(=O)c1ccc(C)cc1C)nc2n3	ZINC000000622732	O=C(CSc2nc1ncncn1n2)c3ccccc3
CCc2s\c(=N/c1ccc(OC)cc1)n(CCO)c2c3ccc(C)cc3	ZINC000000622730	N(c1ccccc1)=c3[nH]c(c2ccccc2)cs3
CC[C@@H](C)NC(=O)Cn1nc(C(F)(F)F)c(Cl)c1C	ZINC000000028974	c1cn[nH]c1
CCOc3ccc2c(C)nc(NC1=NC(C)(C)C=C(C)N1)nc2c3	ZINC000000028976	C3C=CNC(Nc2ncc1ccccc1n2)=N3
COc2ccc([C@@H](C)N(C)C(=O)c1cccc(N(=O)=O)c1)cc2OC	ZINC000000242182	O=C(NCc1ccccc1)c2ccccc2
Clc1ccccc1NC(=O)Nc2cccc3cccnc23	ZINC000000028973	O=C(Nc1ccccc1)Nc2cccc3cccnc23
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
Cc3cccc(C(=O)ON=C2CCN(Cc1ccccc1)CC2)c3	ZINC000000478462	O=C(ON=C2CCN(Cc1ccccc1)CC2)c3ccccc3
N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O	ZINC000000057505	c2ccc1[nH]ccc1c2
COc3ccc(C(=NCc1ccc(C)cc1)c2ccc(OC)cc2)cc3	ZINC000000090476	C(N=C(c1ccccc1)c2ccccc2)c3ccccc3
C3CN(c2ccc1ccccc1n2)CCN3	ZINC000000002020	C3CN(c2ccc1ccccc1n2)CCN3
CCOC(=O)NC(=O)c1cn(CCN(C)C)c(=O)[nH]c1=O	ZINC000000481078	O=c1cc[nH]c(=O)[nH]1
CC(C)N(C[C@@H](O)CO)C(C)C	ZINC000000409167	nonring
NC(=N)Nc2nc1ccc(Cl)cc1[nH]2	ZINC000000408378	c2ccc1[nH]cnc1c2
CCC(CC)n1c(C)cc3c1ccc2nc(N)nc(N)c23	ZINC000000005734	c3ncc2c(ccc1[nH]ccc12)n3
OC[C@H](NC(=O)[C@@H]3[C@H](C(O)=O)[C@@H](c1ccccc1N(=O)=O)C=C(c2ccco2)N3c4ccncc4)C(O)=O	ZINC000005581855	C3CN(c1ccncc1)C(c2ccco2)=CC3c4ccccc4
O=C(CSc1cccc2cccnc12)NCc3ccccc3	ZINC000000036113	O=C(CSc1cccc2cccnc12)NCc3ccccc3
Oc1ccc(Br)cc1CNc3ccc2OCOc2c3	ZINC000000032307	C3Oc2ccc(NCc1ccccc1)cc2O3
CN(C)\C=N\Cc1ccccc1OC(F)(F)F	ZINC000000165248	c1ccccc1
C[N@](CCC(N)=O)Cc1ccccc1	ZINC000000227114	c1ccccc1
N[C@H]([C@@H](O)c1ccccc1)c2ccccc2	ZINC000000120668	C(Cc1ccccc1)c2ccccc2
S=C(CC(=S)N1CCOCC1)N2CCOCC2	ZINC000000027759	S=C(CC(=S)N1CCOCC1)N2CCOCC2
CN(C)CC(=O)Nc1ccccn1	ZINC000000349373	c1ccncc1
C[N@]1CCC[C@H]1CCSc2ccncc2	ZINC000000023851	C2CNC(CCSc1ccncc1)C2
Cc4ccc(c3noc(CN2CCC(Cc1ccccc1)CC2)n3)cc4	ZINC000000203395	C3CN(Cc2nc(c1ccccc1)no2)CCC3Cc4ccccc4
FC(F)(F)c4cccc(N3CCN(CCc2ccc1[nH]c(=O)sc1c2)CC3)c4	ZINC000000604739	O=c4[nH]c3ccc(CCN2CCN(c1ccccc1)CC2)cc3s4
CCOC(=O)N3CCN(CC1=CC[C@H]2C[C@@H]1C2(C)C)CC3	ZINC000000218173	C3CN(CC1=CCC2CC1C2)CCN3
Brc3ccc(OC(=O)N1CCN2CCC1CC2)cc3	ZINC000000008849	O=C(Oc1ccccc1)N2CCN3CCC2CC3
CCN(CC)CCCN3[C@@H](c2ccc1OCOc1c2)SCC3=O	ZINC000000182299	O=C3CSC(c2ccc1OCOc1c2)N3
C[N+](C)(C)CCOn2c(=O)c1ccccc1c2=O	ZINC000000406271	O=c1[nH]c(=O)c2ccccc12
CN2CCC([N@@](C)Cc1cc(C)ccc1C)CC2	ZINC000000239495	C2CC(NCc1ccccc1)CCN2
O=C(CC2CCN(CC1CC1)CC2)c3ccc(C#N)cc3	ZINC000000005428	O=C(CC2CCN(CC1CC1)CC2)c3ccccc3
Cc2[nH]c1ccc(Cl)cc1c2C3=CCNCC3	ZINC000000009350	C3CC(c1c[nH]c2ccccc12)=CCN3
CC2(C)NC(=N)NC(Nc1ccccc1Cl)=N2	ZINC000000146426	N=C2NCN=C(Nc1ccccc1)N2
CN(C)CCN(Cc1ccc(Cl)s1)c2ccccn2	ZINC000000001128	C(Nc1ccccn1)c2cccs2
CCOc1cc(C)c(C(C)C)cc1S(=O)(=O)NCc2ccccn2	ZINC000000384665	O=S(=O)(NCc1ccccn1)c2ccccc2
CN4CCN(c2nc(Nc1ccc(O)cc1)nc3ccccc23)CC4	ZINC000000250305	C4CN(c2nc(Nc1ccccc1)nc3ccccc23)CCN4
CC(C)N(CCO)CCO	ZINC000000394095	nonring
CCOC(=O)[C@H]([C@H]3CCc1c(ccc2ccccc12)C3=O)C(C)=O	ZINC000000044976	O=C1CCCc2c1ccc3ccccc23
CCOC(=O)c1c(C)oc2ccc(O)c(CN(C)C)c12	ZINC000000083554	c2ccc1occc1c2
COc2ccc(C1(CNC(N)=N)CCCC1)cc2OC	ZINC000000488194	C2CCC(c1ccccc1)C2
C[C@@H](CN(C)C)OC(=O)c2ccc1OCOc1c2	ZINC000000206169	C2Oc1ccccc1O2
CC(=O)N3CCC(N2CCN(c1ccccc1)CC2)CC3	ZINC000000212512	C3CC(N2CCN(c1ccccc1)CC2)CCN3
COc2ccc(c1nc(N)nc(N)n1)cc2OC	ZINC000000011431	c2ccc(c1ncncn1)cc2
Nc2cc(c1ccc(F)cc1)nc(N)n2	ZINC000000082203	c2ccc(c1ccncn1)cc2
C2CCN(C1CCNCC1)CC2	ZINC000000388302	C2CCN(C1CCNCC1)CC2
CC[N+]13CCC(CC1)[C@@H](C(=O)c2cccs2)C3	ZINC000000178982	O=C(C1CN2CCC1CC2)c3cccs3
COc2ccc(C1(CN)CCCC1)cc2OC	ZINC000000174645	C2CCC(c1ccccc1)C2
CN(C)C[C@H]1CCc3c(C1=O)c2ccccc2n3C	ZINC000000164458	O=C2CCCc3[nH]c1ccccc1c23
COc1cnc(SC)nc1NN	ZINC000000332630	c1cncnc1
C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN	ZINC000000141845	c2ccc1[nH]ccc1c2
NC(=O)C2CCN(C/C=C/c1ccccc1)CC2	ZINC000000219757	C2CCN(CC=Cc1ccccc1)CC2
CC[C@@]4(c1ccccc1)Oc2cccnc2n3cccc3C4=O	ZINC000000009136	O=C3C(c1ccccc1)Oc2cccnc2n4cccc34
CCN2CCC([N@]1CCC[C@@H](C(=O)N(CC)CC)C1)CC2	ZINC000000280575	C2CCN(C1CCNCC1)CC2
N[C@H](CCS(N)(=O)=O)[C@@H](S)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(O)=O)C(O)=O	ZINC000013531826	c1ccccc1
C2CN(c1ccccc1)CCN2C/C=C/c3ccccc3	ZINC000000183277	C2CN(c1ccccc1)CCN2CC=Cc3ccccc3
CN(C)CCCn1c(=O)n(C)c(=O)c2nc[nH]c12	ZINC000000485556	O=c2[nH]c(=O)c1nc[nH]c1[nH]2
CCOC(=O)[C@@H](CC)Sc2nnc(COc1ccccc1)n2CC	ZINC000000419274	C(Oc1ccccc1)c2nnc[nH]2
NC2=N[C@@H](C[C@@H]1CO1)CCCC2	ZINC000000021633	C2CCC(CC1CO1)N=CC2
O=C(NN1CCCCC1)C2CCNCC2	ZINC000000251559	O=C(NN1CCCCC1)C2CCNCC2
C[N@@](CC(=O)N1CCCC1=O)Cc2ccccc2	ZINC000000027591	O=C1CCCN1C(=O)CNCc2ccccc2
CC(=C)CNC[C@@H]1OCCc2ccccc12	ZINC000000168992	C2Cc1ccccc1CO2
CCN(CC)c2ccc(\C=N\NC(=S)Nc1ccc(C)cc1)cc2	ZINC000000499170	S=C(NN=Cc1ccccc1)Nc2ccccc2
CC(=O)Oc1ccccc1C(=O)O[C@H]2OC(=O)c3ccccc23	ZINC000000000735	O=C(OC1OC(=O)c2ccccc12)c3ccccc3
NC(=O)C3(N1CCCCC1)CCN(C(=O)c2ccco2)CC3	ZINC000000130428	O=C(N2CCC(N1CCCCC1)CC2)c3ccco3
COc3ccc(C(=O)OC[C@@H]1CCC[N+]2(C)CCCC[C@@H]12)cc3	ZINC000000343988	O=C(OCC1CCCN2CCCCC12)c3ccccc3
CC(C)COc3ccc2n(CCN(C)C)c1ccccc1sc2c3	ZINC000000114615	c3ccc2sc1ccccc1[nH]c2c3
C[N+](C)(C)c1cccc(C(=O)NO)c1	ZINC000000398545	c1ccccc1
CCn2c(C)[n+](c1ccccc1)c3ccc(N)cc23	ZINC000000176865	c3ccc([n+]1c[nH]c2ccccc12)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
CN(C)[C@@H](CNS(=O)(=O)c1ccc(Cl)cc1)c2ccccc2	ZINC000000616977	O=S(=O)(NCCc1ccccc1)c2ccccc2
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
NNc2cc(Cl)nc(N1CCOCC1)n2	ZINC000000331112	C2CN(c1ncccn1)CCO2
C[C@@H]2C[C@H](OC(=O)c1ccccc1)CC(C)(C)N2	ZINC000000001410	O=C(OC1CCNCC1)c2ccccc2
NC(=O)C2CCN([C@@H]1CCSC1)CC2	ZINC000000221752	C2CCN(C1CCSC1)CC2
CC(C)COc2ccc(C(=O)OCC[N+]1(C)CCOCC1)cc2	ZINC000000215739	O=C(OCCN1CCOCC1)c2ccccc2
CN(C)CCCn2c(=O)c1ccccc1c3ccccc23	ZINC000000001418	O=c2[nH]c1ccccc1c3ccccc23
CN(C)CCNS(=O)(=O)c1cc(C)sc1C	ZINC000000117014	c1ccsc1
CC(C)(C)N(Cc1ccccc1)C(=O)CSc2nc(N)cc(N)n2	ZINC000000417999	O=C(CSc1ncccn1)NCc2ccccc2
CCN(CC)CCCNC(=S)N(CCCN(C)C)Cc3cc2cc1OCOc1cc2[nH]c3=O	ZINC000006193048	O=c3ccc2cc1OCOc1cc2[nH]3
C[N+]1(C)CCC[C@@H]1COC(=O)C(O)(c2ccccc2)c3ccccc3	ZINC000000000651	O=C(OCC1CCCN1)C(c2ccccc2)c3ccccc3
NC(=O)C2CCN(CCC(=O)Nc1ccccc1Cl)CC2	ZINC000000253798	O=C(CCN1CCCCC1)Nc2ccccc2
Cc2cc(C)n(C[C@H](O)COc1c(Cl)cc(Cl)cc1Cl)n2	ZINC000000318308	C(COc1ccccc1)Cn2cccn2
CCOC(=O)c2csc(Nc1ccncc1)n2	ZINC000000113044	N(c1ccncc1)c2nccs2
CN(C)CCNC(=O)c1c[nH]c2ccccc12	ZINC000000309293	c2ccc1[nH]ccc1c2
COc1cc(C=O)ccc1OC(=O)c2cc(OC)c(OC)c(OC)c2	ZINC000000159143	O=C(Oc1ccccc1)c2ccccc2
COc1cc(C[C@@H](C)N)c(OC)cc1Br	ZINC000000000092	c1ccccc1
Cc5cc(C)nc(O[C@H](C(O)=O)[C@@]4(c1ccccc1)NCC(=O)N(Cc2nn[nH]n2)c3ccccc34)n5	ZINC000013561043	O=C4CNC(COc1ncccn1)(c2ccccc2)c3ccccc3N4Cc5nn[nH]n5
Cc3cccc(NC(=O)[C@@H](Cc1ccccc1)NC(=O)c2ccco2)n3	ZINC000000609415	O=C(Nc1ccccn1)C(Cc2ccccc2)NC(=O)c3ccco3
Nc2ncn(S(=O)(=O)c1ccccc1)n2	ZINC000000073350	O=S(=O)(c1ccccc1)n2cncn2
NC(N)=NS(=O)(=O)c4ccc(NN=c3c(=O)n(c1ccccc1)n(c2ccccc2)c3=O)cc4	ZINC000005385074	O=c3n(c1ccccc1)n(c2ccccc2)c(=O)c3=NNc4ccccc4
N#Cc2cnn(c1ccccc1)c2/N=C/N3CCOCC3	ZINC000000505612	C3CN(C=Nc1ccnn1c2ccccc2)CCO3
O[C@]13OCCO[C@]1(O)C(=O)c2ccccc2C3=O	ZINC000000047126	O=C2C1OCCOC1C(=O)c3ccccc23
COc1ccccc1Oc3ccc(S(=O)(=O)N2CCCC2)cc3	ZINC000000074875	O=S(=O)(N1CCCC1)c3ccc(Oc2ccccc2)cc3
Cc4ccc3nc(c1ccc(O)cc1)c(NC[C@@H]2CCCO2)n3c4	ZINC000000417324	C4COC(CNc2c(c1ccccc1)nc3ccccn23)C4
CN2CCN(CC(=O)Nc1ccc(Cl)c(N(=O)=O)c1)CC2	ZINC000000379454	O=C(CN1CCNCC1)Nc2ccccc2
OCC[n+]2ccc(c1cc[n+](CCO)cc1)cc2	ZINC000006091546	c2cc(c1ccncc1)ccn2
Clc2ccc(NC(=O)Cn1cnc(N(=O)=O)c1)cc2Cl	ZINC000000035919	O=C(Cn1ccnc1)Nc2ccccc2
O=S(=O)(N2CCC(Cc1ccccc1)CC2)c3cccs3	ZINC000000037687	O=S(=O)(N2CCC(Cc1ccccc1)CC2)c3cccs3
O=C(NCc1ccccn1)[C@H](Cc2ccccc2)NC(=O)c3ccco3	ZINC000000610351	O=C(NCc1ccccn1)C(Cc2ccccc2)NC(=O)c3ccco3
C[N+](C)(C)C[C@@H](O)c1cccc(N(=O)=O)c1	ZINC000000207088	c1ccccc1
Fc2ccc(NC1=NCCN1)cc2	ZINC000000098076	C2CN=C(Nc1ccccc1)N2
CCN3CCN(c2cc(SC(C)C)nc(c1ccc(OC)cc1)n2)CC3	ZINC000000631249	C3CN(c2ccnc(c1ccccc1)n2)CCN3
NCC3(c2ccc1OCCOc1c2)CCOCC3	ZINC000000207082	C3COc2cc(C1CCOCC1)ccc2O3
O=c3oc1ccccc1c(NCc2ccccc2)c3CN4CCCCC4	ZINC000000191036	O=c3oc1ccccc1c(NCc2ccccc2)c3CN4CCCCC4
C[C@@H](O)c2nc1cc(N(=O)=O)ccc1n2C	ZINC000000040102	c2ccc1[nH]cnc1c2
Cc1cc(C)c(C#N)c(OCC(N)=O)n1	ZINC000000040100	c1ccncc1
Cc1cc(=O)n(C)c(=O)n1CCCN2CCCC2	ZINC000000088569	O=c2ccn(CCCN1CCCC1)c(=O)[nH]2
C[C@@H](NCC2OCc1ccccc1CO2)c3ccccc3	ZINC000000203094	C(NCc1ccccc1)C3OCc2ccccc2CO3
CCc1nc(N)nc(N)c1c2ccc(Cl)cc2	ZINC000000057464	c2ccc(c1cncnc1)cc2
Clc2ccc(C(=N)NCc1ccccc1)cc2	ZINC000000145162	N=C(NCc1ccccc1)c2ccccc2
Cc2cc(C)nc(SCCN1CCCC1)n2	ZINC000000191582	C2CCN(CCSc1ncccn1)C2
CN(C)CCSc2nc1ccccc1c(=O)n2c3ccccc3	ZINC000000028373	O=c2n(c1ccccc1)cnc3ccccc23
COc2cc(NC(=S)N1CCN(C)CC1)cc(OC)c2	ZINC000000307233	S=C(Nc1ccccc1)N2CCNCC2
Cc2ccc(C)c(NC(=O)[C@@H]1[C@H](C=C(Cl)Cl)C1(C)C)c2	ZINC000000042850	O=C(Nc1ccccc1)C2CC2
C\C(=C/C(=O)NC1CC1)c2cccc(F)c2	ZINC000000004609	O=C(NC1CC1)C=Cc2ccccc2
COc3ccc([C@@H]1NCC[C@]2(O)CCCC[C@H]12)c(OC)c3	ZINC000000234773	C1CCC2C(C1)CCNC2c3ccccc3
COc1ccccc1C(=O)NC(=O)COC(=O)\C=C\c3c(C)nn([C@@H]2CCS(=O)(=O)C2)c3Cl	ZINC000003379687	O=C(COC(=O)C=Cc2cnn(C1CCS(=O)(=O)C1)c2)NC(=O)c3ccccc3
O[C@H]1[C@H]3CCC[C@@H]1[C@@H](N2CCCC2)CC3	ZINC000000185896	C2CC3CCC(N1CCCC1)C(C2)C3
C1C[C@@H]2C[C@H]1C[C@H]2N4CCN(c3ccccc3)CC4	ZINC000000181886	C1CC2CC1CC2N4CCN(c3ccccc3)CC4
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
NC(=N)NCCCn5cc(c4ccc3ccc2ccc(c1cn(CCCNC(N)=N)nn1)nc2c3n4)nn5	ZINC000103257656	c4cc3ccc2ccc(c1c[nH]nn1)nc2c3nc4c5c[nH]nn5
CC(C)c3ccc2[nH]cc(CCN1CCCC1)c2c3	ZINC000000007395	C3CCN(CCc1c[nH]c2ccccc12)C3
CC(C)(C)NCC(=O)c1c[nH]c2ccccc12	ZINC000000093801	c2ccc1[nH]ccc1c2
CCN2CCN(C(=O)c1cc(Cl)ccc1OC)CC2	ZINC000000318334	O=C(N1CCNCC1)c2ccccc2
c4ccc(c3nn(c1ccccc1)[n+](c2ccccc2)n3)cc4	ZINC000000154828	c4ccc(c3nn(c1ccccc1)[n+](c2ccccc2)n3)cc4
O=C(NC1CCCC1)[C@H]3N(CCc2ccccc2)C(=O)c4ccccc34	ZINC000000217770	O=C(NC1CCCC1)C3N(CCc2ccccc2)C(=O)c4ccccc34
CN2CCN(C(=O)c1ccc(C)cc1)CC2	ZINC000000271643	O=C(N1CCNCC1)c2ccccc2
CCN(Cc1ccccc1)C(=O)Cn3c(=O)n(C)c4cnc(c2ccccc2)nc34	ZINC000000602486	O=C(Cn2c(=O)[nH]c3cnc(c1ccccc1)nc23)NCc4ccccc4
CCc2ccc(NC(=O)CSc1nnnn1C)cc2	ZINC000000040749	O=C(CSc1nnn[nH]1)Nc2ccccc2
COc4c1OCOc1cc3CCN(C)[C@H](C#CCN2CCCC2)c34	ZINC000000487088	C4CCN(CC#CC2NCCc3cc1OCOc1cc23)C4
C3CCN(C[C@@H]2CO[C@@H](c1ccco1)O2)CC3	ZINC000000171856	C3CCN(CC2COC(c1ccco1)O2)CC3
CC[N@]3CC[C@](O)(c1ccc(F)cc1)[C@H](C(=O)c2ccc(F)cc2)C3	ZINC000000269650	O=C(C1CNCCC1c2ccccc2)c3ccccc3
CN(C)CCC[C@]3(O)c1ccccc1CSc2sccc23	ZINC000000347400	C2Sc1sccc1Cc3ccccc23
CN(C)c2ccc(NC(=O)c1ccc(F)cc1)cc2	ZINC000000030319	O=C(Nc1ccccc1)c2ccccc2
C[N@]1CC=C3[C@@H](C1)C(c2cc(C)ccc2C)=C(C#N)C(N)=C3C#N	ZINC000000043582	C1NCC2C(=C1)C=CC=C2c3ccccc3
C[N@@]2CC(CNC(=O)OCc1ccccc1)CC3C2Cc4cn(C)c5cccc3c45	ZINC000000537987	O=C(NCC2CNC1Cc3c[nH]c4cccc(C1C2)c34)OCc5ccccc5
C[C@@H](Cc2ccc(C(=O)Oc1ccc(C(N)=N)cc1F)s2)C(=O)N[C@@H](CS(O)(=O)=O)C(O)=O	ZINC000145963460	O=C(Oc1ccccc1)c2cccs2
C[N@]1[C@H]3CC[C@@H]1CC(NC(=O)Nc2ccc(Br)cc2)C3	ZINC000000135951	O=C(NC1CC2CCC(C1)N2)Nc3ccccc3
CN(C)CCc1nn[nH]n1	ZINC000000205484	c1nn[nH]n1
NC(=N)NC(=N)N1N=CC[C@@H]1c2ccccc2	ZINC000000118310	C1C=NNC1c2ccccc2
C[N@]1[C@H]3CC[C@@H]1CC(NC(=O)Nc2ccc(F)cc2F)C3	ZINC000000135956	O=C(NC1CC2CCC(C1)N2)Nc3ccccc3
OC[C@H]1CCCCN1CCC(=O)Nc4ccc(NC(=O)CC[N@@]2CCCC[C@@H]2CO)c5c(=O)c3ccccc3c(=O)c45	ZINC000026973118	O=C(CCN1CCCCC1)Nc4ccc(NC(=O)CCN2CCCCC2)c5c(=O)c3ccccc3c(=O)c45
CC(C)(C)OC(=O)CCN1CCC(C(N)=O)CC1	ZINC000000053539	C1CCNCC1
CN4CCN(c2nc1ccccc1n3c(C)nnc23)CC4	ZINC000000236466	C4CN(c2nc1ccccc1n3cnnc23)CCN4
O=C(CSC2=N[C@@H]1CCCC[C@@H]1N2)N3CCOCC3	ZINC000000314043	O=C(CSC2=NC1CCCCC1N2)N3CCOCC3
Cn3c(=O)n(C)c2ncn(C[C@@H](O)C/N=C/N1CCCCC1)c2c3=O	ZINC000000090919	O=c3[nH]c(=O)c2n(CCCN=CN1CCCCC1)cnc2[nH]3
CC1(C)[C@H]3CC[C@]1(C)c4nc(SCCN2CCCCC2)nnc34	ZINC000000415597	C4CCN(CCSc3nnc2C1CCC(C1)c2n3)CC4
CC[C@@H]1CCC[N@]1CNC(=O)c2cc(OC)c(OC)c(OC)c2	ZINC000000192219	O=C(NCN1CCCC1)c2ccccc2
COC(=O)[C@H]1C[C@@H](O)CN1S(=O)(=O)c2ccc(C)cc2	ZINC000000153394	O=S(=O)(N1CCCC1)c2ccccc2
CC(C)C[C@@H](CN(C)C)NC(=O)CNC(=O)CN	ZINC000037626664	nonring
N[C@@H](CO)CC1CCCCC1	ZINC000000154758	C1CCCCC1
Cc2nnc(NC(=O)Cc1ccc(N(=O)=O)cc1)s2	ZINC000000043455	O=C(Cc1ccccc1)Nc2nncs2
Cn3c(NCCc1ccccc1)nc(c2ccncc2)cc3=O	ZINC000000009114	O=c3cc(c1ccncc1)nc(NCCc2ccccc2)[nH]3
CC(=O)Nc2ccc1sc(C)[n+](CCO)c1c2	ZINC000000297003	c2ccc1scnc1c2
CC(=O)Nc2nc1ccccc1n2CCN3CCCC3	ZINC000000186870	C3CCN(CCn1cnc2ccccc12)C3
COc4ccc(C(=O)Nc3ccc(c2noc(COc1ccc(Br)cc1)n2)cc3)cc4	ZINC000000623070	O=C(Nc3ccc(c2noc(COc1ccccc1)n2)cc3)c4ccccc4
COc2cc(C[N@@](C)C1CCN(C)CC1)cc3OCOc23	ZINC000000216558	C3CC(NCc2ccc1OCOc1c2)CCN3
COc4ccc3cc2c1cc(OC)c(OC)cc1CC[n+]2cc3c4OC	ZINC000000608233	C3C[n+]2cc1ccccc1cc2c4ccccc34
CCOC(=O)N2CCN([C@@H]1CC[C@@H](C)C1)CC2	ZINC000000215999	C2CCC(N1CCNCC1)C2
C[N@@](Cc1ccccc1N)C2CCCCC2	ZINC000000057065	C2CCC(NCc1ccccc1)CC2
Nc2n[nH]c3c(c1cccc(Cl)c1)[nH][nH]n23	ZINC000000038203	c3ccc(c1[nH][nH]n2cn[nH]c12)cc3
Cc2ccc(CSC1=NCCN1)cc2	ZINC000000144261	C2CN=C(SCc1ccccc1)N2
FC(F)(F)c2cccc(NC(=O)c1cnccn1)c2	ZINC000000035636	O=C(Nc1ccccc1)c2cnccn2
O[C@H](Cn2c(=O)c1ccccc1c2=O)c3ccccc3	ZINC000000042291	O=c2n(CCc1ccccc1)c(=O)c3ccccc23
Clc2ccc(CNCc1cccnc1)cc2	ZINC000000076985	C(NCc1cccnc1)c2ccccc2
C[C@@H]2C[C@@H](C)CN(CC(=O)Nc1ccc(S(N)(=O)=O)cc1)C2	ZINC000000139303	O=C(CN1CCCCC1)Nc2ccccc2
Cc2ccc(C[n+]1cccc(C(N)=O)c1)cc2	ZINC000000160601	C(c1ccccc1)[n+]2ccccc2
CC(=O)c3sc2nsc(SCCN1CCCCC1)c2c3N	ZINC000000160603	C3CCN(CCSc1snc2sccc12)CC3
Cc2cn([C@H]1O[C@@H](CO)C[C@H]1O)c(=O)[nH]c2=O	ZINC000000011175	O=c2ccn(C1CCCO1)c(=O)[nH]2
CN(C)OC(=O)c1ccc[n+]2ccn(C)c12	ZINC000000387450	c2cc[n+]1cc[nH]c1c2
CN(C)C(=O)OCCc1n(C)cc[n+]1C	ZINC000000387453	c1c[nH]cn1
CC2(C)C(c1ccco1)[N+](=O)C(C)(C)N2O	ZINC000000201480	O=[N+]1CNCC1c2ccco2
C[C@@H](N)[C@@H]2COc1ccccc1O2	ZINC000000197693	C2COc1ccccc1O2
COc2cc(C(=O)NCc1ccccc1)cc(Cl)c2OCc3ccccc3	ZINC000000622389	O=C(NCc1ccccc1)c3ccc(OCc2ccccc2)cc3
Cc2n(N)c1ccccc1[n+]2CC=C	ZINC000000440571	c2ccc1[nH]cnc1c2
CCOC(=O)C2CCN(Cc1ccco1)CC2	ZINC000000207624	C2CCN(Cc1ccco1)CC2
O=C(NC2CCN(Cc1cccc(N(=O)=O)c1)CC2)c3ccccc3	ZINC000000087269	O=C(NC2CCN(Cc1ccccc1)CC2)c3ccccc3
Cc3cc(=O)oc4cc(OCCn2c(=O)c1ccccc1c2=O)ccc34	ZINC000000547223	O=c4ccc3ccc(OCCn2c(=O)c1ccccc1c2=O)cc3o4
C[C@H](N(CCN(C)C)C(=O)Nc1ccc(Cl)cc1)c2ccncc2	ZINC000000263861	O=C(NCc1ccncc1)Nc2ccccc2
Cc2ccc(NC(=O)CSc1nncn1C)cc2	ZINC000000031482	O=C(CSc1nnc[nH]1)Nc2ccccc2
Cn2c([n+]1ccccc1)c(\C=N\NC(N)=S)sc2=O	ZINC000000206759	O=c2[nH]c([n+]1ccccc1)cs2
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
COc3ccc(c2ccc(S(=O)(=O)N[C@@H](CC#CCN1CCN(S(C)(=O)=O)CC1)C(O)=O)cc2)cc3	ZINC000026011858	O=S(=O)(NCCC#CCN1CCNCC1)c3ccc(c2ccccc2)cc3
CCC(CC)c3nc(Nc1ccc(C(=O)OC)cc1)c2ccccc2n3	ZINC000000136891	N(c1ccccc1)c2ncnc3ccccc23
Fc3ccc(C(=O)N2CCN(C1CCCC1)CC2)cc3	ZINC000000239704	O=C(N2CCN(C1CCCC1)CC2)c3ccccc3
C[N+](C)(C)c1ccc(C=O)cc1	ZINC000000083942	c1ccccc1
CN(C)CCOC(=O)c2c(C)nn3c1ccccc1n(C)c23	ZINC000000090524	c1ccc3c(c1)[nH]c2ccnn23
NC[C@@H](c1ccccc1)c2c[nH]c3ccccc23	ZINC000000110239	C(c1ccccc1)c2c[nH]c3ccccc23
Cc1ccccc1Nc2nc(NN)nc(NN)n2	ZINC000000343085	N(c1ccccc1)c2ncncn2
COC(=O)C[C@@]2(C)OC[C@@H](CN1CCCCC1)O2	ZINC000000191960	C2CCN(CC1COCO1)CC2
NC(=N)SCc2nc(c1ccc(Cl)cc1)no2	ZINC000000137780	c2ccc(c1ncon1)cc2
C[C@@H](O)CCc2nc1cc(N)ccc1[nH]2	ZINC000000333230	c2ccc1[nH]cnc1c2
O=C(CCn2c(=O)c1ccccc1c2=O)Nc3nccs3	ZINC000000047735	O=C(CCn2c(=O)c1ccccc1c2=O)Nc3nccs3
C[C@@H](CS(=O)(=O)c1ccccc1)N2CCCCC2	ZINC000000074264	O=S(=O)(CCN1CCCCC1)c2ccccc2
COc4cc3nc(N2CCN(S(=O)(=O)c1ccc(Cl)cc1)CC2)nc(N)c3cc4OC	ZINC000000638654	O=S(=O)(N3CCN(c2ncc1ccccc1n2)CC3)c4ccccc4
CC2CCN(CN1C(=O)CCC1=O)CC2	ZINC000000298732	O=C1CCC(=O)N1CN2CCCCC2
CCOC(=O)c2c(C)oc3cc(Br)c(OCC(=O)c1ccc(OC)cc1)cc23	ZINC000000623812	O=C(COc2ccc1occc1c2)c3ccccc3
CC(C)N(C(C)C)C(=O)c3ccc(c2nc1ccccc1s2)cc3	ZINC000000049561	c3ccc(c2nc1ccccc1s2)cc3
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
Nc3ncc(Cc2ccc1OCOc1c2)c(N)n3	ZINC000000010465	C3Oc2ccc(Cc1cncnc1)cc2O3
O=C(Nc3c1CCCCc1nc2CCCc23)c4ccccn4	ZINC000000198610	O=C(Nc3c1CCCCc1nc2CCCc23)c4ccccn4
COc2cc(Cc1cnc(N)nc1N)ccc2OCc3ccccc3	ZINC000000010466	C(Oc2ccc(Cc1cncnc1)cc2)c3ccccc3
CN2CCN(NC(=O)COc1ccccc1C)CC2	ZINC000000467699	O=C(COc1ccccc1)NN2CCNCC2
Cc2cc(N)c1ccccc1n2	ZINC000000157475	c2ccc1ncccc1c2
COC(=O)c2cccc(CO/N=C(\C)c1ccc(OC)c(OC)c1)c2	ZINC000000168386	C(ON=Cc1ccccc1)c2ccccc2
C[C@@H](O)[C@@H]5[C@H]4CC(COC(=O)c3cn(CCF)c2c(F)c(N1CCN(C)CC1)c(F)cc2c3=O)=C(C(O)=O)N4C5=O	ZINC000003927284	O=C5CC4CC(COC(=O)c3c[nH]c2cc(N1CCNCC1)ccc2c3=O)=CN45
COC(=O)[C@@H](C#N)C1CC(C)(C)NC(C)(C)C1	ZINC000000104372	C1CCNCC1
OC(=O)COc4cccc(CCn3cc(c1ccccc1)c(c2ccccc2)n3)c4	ZINC000000585606	C(Cn3cc(c1ccccc1)c(c2ccccc2)n3)c4ccccc4
CN2CCN(c1ncccc1N)CC2	ZINC000000168814	C2CN(c1ccccn1)CCN2
O=C2CCN(CCc1ccccc1)CC2	ZINC000000119408	O=C2CCN(CCc1ccccc1)CC2
N[C@H](Cc1ccc(NC(N)=N)cc1)C(=O)NCC(=O)[C@@H](CC(O)=O)c2ncc(NC(=O)C(F)(F)F)o2	ZINC000073402654	O=C(CNC(=O)CCc1ccccc1)Cc2ncco2
CC[N@]3CCC[C@@H](NC(=O)c2scc1CCCCc12)C3	ZINC000000104174	O=C(NC1CCCNC1)c3scc2CCCCc23
Cn2c(COc1ccccc1O)[n+](C)c3ccccc23	ZINC000000390949	C(Oc1ccccc1)c3nc2ccccc2[nH]3
O=N(=O)c3cccc(c2noc(CN1CCCC1)n2)c3	ZINC000000139011	C3CCN(Cc2nc(c1ccccc1)no2)C3
CC(C)CN2CCC(C(=O)NC[C@@H]1CCCO1)CC2	ZINC000000317523	O=C(NCC1CCCO1)C2CCNCC2
NC(=N)NCCC[C@H](NC(=O)[C@@H]2CCN3CC[C@@](N)(Cc1ccccc1)C(=O)N23)C(=O)c4nccs4	ZINC000013556903	O=C(NCC(=O)c1nccs1)C3CCN4CCC(Cc2ccccc2)C(=O)N34
Cc2nc1ccccc1c(N)c2CO	ZINC000000009782	c2ccc1ncccc1c2
NC(=O)c2cc[n+](Cc1ccc(N(=O)=O)cc1)cc2	ZINC000000362611	C(c1ccccc1)[n+]2ccccc2
O=N(=O)c2cccc3nc(C[n+]1ccccc1)[nH]c23	ZINC000000384348	C(c2nc1ccccc1[nH]2)[n+]3ccccc3
O[C@@H](COC2C1CC3CC(C1)CC2C3)CN4CCCCC4	ZINC000000289785	C4CCN(CCCOC2C1CC3CC(C1)CC2C3)CC4
COc3ccc(C(=O)N2CCN(CCCc1ccccc1)CC2)cc3	ZINC000000350371	O=C(N2CCN(CCCc1ccccc1)CC2)c3ccccc3
NCCCNCc3ccn4ncnc(Oc2ccc(NC(=O)NC(=O)Cc1ccc(F)cc1)cc2F)c34	ZINC000029040614	O=C(Cc1ccccc1)NC(=O)Nc4ccc(Oc2ncnn3cccc23)cc4
COc1ccc(C=C(C(C)=O)C(C)=O)cc1	ZINC000000014895	c1ccccc1
CCOC(=O)c3oc2ccc(CNC1CCCCC1)c(Cl)c2c3C	ZINC000000208734	C3CCC(NCc2ccc1occc1c2)CC3
C[C@@H](C[N+](C)(C)C)OC(=O)C2(c1ccccc1)CCCC2	ZINC000000186601	C2CCC(c1ccccc1)C2
Cc2[nH]c1ccccc1c2CCn3c(N)cc(=O)[nH]c3=O	ZINC000000093329	O=c3ccn(CCc1c[nH]c2ccccc12)c(=O)[nH]3
COC(=O)[C@@H]4Cc1c([nH]c2ccccc12)C3(CCN(C)CC3)N4	ZINC000000083417	C4Cc1c([nH]c2ccccc12)C3(CCNCC3)N4
C1CN3CCC1C(c2ccsc2)=C3	ZINC000000017165	C1CN3CCC1C(c2ccsc2)=C3
Oc5ccc(c2sc1cc(O)ccc1c2C(=O)c4ccc(OCCN3(=O)CCCCC3)cc4)cc5	ZINC000000602228	O=C(c2ccc(OCCN1(=O)CCCCC1)cc2)c4c(c3ccccc3)sc5ccccc45
C1CN3CCC1C(c2cccs2)=C3	ZINC000000017166	C1CN3CCC1C(c2cccs2)=C3
CN(C)CCc2[nH]c1ccc(C)cc1c2CC#N	ZINC000000028969	c2ccc1[nH]ccc1c2
CCN(CC)c2ccc(Nc1cc(=O)[nH]c(=O)[nH]1)cc2	ZINC000000028965	O=c2cc(Nc1ccccc1)[nH]c(=O)[nH]2
NCCC(=O)c1ccccc1N	ZINC000000403004	c1ccccc1
CCn1c(C)nnc1S[C@@H](C)C(=O)Nc2cc(N(=O)=O)ccc2C	ZINC000000329251	O=C(CSc1nnc[nH]1)Nc2ccccc2
CN(C)CCNC(=O)c1ccc(\C=N\O)nc1	ZINC000000174346	c1ccncc1
COc2cc(c1ccc(O)cc1)c(OC)c(O)c2c3ccc(OCC=C(C)C)c(O)c3	ZINC000000579895	c3ccc(c2ccc(c1ccccc1)cc2)cc3
CCN(Cc1ccncc1)C(=O)[C@@H](CO)c2ccccc2	ZINC000000057532	O=C(Cc1ccccc1)NCc2ccncc2
NC(=O)C2CCN(Cc1ccccc1Br)CC2	ZINC000000277785	C2CCN(Cc1ccccc1)CC2
CCOC(=O)C2[C@@H](c1ccc(OCC(N)=O)cc1)NC(=S)N=C2C	ZINC000000359948	S=C2NC(c1ccccc1)CC=N2
C[N@@](Cc1ccccc1)[C@@H]3CC(=O)N(c2ccccc2)C3=O	ZINC000000207046	O=C2CC(NCc1ccccc1)C(=O)N2c3ccccc3
O=C1C[C@@H]2CCC[C@H](C1)[N@]2Cc3ccccc3	ZINC000000170627	O=C1CC2CCCC(C1)N2Cc3ccccc3
Cc3ccc2cccc(SCC(=O)NC[C@@H]1CCCO1)c2n3	ZINC000000036162	O=C(CSc1cccc2cccnc12)NCC3CCCO3
FC(F)(F)c2cccc(C[n+]1cccc(C#N)c1)c2	ZINC000000152621	C(c1ccccc1)[n+]2ccccc2
CN3CCN(c1ncnc2ccc(C)cc12)CC3	ZINC000000071736	C3CN(c1ncnc2ccccc12)CCN3
CN3CCN(c2cc(=O)n(c1ccc(Cl)cc1)c(=O)[nH]2)CC3	ZINC000000252472	O=c2cc(N1CCNCC1)[nH]c(=O)n2c3ccccc3
Clc1ccc(N(=O)=O)cc1N2CCNCC2	ZINC000000036169	C2CN(c1ccccc1)CCN2
Cc1ccc(Cl)cc1NC(=O)C[C@@H](NCc2ccccn2)C(O)=O	ZINC000000202874	O=C(CCNCc1ccccn1)Nc2ccccc2
NC(=O)[C@@H]2CCC[N@@](CCc1ccccc1)C2	ZINC000000278275	C2CCN(CCc1ccccc1)CC2
Cc2ccc(C[n+]1nc(C)n(N)c1C)cc2	ZINC000000405173	C(c1ccccc1)[n+]2c[nH]cn2
CC(C)c1ccc(NC(=S)NC(N)=N)cc1	ZINC000000138303	c1ccccc1
Cc1nc(N)sc1CCN	ZINC000000005099	c1cscn1
CC(C)(N)Cc1ccc(F)cc1	ZINC000000156299	c1ccccc1
FC(F)(F)c2cnc(N1CCNCC1)c(Cl)c2	ZINC000000012103	C2CN(c1ccccn1)CCN2
COc1ccc(OC)c([C@@H](O)[C@@H](C)N)c1	ZINC000000057407	c1ccccc1
C[N@]3CCC[C@H](OC(=O)c2ccc1OCCOc1c2)C3	ZINC000000375759	O=C(OC1CCCNC1)c3ccc2OCCOc2c3
COc2ccc1[n+](C)cccc1c2	ZINC000000270660	c2ccc1ncccc1c2
C[C@@H](NCc1ccccc1)[C@@H]3COc2ccccc2O3	ZINC000000174660	C(NCc1ccccc1)C3COc2ccccc2O3
COC(=O)[C@@H](C)CN1CCCCC1	ZINC000000393940	C1CCNCC1
N=C2N[C@H](c1ccccc1)Nc3ccccc23	ZINC000000022225	N=C2NC(c1ccccc1)Nc3ccccc23
COC(=O)c1sccc1NC(=S)NCCN2CCNC2=O	ZINC000000147106	O=C1NCCN1CCNC(=S)Nc2ccsc2
O=C1NCCN1CCNC(=S)NC2CC2	ZINC000000147102	O=C1NCCN1CCNC(=S)NC2CC2
CCN(CC)CCCn2c1ccccc1sc3ccc(Cl)cc23	ZINC000000001135	c3ccc2sc1ccccc1[nH]c2c3
CC(C)NC(=N)NC(=N)Nc1ccc(Cl)c(Cl)c1	ZINC000000001136	c1ccccc1
FC(F)(F)c2cnc(C[n+]1ccccc1)c(Cl)c2	ZINC000000160166	C(c1ccccn1)[n+]2ccccc2
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
CCOC(=O)Cc2c([n+]1ccccc1)[nH]c3ccccc23	ZINC000000259445	c3cc[n+](c2cc1ccccc1[nH]2)cc3
CS(=O)(=O)NC2CCN(Cc1ccccc1)CC2	ZINC000000029517	C2CCN(Cc1ccccc1)CC2
CCN(CC)C[C@@H](O)CO	ZINC000000407012	nonring
C[C@@H](Sc1nc(N)cc(N)n1)C(=O)Nc2ccccc2	ZINC000000422369	O=C(CSc1ncccn1)Nc2ccccc2
COc1ccccc1\C=C\CN2CCSCC2	ZINC000000183393	C2CN(CC=Cc1ccccc1)CCS2
C[N@]2CCCN(Cc1cccc(N(=O)=O)c1)CC2	ZINC000000236608	C2CNCCN(Cc1ccccc1)C2
COc3ccc(c2nc1cccnc1[nH]2)cc3N	ZINC000000027433	c3ccc(c2nc1cccnc1[nH]2)cc3
C4CN(CCN1CCn2c1nc3ccccc23)CCO4	ZINC000000255176	C4CN(CCN1CCn2c1nc3ccccc23)CCO4
CN(C)CCSc3nc(N)c2c1CCN(C)Cc1sc2n3	ZINC000000540748	C1Cc2c(CN1)sc3ncncc23
COc3ccc(c1cc(C(F)F)nn1c2ccc(S(N)(=O)=O)cc2)cc3	ZINC000000601196	c3ccc(c1ccnn1c2ccccc2)cc3
OC3CCN(C(=O)Cn1c(=O)sc2ccc(Cl)cc12)CC3	ZINC000000005602	O=C(Cn1c(=O)sc2ccccc12)N3CCCCC3
C5CCN(CCn3c1ccccc1n4cc(c2ccccc2)nc34)CC5	ZINC000000092815	C5CCN(CCn3c1ccccc1n4cc(c2ccccc2)nc34)CC5
Cc1ccccc1CN3CCN(Cc2cccc(N(=O)=O)c2)CC3	ZINC000000351212	C2CN(Cc1ccccc1)CCN2Cc3ccccc3
Nc2nnc(CCN1CCCCC1)s2	ZINC000000098442	C2CCN(CCc1nncs1)CC2
Fc2cccc(C(=O)OCCN1CCCCC1)c2	ZINC000000210753	O=C(OCCN1CCCCC1)c2ccccc2
CCOC(=O)c1cc(CN)c(C)o1	ZINC000000376441	c1ccoc1
Fc2ccc(C(=O)NCCN1CCCC1)cc2	ZINC000000210755	O=C(NCCN1CCCC1)c2ccccc2
O=c2[nH]c1ccccc1c(=O)n2CCN3CCSCC3	ZINC000000068770	O=c2[nH]c1ccccc1c(=O)n2CCN3CCSCC3
CC(C)(O)C#CC[N+]1(CC=C)CCOCC1	ZINC000000200837	C1COCCN1
CCOC(CNCc1ccccc1)OCC	ZINC000000164289	c1ccccc1
CC(=O)Nc2ccc(OC(=O)c1ccccc1O)cc2	ZINC000000000865	O=C(Oc1ccccc1)c2ccccc2
CN2CCC(c1ccsc1)(C(C)(C)O)CC2	ZINC000000016955	C2CC(c1ccsc1)CCN2
CC(C)[C@H](N)C(=O)N1CCN(C(=O)C[C@@H](C)CC(C)(C)C)[C@H](C)C1	ZINC000000252099	C1CNCCN1
COC(=O)c1ccccc1NC(=O)c2c(N(=O)=O)cnn2C	ZINC000000037094	O=C(Nc1ccccc1)c2ccn[nH]2
COc2ccc(O)c(CNCCCN1CCN(C)CC1)c2	ZINC000020128543	C(CNCc1ccccc1)CN2CCNCC2
COc3cccc(CNC(=O)c2ccc1cnccc1n2)c3	ZINC000000022719	O=C(NCc1ccccc1)c3ccc2cnccc2n3
O=C(CC[N@]2CC[C@@H](c1ccccc1)C2)c3ccco3	ZINC000000177661	O=C(CCN2CCC(c1ccccc1)C2)c3ccco3
CC3CCN(C2CCN(Cc1cccc(N(=O)=O)c1)CC2)CC3	ZINC000000315791	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
Fc4ccc(C(=O)C3CCN(CCn2c(=O)nc1CCCCn1c2=O)CC3)cc4	ZINC000000597570	O=C(C3CCN(CCn2c(=O)nc1CCCCn1c2=O)CC3)c4ccccc4
Clc2cc(NC(=O)c1ccc(N(=O)=O)o1)ccc2N3CCCCC3	ZINC000000452375	O=C(Nc2ccc(N1CCCCC1)cc2)c3ccco3
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
CCOn1c(=O)c(=O)n(O)c2ccccc12	ZINC000000337819	O=c2[nH]c1ccccc1[nH]c2=O
C[N@@](Cc1c[nH]c2ccccc12)C3CCCCC3	ZINC000000142604	C3CCC(NCc1c[nH]c2ccccc12)CC3
OCCN(CCO)C2CCC(c1ccccc1)CC2	ZINC000000221002	C2CCC(c1ccccc1)CC2
Cc4ccc(N1CCn2c1nc3n(C)c(=O)[nH]c(=O)c23)cc4	ZINC000000041935	O=c4[nH]c(=O)c3n2CCN(c1ccccc1)c2nc3[nH]4
NC(=O)C4CCN(C3(n1nnc2ccccc12)CCCCC3)CC4	ZINC000000053066	C4CCN(C3(n1nnc2ccccc12)CCCCC3)CC4
CCC(=O)c3ccc2sc1ccccc1n(C[C@H](C)N(C)C)c2c3	ZINC000000000669	c3ccc2sc1ccccc1[nH]c2c3
Cc2n(C)c1ccccc1[n+]2C	ZINC000000160388	c2ccc1[nH]cnc1c2
CCc2n(C)c1ccccc1[n+]2C	ZINC000000160389	c2ccc1[nH]cnc1c2
NC(=N)N2CCN(C(=O)c1ccc(Cl)cc1)CC2	ZINC000000045187	O=C(N1CCNCC1)c2ccccc2
C4CN(c2nc1ccccc1n2Cc3ccccc3)CCN4	ZINC000000007943	C4CN(c2nc1ccccc1n2Cc3ccccc3)CCN4
NC3=N[C@@H](c1c(O)ccc2ccccc12)C=NN3	ZINC000000036303	N3C=NC(c1cccc2ccccc12)C=N3
CCc1ccccc1NC(=O)COc2ccc(Br)cc2	ZINC000000037567	O=C(COc1ccccc1)Nc2ccccc2
COc3ccc(NS(=O)(=O)c2ccc(NS(=O)(=O)c1cc(Cl)ccc1Cl)cc2)cc3	ZINC000000665788	O=S(=O)(Nc2ccc(S(=O)(=O)Nc1ccccc1)cc2)c3ccccc3
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
CC(=NNC1=NCCN1Cc2ccccc2)c3ccccc3	ZINC000000150294	C3CN(Cc1ccccc1)C(NN=Cc2ccccc2)=N3
COc1ccccc1CC(=O)N2CCOCC2	ZINC000000030165	O=C(Cc1ccccc1)N2CCOCC2
Fc1ccccc1N2CCNCC2	ZINC000000155125	C2CN(c1ccccc1)CCN2
COc3ccc(C(=O)Nc2c(N)nc(SCC(=O)NC[C@@H]1CCCO1)[nH]c2=O)cc3	ZINC000012033243	O=C(CSc2ncc(NC(=O)c1ccccc1)c(=O)[nH]2)NCC3CCCO3
C[C@@H](Cc1ccc(O)cc1)N(C)C	ZINC000000347523	c1ccccc1
CN3CCC(NC(=O)c1cn(C)c2ccccc12)CC3	ZINC000000109836	O=C(NC1CCNCC1)c2c[nH]c3ccccc23
O=C(CN1CCCC1)N3CCN(C(=O)c2ccccc2)C3	ZINC000000196482	O=C(CN1CCCC1)N3CCN(C(=O)c2ccccc2)C3
O=C(NCc1cccnc1)C(\NC(=O)c2ccccc2)=C/c3ccco3	ZINC000000037894	O=C(NCc1cccnc1)C(NC(=O)c2ccccc2)=Cc3ccco3
COc2ccc(CNC(=O)[C@@H]1CCCN1)cc2OC	ZINC000000251665	O=C(NCc1ccccc1)C2CCCN2
CS(=O)(=O)Nc1ccc(F)c([C@@H](O)CN)c1	ZINC000000005703	c1ccccc1
COC(=O)c1ccccc1n2cnnn2	ZINC000000052926	c2ccc(n1cnnn1)cc2
CN3CCN(C(=O)NC[C@H]2CN(Cc1ccccc1)C(=O)C2)CC3	ZINC000000347888	O=C2CC(CNC(=O)N1CCNCC1)CN2Cc3ccccc3
CCOc2cc(\C=N/c1ccc(NC(C)=O)cc1)cc(Cl)c2OC	ZINC000000359554	C(=Nc1ccccc1)c2ccccc2
CCCn3c(SCC(=O)Nc2cc(S(=O)(=O)N1CCOCC1)ccc2OC)nc(O)cc3=O	ZINC000009441912	O=C(CSc1nccc(=O)[nH]1)Nc3cccc(S(=O)(=O)N2CCOCC2)c3
CC(=NNC(N)=N)c1ccc(Cl)cc1Cl	ZINC000000130055	c1ccccc1
CC(C)(C)c3cccc(c2nc1ccc(C(N)=N)cc1[nH]2)c3O	ZINC000000007706	c3ccc(c2nc1ccccc1[nH]2)cc3
CN2CCN(\C=N\c1ncc(C(F)(F)F)cc1Cl)CC2	ZINC000000133240	C2CN(C=Nc1ccccn1)CCN2
C[C@H]3C[C@@H](C)C[N@@](Cc2nc(N)nc(Nc1ccccc1)n2)C3	ZINC000000545251	C3CCN(Cc2ncnc(Nc1ccccc1)n2)CC3
COc2cc1nc(=S)n(CCN(C)C)c(N)c1cc2OC	ZINC000000166356	S=c2nc1ccccc1c[nH]2
COc1ccc([C@@H](C)N)cc1OC	ZINC000000296167	c1ccccc1
CCOc1cccc([C@@H](O)CNC)c1	ZINC000000226413	c1ccccc1
Cc4cccc5cc(CN(C1CCCC1)C(=O)C2CC2)c3nnnn3c45	ZINC000000412354	O=C(C1CC1)N(Cc3cc2ccccc2n4nnnc34)C5CCCC5
C2CCC(N1CCOCC1)=CC2	ZINC000000159833	C2CCC(N1CCOCC1)=CC2
CCOC(=O)c1ccc(CN)cc1	ZINC000000040134	c1ccccc1
COC(=O)c1sc(S(=O)(=O)NCC(=O)OCC(=O)NCC(F)(F)F)c(C(=O)OC)c1C	ZINC000009545932	c1ccsc1
Cc1cc(=O)oc(C)c1C(=O)NCCN2CCCCC2	ZINC000000521510	O=C(NCCN1CCCCC1)c2ccc(=O)oc2
CN(C)CCNc3c1CCCc1c(C#N)c4nc2ccccc2n34	ZINC000000126363	C4Cc3cc2nc1ccccc1n2cc3C4
C[N@]1[C@H]3CC[C@@H]1CC(OC(=O)[C@@H](O)c2ccccc2)C3	ZINC000000056445	O=C(Cc1ccccc1)OC2CC3CCC(C2)N3
O=c2cc(N1CCNCC1)nc3ccccn23	ZINC000000006940	O=c2cc(N1CCNCC1)nc3ccccn23
COc2ccc(C1=CC(=O)CC1)cc2OC	ZINC000000015216	O=C2CCC(c1ccccc1)=C2
C3Oc2ccc(CNCc1cccnc1)cc2O3	ZINC000000103721	C3Oc2ccc(CNCc1cccnc1)cc2O3
C[N+]2(C[C@@H](O)CN1CCCC1=O)CCCCCC2	ZINC000000028364	O=C1CCCN1CCCN2CCCCCC2
CN3CCN(c2nc1ccc(N(=O)=O)cc1s2)CC3	ZINC000000066588	C3CN(c2nc1ccccc1s2)CCN3
CN(C)CCOc1ncncc1F	ZINC000000392059	c1cncnc1
O=C(Nn1cnnc1)c2ccc(N(=O)=O)cc2	ZINC000000066581	O=C(Nn1cnnc1)c2ccccc2
N[C@@H](Cc2cc1ccccc1c3ccccc23)C(=O)N[C@@H]([C@H]5O[C@@H](n4ccc(=O)[nH]c4=O)[C@H](O)[C@@H]5O)C(O)=O	ZINC000003842916	O=C(CCc2cc1ccccc1c3ccccc23)NCC5CCC(n4ccc(=O)[nH]c4=O)O5
C[C@@H](CN(C)C)Sc1nc(C)cc(C)n1	ZINC000000141431	c1cncnc1
CCN4CCC(NC2C1CC3CC(C1)CC2C3)CC4	ZINC000000276969	C4CC(NC2C1CC3CC(C1)CC2C3)CCN4
Fc3ccc(NC(=O)C[C@@H]2N[C@H]1CCCC[C@@H]1NC2=O)cc3	ZINC000000543361	O=C(CC2NC1CCCCC1NC2=O)Nc3ccccc3
CC2(C)CC(NC(=S)Nc1ccccc1)CC(C)(C)N2	ZINC000000173688	S=C(NC1CCNCC1)Nc2ccccc2
CN[C@@H](C)c1ccc(OC)cc1OC	ZINC000000191207	c1ccccc1
CCOC(=O)c1c(NC(=O)C(F)(F)F)scc1c2cccs2	ZINC000000472415	c2csc(c1ccsc1)c2
C[C@@H](CCN1CCN(C=O)CC1)c2ccccc2	ZINC000000214581	C(CN1CCNCC1)Cc2ccccc2
NN2CCN(CC(=O)c1ccccc1)N2	ZINC000000096829	O=C(CN1CCNN1)c2ccccc2
CCCC(=O)c2cnc1c([C@H](O)CN(C)C)cccc1c2Nc3ccccc3C	ZINC000000587404	N(c1ccccc1)c2ccnc3ccccc23
COC(=O)c2ccc(C[N+](C)(C)CN1CCCC1=O)cc2	ZINC000000180381	O=C1CCCN1CNCc2ccccc2
NC(=O)C2CCN(CC1CCCCC1)CC2	ZINC000000216363	C2CCC(CN1CCCCC1)CC2
CCOC(=O)c2c(C)n(C1CC1)c(C)c2CN	ZINC000000161946	C1CC1n2cccc2
CCOC(=O)C2[C@H](c1ccccc1)NC(SC)=NC2=C	ZINC000000207184	C=C2CC(c1ccccc1)NC=N2
CN2CCc3c(N)c1ccccc1nc23	ZINC000000015525	C3Cc2cc1ccccc1nc2N3
COc2cccc(C(=O)NCc1ccc(C)cc1)c2	ZINC000000030032	O=C(NCc1ccccc1)c2ccccc2
C[C@@H]2C[C@H](OC(=O)[C@H](O)c1ccccc1)CC(C)(C)[N@]2C	ZINC000000000283	O=C(Cc1ccccc1)OC2CCNCC2
CC[C@@H](C)[C@@](CCN1CCCCC1)(C#N)c2ccccc2	ZINC000000000284	C2CCN(CCCc1ccccc1)CC2
CC[n+]2ccc(\C=C\c1ccc(OC)cc1OC)cc2	ZINC000000044032	C(=Cc1ccncc1)c2ccccc2
O=C2[C@@H](N1CCCCC1)CCN2c3ccccc3	ZINC000000000287	O=C2C(N1CCCCC1)CCN2c3ccccc3
O[C@@H](CN1CCCCC1)c3ccc2OCCCOc2c3	ZINC000000499408	C3CCN(CCc2ccc1OCCCOc1c2)CC3
C2CN(c1ccccn1)CCN2Cc3ccsc3	ZINC000000237942	C2CN(c1ccccn1)CCN2Cc3ccsc3
CCOC(=O)CSc2nc1ccccc1c(=O)n2CC3CCCC3	ZINC000000292445	O=c2n(CC1CCCC1)cnc3ccccc23
CN(C)CCn2cnc1ncccc1c2=O	ZINC000000088423	O=c1[nH]cnc2ncccc12
O[C@@]2(c1ccccc1)CN3CCC2CC3	ZINC000000260916	C1CN3CCC1C(c2ccccc2)C3
CCOc1ccc(Cl)cc1\C=N\NC(=O)CNc2ccc(F)cc2	ZINC000000487146	O=C(CNc1ccccc1)NN=Cc2ccccc2
CN(C)C(=O)Oc1cccc([N+](C)(C)C)c1	ZINC000000001792	c1ccccc1
NC(=N)NCCC[C@@H](NC(=O)[C@@H]4CC[C@H]3CN(C(=O)[C@@H]2Cc1ccccc1CN2)CC(=O)N34)C(=O)c5nccs5	ZINC000026948467	O=C5CN(C(=O)C2Cc1ccccc1CN2)CC4CCC(C(=O)NCC(=O)c3nccs3)N45
C5CCN(CCCn3c(c1ccccc1)cn4c2ccccc2nc34)C5	ZINC000000274338	C5CCN(CCCn3c(c1ccccc1)cn4c2ccccc2nc34)C5
CSC2=N[C@@H]1CCCC[C@H]1N2	ZINC000000124925	C2CCC1N=CNC1C2
C[C@@H](C#Cc1ccco1)N(O)C(N)=O	ZINC000000015688	c1ccoc1
CCN3CCN(c2ccc(NC(=O)\C=C\c1ccccc1)cc2)CC3	ZINC000000027929	O=C(Nc2ccc(N1CCNCC1)cc2)C=Cc3ccccc3
CNS(=O)(=O)c3ccc(NC(=O)[C@@H]1C[C@@H]2C[C@H]1C=C2)cc3	ZINC000000081957	O=C(Nc1ccccc1)C2CC3CC2C=C3
CC[C@H](C)c2ccc(NC(=O)c1cccs1)cc2	ZINC000000029358	O=C(Nc1ccccc1)c2cccs2
C[C@H]3CN([C@H](C)CO)C(=O)c2cc(NC(=O)CCN1CCOCC1)ccc2O[C@H]3C[N@@](C)CC4CC4	ZINC000061948308	O=C(CCN1CCOCC1)Nc4ccc3OC(CNCC2CC2)CCNC(=O)c3c4
Nc4nc3n(CC1CC1)c(=O)n(CC2CC2)c(=O)c3n4Cc5ccccc5	ZINC000000605274	O=c4n(CC1CC1)c(=O)c3n(Cc2ccccc2)cnc3n4CC5CC5
NCc1ccc(F)cc1C(F)(F)F	ZINC000000157362	c1ccccc1
O=C(CSCSCC(=O)Nc2ccc(C1=NCCN1)cc2)Nc4ccc(C3=NCCN3)cc4	ZINC000001760512	O=C(CSCSCC(=O)Nc2ccc(C1=NCCN1)cc2)Nc4ccc(C3=NCCN3)cc4
COc5ccc(c4cc(C3CCN(c2nc(N)c1cc(OC)c(OC)cc1n2)CC3)[nH]n4)cc5OC	ZINC000000622006	C3CN(c2ncc1ccccc1n2)CCC3c5cc(c4ccccc4)n[nH]5
COc4ccc(CCNC(=O)c3c[nH]c2ccc(S(=O)(=O)N1CCOCC1)cc2c3=O)cc4OC	ZINC000006296575	O=C(NCCc1ccccc1)c4c[nH]c3ccc(S(=O)(=O)N2CCOCC2)cc3c4=O
N[C@H](Cc1ccccn1)c2ccco2	ZINC000000015861	C(Cc1ccco1)c2ccccn2
O=C(CSc2nnc(Cc1ccccc1)n2c3ccccc3)Nc5ccc4OCCOc4c5	ZINC000000623060	O=C(CSc2nnc(Cc1ccccc1)n2c3ccccc3)Nc5ccc4OCCOc4c5
CC[C@@H](O)C#CCN1CCCCC1	ZINC000000268607	C1CCNCC1
COc4ccc(N2C[C@@](O)(Cc1ccc(C)cc1)[n+]3ccccc23)cc4	ZINC000000389464	C3C(Cc1ccccc1)[n+]2ccccc2N3c4ccccc4
CNC(=N)c1cc(Cl)cc(N(=O)=O)c1	ZINC000000048186	c1ccccc1
COC(=O)c3ccc(Nc1cc(C)nc2ccc(C)cc12)cc3	ZINC000000076997	N(c1ccccc1)c2ccnc3ccccc23
Cn3c1ccccc1c4cc2ccccc2c[n+]34	ZINC000000006766	c4ccc3c[n+]2[nH]c1ccccc1c2cc3c4
COc2cc(C(=O)NC1CCN(C)CC1)nc3ccccc23	ZINC000000108644	O=C(NC1CCNCC1)c3ccc2ccccc2n3
Cc1ccccc1NS(=O)(=O)c2ccc(F)cc2	ZINC000000029198	O=S(=O)(Nc1ccccc1)c2ccccc2
O=C(NCCN1CCCC1)c2n[nH]c(=O)c3ccccc23	ZINC000000211519	O=C(NCCN1CCCC1)c2n[nH]c(=O)c3ccccc23
COc2ccc(OC)c(NC(=O)CCC(=O)Oc1ccc(C)cc1)c2	ZINC000000142169	O=C(CCC(=O)Oc1ccccc1)Nc2ccccc2
CCN(CC)CCN(C)CC(=O)N1CCNCC1	ZINC000038031495	C1CNCCN1
COc3ccc2c(C)cc(N1C[C@@H](C)O[C@H](C)C1)nc2c3	ZINC000000087258	C3CN(c2ccc1ccccc1n2)CCO3
FC(F)(F)c1cccnc1N2CCCNCC2	ZINC000000152368	C2CNCCN(c1ccccn1)C2
CN2C(=O)C[C@H](N1CCC(C(N)=O)CC1)C2=O	ZINC000000181384	O=C2CC(N1CCCCC1)C(=O)N2
CC(C)c1ccc(C)c(CN(C)C)c1OC(=O)N(C)C	ZINC000000187952	c1ccccc1
COc4ccc(C2C(C(=O)Nc1ccccc1)=C(C)NC(C)=C2C(=O)Nc3ccccc3)cc4OC	ZINC000000623710	O=C(Nc1ccccc1)C3=CNC=C(C(=O)Nc2ccccc2)C3c4ccccc4
CCOC(=O)C1CCN(CC[C@@H](O)C(F)(F)F)CC1	ZINC000000152365	C1CCNCC1
CN3CCN(Cc2ccc1[nH]cc(CCN)c1c2)S3(=O)=O	ZINC000000016311	O=S1(=O)NCCN1Cc3ccc2[nH]ccc2c3
CN5CCN(CCNCc1cccn1c4nnc(N3CCN(Cc2ccccc2)CC3)s4)CC5	ZINC000020576342	C5CN(CCNCc1cccn1c4nnc(N3CCN(Cc2ccccc2)CC3)s4)CCN5
CN3CCC(N(C)C(=O)c2cnn(c1ccc(F)cc1)c2C)CC3	ZINC000000153689	O=C(NC1CCNCC1)c3cnn(c2ccccc2)c3
Cn1c(=O)n(C)c2cc(N(=O)=O)ccc12	ZINC000000073664	O=c2[nH]c1ccccc1[nH]2
COc2ccc(CC(=O)Nc1cc(C)cc(C)c1)cc2	ZINC000000029280	O=C(Cc1ccccc1)Nc2ccccc2
COC(=O)c1cc(N)ccc1N3CCN(Cc2ccccc2)CC3	ZINC000000153502	C2CN(c1ccccc1)CCN2Cc3ccccc3
COc3ccc(N2CCN(Cc1cccc(C)c1)CC2)cc3	ZINC000000202023	C2CN(c1ccccc1)CCN2Cc3ccccc3
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c2cccc(OC)c2O	ZINC000000623392	N2C=CC(c1ccccc1)C=C2
CN(C)CCNc1ncnc2ccccc12	ZINC000000118541	c2ccc1ncncc1c2
CCOC(=O)C[C@@H](N)c1cccc(O)c1	ZINC000000053414	c1ccccc1
CC(C)(C)NCC(=O)Nc1cc(Cl)cc(Cl)c1	ZINC000000115863	c1ccccc1
C[C@@H](NC2CCN(CCc1ccccc1)CC2)c3ccc(F)cc3	ZINC000000213915	C2CN(CCc1ccccc1)CCC2NCc3ccccc3
NCc1ccc2[nH]c(=O)c3cccc1c23	ZINC000000065137	O=c1[nH]c3cccc2cccc1c23
FC3(F)Oc2ccc(NC(=O)c1cccnc1)cc2O3	ZINC000000032789	O=C(Nc2ccc1OCOc1c2)c3cccnc3
CN(C)CCNC(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000000149980	c1ccccc1
C[n+]2cnc3n(Cc1ccccc1)cnc(N)c23	ZINC000000330551	C(c1ccccc1)n2cncc3ncnc23
NC(=N)c4ccc3n(CC(=O)c2ccc(c1ccccc1)cc2)cnc3c4	ZINC000000578837	O=C(Cn1cnc2ccccc12)c4ccc(c3ccccc3)cc4
CCOc1ccccc1N(CC(=O)Nc3ccc(S(=O)(=O)N2CCOCC2)cc3)S(C)(=O)=O	ZINC000000622285	O=C(CNc1ccccc1)Nc3ccc(S(=O)(=O)N2CCOCC2)cc3
CCOc1ccccc1NC(=O)C[C@@H]3N[C@H]2CCCC[C@H]2NC3=O	ZINC000000536822	O=C(CC2NC1CCCCC1NC2=O)Nc3ccccc3
COc3ccc([C@H]2CC(c1ccc(C)cc1)=NN2C(=O)CCC(O)=O)cc3OC	ZINC000000711219	C2C(c1ccccc1)NN=C2c3ccccc3
C[C@H](O)[C@@H](CCc1cccc2ccccc12)n3cnc(C(N)=O)c3	ZINC000000024494	C(Cc1cccc2ccccc12)Cn3ccnc3
CCN(CC)CC(=O)Nc1ccc(Br)cc1	ZINC000000152107	c1ccccc1
O=c3n([C@H]1CCC[N@]2CCCC[C@@H]12)c(=O)c4ccccc34	ZINC000000049578	O=c3n(C1CCCN2CCCCC12)c(=O)c4ccccc34
COc2nc(NN)nc(N1CCCCC1)n2	ZINC000000109026	C2CCN(c1ncncn1)CC2
COc4ccc(Nc2nc(N1CCNCC1)nc3ccccc23)cc4	ZINC000000199215	C4CN(c3nc(Nc1ccccc1)c2ccccc2n3)CCN4
O=C5C[C@@H]3OCC=C2C[N@]1CC[C@@]47[C@@H]1C[C@@H]2[C@@H]3[C@@H]4N5c6ccccc67	ZINC000000119434	O=C5CC3OCC=C2CN1CCC47C1CC2C3C4N5c6ccccc67
CN3CCN(c1ncnc2nc[nH]c12)CC3	ZINC000000213869	C3CN(c1ncnc2nc[nH]c12)CCN3
C2CCN(CCc1ccccn1)CC2	ZINC000000152565	C2CCN(CCc1ccccn1)CC2
COc3ccc(S(=O)(=O)Nc1ccc(Cl)cc1C(=O)c2ccccc2Cl)cc3OC	ZINC000000632319	O=C(c1ccccc1)c2ccccc2NS(=O)(=O)c3ccccc3
C2CO[C@H](CNCc1ccccn1)C2	ZINC000000299729	C2COC(CNCc1ccccn1)C2
CCc3c(C)sc(NC(=O)c2ccc1OCOc1c2)c3C#N	ZINC000000035579	O=C(Nc1cccs1)c3ccc2OCOc2c3
COC(=O)COc2ccc(S(=O)(=O)N[C@@H](C)c1ccccc1)cc2	ZINC000000470713	O=S(=O)(NCc1ccccc1)c2ccccc2
O=c2[nH]nc(c1ccccn1)c3ccccc23	ZINC000000015464	O=c2[nH]nc(c1ccccn1)c3ccccc23
Cc1cccc(C)c1OCC2CNC2	ZINC000000016483	C1NCC1COc2ccccc2
Cc2nnc1c(=O)n(C)c(=O)n(C)c1n2	ZINC000000032893	O=c2[nH]c(=O)c1nncnc1[nH]2
O=C(CC[N@]1CCCC[C@@H]1c2cccnc2)NCc3ccccc3	ZINC000000489160	O=C(CCN1CCCCC1c2cccnc2)NCc3ccccc3
Cc3ccc(S(=O)(=O)N=C(O)N1CCC[C@H]1C(=O)Nc2ccc(S(=O)(=O)NN=C(N)N)cc2)cc3	ZINC000013808176	O=C(Nc1ccccc1)C2CCCN2C=NS(=O)(=O)c3ccccc3
OC[C@@H]1CCCC[N@]1Cc3ccc2OCOc2c3	ZINC000000209105	C3CCN(Cc2ccc1OCOc1c2)CC3
COC(=O)Cc3c(C)c2ccc(O)c(CN1CCCCC1)c2oc3=O	ZINC000000489063	O=c3ccc2cccc(CN1CCCCC1)c2o3
Cn3nc2c1ccc(N(=O)=O)cc1c(=O)c2c3C(C)(C)C	ZINC000000027282	O=c2c1ccccc1c3n[nH]cc23
CCOc1ccccc1NC(=O)c3c2CCCCCc2sc3NC(=O)CCC(O)=O	ZINC000000709600	O=C(Nc1ccccc1)c3csc2CCCCCc23
CCOC(=O)[C@@H]1CCCNC1	ZINC000000057099	C1CCNCC1
CCc3ccc(S(=O)(=O)N(CC[N@]1[C@@H](C)CCC[C@H]1C)CCC(=O)N2CCNCC2)cc3	ZINC000045945539	O=C(CCN(CCN1CCCCC1)S(=O)(=O)c2ccccc2)N3CCNCC3
CN(C)CC(=O)Nc3c1CCCc1nc2CCCc23	ZINC000000198573	C3Cc2cc1CCCc1nc2C3
C[C@@H]2C[C@@H](OC(=O)CN1CCCCC1)CC(C)(C)C2	ZINC000000171967	O=C(CN1CCCCC1)OC2CCCCC2
O=C(Cn1ccnc1N(=O)=O)NCc2ccccc2	ZINC000000056949	O=C(Cn1ccnc1)NCc2ccccc2
C[C@@H]2CN(C1CCNCC1)C[C@@H](C)O2	ZINC000000299478	C2CC(N1CCOCC1)CCN2
COc1ccc(C[C@@H](C)N)cc1	ZINC000000403036	c1ccccc1
CC[C@@H](Sc2nc1ccccc1[nH]2)C(=O)Nc3nnc(C)s3	ZINC000000033301	O=C(CSc2nc1ccccc1[nH]2)Nc3nncs3
NC(=O)Cn1c(=O)oc2ccc(N(=O)=O)cc12	ZINC000000169256	O=c2[nH]c1ccccc1o2
COC(=O)c2c(C)[nH]c(C(=O)CN1CCC(C)CC1)c2C	ZINC000000090023	O=C(CN1CCCCC1)c2ccc[nH]2
CC[C@H]1C[N@]2CC[C@@H]1C[C@@H]2[C@H](O)c3ccnc4ccc(OC)cc34	ZINC000000156023	C1CN2CCC1CC2Cc3ccnc4ccccc34
Cn3c(NCc2ccc1OCOc1c2)nc4ccccc34	ZINC000000196187	C4Oc3ccc(CNc2nc1ccccc1[nH]2)cc3O4
C[N@@](CCOC(=O)c1cccs1)Cc2ccccc2	ZINC000000174336	O=C(OCCNCc1ccccc1)c2cccs2
CCc1nn(CCN)c3c1ccc2occc23	ZINC000000017687	c3cc2c(ccc1cn[nH]c12)o3
CC(C)[C@@H](O)[P@@](=O)(OCc1ccccc1)c2ccc(N(C)C)cc2	ZINC000000203889	O=P(OCc1ccccc1)c2ccccc2
Cc3nc2n(c1ccccc1)ncc2c(=O)n3CC(N)=O	ZINC000000113750	O=c2[nH]cnc3n(c1ccccc1)ncc23
CCC(=O)Nc3ccc2[nH]cc(C1CCN(C)CC1)c2n3	ZINC000000023433	C3CC(c1c[nH]c2cccnc12)CCN3
O=c1ccc(=O)n1C3CCN(Cc2ccccc2)CC3	ZINC000000069744	O=c1ccc(=O)n1C3CCN(Cc2ccccc2)CC3
O=C(N2CCN(C1CCCC1)CC2)c3cccnc3	ZINC000000239811	O=C(N2CCN(C1CCCC1)CC2)c3cccnc3
CN[C@@]13CCCC[C@H]1Sc2ccccc23	ZINC000000004278	C1CCC2C(C1)Sc3ccccc23
CCOC(=O)N2CCC(NCCC1=CCCCC1)CC2	ZINC000000220810	C2CCC(CCNC1CCNCC1)=CC2
CCCn2c([C@@H](C)NCC)nc1ccccc1c2=O	ZINC000000250498	O=c1[nH]cnc2ccccc12
Cc3ccc(OCC(=O)Nc2sc1CCCc1c2C(N)=O)c(C)c3	ZINC000000076862	O=C(COc1ccccc1)Nc3cc2CCCc2s3
Cc3cc(N1CCCCC1)nc(N2CCOCC2)n3	ZINC000000073494	C3CCN(c2ccnc(N1CCOCC1)n2)CC3
C[C@@H](O)[C@@H]3[C@@H]2[C@@H](C)C(S[C@@H]1CCO[C@@H]1CNC(=O)OCOC(=O)C(C)(C)C)=C(C(O)=O)N2C3=O	ZINC000029480674	O=C3CC2CC(SC1CCOC1)=CN23
CN4CCN(c2cc(c1cccnc1)nc3ccccc23)CC4	ZINC000000018409	C4CN(c2cc(c1cccnc1)nc3ccccc23)CCN4
CCOC(=O)c1c(C)c(C)sc1NC(=S)N2CCN(C)CC2	ZINC000000160373	S=C(Nc1cccs1)N2CCNCC2
CCCn2c(N)c(C(=O)COC(=O)CNS(=O)(=O)c1c(F)cccc1F)c(=O)[nH]c2=O	ZINC000009076885	O=C(CNS(=O)(=O)c1ccccc1)OCC(=O)c2c[nH]c(=O)[nH]c2=O
CC2(C)C(c1ccccc1)[N+](=O)C(C)(C)N2O	ZINC000000120643	O=[N+]1CNCC1c2ccccc2
O=C2NCC1(CCNCC1)O2	ZINC000000014087	O=C2NCC1(CCNCC1)O2
Cc2ccc(OCC(=O)OCc1cccc(Br)c1)cc2C	ZINC000000151107	O=C(COc1ccccc1)OCc2ccccc2
O=N(=O)c3ccc(c2nnn(CCN1CCCCC1)n2)cc3	ZINC000000410845	C3CCN(CCn2nnc(c1ccccc1)n2)CC3
Fc5ccc4c(CCCN3CCC(n1c(=O)[nH]c2ccccc12)CC3)noc4c5	ZINC000000538067	O=c2[nH]c1ccccc1n2C5CCN(CCCc3noc4ccccc34)CC5
CNc3cc(OC)c(C(=O)N[C@@H]2CC[N@@](Cc1ccccc1)[C@@H]2C)cc3Cl	ZINC000000538069	O=C(NC2CCN(Cc1ccccc1)C2)c3ccccc3
COc2ccc(S(=O)(=O)N(CCO)Cc1ccccc1)cc2	ZINC000000029426	O=S(=O)(NCc1ccccc1)c2ccccc2
NC[C@@H](Cc1ccccc1F)c2ccccc2	ZINC000000112546	C(Cc1ccccc1)c2ccccc2
COc1ccccc1C(=O)Nc3ccc2nc(SC)sc2c3	ZINC000000028951	O=C(Nc2ccc1ncsc1c2)c3ccccc3
Cc3noc([C@H]1C[C@H]2CC[C@@H]1N2)n3	ZINC000000023545	C1CC2NC1CC2c3ncno3
CN(C)CCOC(=O)C23CCC1C[C@@H](C[C@@H](C1)C2)C3	ZINC000000242970	C1CC2CC3CC1CC(C2)C3
Cc3ccc(CN2CCN(c1ccccc1)CC2)o3	ZINC000000277685	C2CN(c1ccccc1)CCN2Cc3ccco3
COCCN(C(=O)CSc1nc(N)cc(=O)[nH]1)c3c(N)n(Cc2ccccc2)c(=O)[nH]c3=O	ZINC000009961956	O=C(CSc1nccc(=O)[nH]1)Nc3cn(Cc2ccccc2)c(=O)[nH]c3=O
Cc1[n+](CC#C)ccn2cccc12	ZINC000000270651	c2cc1cnccn1c2
Cc2ccc(F)c(C1=NCCN1)c2	ZINC000000026886	C2CN=C(c1ccccc1)N2
C[C@H](N)Cc1ccc(N(C)C)cc1C	ZINC000000000915	c1ccccc1
CC3(C)OC(=O)N2Cc1cccc[n+]1C[C@@]23O	ZINC000000053398	O=C3OCC2C[n+]1ccccc1CN23
CCOc2ccc(/C=C/C(=O)Nc1nnc(CC)s1)cc2OCC	ZINC000000147461	O=C(Nc1nncs1)C=Cc2ccccc2
Cc1cc(CN)c(C(F)(F)F)o1	ZINC000000158512	c1ccoc1
C[N+]2(C)CCN(c1ccccc1)CC2	ZINC000000155006	C2CN(c1ccccc1)CCN2
CN(C)CCC(=O)c2ccc1OCOc1c2	ZINC000000244015	C2Oc1ccccc1O2
Cc3cc(NCc1cccnc1)c2ccccc2n3	ZINC000000120735	C(Nc1ccnc2ccccc12)c3cccnc3
CN(C)c1ccc(\C=N\N)cc1	ZINC000000129610	c1ccccc1
CCOc3cc(C=c2c(=O)[nH]c(=S)n(c1ccc(OC)cc1)c2=O)cc(CC=C)c3OC	ZINC000000660871	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc3ccccc3
Cc2nc1[nH]c(=O)ccc1cc2c3ccncc3	ZINC000000018358	O=c3ccc2cc(c1ccncc1)cnc2[nH]3
Cc2nc1[nH]c(=O)[nH]c1cc2c3ccncc3	ZINC000000018357	O=c3[nH]c2cc(c1ccncc1)cnc2[nH]3
Cn3cc2c(NC1=NCCN1)cccc2n3	ZINC000000001564	C3CN=C(Nc1cccc2n[nH]cc12)N3
Cc1ccccc1C2(C#N)CCNCC2	ZINC000000022414	C2CC(c1ccccc1)CCN2
COC(=O)C2(c1ccccc1Cl)CCNCC2	ZINC000000022417	C2CC(c1ccccc1)CCN2
N=C3N1CCCCC[C@H]1Nc4sc2CCCCc2c34	ZINC000000280793	N=C3N1CCCCCC1Nc4sc2CCCCc2c34
Cc3cn2c1ccccc1nc2n3CCO	ZINC000000255161	c1ccc2c(c1)nc3[nH]ccn23
N=C2N[C@@H](Cc1ccsc1)CS2	ZINC000000027426	N=C2NC(Cc1ccsc1)CS2
CC2(C)CC(c1ccc(O)c(O)c1)=CC(C)(C)N2	ZINC000000058452	C2CC(c1ccccc1)=CCN2
Cc2cc(C)c(OC[C@@H](O)CN1CCCC1)c(C)c2	ZINC000000351445	C2CCN(CCCOc1ccccc1)C2
CN(C)CCN(Cc1ccccc1)c2ccnc(N(C)C)c2C#N	ZINC000000210132	C(Nc1ccncc1)c2ccccc2
COc3cc(c2nc1ccccn1c2N)ccc3O	ZINC000000058459	c3ccc(c2cn1ccccc1n2)cc3
CN(C)CCOc1ccc(C#N)cc1	ZINC000000346289	c1ccccc1
NC(=N)c1cc(Cl)nc(Cl)c1	ZINC000000163105	c1ccncc1
CCCN3CCC(Nc2ccc1CCCc1c2)CC3	ZINC000000182382	C3Cc2ccc(NC1CCNCC1)cc2C3
NC(=O)CN2Cc1ccccc1OC2=O	ZINC000000001095	O=C2NCc1ccccc1O2
COc3ccc(S(=O)(=O)Nc1ccccc1C(=O)N[C@@H](C)c2ccccc2)cc3OC	ZINC000000665791	O=C(NCc1ccccc1)c2ccccc2NS(=O)(=O)c3ccccc3
O=C(Cn2nc(c1ccccc1)ccc2=O)NCCN3CCCC3	ZINC000000219351	O=C(Cn2nc(c1ccccc1)ccc2=O)NCCN3CCCC3
CNc1oncc1C2=CCC[N@@](C)C2	ZINC000000021868	C2CC=C(c1cnoc1)CN2
Nc3c1CCCCc1nc4ccn(Cc2ccccc2)c(=O)c34	ZINC000000201825	O=c3n(Cc1ccccc1)ccc4nc2CCCCc2cc34
CCOc3cc(\C=c2/c(c1ccccc1)noc2=O)ccc3OC	ZINC000000052698	O=c2onc(c1ccccc1)c2=Cc3ccccc3
C[C@@H](COc1ccccc1)NC(=O)CN2CCCC2	ZINC000000394453	O=C(CN1CCCC1)NCCOc2ccccc2
CCN(CC)CCNC(=O)C(=O)N[C@@H](C)[C@H](N2CCN(c1ccccc1)CC2)c3cccs3	ZINC000020288197	C2CN(c1ccccc1)CCN2Cc3cccs3
CC(=O)N(c1cc(C)on1)S(=O)(=O)c2ccc(N)cc2	ZINC000000000873	O=S(=O)(Nc1ccon1)c2ccccc2
C[n+]5cc2c1OCOc1ccc2c6ccc4cc3OCOc3cc4c56	ZINC000000000706	C6Oc5cc4ccc3c2ccc1OCOc1c2cnc3c4cc5O6
FC(F)C(F)(F)COCc2ccc(C(=O)NC[C@@H]1CCCO1)cc2	ZINC000000468071	O=C(NCC1CCCO1)c2ccccc2
CN2CCN=C(c1ccccc1)c3cc(Cl)ccc23	ZINC000000001659	C3CN=C(c1ccccc1)c2ccccc2N3
NCc2ccc1sccc1c2	ZINC000000159027	c2ccc1sccc1c2
COc3ccc(c2noc(C1CCNCC1)n2)cc3	ZINC000000324401	C3CC(c2nc(c1ccccc1)no2)CCN3
CN(C(C)=O)c2ccc(NS(=O)(=O)c1ccc(N(=O)=O)cc1)cc2	ZINC000000456677	O=S(=O)(Nc1ccccc1)c2ccccc2
CC1=CCN(CCNC(N)=N)CC1	ZINC000000001523	C1CC=CCN1
Cc3cc(C)c(S(=O)(=O)N1CCc2ccccc12)c(C)c3	ZINC000000029602	O=S(=O)(N1CCc2ccccc12)c3ccccc3
COc2c1CNCCn1c3ccc(F)cc23	ZINC000000017967	C1Cn2c(CN1)cc3ccccc23
Clc1ccccc1CN3CCN(c2ccccn2)CC3	ZINC000000207170	C2CN(c1ccccn1)CCN2Cc3ccccc3
O=C([C@@H]1CCCN1)N4CCN(C(c2ccccc2)c3ccccc3)CC4	ZINC000000252085	O=C(C1CCCN1)N4CCN(C(c2ccccc2)c3ccccc3)CC4
C[C@H]1CNCCCN1S(=O)(=O)c2cccc3cncc(C)c23	ZINC000000022706	O=S(=O)(N1CCCNCC1)c2cccc3cnccc23
O=C2N=C(c1ccccc1)SC2c3ccccc3	ZINC000000012806	O=C2N=C(c1ccccc1)SC2c3ccccc3
CS(=O)(=O)N2CCN(C1CCCCCC1)CC2	ZINC000000300586	C2CCCC(N1CCNCC1)CC2
CC(=C)C[C@@H]1C(Br)=CCC[N+]1(C)C	ZINC000000055886	C1CC=CCN1
Nc3cc(N)nc(SCc2ccc(C(=O)N1CCOCC1)cc2)n3	ZINC000000115798	O=C(N1CCOCC1)c3ccc(CSc2ncccn2)cc3
CC(C)[C@@H](OC(=O)c1ccccc1C(O)=O)[C@H](C(C)C)c2ccccc2	ZINC000000640343	O=C(OCCc1ccccc1)c2ccccc2
CN(C)Cc1ccccc1OC(=O)N(C)C	ZINC000000187893	c1ccccc1
Cc2ccc(NC(=O)CCN1CCCC1)cc2	ZINC000000176406	O=C(CCN1CCCC1)Nc2ccccc2
COc2ccc(CN1CCN(C(=O)CN)CC1)c(OC)c2OC	ZINC000000008460	C2CN(Cc1ccccc1)CCN2
Cc1ccc(Cl)cc1NC(=O)CCn3c(=O)c2ccccc2c3=O	ZINC000000045197	O=C(CCn2c(=O)c1ccccc1c2=O)Nc3ccccc3
COc3ccc(CN2CCN(c1ccc(C(C)=O)cc1)CC2)cc3	ZINC000000300512	C2CN(c1ccccc1)CCN2Cc3ccccc3
CC[n+]2cc(N)nc(c1ccc(Br)cc1)n2	ZINC000000506409	c2ccc(c1nccnn1)cc2
C[C@@H](Cn2c(=O)c1cccnc1[nH]c3ccccc23)N(C)C	ZINC000000000671	O=c2[nH]c1ccccc1[nH]c3ncccc23
CCN3CCN(c1ncnc2ccc(Br)cc12)CC3	ZINC000000122268	C3CN(c1ncnc2ccccc12)CCN3
CC2(C)Nc1c(N)cccc1[N+]2=O	ZINC000000439835	O=[N+]1CNc2ccccc12
CCN(CC)C[C@H]2COc1ccccc1O2	ZINC000000000674	C2COc1ccccc1O2
C[C@H]1C[N@@](C)C[C@@H](C)C1(O)C#C	ZINC000000094123	C1CCNCC1
CN(C)CCNC(=O)c1c(C)onc1c2ccccc2	ZINC000000155132	c2ccc(c1ccon1)cc2
COc3c1OCOc1cc2CC[N+](C)(C)[C@H](CC(=O)C=C(C)C)c23	ZINC000000526449	C3Cc2cc1OCOc1cc2CN3
CN(C)CCNC(=S)Nc1ccccc1F	ZINC000000315968	c1ccccc1
CC2(C)NC(=N)NC(Nc1ccc(F)cc1)=N2	ZINC000000203677	N=C2NCN=C(Nc1ccccc1)N2
CCN(CC)S(=O)(=O)c2ccc(NC(=O)\C=C\c1ccco1)cc2	ZINC000000310193	O=C(Nc1ccccc1)C=Cc2ccco2
CC(NCC1CCNCC1)=C2C(=O)CC(C)(C)CC2=O	ZINC000000246936	O=C1CCCC(=O)C1=CNCC2CCNCC2
Clc2ccc(OC[C@@H]1CCN1)cn2	ZINC000000007009	C2CC(COc1cccnc1)N2
C(NCc1ccncc1)c2ccncc2	ZINC000000001506	C(NCc1ccncc1)c2ccncc2
C[N+](C)(C)CC[C@@H](O)c1ccccc1	ZINC000000217484	c1ccccc1
C[N@]1CCN3[C@@H](C1)c2cccn2Cc4ccccc34	ZINC000000000050	C1CN3C(CN1)c2cccn2Cc4ccccc34
CNC3CCN(C(=O)[C@@H](Cc1cccc(C(N)=N)c1)NS(=O)(=O)NCc2cccc(OC)c2OC)CC3	ZINC000095542154	O=C(C(Cc1ccccc1)NS(=O)(=O)NCc2ccccc2)N3CCCCC3
CSc3cccc(NC2CCN(CCc1ccccc1)CC2)c3	ZINC000000227684	C2CN(CCc1ccccc1)CCC2Nc3ccccc3
NC(=O)c2nnc(c1ccc(N(=O)=O)cc1)o2	ZINC000000105832	c2ccc(c1nnco1)cc2
CN(C)CCNC(=O)c1cc(C)cc(C)c1	ZINC000000496685	c1ccccc1
Nc1sc(C#N)c(N)c1C#N	ZINC000000055146	c1ccsc1
Nc2nc1CC[N@](CC=C)CCc1s2	ZINC000000006644	C2Cc1ncsc1CCN2
CCCc1cc(CC)cc(N)n1	ZINC000000021817	c1ccncc1
C[C@H]1CCC[C@@H](C)[N@]1C[C@@H](O)COc2ccc(N)cc2	ZINC000000262190	C2CCN(CCCOc1ccccc1)CC2
Cc2cc[n+](Cc1cnc(C)nc1N)cc2	ZINC000000251478	C(c1cncnc1)[n+]2ccccc2
CCc1ccccc1NC(=O)c2ccc(F)cc2	ZINC000000029775	O=C(Nc1ccccc1)c2ccccc2
C[C@H](N[C@@H]1CCCNC1)c2ccccc2N5CCN(C(=O)[C@@H](Cc3ccc(Cl)cc3)NC(=O)[C@@H](N)Cc4ccccn4)CC5	ZINC000028134531	O=C(CCc1ccccn1)NC(Cc2ccccc2)C(=O)N5CCN(c3ccccc3CNC4CCCNC4)CC5
CCN(CC)C(=O)[n+]1ccc(N)cc1	ZINC000000389055	c1ccncc1
CC(=O)Oc1ccccc1C(=O)Nc2ccc(C(N)=O)cc2	ZINC000000030338	O=C(Nc1ccccc1)c2ccccc2
O=c2cccc1[C@H]4C[C@@H](Cn12)[C@@H]3CCC[N@]3C4	ZINC000000265577	O=c2cccc1C4CC(Cn12)C3CCCN3C4
Cn3c(N2CCN(CCc1ccccc1)CC2)cc(=O)n(C)c3=O	ZINC000000015120	O=c3cc(N2CCN(CCc1ccccc1)CC2)[nH]c(=O)[nH]3
CC(=O)Oc2ccc(C(=O)Nc1ccc(C#N)cc1)cc2	ZINC000000030297	O=C(Nc1ccccc1)c2ccccc2
CSc3nc2ccc(NC(=O)CCc1ccccc1)cc2s3	ZINC000000048938	O=C(CCc1ccccc1)Nc3ccc2ncsc2c3
Brc1ccccc1NS(=O)(=O)c2ccccc2	ZINC000000032086	O=S(=O)(Nc1ccccc1)c2ccccc2
Cc2ccc(S(=O)(=O)N/N=C/c1ccc(O)cc1O)cc2	ZINC000000071885	O=S(=O)(NN=Cc1ccccc1)c2ccccc2
CCOC(=O)c3cccc(NC2=NC1(CCCCC1)NC(=N)N2)c3	ZINC000000203765	N=C3NC(Nc1ccccc1)=NC2(CCCCC2)N3
CC(=O)Nc3ccc2n(CCO)c1ccccc1[n+]2c3	ZINC000000387484	c1ccc3c(c1)[nH]c2cccc[n+]23
COc2cc1nc(C)[nH]c1cc2OC	ZINC000000246411	c2ccc1[nH]cnc1c2
Cc1cc(Cl)ccc1OCc3nc(c2cccc(N(=O)=O)c2)no3	ZINC000000099434	C(Oc1ccccc1)c3nc(c2ccccc2)no3
COc2ccc(NC(=O)Cn1cc(N(=O)=O)cn1)cc2	ZINC000000037044	O=C(Cn1cccn1)Nc2ccccc2
CN(C)c3ccc([N+](=O)Cc1ccc(C)c2nsnc12)cc3	ZINC000000296717	O=[N+](Cc1cccc2nsnc12)c3ccccc3
COc4cccc(S(=O)(=O)Nc3ccc(C(=O)N2CCc1cc(OC)c(OC)cc1C2)cc3)c4	ZINC000000631131	O=C(N2CCc1ccccc1C2)c4ccc(NS(=O)(=O)c3ccccc3)cc4
CCc3nc2ccc(C(=O)N1CCN(S(=O)(=O)CC)CC1)cn2c3N(CCC(C)C)CCN(C)C	ZINC000061902902	O=C(N1CCNCC1)c3ccc2nccn2c3
CCOC(=O)N4CCC(NC2c1ccccc1c3ccccc23)CC4	ZINC000000217711	C4CC(NC2c1ccccc1c3ccccc23)CCN4
NCCCN2CCN(C(=O)[C@H](CCCNC(N)=N)NS(=O)(=O)c1cccc(C(F)(F)F)c1)CC2	ZINC000016051611	O=C(CNS(=O)(=O)c1ccccc1)N2CCNCC2
CC(=O)C(=Cc1ccc(S(C)(=O)=O)cc1)C(C)=O	ZINC000000006844	c1ccccc1
CC[C@H](N1CCC(C(N)=O)CC1)c2nnnn2C3CCCC3	ZINC000000413524	C3CCN(Cc1nnnn1C2CCCC2)CC3
CC(=O)Nc2ccc(OCC[n+]1ccccc1)cc2	ZINC000000297621	C(C[n+]1ccccc1)Oc2ccccc2
N=C3N[C@@H](C(=O)c1ccccc1)[C@@H](c2ccccc2)N3	ZINC000000173760	N=C3NC(C(=O)c1ccccc1)C(c2ccccc2)N3
Fc3ccc(C[N@]2CCCN(C(=S)NC1CCCCC1)CC2)cc3	ZINC000000066332	S=C(NC1CCCCC1)N3CCCN(Cc2ccccc2)CC3
Clc2ccc(NC(=O)[C@@H]1CCC(=O)N1)cc2Br	ZINC000000038220	O=C2CCC(C(=O)Nc1ccccc1)N2
Cc2ccc(C(=O)C1CCNCC1)cc2	ZINC000000110326	O=C(C1CCNCC1)c2ccccc2
O[C@@](Cn1ccnc1)(c2ccc(F)cc2)c4ccc(c3ccncc3)cc4	ZINC000000599401	C(C(c1ccccc1)c3ccc(c2ccncc2)cc3)n4ccnc4
CC(=O)Nc3ccc(c2n/c(=C/c1cccs1)c(=O)o2)cc3	ZINC000000032084	O=c2oc(c1ccccc1)nc2=Cc3cccs3
CN(C)C[C@@H]1CSCC[C@@]1(O)c2ccccc2	ZINC000000347728	C2CC(c1ccccc1)CCS2
CCN(CC)C(=O)[C@@H]2CCC[N@@](Cc1cccnc1)C2	ZINC000000199348	C2CCN(Cc1cccnc1)CC2
CO[C@@H]2[C@H](OC(=O)NC(=O)CCl)CO[C@]1(COC(C)(C)O1)[C@@]2(O)[C@@H]3O[C@@H]3CCCc4ccccc4	ZINC000003946250	C4COC1(COCO1)C(C2OC2CCCc3ccccc3)C4
COc3ccc(C(=O)COC(=O)c1ccccc1c2ccccc2)cc3	ZINC000000313334	O=C(COC(=O)c1ccccc1c2ccccc2)c3ccccc3
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
Cc3ccc(S(=O)(=O)Nc2nc1ccccc1nc2Cl)cc3	ZINC000000041740	O=S(=O)(Nc2cnc1ccccc1n2)c3ccccc3
FC(F)(F)c2ccc(Cl)c(NC(=O)c1cccnc1)c2	ZINC000000029311	O=C(Nc1ccccc1)c2cccnc2
NC[C@@H](O)c2ccc1ccccc1c2	ZINC000000169985	c2ccc1ccccc1c2
CCOc1ccccc1NC(=O)c3cccc(NS(=O)(=O)c2ccc(C)cc2)c3	ZINC000000683282	O=C(Nc1ccccc1)c3cccc(NS(=O)(=O)c2ccccc2)c3
Cc3cccc(C(=O)N2CCc1ccccc1C2)c3	ZINC000000029310	O=C(N2CCc1ccccc1C2)c3ccccc3
COC(=O)c1ccccc1S(=O)(=O)C2CCNCC2	ZINC000000154174	O=S(=O)(C1CCNCC1)c2ccccc2
OC(=O)[C@@H](CC(=O)Nc1cccc2ccccc12)NCc3cccnc3	ZINC000000195789	O=C(CCNCc1cccnc1)Nc2cccc3ccccc23
COc2ccc(CCNS(=O)(=O)c1cc(C)ccc1C)cc2OC	ZINC000000387211	O=S(=O)(NCCc1ccccc1)c2ccccc2
COc2ccc(NC(=O)CSC1=NCCN1)cc2	ZINC000000141881	O=C(CSC1=NCCN1)Nc2ccccc2
CCCc1nn(C)c(C(N)=O)c1N	ZINC000000168940	c1cn[nH]c1
CCOc3ccc(OCC)c(Cc2oc(c1ccccc1)nc2O)c3	ZINC000000042471	C(c1ccccc1)c3cnc(c2ccccc2)o3
NC(=O)c1cnn2c(N)c(C#N)cnc12	ZINC000000124441	c2cnc1ccnn1c2
Cn4c(=O)n(C)c3ncn(CC(=O)Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c3c4=O	ZINC000006489852	O=C(Cn1cnc2[nH]c(=O)[nH]c(=O)c12)Nc4ccc(S(=O)(=O)Nc3ncccn3)cc4
CN1C[C@@H](O)C[n+]2c1sc3ccccc23	ZINC000000375165	C3CNc2sc1ccccc1[n+]2C3
C[N+](C)(C)/C=C/c1ccc(N(=O)=O)o1	ZINC000000162095	c1ccoc1
CNc3cccc(CCOc2ccc1C[C@H](CC(O)=O)C(=O)N(CC(F)(F)F)Cc1c2)n3	ZINC000000581923	O=C3CCc2ccc(OCCc1ccccn1)cc2CN3
CSc2nnc(c1cc[n+](C)cc1)n2CCO	ZINC000000353156	c2cc(c1nnc[nH]1)ccn2
CN(C)CCNC(=O)c1cccc(Cl)c1	ZINC000000213479	c1ccccc1
CN(C)CCNC(=O)c1ccc(F)cc1	ZINC000000213474	c1ccccc1
O=c2n(CN1CCCCC1)c4cccc3cccc2c34	ZINC000000125964	O=c2n(CN1CCCCC1)c4cccc3cccc2c34
CN(C)CCNC(=S)Nc1ccc(F)cc1	ZINC000000316122	c1ccccc1
Brc3cncc(N1CCN2CCC1CC2)c3	ZINC000000025861	C1CN3CCC1N(c2cccnc2)CC3
CCOC(=O)c2c(C)nc3c([C@@H]1CCC[N@]1C)cccn23	ZINC000000134536	C3CNC(c1cccn2ccnc12)C3
CN(C)CCNC(=O)c1cccnc1N2CCN(C)CC2	ZINC000000481267	C2CN(c1ccccn1)CCN2
CCOC(=O)c1cc(C(C)(C)C)oc1CN	ZINC000000032660	c1ccoc1
C[N+]2(CCOC(=O)Nc1ccccc1)CCCCC2	ZINC000000171850	O=C(Nc1ccccc1)OCCN2CCCCC2
O=N(=O)N=C3NCN(C2CCN(Cc1ccccc1)CC2)CN3	ZINC000000085820	N=C3NCN(C2CCN(Cc1ccccc1)CC2)CN3
C4CCN(CCSc1nnc3c(n1)[nH]c2ccccc23)CC4	ZINC000000080363	C4CCN(CCSc1nnc3c(n1)[nH]c2ccccc23)CC4
O[C@H](CN1CCCCC1)CN(c2ccccc2)c3ccccc3	ZINC000000126997	C3CCN(CCCN(c1ccccc1)c2ccccc2)CC3
COC(=C)C[N+](C)(C)C	ZINC000000000457	nonring
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
COc1ccc(S(N)(=O)=O)cc1C(=O)NC2CCN(C)CC2	ZINC000000347658	O=C(NC1CCNCC1)c2ccccc2
CCN(CC)CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000000118206	c1ccccc1
c3cc(n1nnc2cnccc12)ccn3	ZINC000000331547	c3cc(n1nnc2cnccc12)ccn3
N[C@H]2[C@@H](CO)COc3ccc1ccccc1c23	ZINC000000167384	C3COc2ccc1ccccc1c2C3
C(c2nc1ccccc1[nH]2)[n+]3ccccc3	ZINC000000340975	C(c2nc1ccccc1[nH]2)[n+]3ccccc3
Cn2c(N)c(C(=O)CNC1CCCCC1)c(=O)n(C)c2=O	ZINC000000141334	O=C(CNC1CCCCC1)c2c[nH]c(=O)[nH]c2=O
COc1ccccc1CCN2CCC(C[N@@](C)C[C@@H](O)CO)CC2	ZINC000011957151	C2CCN(CCc1ccccc1)CC2
COc3cc2[C@@H](C)NCC1(CCCC1)c2cc3OC	ZINC000000197787	C1CCC3(C1)CNCc2ccccc23
CCCN2CCC(NCCNC(=O)c1ccco1)CC2	ZINC000006879334	O=C(NCCNC1CCNCC1)c2ccco2
CCN3CCN(CC(=O)N2CCC[C@@H]([N@@](C)CCc1ccccn1)C2)CC3	ZINC000019839689	O=C(CN1CCNCC1)N3CCCC(NCCc2ccccn2)C3
O=C(NC[C@@H]1CCCO1)C3CCN(C[C@H]2CCC=CC2)CC3	ZINC000000317506	O=C(NCC1CCCO1)C3CCN(CC2CCC=CC2)CC3
COc2cc1CC[N@](CCC(N)=O)[C@H](C)c1cc2OC	ZINC000000525572	C2Cc1ccccc1CN2
O=N(=O)c1ccccc1CN2CCNCC2	ZINC000000239623	C2CN(Cc1ccccc1)CCN2
COC(=O)COc2ccc(=O)n(c1ccccc1)n2	ZINC000000316053	O=c1cccnn1c2ccccc2
NC[C@@H](O)COCc1ccco1	ZINC000000249239	c1ccoc1
CC(C)c2nc1nc(N)nc(N)c1nc2C(C)C	ZINC000000040831	c2cnc1ncncc1n2
CCc2cn(Cc1ccccc1)c[n+]2Cc3ccccc3	ZINC000000161623	C(c1ccccc1)n3cc[n+](Cc2ccccc2)c3
CN(CCO)S(=O)(=O)c1ccc(N)cc1	ZINC000000211528	c1ccccc1
NC(=O)C[N@]2CCCC1(CCCCC1)C2	ZINC000000040834	C1CCC2(CC1)CCCNC2
CS(=O)(=O)c1ccc(CN)cc1	ZINC000000086758	c1ccccc1
CN2CCN(NC(=O)C1CCCC1)CC2	ZINC000000369172	O=C(NN1CCNCC1)C2CCCC2
CCOC(=O)\C=C\[n+]1cccc(C)c1	ZINC000000268326	c1ccncc1
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
Cc2sc(NC(=O)Cc1ccccc1)c(C(N)=O)c2C	ZINC000000035368	O=C(Cc1ccccc1)Nc2cccs2
Cc2cc(C)c(n1cccc1CN)c(C)c2	ZINC000000035367	c2ccc(n1cccc1)cc2
CCN(CC)CCn2c1ccccc1c3nnc(=NN)[nH]c23	ZINC000000530405	N=c3nnc2c1ccccc1[nH]c2[nH]3
O=c2nc(N1CCCCC1)s/c2=C/c3ccccn3	ZINC000000032401	O=c2nc(N1CCCCC1)sc2=Cc3ccccn3
CC[n+]1ccc(C)c(CCOC(C)=O)c1	ZINC000000227215	c1ccncc1
CN(C)CCNc2cc(C)c1ccccc1n2	ZINC000000015672	c2ccc1ncccc1c2
NCc1ccc(F)c(Br)c1	ZINC000000157219	c1ccccc1
CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)NCc2ccccc2	ZINC000000044132	O=C(NCc1ccccc1)C2CCCN2
C[C@@H]2NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)NC(=O)[C@@H](CCCCN)NC2=O	ZINC000028091599	O=C2CNC(=O)CNC(=O)C1CCCN1C(=O)CNC(=O)CN2
O=c2[nH]c1ccccc1n2C4CCN(CCOc3ccccc3)CC4	ZINC000000001873	O=c2[nH]c1ccccc1n2C4CCN(CCOc3ccccc3)CC4
C3COC2(CCN(Cc1ccccc1)CC2)O3	ZINC000000134518	C3COC2(CCN(Cc1ccccc1)CC2)O3
C3C[C@H](CN2CCN(c1ncccn1)CC2)CC=C3	ZINC000000217806	C3CC(CN2CCN(c1ncccn1)CC2)CC=C3
O[C@@H](CN2CCC(O)(c1ccc(Cl)cc1)CC2)c3ccccc3	ZINC000000118442	C2CN(CCc1ccccc1)CCC2c3ccccc3
Fc3ccc(C(=O)Nc2nnc(SCc1ccccc1)s2)cc3	ZINC000000052639	O=C(Nc2nnc(SCc1ccccc1)s2)c3ccccc3
CCOc3ccc(NC(=O)c2ccc(NS(=O)(=O)c1cccc(F)c1)cc2)cc3	ZINC000000631142	O=C(Nc1ccccc1)c3ccc(NS(=O)(=O)c2ccccc2)cc3
C[C@@H](Nc2nc(N1CCNCC1)nc3ccccc23)c4ccccc4	ZINC000000568534	C4CN(c3nc(NCc1ccccc1)c2ccccc2n3)CCN4
COc2ccc(O)c(Cc1nccn1C)c2	ZINC000000003690	C(c1ccccc1)c2ncc[nH]2
CCOc2ccc(NC(=O)CCS(=O)(=O)c1ccc(C)cc1)cc2	ZINC000000224812	O=C(CCS(=O)(=O)c1ccccc1)Nc2ccccc2
OC[C@@H](NCc1ccccc1)C#CCN2CCCC2	ZINC000000185570	C2CCN(CC#CCNCc1ccccc1)C2
CCOC(=O)[C@@H]1CCCCN1C2CCN(C)CC2	ZINC000000291709	C2CCN(C1CCNCC1)CC2
C(NCc1cccs1)c2cccs2	ZINC000000128023	C(NCc1cccs1)c2cccs2
CCOc1ccc(C(F)(F)F)cc1NS(=O)(=O)c2cc(C(C)C)c(OC)cc2C	ZINC000000645835	O=S(=O)(Nc1ccccc1)c2ccccc2
CN1CCC2(CC1)OC(=O)N(C(C)(C)C)C2=O	ZINC000000011052	O=C2NC(=O)C1(CCNCC1)O2
CC[C@@H](Sc2nc1ccccc1o2)C(=O)Nc3ccc(Cl)cn3	ZINC000000069597	O=C(CSc2nc1ccccc1o2)Nc3ccccn3
CCn3c(=O)n(C(=O)NC1C[C@@H]2CC[C@H](C1)[N@]2C)c4ccccc34	ZINC000000004620	O=C(NC1CC2CCC(C1)N2)n3c(=O)[nH]c4ccccc34
O=c3[nH]c2ccc(S(=O)(=O)NCCN1CCCCC1)cc2c4ccccc34	ZINC000000603138	O=c3[nH]c2ccc(S(=O)(=O)NCCN1CCCCC1)cc2c4ccccc34
Cc2cc(=O)oc3cc(O[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1O)ccc23	ZINC000000057398	O=c3ccc2ccc(OC1CCCCO1)cc2o3
CC(C)(C)OC(=O)N3CCC(C(=O)N1CCC[C@H]1C(=O)N[C@H](CC(N)=O)C(O)=O)(c2ccccc2)CC3	ZINC000009129324	O=C(N1CCCC1)C3(c2ccccc2)CCNCC3
CN(C)C[C@@H](CN)Cc1ccc(N(C)C)cc1	ZINC000011736662	c1ccccc1
NC(=O)C4(N1CCCCC1)CCN([C@@H]2OC(=O)c3ccccc23)CC4	ZINC000000106585	O=C3OC(N2CCC(N1CCCCC1)CC2)c4ccccc34
COC(=O)[C@H](CC(C)C)NC(=O)C(c1ccccc1)c2ccccc2	ZINC000000054605	C(c1ccccc1)c2ccccc2
Cc1cc(O)cc(C)c1C[C@@H](N)C(=O)NCc3nc(C)c(CNC(=O)[C@H](N)Cc2c(C)cc(O)cc2C)[nH]c3=O	ZINC000084597541	O=C(CCc1ccccc1)NCc3cnc(CNC(=O)CCc2ccccc2)c(=O)[nH]3
Cc2cc(NC(=O)C1CCC(CN)CC1)ccn2	ZINC000000012059	O=C(Nc1ccncc1)C2CCCCC2
O=C1CCCN1c4ccc(S(=O)(=O)Nc3ccc(S(=O)(=O)N2CCOCC2)cc3)cc4	ZINC000001426081	O=C1CCCN1c4ccc(S(=O)(=O)Nc3ccc(S(=O)(=O)N2CCOCC2)cc3)cc4
CCN(C(=O)COc1ccc(Br)cc1C)c2ccccc2	ZINC000000358964	O=C(COc1ccccc1)Nc2ccccc2
CN5CCN(C[C@H]4C[C@@H](C(=O)NCCN1CCNC1=O)C[N@@](Cc3ccc2ccccc2c3)C4)CC5	ZINC000023353951	O=C(NCCN1CCNC1=O)C5CC(CN2CCNCC2)CN(Cc4ccc3ccccc3c4)C5
CC(C)(C)NC(=O)C3CCN(Cc2ccc1OCOc1c2)CC3	ZINC000000299275	C3CCN(Cc2ccc1OCOc1c2)CC3
Cc2cnc1ccc(Br)c[n+]1c2C	ZINC000000078045	c2cc[n+]1cccnc1c2
CC(C)CNCC2OCc1ccccc1CO2	ZINC000000195221	C2OCc1ccccc1CO2
CCCC(=O)N3CCN(c2nc(N)c1cc(OC)c(OC)cc1n2)CC3	ZINC000000638562	C3CN(c2ncc1ccccc1n2)CCN3
C3CN=C(NC(C1CC1)C2CC2)O3	ZINC000000009708	C3CN=C(NC(C1CC1)C2CC2)O3
COC[C@@H](N)Cc1ccccc1	ZINC000000403116	c1ccccc1
Fc2ccc(C[N+](=O)c1ccccc1)cc2	ZINC000000078412	O=[N+](Cc1ccccc1)c2ccccc2
Nc2cc(N)nc(SCC(=O)NC1CCCC1)n2	ZINC000000410873	O=C(CSc1ncccn1)NC2CCCC2
COC(=O)c2ccc(NC(=O)CNC1CCCCC1)cc2	ZINC000000278521	O=C(CNC1CCCCC1)Nc2ccccc2
Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N3Cc2ccccc2C[C@H]3C(=O)N[C@@H](CCCNC(N)=N)C(N)=O	ZINC000028372024	O=C(CCc1ccccc1)N3CCc2ccccc2C3
C2CO[C@H](CNCc1ccco1)C2	ZINC000000265972	C2COC(CNCc1ccco1)C2
CCOC(=O)c1c(C)[nH]c(C)c1c2ccccc2OC	ZINC000000028947	c2ccc(c1cc[nH]c1)cc2
O=C(CNC1CCCCC1)Nc3sc2CCCCc2c3C#N	ZINC000000411672	O=C(CNC1CCCCC1)Nc3cc2CCCCc2s3
S=C2N(CN1CCCCC1)CCN2CN3CCCCC3	ZINC000000027631	S=C2N(CN1CCCCC1)CCN2CN3CCCCC3
CC1=[N+](C)CCn2c(C)ccc12	ZINC000000270644	C2Cn1cccc1C=N2
CN(C)c1nc(N(C)C)nc(N(C)C)n1	ZINC000000000905	c1ncncn1
CC[N@]2CCC[C@@H](NC(=O)c1cc(NC)ccc1OC)C2	ZINC000000347685	O=C(NC1CCCNC1)c2ccccc2
CN1CC(=O)NC(=O)N1c3cc(Cl)c(Oc2ccc(S(C)(=O)=O)cc2)c(Cl)c3	ZINC000000538388	O=C3CNN(c2ccc(Oc1ccccc1)cc2)C(=O)N3
COc1cc(N)cn[n+]1c2ccccc2	ZINC000000000908	c2ccc([n+]1ccccn1)cc2
O[C@@H](CSc1cccs1)CN2CCCC2	ZINC000000160142	C2CCN(CCCSc1cccs1)C2
CCN(CC)C[C@@H](C)OC(=O)N1CCN(C)CC1	ZINC000003599734	C1CNCCN1
CCN(CC)C[C@@H](O)CSc1cccs1	ZINC000000160141	c1ccsc1
COc3ccc(C(=O)c2nc1ccccc1n2C(C)C)cc3OC	ZINC000000034812	O=C(c1ccccc1)c3nc2ccccc2[nH]3
Cc2onc(c1ccccc1)c2C(=O)N3CCNCC3	ZINC000000158506	O=C(N1CCNCC1)c2conc2c3ccccc3
OC(=O)CN(C(=O)CNC(=O)OCN2C(=O)c1ccccc1S2(=O)=O)C(=O)OCc3ccccc3	ZINC000027550725	O=C(CNC(=O)OCN2C(=O)c1ccccc1S2(=O)=O)NC(=O)OCc3ccccc3
COC(=O)c4ccc(Nc2c1CCCc1nc3ccccc23)cc4	ZINC000000122851	C4Cc3nc1ccccc1c(Nc2ccccc2)c3C4
CCn2c1ncccc1[nH]c(=O)c3cc(Br)cnc23	ZINC000000013458	O=c2[nH]c1cccnc1[nH]c3ncccc23
CCOC(=O)c1ccccc1NS(=O)(=O)c2ccc(OCC)cc2	ZINC000000470985	O=S(=O)(Nc1ccccc1)c2ccccc2
CCOC(=O)C2C(c1cccc(OC)c1)C(C(=O)OCC)C(=C)NC2=C	ZINC000000628410	C=C2CC(c1ccccc1)CC(=C)N2
COc2cccc(CN1CCSCC1)c2OC	ZINC000000237148	C2CN(Cc1ccccc1)CCS2
CCOC(=O)c1c[nH]c(=O)c(C(N)=O)c1C	ZINC000000170378	O=c1cccc[nH]1
O=C(O[C@@H]1CN2CCC1CC2)[C@@H]4COc3ccccc3O4	ZINC000000108981	O=C(OC1CN2CCC1CC2)C4COc3ccccc3O4
CCOc3ccc(NS(=O)(=O)c2ccc(/N=C/c1cc(Cl)cc(Cl)c1O)cc2)cc3	ZINC000000674113	O=S(=O)(Nc1ccccc1)c3ccc(N=Cc2ccccc2)cc3
Oc3nc(N[C@@H](c1ccc(F)cc1)c2c(O)[nH]c(=O)[nH]c2=O)sc3CC(=O)Nc4ccc(F)cc4	ZINC000020559522	O=C(Cc3cnc(NC(c1ccccc1)c2c[nH]c(=O)[nH]c2=O)s3)Nc4ccccc4
C[C@H](O)CN[C@H](CC[C@@H]1C[C@@H](CO)CC[C@@](O)(CC(O)=O)CN[C@@]2(C)CCN[C@H](CC#C1)C2)C[C@@H]3CC[C@@H](O)[C@H](C)N3	ZINC000085487989	C3CCCC(CCCCC1CCCCN1)C#CCC2CC(CCN2)NCC3
CC(=NNC(=O)c2[nH]nc1CCCCc12)c3ccc(O)cc3	ZINC000000056086	O=C(NN=Cc1ccccc1)c3[nH]nc2CCCCc23
Cc3ccc(S(=O)(=O)NC(=O)N[C@H](Cc1ccccc1)C(=O)Nc2ccc(S(=O)(=O)N=C(N)N)cc2)cc3	ZINC000029475939	O=C(NC(Cc1ccccc1)C(=O)Nc2ccccc2)NS(=O)(=O)c3ccccc3
CCOc2ccc(/C=C/C(=O)Nc1ccccc1C(N)=O)cc2OC	ZINC000000022178	O=C(Nc1ccccc1)C=Cc2ccccc2
CCN3C(=O)C[C@H](N2CCC(Cc1ccccc1)CC2)C3=O	ZINC000000053073	O=C3CC(N2CCC(Cc1ccccc1)CC2)C(=O)N3
CCOc2ccc(c1cnc(N)nc1N)cc2	ZINC000000374791	c2ccc(c1cncnc1)cc2
CSc1nc(C)cc(SC(N)=N)n1	ZINC000000393729	c1cncnc1
CN(C)C[C@H]1CCCC[C@@]1(OC(C)=O)c2ccccc2	ZINC000000185594	C2CCC(c1ccccc1)CC2
COc2cc4CC[N@](C)[C@H]3Cc1cccc(OC)c1c(c2O)c34	ZINC000000174787	C2Cc3cccc4c1ccccc1CC(N2)c34
CCOC(=O)N3CCN(c2nc1ccccc1n2C)CC3	ZINC000000007947	C3CN(c2nc1ccccc1[nH]2)CCN3
C[C@H](N)Cn1ncc2ccc(O)cc12	ZINC000000009096	c2ccc1[nH]ncc1c2
C[C@@H](N)Cc2cn(C)c3ccc1OCCCc1c23	ZINC000000009097	C3COc2ccc1[nH]ccc1c2C3
Cc2[nH]c1ccc(F)cc1c2CCN	ZINC000000140728	c2ccc1[nH]ccc1c2
NCCN4[C@@H](c1ccccc1)c2c(n[nH]c2c3ccccc3)C4=O	ZINC000000054554	O=C2NC(c1ccccc1)c3c2n[nH]c3c4ccccc4
CCC(Nc2cccc(S(=O)(=O)N1CCCC1)c2)=c3c(=O)[nH]c(=S)n(CCOC)c3=O	ZINC000009963840	O=c1[nH]c(=S)[nH]c(=O)c1=CNc3cccc(S(=O)(=O)N2CCCC2)c3
COc2ccc(C(=O)NC(=S)NNS(=O)(=O)c1ccc(Br)cc1)cc2OC	ZINC000009373281	O=C(NC(=S)NNS(=O)(=O)c1ccccc1)c2ccccc2
O=c2[nH]c1ccccc1cc2C[N@]4CCc3ccccc3C4	ZINC000000018918	O=c2[nH]c1ccccc1cc2CN4CCc3ccccc3C4
C[C@H]2CN=C(SCc1ccc(Cl)cc1)N2	ZINC000000144283	C2CN=C(SCc1ccccc1)N2
NC2=NC(=O)[C@H](c1ccccc1)O2	ZINC000000000591	O=C1N=COC1c2ccccc2
COc3ccc(c2cnc1cc(OC)c(OC)cc1c2)cc3	ZINC000000008074	c3ccc(c2cnc1ccccc1c2)cc3
CN4CCC(N(C)c2ncnc3sc1CCCCc1c23)CC4	ZINC000000098649	C1CCc3c(C1)sc4ncnc(NC2CCNCC2)c34
C3CN=C(Cc2ccc1OCOc1c2)N3	ZINC000000009671	C3CN=C(Cc2ccc1OCOc1c2)N3
OCCn1c(N(=O)=O)cnc1c2ccc(F)cc2	ZINC000000001466	c2ccc(c1ncc[nH]1)cc2
COc1ccccc1Oc3cccc(N(Cc2cccnc2)S(=O)(=O)CC(F)(F)F)c3	ZINC000000591610	C(Nc2cccc(Oc1ccccc1)c2)c3cccnc3
CN(C)CCCNS(=O)(=O)N1CCNCC1	ZINC000020247714	C1CNCCN1
CCSc1ccc(C[N+](C)(C)C)s1	ZINC000000048037	c1ccsc1
O=c3cc(Nc2ccc(N1CCCCCC1)cc2)[nH]c(=O)[nH]3	ZINC000000277732	O=c3cc(Nc2ccc(N1CCCCCC1)cc2)[nH]c(=O)[nH]3
COC(=O)c1cc(C[N+](C)(C)C[C@@H](O)CO)c(Cl)cc1Cl	ZINC000000305674	c1ccccc1
COC(=O)C1=C(C)NC(=O)N[C@@H]1c2ccccc2OC	ZINC000000041491	O=C2NC=CC(c1ccccc1)N2
Cc1cccc[n+]1CCC(N)=O	ZINC000000393588	c1ccncc1
Cc2cccc(C(=O)NCc1ccc(S(N)(=O)=O)cc1)c2N(=O)=O	ZINC000000464157	O=C(NCc1ccccc1)c2ccccc2
C[C@@H]2CN(C(C)=O)c1ccccc1[n+]3c(C)csc23	ZINC000000112689	C3Cc1scc[n+]1c2ccccc2N3
COc2cc(Cc1cnc(N)nc1N)cc(OC)c2N(C)C	ZINC000000000011	C(c1ccccc1)c2cncnc2
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
CC[C@@](CO)(C(=O)O[C@@H]1C[N+]2(C)CCC1CC2)c3ccccc3	ZINC000000355496	O=C(Cc1ccccc1)OC2CN3CCC2CC3
CCCc2cc(=O)oc3cc(OCC(=O)c1ccc(F)cc1)ccc23	ZINC000000082675	O=C(COc2ccc1ccc(=O)oc1c2)c3ccccc3
CN(C)Cc1ccc(CO)o1	ZINC000000155106	c1ccoc1
CC(C)(C)OC(=O)N2CCN(c1ccc(CN)cc1)CC2	ZINC000000168873	C2CN(c1ccccc1)CCN2
C[N@@](Cc2ccc1OCOc1c2)C3CCCCC3	ZINC000000044124	C3CCC(NCc2ccc1OCOc1c2)CC3
FC(F)(F)c2cccc(S(=O)(=O)C1CCNCC1)c2	ZINC000000154185	O=S(=O)(C1CCNCC1)c2ccccc2
CS(=O)(=O)c1cc(C(N)=O)cc(S(C)(=O)=O)c1	ZINC000000154187	c1ccccc1
FC(F)Oc2ccc(C(=O)Nc1c(Cl)cncc1Cl)cc2OCC3CC3	ZINC000000592419	O=C(Nc1ccncc1)c3cccc(OCC2CC2)c3
Cc2ccc(N1C(=N)NC(=N)NC1(C)C)c(C)c2	ZINC000000203660	N=C2NCN(c1ccccc1)C(=N)N2
COc2ccc(OC)c(C[N@@](C)C1CCN(C)CC1)c2	ZINC000000199823	C2CC(NCc1ccccc1)CCN2
OCCNCCCNCc1ccc(F)cc1	ZINC000013732661	c1ccccc1
COc3ccc(OC)c(NS(=O)(=O)c2ccc(NC(=O)CCc1ccccc1)cc2)c3	ZINC000000665742	O=C(CCc1ccccc1)Nc3ccc(S(=O)(=O)Nc2ccccc2)cc3
O[C@@H]3C=C5CC[N@]4Cc2cc1OCOc1cc2[C@H]([C@H]3O)[C@@H]45	ZINC000000000024	C5Oc4cc3CN1CCC2=CCCC(C12)c3cc4O5
CCN[C@@H](C)Cc1cccc(C(F)(F)F)c1	ZINC000000000294	c1ccccc1
CCC(=O)O[C@@]2(c1ccccc1)CC[N@@](C)C[C@@H]2CC=C	ZINC000000000021	C2CC(c1ccccc1)CCN2
NC(=N)NCCn1ccc2ccccc12	ZINC000000216148	c2ccc1[nH]ccc1c2
CCOc3ccc(n1nnnc1SCC(=O)NCc2ccccc2)cc3	ZINC000000622980	O=C(CSc1nnnn1c2ccccc2)NCc3ccccc3
C[N@]1[C@H]3CC[C@@H]1CC(NC(=O)CSc2ccc(C)cc2)C3	ZINC000000136053	O=C(CSc1ccccc1)NC2CC3CCC(C2)N3
Nc1nccc[n+]1Cc2ccccc2	ZINC000000392299	C(c1ccccc1)[n+]2cccnc2
COc2cccc([C@@H](CN)N1CCN(CCO)CC1)c2	ZINC000020225796	C2CN(Cc1ccccc1)CCN2
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
COc2ccc(NC(=O)CCC(=O)Nc1ccc(F)cc1)c(OC)c2	ZINC000000405852	O=C(CCC(=O)Nc1ccccc1)Nc2ccccc2
COc2cc(NC(=O)CCOc1ccc(F)cc1)cc(OC)c2OC	ZINC000000107264	O=C(CCOc1ccccc1)Nc2ccccc2
Clc1ccccc1C(=O)Nc2ccc(C#N)c(Cl)c2	ZINC000000030304	O=C(Nc1ccccc1)c2ccccc2
O[C@@]3(C[n+]1ccccc1)NCCc2ccccc23	ZINC000000051739	C3Cc1ccccc1C(C[n+]2ccccc2)N3
COC(=O)[C@@H](Cc2cn(Sc1ccccc1NC(C)=O)c3ccccc23)NC(=O)[C@@H](N)CCCCN	ZINC000029402047	S(c1ccccc1)n2ccc3ccccc23
CN(C)CCSc1nc(C)cc(C)n1	ZINC000000191579	c1cncnc1
Cc2ccc1nc(N)[nH]c(=O)c1c2Sc3ccncc3	ZINC000000008107	O=c2[nH]cnc3cccc(Sc1ccncc1)c23
CCc3ccc(NC2=N[C@@H](C(=O)NC1CCCCC1)C=C(O)N2)cc3	ZINC000000529271	O=C(NC1CCCCC1)C3C=CNC(Nc2ccccc2)=N3
COc2ccc(N(CC(=O)NCc1cccnc1)S(C)(=O)=O)cc2	ZINC000000331329	O=C(CNc1ccccc1)NCc2cccnc2
O=C(NCCN1CCCC1)NC2CCCCC2	ZINC000000401746	O=C(NCCN1CCCC1)NC2CCCCC2
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
C[C@@H](O)\C=C\c1cccc[n+]1C	ZINC000000161855	c1ccncc1
CC(C)[N@]1CCc2c(C1)sc(N)c2C(N)=O	ZINC000000216897	C2Cc1ccsc1CN2
CC(=O)Cn1ccc(N(=O)=O)n1	ZINC000000060422	c1cn[nH]c1
COc1cc(Br)c(CCN)cc1OC	ZINC000000336690	c1ccccc1
C[C@@H]1CCCC[N@]1Cc2c[nH]c3ccccc23	ZINC000000142616	C3CCN(Cc1c[nH]c2ccccc12)CC3
Cn2c(N1CCCCC1)nc3n(C)c(=O)[nH]c(=O)c23	ZINC000000040793	O=c3[nH]c(=O)c2[nH]c(N1CCCCC1)nc2[nH]3
Nc1c(C#N)c(C#N)nn1CC(=O)[n+]2ccccc2	ZINC000000491439	O=C(Cn1cccn1)[n+]2ccccc2
CCOC(=O)[C@@H]2CCC[N@@](Cc1ccc(F)cc1F)C2	ZINC000000237968	C2CCN(Cc1ccccc1)CC2
NNc2ccc(C(=O)ON1C(=O)CCC1=O)cc2	ZINC000000012618	O=C1CCC(=O)N1OC(=O)c2ccccc2
CN2CCN(C(=O)c1ccc(N(C)S(C)(=O)=O)cc1)CC2	ZINC000000479707	O=C(N1CCNCC1)c2ccccc2
N#Cc3sc2nc1ccccc1n2c3/N=C/N4CCOCC4	ZINC000000154506	C4CN(C=Nc2csc3nc1ccccc1n23)CCO4
CN3CCN(C(=O)N(c1ccccc1)c2ccccc2)CC3	ZINC000000152068	O=C(N1CCNCC1)N(c2ccccc2)c3ccccc3
NNc1ncc(Cl)cc1Cl	ZINC000000269666	c1ccncc1
C[C@@H]1CC(C)(C)O[C@@H](C(C)(C)CN(C)C)O1	ZINC000000171820	C1COCOC1
COc3ccc(c2nnc(NC(=O)[C@H]1CCCN1)s2)cc3	ZINC000000324179	O=C(Nc2nnc(c1ccccc1)s2)C3CCCN3
Clc1ccccc1Cn3cc2[nH]cccc2c3=O	ZINC000000003002	O=c2n(Cc1ccccc1)cc3[nH]cccc23
CN(C(=O)Cc1cccs1)C3(C(=O)NC2CCCC2)CCCCC3	ZINC000000246605	O=C(Cc1cccs1)NC3(C(=O)NC2CCCC2)CCCCC3
COc3ccc2Cc1ccn(C[C@H](C)N)c1c2c3	ZINC000000020046	C2c1ccccc1c3[nH]ccc23
CN(C)c3ccc(\C=N\C2=NN(c1ccccc1)CC2)cc3	ZINC000000193971	C2CC(N=Cc1ccccc1)=NN2c3ccccc3
Cc2cc(C)n(c1ccc(NN)nn1)n2	ZINC000000440768	c2cnnc(n1cccn1)c2
CCN3CCN(c2ccc(NC(=O)c1ccc(F)cc1)cc2)CC3	ZINC000000588156	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
CC(=O)Nc2ccc(OC(=O)c1cccs1)cc2	ZINC000000001884	O=C(Oc1ccccc1)c2cccs2
C[N@]1CC[C@]25[C@@H]3Oc4c(O)ccc(C[C@@H]1[C@@]2(O)CCC3=O)c45	ZINC000000001880	O=C1CCC2C3Cc4cccc5OC1C2(CCN3)c45
COC(=O)[C@@H]2[C@@H](OC(=O)c1ccccc1)C[C@@H]3CC[C@H]2[N@@]3C	ZINC000000000895	O=C(OC1CC2CCC(C1)N2)c3ccccc3
CC[C@@H](C)NC(=O)c2cc(=O)n(Cc1cccc(C)c1)c3ccccc23	ZINC000000217631	O=c2ccc1ccccc1n2Cc3ccccc3
C[C@@H]2CN(C1=NCCN1)C[C@@H](C)O2	ZINC000000152795	C2CN=C(N1CCOCC1)N2
CN2CCC(NCc1ccco1)CC2	ZINC000000268581	C2CC(NCc1ccco1)CCN2
COc2ccc1[nH]cc(CCNC(N)=N)c1c2	ZINC000000094217	c2ccc1[nH]ccc1c2
NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]4CN(C(=O)C3CCNCC3)CCN4C(=O)C5CCNCC5	ZINC000067902404	O=C(NCCc1c[nH]c2ccccc12)C4CN(C(=O)C3CCNCC3)CCN4C(=O)C5CCNCC5
CN(C)CCNc2nc(c1ccccc1)nc3ccccc23	ZINC000000084056	c3ccc(c2ncc1ccccc1n2)cc3
Cn1ncc(Cl)c1C(=O)Nc3ccc(CN2CCCCC2)cc3	ZINC000000374888	O=C(Nc2ccc(CN1CCCCC1)cc2)c3ccn[nH]3
Cc2cccc(NC1=NC(C)(C)NC(=N)N1)c2	ZINC000000269202	N=C2NCN=C(Nc1ccccc1)N2
CCn1ccc(CNC)n1	ZINC000000034155	c1cn[nH]c1
COc2ccc(CNCc1ccc(C)cc1)c(OC)c2	ZINC000000172229	C(NCc1ccccc1)c2ccccc2
CN(C1CCCCC1)S(=O)(=O)c2ccccc2	ZINC000000029179	O=S(=O)(NC1CCCCC1)c2ccccc2
CCOC(=O)[C@@]2(C#N)[C@@H](c1ccccc1)C(OC)(OC)C2(OC)OC	ZINC000000340800	C2CC(c1ccccc1)C2
O=C(N2CCN(CCc1ccccc1)CC2)c3ccco3	ZINC000000012724	O=C(N2CCN(CCc1ccccc1)CC2)c3ccco3
CCN(CC)c2ccc(Nc1[nH]c(=O)nnc1C)cc2	ZINC000000114347	O=c2nncc(Nc1ccccc1)[nH]2
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
CC[N@]1CCC[C@@H]1CNC(=O)CC2CCNCC2	ZINC000019440648	O=C(CC1CCNCC1)NCC2CCCN2
Cc3cc2nc(C[n+]1cccc(C(N)=O)c1)[nH]c2cc3C	ZINC000000386939	C(c2nc1ccccc1[nH]2)[n+]3ccccc3
CC[C@@](C)(NS(=O)(=O)c1c(C)ccc2nsnc12)C#C	ZINC000000033712	c2ccc1nsnc1c2
COc1ccccc1NC(=O)c3c(N)sc2C[N@](C)CCc23	ZINC000000235455	O=C(Nc1ccccc1)c3csc2CNCCc23
O=c2c(=CNCC1CCNCC1)c(=O)c3ccccc23	ZINC000000246940	O=c2c(=CNCC1CCNCC1)c(=O)c3ccccc23
COc2ccc(Cc1nnc(N)o1)cc2OC	ZINC000000105021	C(c1ccccc1)c2nnco2
NC(=N)NCc2nn(Cc1ccccc1)c(=O)c3ccccc23	ZINC000000502110	O=c2n(Cc1ccccc1)ncc3ccccc23
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)CCNC(=O)C1CCNCC1	ZINC000005708402	C1CCNCC1
CN(C)c2ccc(\C=C\c1cc[n+](C)cc1)cc2	ZINC000000143705	C(=Cc1ccncc1)c2ccccc2
CCOc2ccc(C(=O)Nc1sc(C)c(C)c1C(N)=O)cc2	ZINC000000035687	O=C(Nc1cccs1)c2ccccc2
O[C@@H](Cc1ccc(F)cc1)[C@@H](c2ccc(C#N)cc2)n3cncn3	ZINC000000006079	C(Cc1ccccc1)C(c2ccccc2)n3cncn3
CC2CCN(Cc1cnc(NC(C)=O)s1)CC2	ZINC000000032420	C2CCN(Cc1cncs1)CC2
O[C@H](CNCc2ccc1OCOc1c2)CSc3cccs3	ZINC000000119187	C(CNCc2ccc1OCOc1c2)CSc3cccs3
Cc3cc(C)n(C(=O)CNC(=O)C(c1ccccc1)c2ccccc2)n3	ZINC000000286491	O=C(NCC(=O)n1cccn1)C(c2ccccc2)c3ccccc3
C[C@H]3CN(Cc2c(C)[nH]c1c(C)cccc1c2=O)C[C@H](C)O3	ZINC000000142544	O=c2c(CN1CCOCC1)c[nH]c3ccccc23
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
Cc2nc(NN)cc(c1ccccc1)n2	ZINC000000343388	c2ccc(c1ccncn1)cc2
C[N+]2(CCOC(=O)c1ccc(O)cc1O)CCCCC2	ZINC000000492442	O=C(OCCN1CCCCC1)c2ccccc2
O=S(=O)(NCCc1ccncc1)c2ccccc2	ZINC000000056385	O=S(=O)(NCCc1ccncc1)c2ccccc2
CC[C@H](C)[C@H](N)C(=O)Nc1ccncc1	ZINC000000025491	c1ccncc1
C3CC(OCc2ccc1ccccc1c2)CCN3	ZINC000000003647	C3CC(OCc2ccc1ccccc1c2)CCN3
CC3=C[C@@](O)(c1ccccc1)C(=[N+]2CCOCC2)N3O	ZINC000000328086	C3C[N+](=C1NC=CC1c2ccccc2)CCO3
CCC(=O)Oc1ccc(CNC(C)(C)C)cc1	ZINC000000185112	c1ccccc1
Nc2nc1ccccc1n2Cc3cccc4nonc34	ZINC000000190042	C(c1cccc2nonc12)n3cnc4ccccc34
CCC[C@@H](C)C(=O)NCc1ccc(S(N)(=O)=O)cc1	ZINC000000030903	c1ccccc1
C[C@@H]2CN=C(NC1CCCCC1)S2	ZINC000000135009	C2CCC(NC1=NCCS1)CC2
C[C@@H](Oc1ccccc1)C(=O)N(C)Cc2ccccc2	ZINC000000030906	O=C(COc1ccccc1)NCc2ccccc2
COc2ccc([C@@]1(C)SC(NC(C)=O)=NN1C(C)=O)cc2	ZINC000000041532	N1N=CSC1c2ccccc2
C[C@@H](NC(=O)OCc2ccc(COC(=O)N[C@H](C)C(=O)NCc1ccc(CN)cc1)cc2)C(=O)NCc3ccc(CN)cc3	ZINC000026470237	O=C(CNC(=O)OCc2ccc(COC(=O)NCC(=O)NCc1ccccc1)cc2)NCc3ccccc3
NC(=N)c1ccc(C(F)(F)F)nc1	ZINC000000154415	c1ccncc1
COC(=O)c2cc(NC(=O)c1cc(OC)cc(OC)c1)ccc2Cl	ZINC000000581262	O=C(Nc1ccccc1)c2ccccc2
Nc1ccccc1NC3CCN(Cc2ccccc2)CC3	ZINC000000161635	C2CN(Cc1ccccc1)CCC2Nc3ccccc3
Cc3cccc(N2CCN(CCc1cc(C)[nH]n1)CC2)c3	ZINC000000002195	C2CN(c1ccccc1)CCN2CCc3cc[nH]n3
COc2cc(Cc1cnc(N)nc1N)cc3C(C)=C(F)[C@](C)(CF)Nc23	ZINC000000603382	C3Nc2ccc(Cc1cncnc1)cc2C=C3
Nc2cc(N)nc(SC[C@@H]1CCCO1)n2	ZINC000000415631	C2COC(CSc1ncccn1)C2
NC(=O)C2CCN(C[C@H]1CCC=CC1)CC2	ZINC000000042134	C2CCN(CC1CCC=CC1)CC2
CN(C)Cn1nnc2ccccc12	ZINC000000344382	c2ccc1[nH]nnc1c2
CSCC[C@@H](NC(=O)[C@H](CCSC)NC(=O)N1CCn2c1nc3ccccc23)C(O)=O	ZINC000009130477	C1Cn2c(N1)nc3ccccc23
CCN(CC)c3nc(N1CCOCC1)nc(N2CCOCC2)n3	ZINC000000042138	C3CN(c2ncnc(N1CCOCC1)n2)CCO3
CCOc3ccc(NC(=O)CN(c1ccc(F)cc1)S(=O)(=O)c2ccc(C)cc2)cc3	ZINC000000622292	O=C(CN(c1ccccc1)S(=O)(=O)c2ccccc2)Nc3ccccc3
COc3ccc2n(C(=O)c1ccc(Cl)cc1)c(C)c(CC(=O)NO)c2c3	ZINC000000608008	O=C(c1ccccc1)n2ccc3ccccc23
CN(C)CCn2nnc3c(=O)oc1ccccc1c23	ZINC000000198778	O=c2oc1ccccc1c3[nH]nnc23
CCCC(=O)c2cnc1c(OC)cccc1c2Nc3ccccc3OC	ZINC000000575248	N(c1ccccc1)c2ccnc3ccccc23
Cc2[nH]c1ccc(OC(F)(F)Cl)cc1c2CCN	ZINC000000034571	c2ccc1[nH]ccc1c2
CCN3CCN(c2oc(COc1ccccc1)nc2C#N)CC3	ZINC000000108334	C3CN(c2cnc(COc1ccccc1)o2)CCN3
CN(C)CC(=O)Nc1cc(C)nc2ccccc12	ZINC000000104326	c2ccc1ncccc1c2
COc2ccc(C(=O)NC1CC(C)(C)NC(C)(C)C1)cc2	ZINC000000195334	O=C(NC1CCNCC1)c2ccccc2
NCc2ccc(n1cccn1)cc2	ZINC000000158886	c2ccc(n1cccn1)cc2
Cn2c[n+](Cc1ccccc1)cn2	ZINC000000401239	C(c1ccccc1)[n+]2cn[nH]c2
Cc3cc(N1CCOCC1)nc(NCc2ccccc2)n3	ZINC000000123002	C3CN(c2ccnc(NCc1ccccc1)n2)CCO3
NC[C@@H](O)CN2CCN(Cc1ccccc1)CC2	ZINC000019358914	C2CN(Cc1ccccc1)CCN2
NNc1ccc(N(CCO)CCO)nn1	ZINC000000001866	c1ccnnc1
Fc3cc2[C@H]1CNC[C@H](C1)c2cc3F	ZINC000000024032	C1NCC2CC1c3ccccc23
COc2ccc(C(=O)c1coc(S(N)(=O)=O)c1)cc2	ZINC000000002603	O=C(c1ccccc1)c2ccoc2
CCCc2c(C)c1c(OCC(=O)OC)cc(OCC(=O)OC)cc1oc2=O	ZINC000000622197	O=c2ccc1ccccc1o2
C[C@@H]1C(=O)O[C@@H]2CC[N@]3CC=C(COC(=O)[C@](C)(O)[C@]1(C)O)[C@H]23	ZINC000000409216	O=C1CCCC(=O)OC2CCN3CC=C(CO1)C23
C2CC(Cc1c[nH]cn1)CCN2	ZINC000000005777	C2CC(Cc1c[nH]cn1)CCN2
CCOC(=O)c2ccc1n(CCO)c(C)[n+](CCO)c1c2	ZINC000000262673	c2ccc1[nH]cnc1c2
COc3ccc2[nH]c(C(=O)N(C)C1CCN(C)CC1)cc2c3	ZINC000000147249	O=C(NC1CCNCC1)c3cc2ccccc2[nH]3
CCn2c(COc1ccc(C)cc1)nnc2SCC(=O)OC(C)C	ZINC000000419251	C(Oc1ccccc1)c2nnc[nH]2
O=N(=O)c3cccc([C@@H]1NCCc2nc[nH]c12)c3	ZINC000000197248	C3Cc1nc[nH]c1C(c2ccccc2)N3
O=C(NCc1ccncc1)[C@H]2CCCCN2	ZINC000000017735	O=C(NCc1ccncc1)C2CCCCN2
NN=C(N)CCCCCCCCC(N)=NN	ZINC000004203870	nonring
Cc5nc4cc3CC[C@@H](N(CC#C)c2ccc(C(=O)N[C@@H](CCCS(=O)(=O)c1nc[nH]n1)C(O)=O)cc2)c3cc4c(=O)[nH]5	ZINC000003807151	O=C(NCCCCS(=O)(=O)c1nc[nH]n1)c5ccc(NC3CCc4cc2nc[nH]c(=O)c2cc34)cc5
CN4CCN(c2nc(C)nc3n(CCc1ccccc1)ncc23)CC4	ZINC000000082118	C4CN(c2ncnc3n(CCc1ccccc1)ncc23)CCN4
C/C=C/C(=O)Nc2ccc(N1CCN(C)CC1)cc2	ZINC000000128589	C2CN(c1ccccc1)CCN2
COc4ccc([C@@H]2NC(=N)Nc3nc1ccccc1n23)cc4	ZINC000000544469	N=C2NC(c1ccccc1)n3c(N2)nc4ccccc34
CC(=O)Nc3ccc2[n+](c1ccccc1)c(C)n(C)c2c3	ZINC000000262676	c3ccc([n+]1c[nH]c2ccccc12)cc3
Nc3cccc(C2=N[C@@H]1C=CC=C[C@@H]1N=C2)c3	ZINC000000169288	C3=CC2N=CC(c1ccccc1)=NC2C=C3
O=C2CC[C@@H](C(=O)N1CCCCC1)N2	ZINC000000003826	O=C2CCC(C(=O)N1CCCCC1)N2
Nc1ccccc1S(=O)(=O)NCC(=O)N2CCCC2	ZINC000000256610	O=C(CNS(=O)(=O)c1ccccc1)N2CCCC2
CC(=O)Oc1ccccc1C(=O)OCc2cccc(CON(=O)=O)n2	ZINC000000008827	O=C(OCc1ccccn1)c2ccccc2
COC(CN[C@@H]1CCCc2c1[nH]c3ccc(C)cc23)OC	ZINC000000200163	C1CCc2c(C1)[nH]c3ccccc23
CN(C)CCOC(=O)c1ccco1	ZINC000000187994	c1ccoc1
CC(C)(\C=N\O)[N+](=O)Cc1ccccn1	ZINC000000337820	c1ccncc1
O=C(NC2CCN(Cc1ccccc1)CC2)c3ccsc3	ZINC000000157767	O=C(NC2CCN(Cc1ccccc1)CC2)c3ccsc3
C[C@H](Cc1ccccc1)N(C)C(=O)Cn3nc(c2ccccc2)ccc3=O	ZINC000000607932	O=C(Cn2nc(c1ccccc1)ccc2=O)NCCc3ccccc3
COc3ccc(C[N@]2CCc1ccccc1C2)cc3	ZINC000000239527	C2Cc1ccccc1CN2Cc3ccccc3
CN2CCC(N(C)Cc1ccccc1N(=O)=O)CC2	ZINC000000239833	C2CC(NCc1ccccc1)CCN2
Fc2cccc3CN(N=C1NCCN1)Cc23	ZINC000000010612	C3CNC(=NN2Cc1ccccc1C2)N3
O[C@@H]1CCN[C@H]2CCCC[C@@H]12	ZINC000000128696	C2CCC1NCCCC1C2
O[C@@H](CC2CCN(Cc1ccccc1)CC2)c3ccc(F)cc3	ZINC000000014992	C2CN(Cc1ccccc1)CCC2CCc3ccccc3
CCc2cccc3Oc1ccccc1S(=O)(=O)c23	ZINC000000004918	O=S3(=O)c1ccccc1Oc2ccccc23
Fc3ccc(CC(=O)C2CCN(Cc1ccncc1)CC2)cc3	ZINC000000014994	O=C(Cc1ccccc1)C3CCN(Cc2ccncc2)CC3
O=C2C[C@H](N1CCSCC1)C(=O)N2CCc3ccccc3	ZINC000000033217	O=C2CC(N1CCSCC1)C(=O)N2CCc3ccccc3
COC(=O)c1ccccc1C(=O)N2C[C@@H](O)CO2	ZINC000000169061	O=C(N1CCCO1)c2ccccc2
CCOC(=O)c2cnc1cccc[n+]1c2Cl	ZINC000000114978	c2cc[n+]1cccnc1c2
CC[C@H](C)[C@@H]2NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H]([C@H](CS(O)(=O)=O)C(C)=O)NC(=O)[C@H]([C@@H](C)CC)NC2=O	ZINC000043026985	O=C2CNC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)CN2
CSc2nc(C)cc(Oc1ccc(=O)n(C)n1)n2	ZINC000000098994	O=c2ccc(Oc1ccncn1)n[nH]2
CNCCCC(=O)N1CCC[N@@](CCOC)CC1	ZINC000037826884	C1CNCCNC1
CC(C)(C)[C@H](N)C(=O)N1CCC[C@@H]1C#N	ZINC000000009241	C1CCNC1
COc3ccc(S(=O)(=O)N(Cc1ccccc1)Cc2ccccc2)cc3OC	ZINC000000601940	O=S(=O)(N(Cc1ccccc1)Cc2ccccc2)c3ccccc3
NC[C@H](C#C)c1ccc(O)cc1	ZINC000000009712	c1ccccc1
CN[C@@H](C)C(=O)c1ccccc1	ZINC000000403054	c1ccccc1
CN(C)CCNC(=O)c2scc1CCCCc12	ZINC000000119128	C2CCc1cscc1C2
C[N@]1CCc3c(C1)sc(NC(=S)Nc2ccccc2)c3C#N	ZINC000000156000	S=C(Nc1ccccc1)Nc3cc2CCNCc2s3
O[C@@H]3CCC[N@](C2CCN(Cc1ccccc1)CC2)C3	ZINC000000279803	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
CCc3ccc(OC)c(S(=O)(=O)Nc2ccc(C(=O)c1cccs1)cc2)c3	ZINC000000645824	O=C(c2ccc(NS(=O)(=O)c1ccccc1)cc2)c3cccs3
COc2ccc1[nH]cc(CN(C)C)c1c2	ZINC000000057161	c2ccc1[nH]ccc1c2
CC3CCC(N2CCN(S(=O)(=O)c1ccccc1)CC2)CC3	ZINC000000182018	O=S(=O)(N2CCN(C1CCCCC1)CC2)c3ccccc3
C[C@H]1CNCCN1c2ccccc2	ZINC000000393936	C2CN(c1ccccc1)CCN2
CCCc2ncc(C[n+]1ccccc1C)c(N)n2	ZINC000000000934	C(c1cncnc1)[n+]2ccccc2
CC(C)c2nnc(SCC(=O)Nc1sc(C)c(C)c1C#N)n2C	ZINC000000410466	O=C(CSc1nnc[nH]1)Nc2cccs2
CN(C)(=O)CCOC(c1ccccc1)c2ccccc2	ZINC000000000932	C(c1ccccc1)c2ccccc2
CC2(C)CC(N1CN=C(N)N(C#N)C1)CC(C)(C)N2	ZINC000000027629	C2CC(N1CNC=NC1)CCN2
Cn3cnc2C[N@](C[C@H](O)c1ccc(Br)cc1)CCc23	ZINC000000408249	C(Cc1ccccc1)N3CCc2[nH]cnc2C3
CC(=O)N2CCN(CC(\C)=C/c1ccccc1)CC2	ZINC000000219534	C2CN(CC=Cc1ccccc1)CCN2
NCC[C@H]1CCCCC(=O)N1	ZINC000000200576	O=C1CCCCCN1
COC(=O)CC1CC(C)(C)NC(C)(C)C1	ZINC000000103960	C1CCNCC1
Clc3ccc(C(=O)CN2Cc1ccccc1C2=N)cc3	ZINC000000193567	N=C2N(CC(=O)c1ccccc1)Cc3ccccc23
Cc2cc(C)c(NC(=O)COc1ccc(Cl)cc1)c(C)c2	ZINC000000038819	O=C(COc1ccccc1)Nc2ccccc2
CCOC(=O)N2CCC(NC1CCCCCC1)CC2	ZINC000000182234	C2CCCC(NC1CCNCC1)CC2
COc3ccc(C(=O)c2c(N)sc1C[N@](C)CCc12)cc3	ZINC000000155021	O=C(c1ccccc1)c3csc2CNCCc23
COc2cc(OC)c(C(=O)CCCN1CCCC1)c(OC)c2	ZINC000000005191	O=C(CCCN1CCCC1)c2ccccc2
S=c3[nH]c(N1CCOCC1)c2CCCCc2c3C#N	ZINC000000226336	S=c3cc1CCCCc1c(N2CCOCC2)[nH]3
COc3c1OCOc1cc2CC[N@](C)[C@@H](C[C@@H](C)O)c23	ZINC000000485912	C3Cc2cc1OCOc1cc2CN3
COc3ccc(c2csc(N1CCOCC1)n2)cc3OC	ZINC000000038362	C3CN(c2nc(c1ccccc1)cs2)CCO3
C3CN(P(N1CCOCC1)N2CCOCC2)CCO3	ZINC000000394037	C3CN(P(N1CCOCC1)N2CCOCC2)CCO3
C[C@H]1CC(=O)NN=C1c3ccc(n2ccc(=O)cc2)cc3	ZINC000000005598	O=C3CCC(c2ccc(n1ccc(=O)cc1)cc2)=NN3
CN(C)CCCn2c(=O)n(c1ccccc1)c3cc(Cl)ccc23	ZINC000000001182	O=c2[nH]c1ccccc1n2c3ccccc3
CN(C)S(=O)(=O)c2ccc(N)c(C(=O)N1CCN(C)CC1)c2	ZINC000000001255	O=C(N1CCNCC1)c2ccccc2
COc3ccc2n(C)c(C)c(C(=O)CNC1=NCCS1)c2c3	ZINC000000117589	O=C(CNC1=NCCS1)c2c[nH]c3ccccc23
Cc1cccc(Cl)c1NC(=O)CN	ZINC000000394100	c1ccccc1
CC[C@@H]1CCCCN1S(=O)(=O)c2c(C)[nH]c(=O)[nH]c2=O	ZINC000000092862	O=c2[nH]cc(S(=O)(=O)N1CCCCC1)c(=O)[nH]2
C[C@H](NC(=O)C1(N)CCNCC1)C(=O)Nc5ccc4c(=O)c3cc(NC(=O)[C@H](C)NC(=O)C2(N)CCNCC2)ccc3c(=O)c4c5	ZINC000653731218	O=C(CNC(=O)C1CCNCC1)Nc5ccc4c(=O)c3cc(NC(=O)CNC(=O)C2CCNCC2)ccc3c(=O)c4c5
Cc3cc[n+](CC2OCc1ccccc1CO2)cc3	ZINC000000185744	C2OC(C[n+]1ccccc1)OCc3ccccc23
O=C2CCN[C@@H]1CCCC[C@H]12	ZINC000000140739	O=C2CCNC1CCCCC12
COc3cc(C(=O)Nc1ccccc1CC[C@H]2CCCC[N@]2C)ccc3O	ZINC000000597290	O=C(Nc1ccccc1CCC2CCCCN2)c3ccccc3
Clc3ccc(OCC(=O)N[C@@H]1CN2CCC1CC2)cc3	ZINC000000537719	O=C(COc1ccccc1)NC2CN3CCC2CC3
Cc1cccc2ncc(C(N)=O)c(=O)n12	ZINC000000010761	O=c1ccnc2ccccn12
C[C@H](NC(=O)CCN)C(=O)Nc3ccc2c(=O)c1cc(NC(=O)[C@H](C)NC(=O)CCN)ccc1c(=O)c2c3	ZINC000653731211	O=c2c1ccccc1c(=O)c3ccccc23
O=N(=O)c1ccccc1CN3CCC(N2CCCCC2)CC3	ZINC000000243775	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
N[C@@H](Cc1cc(I)c(O)c(I)c1)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O	ZINC000653870725	c1ccccc1
C[N+]5(CCC(=O)Nc3ccc(NC(=O)CC[N+]1(C)CCOCC1)c4c(=O)c2ccccc2c(=O)c34)CCOCC5	ZINC000026971790	O=C(CCN1CCOCC1)Nc4ccc(NC(=O)CCN2CCOCC2)c5c(=O)c3ccccc3c(=O)c45
Cc1ccc(F)c2c(CCN)c(C)[nH]c12	ZINC000000140735	c2ccc1[nH]ccc1c2
COc1cc(S(N)(=O)=O)c(OC)cc1N	ZINC000000394316	c1ccccc1
CCN(CC)C(=O)[C@@H]1CCCNC1	ZINC000000155113	C1CCNCC1
C[C@H](CN(C)C)CN2c1ccccc1S(=O)(=O)c3ccccc23	ZINC000000000582	O=S3(=O)c1ccccc1Nc2ccccc23
C[N@@](CCc1ccccn1)[C@@H]3CC(=O)N(c2ccccc2)C3=O	ZINC000000272674	O=C2CC(NCCc1ccccn1)C(=O)N2c3ccccc3
Cn4c(=O)n(C)c3cn(Cc1ccccc1)c(c2ccccc2)c3c4=O	ZINC000000033678	O=c4[nH]c(=O)c3c(c1ccccc1)n(Cc2ccccc2)cc3[nH]4
OC2CCN(C[C@H]1CCC=CC1)CC2	ZINC000000183295	C2CCN(CC1CCC=CC1)CC2
CC(=NNC1=NCCN1)c2ccc(C)cc2	ZINC000000150257	C2CN=C(NN=Cc1ccccc1)N2
NC(=O)Cn2cnc(c1ccc(N(=O)=O)cc1)c2	ZINC000000063458	c2ccc(c1c[nH]cn1)cc2
C4CCN(CCOc2nnc(c1ccccc1)c3ccccc23)CC4	ZINC000000532384	C4CCN(CCOc2nnc(c1ccccc1)c3ccccc23)CC4
CN(C)C(On1nnc2ccccc12)=[N+](C)C	ZINC000000156069	c2ccc1[nH]nnc1c2
CCN(CC)CCNc1nc(C)cc(C)n1	ZINC000000150093	c1cncnc1
Cc3nc2cc(NCc1ccccc1O)ccc2n3Cc4ccccc4	ZINC000000237778	C(Nc3ccc2n(Cc1ccccc1)cnc2c3)c4ccccc4
OCC(CO)Nc4ccc3OCCC[C@H]1CN(CC[C@H]1CC(=O)N2CCNCC2)C(=O)CNCc3c4	ZINC000077261668	O=C2CNCc1ccccc1OCCCC3CN2CCC3CC(=O)N4CCNCC4
Nc3nc(N1CCCCC1)nc(N2CCCCC2)n3	ZINC000000270569	C3CCN(c2ncnc(N1CCCCC1)n2)CC3
NC(=O)COC(=O)c1ccccc1Nc2cccc(C(F)(F)F)c2	ZINC000000001214	N(c1ccccc1)c2ccccc2
CN(C)CCNc2ncnc3sc1CCCc1c23	ZINC000000380279	C3Cc2sc1ncncc1c2C3
CCOC(=O)c1c(C)c(C)sc1NC(=O)CCOc2ccccc2	ZINC000000067487	O=C(CCOc1ccccc1)Nc2cccs2
CCCN3CCC(N2CCN(c1ccc(C(C)=O)cc1)CC2)CC3	ZINC000000280208	C3CC(N2CCN(c1ccccc1)CC2)CCN3
Cc2c(NC1=NCCN1)ccc3nccnc23	ZINC000000014043	C3CN=C(Nc2ccc1nccnc1c2)N3
Cn1cnc2n(C)c(=O)n(CC=O)c(=O)c12	ZINC000000039854	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
C[C@H](Cc1ccccc1)NC(=O)Cc2ccc(N)cc2	ZINC000000000614	O=C(Cc1ccccc1)NCCc2ccccc2
CCCc4cc(N1CCN(CC)CC1)n3c(nc2ccccc23)c4C#N	ZINC000000352599	C4CN(c2cccc3nc1ccccc1n23)CCN4
C[N@@](Cc1ccccc1)CC(C)(C)C(C)(C)O	ZINC000000158444	c1ccccc1
Clc2ccc(CC(=O)Nc1ccc(CC#N)cc1)cc2	ZINC000000037204	O=C(Cc1ccccc1)Nc2ccccc2
CN2CCN(C(=O)NCCC1CCCCC1)CC2	ZINC000000352593	O=C(NCCC1CCCCC1)N2CCNCC2
CN(c2ccc(C(=O)Nc1cccc(N(=O)=O)c1)cc2)S(C)(=O)=O	ZINC000000617081	O=C(Nc1ccccc1)c2ccccc2
Cc3ccc(C#N)c(SCC(=O)c2cc1ccccc1oc2=O)n3	ZINC000000044152	O=C(CSc1ccccn1)c3cc2ccccc2oc3=O
CC(=O)Oc1cc(OC(C)=O)cc(C(C)=O)c1	ZINC000000056415	c1ccccc1
CO[C@@H](C)C(=O)N2CCN(Cc1ccccc1)CC2	ZINC000000389079	C2CN(Cc1ccccc1)CCN2
NC(=N)c1ccc(F)c(Cl)c1	ZINC000000089244	c1ccccc1
CCN(CC)CCNC(=O)C(=O)N[C@@H](C)[C@H](N2CCN(Cc1ccccc1)CC2)c3cccs3	ZINC000023181147	C2CN(Cc1cccs1)CCN2Cc3ccccc3
CC(C)N(CC(N)=O)Cc1ccc(C[N@](CC(N)=O)C(C)C)cc1	ZINC000014927065	c1ccccc1
CC(C)(C)[N+](=O)Cc1cc(Cl)ccc1O	ZINC000000008621	c1ccccc1
O[C@H]1CSc3n(C1)c2ccccc2[n+]3CC=C	ZINC000000439780	C3CSc2nc1ccccc1n2C3
OCc1ccccc1CNC2CCCCC2	ZINC000000064936	C2CCC(NCc1ccccc1)CC2
CC[C@](C)(CN(C)C)OC(=O)c1ccccc1	ZINC000000000038	c1ccccc1
C[N@@](CCO)C[C@@H](O)Cn2c1ccc(Br)cc1c3cc(Br)ccc23	ZINC000000626512	c1ccc3c(c1)[nH]c2ccccc23
CCN(CC)CCN3[C@@H](c1ccc(F)cc1)Nc2ccccc2C3=O	ZINC000000484245	O=C2NC(c1ccccc1)Nc3ccccc23
COc2ccc(Cc1c(Cl)ncnc1NN)cc2	ZINC000000295355	C(c1ccccc1)c2cncnc2
O=C(Cc1ccccc1)Nc2nccs2	ZINC000000029573	O=C(Cc1ccccc1)Nc2nccs2
CC(C)[N@]2C[C@@H](C)[C@H](OC(=O)c1ccccc1)C[C@H]2C	ZINC000000052775	O=C(OC1CCNCC1)c2ccccc2
COc2ccc([C@H](OC(C)=O)C#N)c(OCc1ccccc1)c2OC	ZINC000000036424	C(Oc1ccccc1)c2ccccc2
CCOC(=O)C1CCN(S(C)(=O)=O)CC1	ZINC000000029622	C1CCNCC1
CCn3c(=C\C=C\c2oc1ccccc1[n+]2CC)/oc4ccccc34	ZINC000000106856	C(=Cc2nc1ccccc1o2)C=c4[nH]c3ccccc3o4
CCOC(=O)[C@@H]1CCC[N@@](C)C1	ZINC000000155206	C1CCNCC1
Cc4ccc3occ(CN2CCC(N1CCCCC1)CC2)c(=O)c3c4	ZINC000000212267	O=c3c(CN2CCC(N1CCCCC1)CC2)coc4ccccc34
C3CC(c2nc(c1cnccn1)no2)CCN3	ZINC000000154378	C3CC(c2nc(c1cnccn1)no2)CCN3
C[C@@H](CCN(C)C)N(C)C	ZINC000000404465	nonring
NC(=O)C3CCN(Cc2nc(c1ccccc1)no2)CC3	ZINC000000200215	C3CCN(Cc2nc(c1ccccc1)no2)CC3
C[C@H](O)CN[C@@H]1CCC[C@H](C)C1	ZINC000000268956	C1CCCCC1
CC2(C)CC(NC(=O)Cn1cccc(N(=O)=O)c1=O)CC(C)(C)N2	ZINC000000104899	O=C(Cn1ccccc1=O)NC2CCNCC2
CN(C)c2ccc(\C=C\CN1CCCCC1)cc2	ZINC000000217823	C2CCN(CC=Cc1ccccc1)CC2
CCc2ccc(NS(=O)(=O)c1ccc(OCC(=O)OC)cc1)cc2	ZINC000000479285	O=S(=O)(Nc1ccccc1)c2ccccc2
COc2cc(OC)c1c(C)c(CC(=O)NCC(=O)N[C@H](C(C)C)C(O)=O)c(=O)oc1c2	ZINC000011865445	O=c2ccc1ccccc1o2
C[N@]1CCC3=C(C1)c2nsnc2SC3	ZINC000000021235	C1CC3=C(CN1)c2nsnc2SC3
Clc2cc(Cl)c(N1CCNCC1)n(=O)c2	ZINC000000140958	O=n1ccccc1N2CCNCC2
Cc3ccc(n2c(COc1ccc(Cl)c(C)c1)n[nH]c2=O)cc3	ZINC000000004641	O=c2[nH]nc(COc1ccccc1)n2c3ccccc3
COc2cc(C(=O)O/N=C(\C)c1ccc(F)cc1)cc(OC)c2OC	ZINC000000137539	O=C(ON=Cc1ccccc1)c2ccccc2
CN(C)CCc1c[nH]c2cccc(O)c12	ZINC000000002001	c2ccc1[nH]ccc1c2
Cc2ccc(C)c(OCC(=O)n1cnnc1N)c2	ZINC000000092002	O=C(COc1ccccc1)n2cnnc2
O=c5n(CC[n+]4ccc(CCCc3cc[n+](CCn2c(=O)c1ccccc1c2=O)cc3)cc4)c(=O)c6ccccc56	ZINC000027984037	O=c5n(CC[n+]4ccc(CCCc3cc[n+](CCn2c(=O)c1ccccc1c2=O)cc3)cc4)c(=O)c6ccccc56
COc2nc(N1CCCC1)nc(N(CC=C)C#N)n2	ZINC000000110900	C2CCN(c1ncncn1)C2
CCOC(=O)C(C)(C)Sc2nnc(COc1ccc(C)cc1)n2C	ZINC000000412410	C(Oc1ccccc1)c2nnc[nH]2
CN(C)[C@H]3CCN(C(=O)c1nn(C)c2ccccc12)C3	ZINC000000020610	O=C(N1CCCC1)c2n[nH]c3ccccc23
O=N(=O)c1ccc2c(c1)[nH]c(=O)c3nncn23	ZINC000000007118	O=c2[nH]c1ccccc1n3cnnc23
Nc2nc(CN1CCCCC1)cs2	ZINC000000246273	C2CCN(Cc1cscn1)CC2
CCN(CC)CCN2C(=O)CCCc3sc1CCCCc1c23	ZINC000000192096	O=C3CCCc2sc1CCCCc1c2N3
CN(C)[C@@H](CO)[C@@H](O)c1ccc(N)cc1	ZINC000000525465	c1ccccc1
C2CC[C@@H](c1cccnc1)NC2	ZINC000000031165	C2CCC(c1cccnc1)NC2
O=C(NCc2cccc(Oc1ccccc1)c2)c3ccc(N(=O)=O)cc3	ZINC000000314343	O=C(NCc2cccc(Oc1ccccc1)c2)c3ccccc3
Cc1ccc(NN=C(C#N)C(N)=S)cc1	ZINC000000040070	c1ccccc1
CC(C)[N@]3C[C@H]2C[C@H](CN(C(=O)c1ccccc1)C2)C3	ZINC000000005064	O=C(N2CC1CNCC(C1)C2)c3ccccc3
COc3ccc2[nH]cc(C1CCN(C)CC1)c2n3	ZINC000000007594	C3CC(c1c[nH]c2cccnc12)CCN3
Fc3ccc(NC(=O)CSc2nnc1CCCCCn12)cc3	ZINC000000029005	O=C(CSc2nnc1CCCCCn12)Nc3ccccc3
COc3ccc(n2c(SCC(C)=C)nc1ccccc1c2=O)cc3	ZINC000000028534	O=c2n(c1ccccc1)cnc3ccccc23
COc3ccc(CSCC(=O)NC1C[C@@H]2CC[C@H](C1)[N@]2C)cc3	ZINC000000136072	O=C(CSCc1ccccc1)NC2CC3CCC(C2)N3
C[N@]1[C@H]3CC[C@@H]1CC(NC(=O)CS(=O)(=O)c2ccccc2)C3	ZINC000000136077	O=C(CS(=O)(=O)c1ccccc1)NC2CC3CCC(C2)N3
COC(=O)c1ccc(=O)n(CCN(C)C)c1	ZINC000000487069	O=c1cccc[nH]1
Cc1cc(C)[n+](C)n1C[C@@H](O)Cn3c2ccccc2c4ccccc34	ZINC000000301544	C(Cn1cccn1)Cn3c2ccccc2c4ccccc34
C[N@]1[C@H]3CC[C@@H]1CC(NS(=O)(=O)c2ccc(F)cc2)C3	ZINC000000135914	O=S(=O)(NC1CC2CCC(C1)N2)c3ccccc3
CN3CCC(N(C)[C@@H]2CC(=O)N(c1ccccc1)C2=O)CC3	ZINC000000077141	O=C2CC(NC1CCNCC1)C(=O)N2c3ccccc3
ClC1(Cl)C[C@@H]1CSC2=NCCN2	ZINC000000141771	C2CN=C(SCC1CC1)N2
Cc2ccc(C(=O)C[C@@H](SCc1ccc(Cl)cc1)C(O)=O)cc2	ZINC000000044317	O=C(CCSCc1ccccc1)c2ccccc2
CCOc3ccc(N2C(=O)C[C@H](N[C@@H]1CCCCNC1=O)C2=O)cc3	ZINC000000084425	O=C2CC(NC1CCCCNC1=O)C(=O)N2c3ccccc3
c4ccc(c3nc(n1ccnc1)nc(n2ccnc2)n3)cc4	ZINC000000056296	c4ccc(c3nc(n1ccnc1)nc(n2ccnc2)n3)cc4
O=C2NCCN(c1ccccc1)N2	ZINC000000025267	O=C2NCCN(c1ccccc1)N2
COC(=O)[n+]2ccc(N1CCOCC1)cc2	ZINC000000368079	C2CN(c1ccncc1)CCO2
Fc4ccc(C(=O)NCCN3CCC(n1c(=O)[nH]c2cc(Cl)ccc12)CC3)cc4	ZINC000000537818	O=C(NCCN3CCC(n1c(=O)[nH]c2ccccc12)CC3)c4ccccc4
O=C1Cc4c(N1)ccc5c(CCC3CCN(Cc2ccccc2)CC3)noc45	ZINC000000580309	O=C1Cc4c(N1)ccc5c(CCC3CCN(Cc2ccccc2)CC3)noc45
CS(=O)(=O)c2ccc(N1CCNCC1)cc2	ZINC000000154150	C2CN(c1ccccc1)CCN2
CC[C@H](N)[C@@H]1CCCCNC1=O	ZINC000000199212	O=C1CCCCCN1
CCn3cc(/C=C/C(=O)Nc2c(C)nn(Cc1ccccc1)c2C)cn3	ZINC000000375797	O=C(Nc2cnn(Cc1ccccc1)c2)C=Cc3cn[nH]c3
Cc3cc(n2cc(C=O)c(c1ccc(O)cc1)n2)nc4ccccc34	ZINC000000037820	c4ccc(c3ccn(c2ccc1ccccc1n2)n3)cc4
COC(=O)CCN1CCCCC1	ZINC000000050803	C1CCNCC1
COC(=O)c2ccc(C(=O)OC)c(n1c(=O)ccc1=O)c2	ZINC000000103081	O=c1ccc(=O)n1c2ccccc2
COc2cc1nccc(N)c1cc2OC	ZINC000000000924	c2ccc1ncccc1c2
O=C(OC[C@H]1CCC[N@]2CCCC[C@@H]12)c3ccccc3	ZINC000000052243	O=C(OCC1CCCN2CCCCC12)c3ccccc3
CN(C)C[C@@H]2Oc1ccccc1O[C@@]2(O)c3ccccc3	ZINC000000283835	C2Oc1ccccc1OC2c3ccccc3
O=c3c1ccccc1c4nn2nnnc2nc34	ZINC000000074890	O=c3c1ccccc1c4nn2nnnc2nc34
Cc2ccc(CNC1=NCCS1)cc2	ZINC000000104585	C2CN=C(NCc1ccccc1)S2
CC3=NN(C(=O)c1ccc(N(=O)=O)cc1)[C@@](O)(c2ccncc2)C3	ZINC000000048866	O=C(N1N=CCC1c2ccncc2)c3ccccc3
Cn3cc(NC(=O)c2cc(NC(=O)c1cc(NC(=O)[C@@H](N)CN)cn1C)cn2C)cc3C(=O)NCCC(N)=N	ZINC000028964045	O=C(Nc2c[nH]c(C(=O)Nc1cc[nH]c1)c2)c3ccc[nH]3
O[C@H](C(=O)c1ccccc1)c2ccccc2	ZINC000000000076	O=C(Cc1ccccc1)c2ccccc2
OCCNCCn1c(=O)c2ccc3c5ccc6c(=O)n(CCNCCO)c(=O)c7ccc(c4ccc(c1=O)c2c34)c5c67	ZINC000028640640	O=c1[nH]c(=O)c2ccc4c5ccc7c(=O)[nH]c(=O)c6ccc(c3ccc1c2c34)c5c67
Cc1ncnc(NN)c1Br	ZINC000000331521	c1cncnc1
COc3ccc(c2cc(c1ccccc1)nc(NN)n2)cc3OC	ZINC000000435062	c3ccc(c2cc(c1ccccc1)ncn2)cc3
CCOc2ccc(c1nnc(SCC(=O)N(CC)CC)n1N)cc2	ZINC000000526828	c2ccc(c1nnc[nH]1)cc2
CCOC(=O)CCC[n+]1c(C)n(N)c2ccccc12	ZINC000000386946	c2ccc1[nH]cnc1c2
COc2ccc(CN1CCC(O)CC1)cc2Br	ZINC000000201209	C2CCN(Cc1ccccc1)CC2
COc2ccc(OC)c(CN1CCC(O)CC1)c2	ZINC000000241738	C2CCN(Cc1ccccc1)CC2
Brc2ccc(N1CCCNCC1)cn2	ZINC000000023623	C2CNCCN(c1cccnc1)C2
C3CN(c1n[nH]c2ccccc12)CCN3	ZINC000000013497	C3CN(c1n[nH]c2ccccc12)CCN3
Cc2[nH]c1ccc(CN)cc1c2C	ZINC000000142398	c2ccc1[nH]ccc1c2
CCOC(=O)C2CCN(C1CCN(CC)CC1)CC2	ZINC000000280142	C2CCN(C1CCNCC1)CC2
CN(C)Cc3cc2oc(=O)c1NCCCc1c2cc3O	ZINC000000198167	O=c3oc1ccccc1c2CCCNc23
COC(=O)c4cc(CN1CCN(C(N)=N)CC1)cc(C(=O)N3CCN(C(=O)c2ccc(C=N)cc2)CC3)c4	ZINC000103230224	O=C(N3CCN(C(=O)c2cccc(CN1CCNCC1)c2)CC3)c4ccccc4
NCCc2nc1ccccc1[nH]2	ZINC000000080438	c2ccc1[nH]cnc1c2
CC(C)(C)Nc2nc(NC(C)(C)C)nc(N1CCCCC1)n2	ZINC000000185371	C2CCN(c1ncncn1)CC2
Cc2cc1nc(C)[nH]c1cc2C	ZINC000000031202	c2ccc1[nH]cnc1c2
N[C@@H](CO)[C@@H](O)c1ccc(N(=O)=O)cc1	ZINC000000035766	c1ccccc1
Cc3ccc(NC(=O)CSc2nnc(c1ccccc1)n2CC=C)c(C)c3	ZINC000000623101	O=C(CSc2nnc(c1ccccc1)[nH]2)Nc3ccccc3
O=C1CCC(=O)N1OC(N2CCCC2)=[N+]3CCCC3	ZINC000000391931	O=C1CCC(=O)N1OC(N2CCCC2)=[N+]3CCCC3
CN2CCC(OC(=O)COc1ccc(C)cc1)CC2	ZINC000000383088	O=C(COc1ccccc1)OC2CCNCC2
OCCC2(O)CCN(Cc1ccccc1)CC2	ZINC000000136661	C2CCN(Cc1ccccc1)CC2
C3CCN(C2CCN(Cc1ccoc1)CC2)CC3	ZINC000000212705	C3CCN(C2CCN(Cc1ccoc1)CC2)CC3
COCC(=O)OC[C@@H]1CCC[N+]2(C)CCCC[C@H]12	ZINC000000037408	C2CCN1CCCCC1C2
CN(C)C(ON1C(=O)CCC1=O)=[N+](C)C	ZINC000000391932	O=C1CCC(=O)N1
Nc2nc1ccccc1n2CCN3CCOCC3	ZINC000000186858	C3CN(CCn1cnc2ccccc12)CCO3
C=CCn3c(SCc2nc1ccccc1[nH]2)nnc3c4ccccc4	ZINC000000186588	C(Sc2nnc(c1ccccc1)[nH]2)c4nc3ccccc3[nH]4
CN(C)CCn3c1c(CCCn2cnnc12)c4ccccc34	ZINC000000052653	C4Cc1c([nH]c2ccccc12)c3nncn3C4
CCC[N@]1CC[C@H]2[C@@H]1CCc3ccc(O)cc23	ZINC000000022280	C3CC1C(CCc2ccccc12)N3
C[N@]1CCc3c(Cl)ccc2CCC[C@@H](C1)c23	ZINC000000004783	C1CC2CNCCc3cccc(C1)c23
Nc2nc1ccccc1n2CCN3CCCC3	ZINC000000186853	C3CCN(CCn1cnc2ccccc12)C3
Cc2cc(C)cc(NC(=O)CN1CCCCC1)c2	ZINC000000042122	O=C(CN1CCCCC1)Nc2ccccc2
C3CN(Cc1c[nH]c2ncccc12)CCC3CCc4ccccc4	ZINC000000022901	C3CN(Cc1c[nH]c2ncccc12)CCC3CCc4ccccc4
Cc2c(N(=O)=O)cc1[nH]c(=O)c(=O)[nH]c1c2CN3CCCC3	ZINC000000017349	O=c3[nH]c2cccc(CN1CCCC1)c2[nH]c3=O
FC(F)(F)c2nc1ccccc1n2CC(=O)NCCN3CCCC3	ZINC000000612423	O=C(Cn1cnc2ccccc12)NCCN3CCCC3
C[C@@H]2C[C@@H](C)CN(CCC(=O)Nc1ccccc1F)C2	ZINC000000176646	O=C(CCN1CCCCC1)Nc2ccccc2
CC(=O)OCC1=C(C(O)=O)N3[C@@H](SC1)[C@H](NC(=O)CCn2nc(C)c(Cl)c2C)C3=O	ZINC000009974933	O=C(CCn1cccn1)NC3C2SCC=CN2C3=O
COc3ccc(CN2CCC([N@]1CCC[C@@H](C)C1)CC2)c(OC)c3	ZINC000000207752	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
Cc1[n+](CC=C)n(C)c2cc(Cl)c(Cl)cc12	ZINC000000199143	c2ccc1[nH]ncc1c2
Ic2ccc(NC(=O)COC(=O)c1ccco1)cc2	ZINC000000622348	O=C(COC(=O)c1ccco1)Nc2ccccc2
CC(C)Oc2ccc(COc1ccc([C@@H](C)CC(O)=O)cc1)cc2Cl	ZINC000000623216	C(Oc1ccccc1)c2ccccc2
Clc4ccc3n(Cc1ccccc1)c(=O)n(Cc2ccccc2)c3c4	ZINC000000035509	O=c3n(Cc1ccccc1)c2ccccc2n3Cc4ccccc4
CC(C)COc2ccc(COc1ccc(CC(O)=O)cc1C)cc2Cl	ZINC000000623218	C(Oc1ccccc1)c2ccccc2
C[N@]1[C@H]3CC[C@@H]1CC(NCc2ccccc2)C3	ZINC000000198761	C2CC3CC(NCc1ccccc1)CC2N3
CN(C)[C@@H](CCN)COc2ccc1OCOc1c2	ZINC000020401617	C2Oc1ccccc1O2
Cc1ccccc1OCC(=O)NC2CC(C)(C)NC(C)(C)C2	ZINC000000195342	O=C(COc1ccccc1)NC2CCNCC2
CCOC(=O)c2oc1ccccc1c2CN3CCC(C(N)=O)CC3	ZINC000000118667	C3CCN(Cc1coc2ccccc12)CC3
COc2ccc(C(=O)COc1ccc(Br)cc1)c(O)c2	ZINC000000041787	O=C(COc1ccccc1)c2ccccc2
C[C@@H]2CN(C1CC(C)(C)NC(C)(C)C1)CCC2=O	ZINC000000129256	O=C2CCN(C1CCNCC1)CC2
CC(C)(C)c2ccc(OCc1ccc(C(=O)NC[C@@H](CCC(O)=O)C(F)(F)F)cc1)cc2	ZINC000002649109	C(Oc1ccccc1)c2ccccc2
CNC[C@@H](O)c2ccc1cc[nH]c1c2	ZINC000000185685	c2ccc1[nH]ccc1c2
COC(=O)c2ccc(C(=O)OC)c(NC(=O)c1cccs1)c2	ZINC000000029356	O=C(Nc1ccccc1)c2cccs2
COc2ccc(CCC(=O)Nc1cc(C)c(O)c(C)c1)cc2	ZINC000000007070	O=C(CCc1ccccc1)Nc2ccccc2
CCOC(=O)c1ccccc1NC(=O)c2ccc(N(=O)=O)o2	ZINC000000045668	O=C(Nc1ccccc1)c2ccco2
O=C(Nn2c(=S)[nH]c1ccccc1c2=O)c3cccc(N(=O)=O)c3	ZINC000000037014	O=C(Nn2c(=S)[nH]c1ccccc1c2=O)c3ccccc3
NCCNC(=O)[C@@H]3CNC(=O)NCCCC[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc2ccccc2)C(=O)N3	ZINC000096941662	O=C(CCc1ccccc1)NC3CCCCNC(=O)NCCNC(=O)C(Cc2ccccc2)NC3=O
Cc2cc(C)n1n[s+]cc1n2	ZINC000000039573	c2cnc1c[s+]nn1c2
COc3ccc(C(=O)N[C@H](Nc1ccccc1)C(=O)c2ccccc2)cc3	ZINC000000622988	O=C(NC(Nc1ccccc1)C(=O)c2ccccc2)c3ccccc3
COc2ccc(n1c(C)c[nH]c1=O)cc2	ZINC000000000472	O=c1[nH]ccn1c2ccccc2
NC(=N)NCCC[C@@H](NC(=O)OCc1ccccc1)C(=O)NCC(=O)N[C@H]2CCCN(C(N)=N)[C@@H]2O	ZINC000027857609	O=C(CNC(=O)OCc1ccccc1)NCC(=O)NC2CCCNC2
COc2cc(C)c(Oc1cc(C)cc(O)c1O)c(O)c2	ZINC000000003968	O(c1ccccc1)c2ccccc2
CCCCCCCCn2c(O)c(C(=O)Nc1cccc(F)c1)c(=O)c3ccccc23	ZINC000002592303	O=C(Nc1ccccc1)c3c[nH]c2ccccc2c3=O
Cc3cc(C)[n+]2nc(SCc1ccccc1)sc2n3	ZINC000000124266	C(Sc2n[n+]1cccnc1s2)c3ccccc3
CNCC(=O)Nc2ccc(NC(=O)CNC)c3c(=O)c1ccccc1c(=O)c23	ZINC000005996294	O=c2c1ccccc1c(=O)c3ccccc23
COC(=O)C12CCN(CC1)C2	ZINC000000003967	C1CN2CCC1C2
COc1cc(N)c(Cl)cc1C(=O)N[C@@H]2CN3CCC2CC3	ZINC000000003961	O=C(NC1CN2CCC1CC2)c3ccccc3
O=C(CCN1C(=O)CCC1=O)OC[C@H]2CCC[N@]3CCCC[C@@H]23	ZINC000000035433	O=C(CCN1C(=O)CCC1=O)OCC2CCCN3CCCCC23
CN4CCC(c3cc(c1ccncc1)c(c2ccc(F)cc2)[nH]3)CC4	ZINC000000009158	C4CC(c3cc(c1ccncc1)c(c2ccccc2)[nH]3)CCN4
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
C[N@@](CCc1ccccn1)Cc2c[nH]c3ccccc23	ZINC000000088068	C(Cc1ccccn1)NCc2c[nH]c3ccccc23
CC(=O)CC(=O)N1[C@@H](O)CC[N+]1(C)C	ZINC000000302444	C1CNNC1
C(Sc1ncnc2ccccc12)c3ccco3	ZINC000000024750	C(Sc1ncnc2ccccc12)c3ccco3
Fc3ccc(NC(=O)N2CCN(c1ccncc1)CC2)cc3	ZINC000000152484	O=C(Nc1ccccc1)N3CCN(c2ccncc2)CC3
COC(=O)c1ccccc1NC(=O)c2cc[n+](C)cc2	ZINC000000364621	O=C(Nc1ccccc1)c2ccncc2
CCOC(=O)[C@H]2CCC[N@@](Cc1ccc(N(=O)=O)o1)C2	ZINC000000292224	C2CCN(Cc1ccco1)CC2
COc2cc(CNn1nnnc1N)ccc2OCC(=O)NC(C)(C)C	ZINC000000359908	C(Nn1cnnn1)c2ccccc2
COc3cccc(CNc2nc1ccccc1n2C)c3O	ZINC000000111513	C(Nc2nc1ccccc1[nH]2)c3ccccc3
CN(N)c3nc(N1CCCC1)nc(N2CCCC2)n3	ZINC000000040832	C3CCN(c2ncnc(N1CCCC1)n2)C3
COc1cc(CNC(C)(C)C)ccc1OCC(=O)NC(C)(C)C	ZINC000000359906	c1ccccc1
Nc3nc(c1ccccc1)[n+](c2ccccc2)s3	ZINC000000041257	c3ccc(c1ncs[n+]1c2ccccc2)cc3
CC(C)N3CCC(N2CCN(c1ccccc1)CC2)CC3	ZINC000000207683	C3CC(N2CCN(c1ccccc1)CC2)CCN3
NNc2cc(c1ccccc1)ncn2	ZINC000000331980	c2ccc(c1ccncn1)cc2
NC(=N)CCCc1c[nH]cn1	ZINC000000004903	c1c[nH]cn1
Cc4cc3c(c1ccccc1F)nc(N2CCNCC2)nc3s4	ZINC000000004901	C4CN(c3nc(c1ccccc1)c2ccsc2n3)CCN4
COC(=O)[C@@H]1CNCCN1c2ccccc2	ZINC000000070645	C2CN(c1ccccc1)CCN2
CN2CCC(OC(=O)c1cccc(F)c1)CC2	ZINC000000110644	O=C(OC1CCNCC1)c2ccccc2
CC(C)=CCNc1ncnc2[nH]cnc12	ZINC000000032351	c2ncc1nc[nH]c1n2
Clc2cccc(OCCN1CCCCC1)c2	ZINC000000227417	C2CCN(CCOc1ccccc1)CC2
CCOC(=O)c1cccnc1S[C@@H](CC)C(=O)NCc2ccco2	ZINC000000218384	O=C(CSc1ccccn1)NCc2ccco2
NC(=N)COc1ccccc1	ZINC000000124317	c1ccccc1
CC(C)(C)N1CC(O)CN(C(C)(C)C)CC(O)C1	ZINC000000171774	C1CNCCCNC1
Cc3cc(C)c2cc(C(=O)NCCN1CCCCC1)[nH]c2c3	ZINC000000171571	O=C(NCCN1CCCCC1)c3cc2ccccc2[nH]3
Fc1ccccc1C(=O)N2CCNCC2	ZINC000000255515	O=C(N1CCNCC1)c2ccccc2
CCN(CC)Cc1c(O)ccc2c(C)cc(=O)oc12	ZINC000000068811	O=c2ccc1ccccc1o2
CCN(CC)CCNC(=O)c1ccccc1NC(=O)C(=O)Nc2ccccc2C(=O)NCCN(CC)CC	ZINC000005809370	O=C(Nc1ccccc1)C(=O)Nc2ccccc2
Cc2ccc1[nH]c(=O)c(=NNC(N)=N)c1c2	ZINC000000189060	N=c1c(=O)[nH]c2ccccc12
CSc2nc(c1ccc(N(=O)=O)cc1)nn2C(C)=O	ZINC000000033358	c2ccc(c1nc[nH]n1)cc2
C[C@@H](O)[C@H](NC(=O)c2ccc(c1ccccc1)cc2)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)NN	ZINC000049774930	c2ccc(c1ccccc1)cc2
CCCn3c(NCc1ccccc1NS(=O)(=O)c2ccc(C)cc2)nc4ccccc34	ZINC000000892345	O=S(=O)(Nc1ccccc1CNc3nc2ccccc2[nH]3)c4ccccc4
Cc3ccc(CSc1nncn1/N=C/c2ccccc2Cl)cc3	ZINC000000147657	C(Sc1nncn1N=Cc2ccccc2)c3ccccc3
NC(=O)CCOC2CCN(Cc1ccccc1)CC2	ZINC000000161461	C2CCN(Cc1ccccc1)CC2
C3N(c1ccnc2ccccc12)Cc4ccccc34	ZINC000000026872	C3N(c1ccnc2ccccc12)Cc4ccccc34
COc3ccc(CN[C@@H](C)[C@@H]2COc1ccccc1O2)c(OC)c3	ZINC000000189266	C(NCc1ccccc1)C3COc2ccccc2O3
Fc3cccc4c(N2CCc1ccccc1C2)ccnc34	ZINC000000026876	C2Cc1ccccc1CN2c3ccnc4ccccc34
CC[n+]2ccnc3cc1ccccc1cc23	ZINC000000028372	c3ccc2cc1nccnc1cc2c3
Cc5ccc(COc4ccc(C2C1=C(CCCC1=O)N(CCC(O)=O)C3=C2C(=O)CCC3)cc4)cc5	ZINC000000661594	O=C1CCCC5=C1C(c3ccc(OCc2ccccc2)cc3)C4=C(CCCC4=O)N5
C[N+]14CCCC[C@@H]1[C@H](CCOC(=O)c3ccc2OCOc2c3)CCC4	ZINC000000343975	O=C(OCCC1CCCN2CCCCC12)c4ccc3OCOc3c4
CN(C)c4ccc([C@H](N1CCCC1)c3cc2OCOc2cc3O)cc4	ZINC000000045038	C4CCN(C(c1ccccc1)c3ccc2OCOc2c3)C4
NCCc1ccc(S(N)(=O)=O)cc1	ZINC000000056629	c1ccccc1
NC[C@@H](O)c1ccc(O)c(O)c1	ZINC000000057623	c1ccccc1
CC(C)(C)NC(NCC1CC1)N=N	ZINC000000089933	C1CC1
Cc2ccc(OC[C@H]1CCCN1)cn2	ZINC000000018380	C2CNC(COc1cccnc1)C2
C(NCc1ccco1)C3OCc2ccccc2CO3	ZINC000000174697	C(NCc1ccco1)C3OCc2ccccc2CO3
COc1ccc(S(=O)(=O)NC(C)(C)C)cc1	ZINC000000029547	c1ccccc1
N[C@H](Cc1ccccc1)C(=O)Nc2ccccc2	ZINC000000057629	O=C(CCc1ccccc1)Nc2ccccc2
CN(C)Cc1cc(NS(C)(=O)=O)ccc1Oc2ccc(C(F)(F)F)cc2	ZINC000000593144	O(c1ccccc1)c2ccccc2
OC[C@H]4O[C@H](Oc3ccc2c(=O)c(c1ccc(O)cc1)coc2c3)[C@@H](O)[C@@H](O)[C@@H]4O	ZINC000000621861	O=c3c(c1ccccc1)coc4cc(OC2CCCCO2)ccc34
C[n+]1ccc(C(=O)NO)cc1	ZINC000000321315	c1ccncc1
Fc1ccccc1S(=O)(=O)N2CCOCC2	ZINC000000074377	O=S(=O)(N1CCOCC1)c2ccccc2
CC(C)S(=O)(=O)NC[C@H](C)c2ccc(c1ccc(CCNS(C)(=O)=O)cc1)cc2	ZINC000000593414	c2ccc(c1ccccc1)cc2
COc1cc(NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](N)C(C)C)cc2ccccc12	ZINC000035051152	c2ccc1ccccc1c2
C[N+]4([C@@H]1CC[C@H]2CCC[C@@H]1C23OCCO3)CCOCC4	ZINC000000402409	C2CC3CCC(N1CCOCC1)C(C2)C34OCCO4
CN3CCN(c2ccc(NC(=O)c1ccc(F)cc1F)cc2)CC3	ZINC000000128573	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
NNc2cnc1ccccc1n2	ZINC000000165342	c2ccc1nccnc1c2
CN3CCN(c2ccc(NC(=O)Cc1ccccc1)cc2)CC3	ZINC000000128571	O=C(Cc1ccccc1)Nc3ccc(N2CCNCC2)cc3
CN3CCN(c2ccc(NS(=O)(=O)c1ccccc1)cc2)CC3	ZINC000000128577	O=S(=O)(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
Cc3ccc(S(=O)(=O)N(CC(=O)Nc1ccc(C)cc1C)Cc2ccccc2Cl)cc3	ZINC000000622525	O=C(CN(Cc1ccccc1)S(=O)(=O)c2ccccc2)Nc3ccccc3
O[C@H](COc2ccc(c1ccc(C#N)cc1)cc2)CN3CCCCC3	ZINC000000380606	C3CCN(CCCOc2ccc(c1ccccc1)cc2)CC3
CN(Cc1ccccc1)C(=O)C3CCN(Cc2ccc(C)o2)CC3	ZINC000000299661	O=C(NCc1ccccc1)C3CCN(Cc2ccco2)CC3
COc3ccc(\C=C1/[C@@H](O)C2CCN1CC2)cc3	ZINC000000192680	C1CN2CCC1CC2=Cc3ccccc3
CN4CCN(c3cc2n(C)c1ccccc1oc2nn3)CC4	ZINC000000050247	C4CN(c3cc2[nH]c1ccccc1oc2nn3)CCN4
Brc2cnc(N1CCNCC1)nc2	ZINC000000083576	C2CN(c1ncccn1)CCN2
COc2ccc1NC(=N)CSc1c2	ZINC000000336182	N=C2CSc1ccccc1N2
CC[C@@H](C)[C@@H](N)C(=O)N2CCN(C(=O)C1CCCCC1)CC2	ZINC000000252615	O=C(C1CCCCC1)N2CCNCC2
C[C@@H]2C[N@@](CCc1ccccc1)CCC2=O	ZINC000000129229	O=C2CCN(CCc1ccccc1)CC2
Cc1ncsc1[C@H](O)c2cccs2	ZINC000000019388	C(c1cccs1)c2cncs2
N[C@@H](c1ccccc1)c2ccc(Cl)cc2	ZINC000000155169	C(c1ccccc1)c2ccccc2
C(Cc2ccc1OCOc1c2)NC4C3CC5CC(C3)CC4C5	ZINC000000172180	C(Cc2ccc1OCOc1c2)NC4C3CC5CC(C3)CC4C5
Clc3cccc(CSCc2ccc(C(=O)NC1CCCC1)o2)c3	ZINC000000221254	O=C(NC1CCCC1)c3ccc(CSCc2ccccc2)o3
CNc1nc(OC)cc(OC)n1	ZINC000000039613	c1cncnc1
CCOC(=O)C2(c1ccccc1)CCN(C)CC2	ZINC000000001681	C2CC(c1ccccc1)CCN2
CCCC2=C(C(=O)OCC)[C@@H](c1ccccc1OCC)NC(=O)N2C	ZINC000000203943	O=C2NC=CC(c1ccccc1)N2
OCC[N@]3CCCN(c2nc1ccccc1o2)CC3	ZINC000000019143	C3CNCCN(c2nc1ccccc1o2)C3
Nc2nnc(Cc1ccc(Br)cc1)s2	ZINC000000036132	C(c1ccccc1)c2nncs2
C[C@H](CN)c1cc(F)cc2ccoc12	ZINC000000026050	c2ccc1occc1c2
CC(C)c2ccc(C[N@]1CCC[C@@H](O)C1)cc2	ZINC000000200891	C2CCN(Cc1ccccc1)CC2
OC2CCN(Cc1ccc(N(=O)=O)cc1)CC2	ZINC000000240189	C2CCN(Cc1ccccc1)CC2
CN(C)CC(=O)n2c1ccccc1sc3ccccc23	ZINC000000000200	c3ccc2sc1ccccc1[nH]c2c3
O[C@H](CN[C@H]1CCCCNC1=O)c2ccccc2	ZINC000000130400	O=C1NCCCCC1NCCc2ccccc2
CCn3c1ncccc1n(C)c(=S)c4oc2cccnc2c34	ZINC000000021714	S=c3[nH]c1cccnc1[nH]c4c2ncccc2oc34
CC(C)CN3CCC(C(=O)N2CCN(c1ccccc1F)CC2)CC3	ZINC000000455556	O=C(C1CCNCC1)N3CCN(c2ccccc2)CC3
COC(=O)CCN1C=CC(C)(C)C=C1	ZINC000000004347	C1C=CNC=C1
Cc1[nH]cnc1Cc3nc(c2ccccc2)cs3	ZINC000000004346	C(c1c[nH]cn1)c3nc(c2ccccc2)cs3
Cn2cc(N(=O)=O)c(C(=O)N1CCCCC1)n2	ZINC000000055440	O=C(N1CCCCC1)c2cc[nH]n2
CCCN2CCC(N1CCC(O)CC1)CC2	ZINC000000279581	C2CCN(C1CCNCC1)CC2
CN(C)CCOC(=O)c1ccc(Cl)c(N)c1	ZINC000000001202	c1ccccc1
CCNc1occ(O)c1C(=O)OCC	ZINC000000408482	c1ccoc1
CC2(C)C[C@@H](NCc1ccccc1)CCO2	ZINC000000051287	C2CC(NCc1ccccc1)CCO2
C(CN2CCN(c1ncccn1)CC2)Nc4ccc3ccccc3n4	ZINC000000007523	C(CN2CCN(c1ncccn1)CC2)Nc4ccc3ccccc3n4
CN(N=C(C)N)c1cccc(F)c1C#N	ZINC000000140416	c1ccccc1
O=C(Nc1ccccc1)c3ccc[n+](Cc2ccc(N(=O)=O)cc2)c3	ZINC000000307878	O=C(Nc1ccccc1)c3ccc[n+](Cc2ccccc2)c3
O=C1CCCC[C@@H]1CN2CCCCC2	ZINC000000000626	O=C1CCCCC1CN2CCCCC2
COC(=O)c3ccc2[nH]c(C)c(C[N@@](C)C1CCCCC1)c(=O)c2c3	ZINC000000144130	O=c2c(CNC1CCCCC1)c[nH]c3ccccc23
C[C@@H](O)CN(C)c1ccc(NN)nn1	ZINC000000000624	c1ccnnc1
CN1CCc3c(C1)c(NCc2ccccc2)nc4n[nH]c(N)c34	ZINC000000055285	C1Cc3c(CN1)c(NCc2ccccc2)nc4n[nH]cc34
COc2cc(C)c(\C=C(\C#N)C(=O)NC[C@@H]1CCCO1)cc2C(C)C	ZINC000000048495	O=C(NCC1CCCO1)C=Cc2ccccc2
COC(=O)c2c1CCCc1sc2NC(=O)COc3ccccc3F	ZINC000000484256	O=C(COc1ccccc1)Nc3cc2CCCc2s3
CN3CCC(N2CCN(c1ccc(Cl)cc1)CC2)CC3	ZINC000000279568	C3CC(N2CCN(c1ccccc1)CC2)CCN3
O=S(=O)(Cc1cccc[n+]1Cc2ccccc2)c3ccccc3	ZINC000000398740	O=S(=O)(Cc1cccc[n+]1Cc2ccccc2)c3ccccc3
O[C@@H](CNC[C@@H]2COc1ccccc1O2)c3ccccc3	ZINC000000157211	C(Cc1ccccc1)NCC3COc2ccccc2O3
CC(=O)N3CCN(c2[nH]c(=S)c(C#N)c1CC(C)(C)OCc12)CC3	ZINC000000496250	S=c3cc1CCOCc1c(N2CCNCC2)[nH]3
C[C@@H]3CC(=O)c2n(Cc1ccccc1)nc[n+]2N3	ZINC000000409681	O=C2CCN[n+]3cnn(Cc1ccccc1)c23
CC(=O)OCCn2c(C)[n+](c1ccccc1)c3ccc(Cl)cc23	ZINC000000357757	c3ccc([n+]1c[nH]c2ccccc12)cc3
C3CCN(CCN(Cc1ccccc1)c2ccccc2)C3	ZINC000000001534	C3CCN(CCN(Cc1ccccc1)c2ccccc2)C3
Cc3cc(OCC(=O)N1CCc2ccccc12)cc(C)c3Cl	ZINC000000037587	O=C(COc1ccccc1)N2CCc3ccccc23
C(c2ccc1ccccc1n2)[n+]3ccccc3	ZINC000000041806	C(c2ccc1ccccc1n2)[n+]3ccccc3
C[C@@H]2O[C@H](n1cc(F)c(=O)[nH]c1=O)[C@@H](O)[C@H]2O	ZINC000000001332	O=c2ccn(C1CCCO1)c(=O)[nH]2
CNCc1ccccc1[C@H](O)c2ccc(F)cc2	ZINC000000004120	C(c1ccccc1)c2ccccc2
CC[n+]1c(SC)ccc2cc(OC)ccc12	ZINC000000078040	c2ccc1ncccc1c2
COC(=O)[C@@H](Cc1ccccc1)NC(=O)CCc3c(C)nc(N2CCOCC2)[nH]c3=O	ZINC000012915006	O=C(CCc2cnc(N1CCOCC1)[nH]c2=O)NCCc3ccccc3
CN(C)CCO[C@](C)(c1ccccc1)c2ccc(Cl)cc2	ZINC000000000137	C(c1ccccc1)c2ccccc2
COc2ccc(C(=O)N1CCCC1=O)cc2	ZINC000000015951	O=C1CCCN1C(=O)c2ccccc2
O=C(OCCN1CCCCCC1)[C@H](C2CCCCC2)c3ccsc3	ZINC000000000132	O=C(OCCN1CCCCCC1)C(C2CCCCC2)c3ccsc3
COc3ccc2sc1ccccc1n(CCCN(C)C)c2c3	ZINC000000000488	c3ccc2sc1ccccc1[nH]c2c3
CN[C@@H](C)Cc1ccccc1OC	ZINC000000000487	c1ccccc1
C[C@@H]1O[C@@]2(CS1)CN3CCC2CC3	ZINC000000010163	C1CN3CCC1C2(CSCO2)C3
CCn3c(C)c(\C=N\NC(=O)c2ccc1OCOc1c2)c4ccccc34	ZINC000000487278	O=C(NN=Cc1c[nH]c2ccccc12)c4ccc3OCOc3c4
O[C@H]2C[N+]3(Cc1ccccc1N(=O)=O)CCC2CC3	ZINC000000178979	C2C[N+]3(Cc1ccccc1)CCC2CC3
CC(C)N[C@@H](C)Cc1ccc(O)cn1	ZINC000000004659	c1ccncc1
COC(=O)C3=C(O)CC[C@](C#N)(c2ccc(OC)c(OC1CCCC1)c2)C3	ZINC000000600664	C3CCC(Oc2cccc(C1CCC=CC1)c2)C3
CC2(C)C[C@](Cc1ccccc1)([C@@H](CN)CO)CCO2	ZINC000000191084	C2CC(Cc1ccccc1)CCO2
COc1ccccc1C(=O)N/C(=C/c2ccc(F)cc2)C(=O)Nc3cccc(C(O)=O)c3	ZINC000000657718	O=C(Nc1ccccc1)C(NC(=O)c2ccccc2)=Cc3ccccc3
CC(C)O[C@@]23Oc1ccccc1C=C2N4CCC3CC4	ZINC000000178975	C1CN4CCC1C3Oc2ccccc2C=C34
Cc3c(O)c(CN1CCCCC1)cc4c(c2ccccc2)cc(=O)oc34	ZINC000000046577	O=c4cc(c1ccccc1)c3cc(CN2CCCCC2)ccc3o4
CCc3nnc(NS(=O)(=O)c2ccc(NC(=O)CCc1ccccc1)cc2)s3	ZINC000000705517	O=C(CCc1ccccc1)Nc3ccc(S(=O)(=O)Nc2nncs2)cc3
CCC[N@]1[C@H]2CC[C@@H]1CC(O)C2	ZINC000000336721	C1CC2CCC(C1)N2
CNC[C@@H](OC)c1cccc(C(F)(F)F)c1	ZINC000000000313	c1ccccc1
CN(C)c2ccc(\C=N\NC(=S)Nc1cccc(C)c1)cc2	ZINC000000027893	S=C(NN=Cc1ccccc1)Nc2ccccc2
C[N@]1CCCC[C@H]1C(=O)Nc2c(C)cccc2C	ZINC000000154964	O=C(Nc1ccccc1)C2CCCCN2
COc2cccc3[C@@H]1CC[N@@](CC=C)[C@H]1CCc23	ZINC000000013943	C3CC1C(CCc2ccccc12)N3
COc4ccc(c3cn2c(nc1ccccc12)n3CCNC(C)C)cc4	ZINC000000240874	c4ccc(c3cn2c(nc1ccccc12)[nH]3)cc4
CC[C@@H](N)[C@@H](O)c1ccc(O)c(O)c1	ZINC000000000273	c1ccccc1
CCN(CC)[C@@H](C)CC(=O)Nc1ccccc1	ZINC000000000556	c1ccccc1
NC(=N)[C@@H](O)c2ccc1OCOc1c2	ZINC000000000559	C2Oc1ccccc1O2
COc2ccc(Nc1ncc[nH]1)c(C)c2	ZINC000000020287	N(c1ccccc1)c2ncc[nH]2
Clc3cc(c1nn[nH]n1)cc4c(=O)c2cccnc2oc34	ZINC000000002203	O=c3c1cccnc1oc4ccc(c2nn[nH]n2)cc34
COc4ccc(C(=O)N3CCN(C[C@H]1C[C@H]2C[C@@H]1C=C2)CC3)cc4	ZINC000000300559	O=C(N3CCN(CC1CC2CC1C=C2)CC3)c4ccccc4
NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000000139845	c1ccccc1
CNCc1ccc(C(F)(F)F)cc1	ZINC000000161983	c1ccccc1
Nc2cc(N)nc(SCC(=O)c1ccccc1)n2	ZINC000000351585	O=C(CSc1ncccn1)c2ccccc2
CC(=O)NC1CC(C)(C)NC(C)(C)C1	ZINC000000154561	C1CCNCC1
CC(C)NCC(=O)Nc1cc(N(C)C)nc2ccccc12	ZINC000000355055	c2ccc1ncccc1c2
CC[C@@]1(O)C[C@H](C)[N@@](C)C[C@@H]1C	ZINC000000251730	C1CCNCC1
C[C@@H]3CCC[C@@H](N2CCN(C(=O)c1ccncc1)CC2)C3	ZINC000000300552	O=C(N2CCN(C1CCCCC1)CC2)c3ccncc3
CN1CCCN=C1COC(=O)[C@](O)(C2CCCCC2)c3ccccc3	ZINC000000020260	O=C(OCC1=NCCCN1)C(C2CCCCC2)c3ccccc3
NC13C[C@@H]2C[C@H](C1)CC(O)(C2)C3	ZINC000000301205	C1C2CC3CC1CC(C2)C3
Clc6ccc(C[C@@H](NC(=O)[C@@H]2Cc1ccccc1CN2)C(=O)N5CCN([C@@H]3CCCC[C@@H]3Cn4cncn4)CC5)cc6	ZINC000028379668	O=C(NC(Cc1ccccc1)C(=O)N4CCN(C2CCCCC2Cn3cncn3)CC4)C6Cc5ccccc5CN6
CC2CCN(CC[C@@H](C)N(C)S(=O)(=O)c1cccc(C)c1)CC2	ZINC000000007275	O=S(=O)(NCCCN1CCCCC1)c2ccccc2
CN2CCC([N@@](C)Cc1sccc1C)CC2	ZINC000000236641	C2CC(NCc1cccs1)CCN2
CSc2cnc1c(=O)[nH]c(=O)n(C)c1n2	ZINC000000339440	O=c2[nH]c(=O)c1nccnc1[nH]2
C2CC(=Cc1c[nH]cn1)CCN2	ZINC000000016613	C2CC(=Cc1c[nH]cn1)CCN2
CC2(C)CC(NS(=O)(=O)c1ccccc1)CC(C)(C)N2	ZINC000000139843	O=S(=O)(NC1CCNCC1)c2ccccc2
O=C2C[C@H](N1CCCCC1)C(=O)N2c3ccccc3	ZINC000000102080	O=C2CC(N1CCCCC1)C(=O)N2c3ccccc3
Cn2c(=O)c(C(N)=S)cn(c1ccccc1)c2=O	ZINC000000161431	O=c2ccn(c1ccccc1)c(=O)[nH]2
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
CCOC(=O)c2ccc(N(C)S(=O)(=O)c1ccc(OC)cc1)cc2	ZINC000000479902	O=S(=O)(Nc1ccccc1)c2ccccc2
CN(C)C(=O)C(CCN2(=O)CCC(O)(c1ccc(Cl)cc1)CC2)(c3ccccc3)c4ccccc4	ZINC000000537930	O=N4(CCC(c1ccccc1)c2ccccc2)CCC(c3ccccc3)CC4
CN(C)CCNC(=O)[C@H]4C[C@@H](C(=O)Nc2ccc1CCCc1c2)C[N@@](Cc3ccc(O)cc3)C4	ZINC000014748612	O=C(Nc2ccc1CCCc1c2)C4CCCN(Cc3ccccc3)C4
Cn3c(=O)[nH]c(=O)c4n(C[C@@H](O)COc1ccccc1)c(NN=c2c(=O)[nH]c(=O)[nH]c2=O)nc34	ZINC000009110965	O=c4[nH]c(=O)c(=NNc2nc1[nH]c(=O)[nH]c(=O)c1n2CCCOc3ccccc3)c(=O)[nH]4
Nc2cc(N)nc(SCC(=O)N1CCCCC1)n2	ZINC000000421016	O=C(CSc1ncccn1)N2CCCCC2
CC(C)CNC(=O)C2CCN(Cc1ccc(F)cc1)CC2	ZINC000000236099	C2CCN(Cc1ccccc1)CC2
Nc3nc(N2CCN(C/C=C/c1ccccc1)CC2)nc4ccccc34	ZINC000000520249	C3CN(c2ncc1ccccc1n2)CCN3CC=Cc4ccccc4
COc1ccc(Cl)cc1C(=O)NCCc3ccc(S(=O)(=O)N=C(O)NC2CCCCC2)cc3	ZINC000000537805	O=C(NCCc2ccc(S(=O)(=O)N=CNC1CCCCC1)cc2)c3ccccc3
CC(C)OC(=O)CSc1nc(N)cc(N)n1	ZINC000000421013	c1cncnc1
CN1CCOCCOCCOCC1	ZINC000000242349	C1COCCOCCOCCN1
CCOc2ccc(CN1CCC(O)CC1)cc2	ZINC000000042939	C2CCN(Cc1ccccc1)CC2
CCOC(=O)c2c(NS(=O)(=O)c1ccc(OC)cc1)sc(C)c2c3ccc(Cl)cc3	ZINC000000662971	O=S(=O)(Nc2cc(c1ccccc1)cs2)c3ccccc3
CC(C)CNC(=O)c2ccc(N(C)S(=O)(=O)c1ccccc1)cc2	ZINC000000233825	O=S(=O)(Nc1ccccc1)c2ccccc2
NCCCC[C@@H](N)C(=O)Nc1ccc(N(=O)=O)cc1	ZINC000004556755	c1ccccc1
C1COCCOCCOCCN1	ZINC000000242347	C1COCCOCCOCCN1
FC(F)(F)c2ccnc(N1CCCNCC1)n2	ZINC000000066276	C2CNCCN(c1ncccn1)C2
Cc2cc[n+](Cc1ccc(Br)cc1)cc2	ZINC000000084099	C(c1ccccc1)[n+]2ccccc2
O[C@@]3(c1ccc(F)cc1)C[n+]2ccccc2N3c4ccccc4	ZINC000000239777	C3C(c1ccccc1)N(c2ccccc2)c4cccc[n+]34
C[C@@H](N1CCC(=C)CC1)[C@](O)(Cn2cncn2)c3ccc(F)cc3F	ZINC000000006251	C=C3CCN(CC(Cn1cncn1)c2ccccc2)CC3
COc3cccc(N2CCN(C[C@@H](C)Nc1ccccn1)CC2)c3	ZINC000000163582	C(CN2CCN(c1ccccc1)CC2)Nc3ccccn3
CCOc3cc(\C=c2/c(=O)[nH]n(c1cccc(C(F)(F)F)c1)c2=O)ccc3OCc4cccs4	ZINC000000623597	O=c2[nH]n(c1ccccc1)c(=O)c2=Cc4ccc(OCc3cccs3)cc4
Nc3nc2n([C@@H]1C[C@@H](O)[C@H](CO)C1=C)cnc2c(=O)[nH]3	ZINC000000005235	C=C1CCCC1n2cnc3c(=O)[nH]cnc23
CCOC(=O)C(=C/c1ncc(N(=O)=O)n1C)/C(C)=O	ZINC000000001990	c1c[nH]cn1
CCOc1cc(\C=N\O)c(Br)cc1OCC(=O)Nc2ccccc2OC	ZINC000000668545	O=C(COc1ccccc1)Nc2ccccc2
CN(C)Cc2c(O)ccc3occ([C@@H](O)c1ccccc1)c23	ZINC000000196731	C(c1ccccc1)c2coc3ccccc23
COc1cc(C)ccc1S(=O)(=O)NC2CC(C)(C)NC(C)(C)C2	ZINC000000384609	O=S(=O)(NC1CCNCC1)c2ccccc2
Oc2ccc(NC(=O)N1CCNC1=O)cc2O	ZINC000000043534	O=C1NCCN1C(=O)Nc2ccccc2
CN3CCN(c2c(C=O)c1ccccc1n2C)CC3	ZINC000000168735	C3CN(c2cc1ccccc1[nH]2)CCN3
COc2ccc(OC(=O)c1ccc(Br)cc1)c(C(C)=O)c2	ZINC000000262430	O=C(Oc1ccccc1)c2ccccc2
CSc2nc(=O)n1nccc1[nH]2	ZINC000000080404	O=c1nc[nH]c2ccnn12
Cc3cc(C)n(C(=O)c2ccc(NC(=O)C1CC1)cc2)n3	ZINC000000038580	O=C(Nc2ccc(C(=O)n1cccn1)cc2)C3CC3
O=C(NCc1ccccn1)c2nc[nH]n2	ZINC000000269317	O=C(NCc1ccccn1)c2nc[nH]n2
C/N=C(/N1CCCCC1)c2ccc(N(=O)=O)cc2	ZINC000000031218	N=C(N1CCCCC1)c2ccccc2
CC(=O)Nc1nonc1NC(=O)c2ccccc2Cl	ZINC000000031183	O=C(Nc1cnon1)c2ccccc2
CCOC(=O)C2CCN(Cc1ccc(F)c(F)c1)CC2	ZINC000000239176	C2CCN(Cc1ccccc1)CC2
CC[C@@H]3CSC4=[N+](c1ccccc1)[C@@](O)(c2ccc(OC)cc2)CN34	ZINC000000623116	C4CN3CC(c1ccccc1)[N+](c2ccccc2)=C3S4
CCN(CC)CCc1ccncc1	ZINC000000163340	c1ccncc1
COc2ccc(CC(=O)NCCN1CCCC1)cc2	ZINC000000383091	O=C(Cc1ccccc1)NCCN2CCCC2
CN2CCN(NC(=O)c1ccc(N(=O)=O)cc1Cl)CC2	ZINC000000258982	O=C(NN1CCNCC1)c2ccccc2
CCOC(=O)C2CCN(Cc1ccccc1OC)CC2	ZINC000000240503	C2CCN(Cc1ccccc1)CC2
Cc3ccc(c2cnc1ccccc1[n+]2C)c(C)c3	ZINC000000064438	c3ccc(c2cnc1ccccc1n2)cc3
CSc2ncc(Cl)c(C(=O)Nc1ccccc1C#N)n2	ZINC000000040866	O=C(Nc1ccccc1)c2ccncn2
Brc2cccc(C(=O)NCCN1CCCC1)c2	ZINC000000383076	O=C(NCCN1CCCC1)c2ccccc2
Cc1ccc(OC[C@@H](O)CN)cc1	ZINC000000289623	c1ccccc1
FC(F)(F)c2cc(N1CCOCC1)ccc2C#N	ZINC000000003173	C2CN(c1ccccc1)CCO2
O[C@@H]2CCC[N@@](Cc1cccnc1)C2	ZINC000000199796	C2CCN(Cc1cccnc1)CC2
NC(=N)c1cccc(C(F)(F)F)c1	ZINC000000089416	c1ccccc1
C[C@@H]3S[C@@]1(CN2CCC1CC2)NC3=O	ZINC000000244192	O=C3CSC1(CN2CCC1CC2)N3
COc1ccccc1CNn2c(C)nnc2SCc3ccccc3F	ZINC000000623755	C(Nn1cnnc1SCc2ccccc2)c3ccccc3
CCC[n+]3ccc(c1c[nH]c2ccccc12)cc3	ZINC000000042755	c3ccc2c(c1ccncc1)c[nH]c2c3
CCN(CC)S(=O)(=O)c2cc(C(=O)N[C@@H](C)c1ccccc1)ccc2Cl	ZINC000000623203	O=C(NCc1ccccc1)c2ccccc2
C[C@@H](O)C[N+](=O)Cc1ccccc1	ZINC000000126541	c1ccccc1
NC(=N)c1cc(Cl)cc(Cl)c1	ZINC000000115281	c1ccccc1
O=C2O[C@H](CCN1CCCCC1)OC2(c3ccccc3)c4ccccc4	ZINC000000608027	O=C2OC(CCN1CCCCC1)OC2(c3ccccc3)c4ccccc4
Cc2ccc(C)c(C[N@]1CC[C@@H](O)C1)c2	ZINC000000212804	C2CCN(Cc1ccccc1)C2
CCc3nn2c(=O)cc(N1CCNCC1)nc2s3	ZINC000000213538	O=c2cc(N1CCNCC1)nc3scnn23
O=C(N1CCCCC1)c2ccccc2Nc3ccncc3	ZINC000000001848	O=C(N1CCCCC1)c2ccccc2Nc3ccncc3
COc1ccc(Cl)cc1NC(=O)CN2CCC(C)CC2	ZINC000000127784	O=C(CN1CCCCC1)Nc2ccccc2
C2CN=C(COc1cccnc1)N2	ZINC000000066462	C2CN=C(COc1cccnc1)N2
CC(=O)OC[C@@H]2O[C@@H](OC(C)=O)[C@@H](NS(=O)(=O)Cc1ccccc1)[C@@H](OC(C)=O)[C@@H]2OC(C)=O	ZINC000004896978	O=S(=O)(Cc1ccccc1)NC2CCCOC2
NC(=N)c2cc1c(I)cccc1s2	ZINC000000017086	c2ccc1sccc1c2
C2CN(Cc1ccccc1)CCC2n3cccc3	ZINC000000161500	C2CN(Cc1ccccc1)CCC2n3cccc3
CC[C@@H](C(=O)N1CCC(C(=O)OC)CC1)c2ccccc2	ZINC000000031725	O=C(Cc1ccccc1)N2CCCCC2
CCOC(=O)C1CCN(C(C)(C)C=O)CC1	ZINC000000168201	C1CCNCC1
OC2(C#CCN1CCCC1)CCCCC2	ZINC000000274361	C2CCC(C#CCN1CCCC1)CC2
NC(=O)c1ccc(Cl)c(S(N)(=O)=O)c1	ZINC000000002088	c1ccccc1
CO[C@]12CC[C@@]3(C[C@@H]1CNC(=O)[C@@H](N)CC(N)=O)[C@H]4Cc6ccc(O)c7O[C@@H]2[C@]3(CC[N@]4CC5CC5)c67	ZINC000221251271	C1CC1CN2CCC37C4Oc6cccc(CC2C35CCC4CC5)c67
COc2cc(C[C@@H](C)N1CCSCC1)ccc2O	ZINC000000214159	C2CN(CCc1ccccc1)CCS2
NCC(=O)N[C@H](CCCNC(N)=N)C(=O)Nc1ccc(N(=O)=O)cc1	ZINC000004545953	c1ccccc1
COc2ccc(NC(=O)CN(c1cc(C)ccc1OC)S(C)(=O)=O)cc2Cl	ZINC000000622157	O=C(CNc1ccccc1)Nc2ccccc2
CN2CCN(/N=C/c1ccc(N(=O)=O)cc1)CC2	ZINC000000435697	C2CN(N=Cc1ccccc1)CCN2
COCc3cc(C)c(C#N)c(SCc2nc1ccccc1[nH]2)n3	ZINC000000050012	C(Sc1ccccn1)c3nc2ccccc2[nH]3
C[C@@H](O)CNC[C@H](C)O	ZINC000000157558	nonring
CCN(CC)CC#CC1(OC(C)=O)CCCCC1	ZINC000000206924	C1CCCCC1
OCC[C@]24N[C@H](Cc1ccccc12)[C@@H]3CCCC[C@@H]34	ZINC000000010568	C1CCC3C(C1)C4Cc2ccccc2C3N4
C[C@H]1CCCC[N@]1Cc3nc(N)nc(Nc2cccc(Cl)c2C)n3	ZINC000000202200	C3CCN(Cc2ncnc(Nc1ccccc1)n2)CC3
COc3cc2CC[N@](Cc1ccsc1)Cc2cc3OC	ZINC000000200307	C2Cc1ccccc1CN2Cc3ccsc3
CCOc1ccccc1N(CC(=O)Nc2cccnc2)S(C)(=O)=O	ZINC000000329026	O=C(CNc1ccccc1)Nc2cccnc2
C=CC[N+]2(CC#Cc1ccccc1)CCOCC2	ZINC000000196849	C2CN(CC#Cc1ccccc1)CCO2
CN(C)c3ccc(\C=N\N2CCN(c1ccccc1)CC2)cc3	ZINC000000136497	C2CN(c1ccccc1)CCN2N=Cc3ccccc3
Fc1ccccc1[C@@H]2SCC(=O)N2CCN3CCCCC3	ZINC000000072749	O=C2CSC(c1ccccc1)N2CCN3CCCCC3
Cc1ccsc1C[N@]2CCC[C@@H]2CO	ZINC000000212939	C2CCN(Cc1cccs1)C2
OC2(\C=C\CN1CCCCC1)CCCCC2	ZINC000000123377	C2CCC(C=CCN1CCCCC1)CC2
COc3ccc(CCC(=O)OCC(=O)c2ccc1ccccc1c2)cc3	ZINC000000384559	O=C(CCc1ccccc1)OCC(=O)c3ccc2ccccc2c3
CC3CCN(Cn2cnn(CN1CCC(C)CC1)c2=S)CC3	ZINC000000102969	S=c2n(CN1CCCCC1)cnn2CN3CCCCC3
CCN(CC)C(=O)O[n+]1cccc(CC)c1	ZINC000000201411	c1ccncc1
NCc3ccc(c2cc(c1ccccc1)[nH]n2)cc3	ZINC000000008800	c3ccc(c2cc(c1ccccc1)[nH]n2)cc3
CN(C)CCCN(C)C[C@H]1CO[C@@H]4N([C@@H](CN(C)CCCN(C)C)O1)C(=O)N(C)c5nc3n(C)c2ccccc2c3nc45	ZINC000026752927	O=C5Nc3nc2[nH]c1ccccc1c2nc3C4OCCOCN45
OC[C@H](O)Cn1cc(F)c(=O)[nH]c1=O	ZINC000000033904	O=c1cc[nH]c(=O)[nH]1
COc4ccc(NC(=O)C2C(c1ccccc1)=C2c3ccccc3)cc4	ZINC000000051289	O=C(Nc1ccccc1)C3C(c2ccccc2)=C3c4ccccc4
Cn1c(Cl)c[n+](C)c1[C@@H](O)c2ccccc2	ZINC000000231570	C(c1ccccc1)c2ncc[nH]2
C(c1ccccc1)[n+]2csc3ccccc23	ZINC000000041240	C(c1ccccc1)[n+]2csc3ccccc23
CC(=O)Cn1cc(N(=O)=O)cn1	ZINC000000049640	c1cn[nH]c1
CCOC(=O)C(=C/N=c1\ccn(C)c2ccccc12)/C#N	ZINC000000289847	N=c1cc[nH]c2ccccc12
NC(=N)NCCC[C@@H]3N4[C@H](CN(CCc2ccc1ccccc1c2)C3=O)SC[C@H](NC(=O)CNC(N)=N)C4=O	ZINC000299835986	O=C4CCSC3CN(CCc2ccc1ccccc1c2)C(=O)CN34
COc1ccccc1NC(=O)CSCc2cnc(C)c(O)c2CO	ZINC000000094351	O=C(CSCc1cccnc1)Nc2ccccc2
CO[C@H](Cc1ccc(OC)cc1OCc2ccccc2)[C@@H](O)c3ccccc3	ZINC000000622449	C(Cc1ccccc1)Cc2ccccc2OCc3ccccc3
CN(C)CCCNCC#CCNCCCN(C)C	ZINC000001728967	nonring
Nc2nc(N)c1ccccc1n2	ZINC000000156374	c2ccc1ncncc1c2
CN2CCC(N(C)C(=S)NCCc1ccccc1)CC2	ZINC000000109209	S=C(NCCc1ccccc1)NC2CCNCC2
Cc3ccc(c2nnc(SCCN1CCCCC1)n2C)cc3	ZINC000000410805	C3CCN(CCSc2nnc(c1ccccc1)[nH]2)CC3
Cn2n(C)c(=O)n(c1ccc(S(N)(=O)=O)cc1)c2=O	ZINC000000033762	O=c1[nH][nH]c(=O)n1c2ccccc2
CCn2c(N)[n+](CC(=O)c1ccc(C)cc1)c3ccccc23	ZINC000000086386	O=C(C[n+]1c[nH]c2ccccc12)c3ccccc3
C[C@@H]2CN=C(Nc1ccc(N)cc1)S2	ZINC000000086384	C2CN=C(Nc1ccccc1)S2
Cc3cc(Nc1cccc(Cl)c1)nc(N2CCOCC2)n3	ZINC000000073508	C3CN(c2nccc(Nc1ccccc1)n2)CCO3
CCc2nc1ccccc1c(NC(=O)CN(C)C)c2C	ZINC000000190461	c2ccc1ncccc1c2
CC(=O)Oc2c(C)c(C)c1O[C@@](C)(CC[N+](C)(C)C)CCc1c2C	ZINC000000012154	C2COc1ccccc1C2
O=C(N2CCN(C[C@H]1CCC=CC1)CC2)c3ccco3	ZINC000000316628	O=C(N2CCN(CC1CCC=CC1)CC2)c3ccco3
CCOc1cc(C=O)cc(Cl)c1OC(=O)c2cccc(N(=O)=O)c2	ZINC000000312855	O=C(Oc1ccccc1)c2ccccc2
CC4(C)O[C@@H]3[C@H](CN(CCNC(N)=N)C(N)=N)O[C@H](CC(=O)NCCc1c[nH]c2ccccc12)[C@@H]3O4	ZINC000049088043	O=C(CC2OCC1OCOC12)NCCc3c[nH]c4ccccc34
CC(C)Nc3nc(N1CCCC1)nc(N2CCCC2)n3	ZINC000000087389	C3CCN(c2ncnc(N1CCCC1)n2)C3
C[N+]1=c2cc(N)c(=O)c3[nH]cc(CC1)c23	ZINC000000019950	O=c1ccc3=NCCc2c[nH]c1c23
CCn3c(=O)c(=C\C=C1/CCC[N@]1C)\n(c2ccccc2)c3=S	ZINC000000179482	O=c2[nH]c(=S)n(c1ccccc1)c2=CC=C3CCCN3
Cc2cc(\C=c1\c(=O)[nH]c(=S)n(CC=C)c1=O)c(C)n2c4ccc(OCc3ccccc3F)cc4	ZINC000000681142	O=c1[nH]c(=S)[nH]c(=O)c1=Cc4ccn(c3ccc(OCc2ccccc2)cc3)c4
C[C@@H](Cc1c[nH]c2ccc(Cl)cc12)/N=C/c3ccc(N(C)C)cc3	ZINC000000053115	C(Cc1c[nH]c2ccccc12)N=Cc3ccccc3
CN(C)Cc3ccc(C(=O)N2CCN(Cc1ccccc1)CC2)cc3	ZINC000000013541	O=C(N2CCN(Cc1ccccc1)CC2)c3ccccc3
Cc2[nH]c1c(Cl)cc(Cl)cc1c2CCN	ZINC000000140713	c2ccc1[nH]ccc1c2
CS(=O)(=O)Nc2cc1CCC(=O)c1cc2Oc3ccc(F)cc3F	ZINC000000537736	O=C2CCc3ccc(Oc1ccccc1)cc23
CCOc2cc(C=Cc1[nH]c(=O)[nH]c(=O)c1N(=O)=O)cc(Br)c2OCC(=O)OC	ZINC000009235285	O=c2cc(C=Cc1ccccc1)[nH]c(=O)[nH]2
CCOc3ccc(NC(=O)[C@H]2CN(c1ccc(C)cc1)C(=O)C2)cc3	ZINC000000045021	O=C2CC(C(=O)Nc1ccccc1)CN2c3ccccc3
COc3cc2CCN(CCc1ccc(N)cc1)CCc2cc3OC	ZINC000000000830	C(Cc1ccccc1)N3CCc2ccccc2CC3
Nc3ccc2nc(c1cc(O)ccc1N)[nH]c2c3	ZINC000000075591	c3ccc(c2nc1ccccc1[nH]2)cc3
C[C@H](N1CCC(O)CC1)c2ccccc2	ZINC000000208239	C2CCN(Cc1ccccc1)CC2
CC(C)(C)c3cc2nc(C(F)(F)F)cc(N1CCNCC1)n2n3	ZINC000000170720	C3CN(c1ccnc2ccnn12)CCN3
CN(C)CCOC(=O)c3ccc2[nH]c1CCSCc1c2c3	ZINC000000190266	C3Cc2[nH]c1ccccc1c2CS3
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
Cc1ccccc1OC[C@H](O)C[n+]2cn(C)c3cc(C)c(C)cc23	ZINC000000307203	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
NCCC(=O)n2c1ccccc1sc3ccc(C(F)(F)F)cc23	ZINC000000069851	c3ccc2sc1ccccc1[nH]c2c3
CC2CCN(CCC(=O)Nc1nccs1)CC2	ZINC000000210057	O=C(CCN1CCCCC1)Nc2nccs2
COc2ccc(S(=O)(=O)Nc1ccccc1C(=O)NCC(C)C)cc2Br	ZINC000000640095	O=S(=O)(Nc1ccccc1)c2ccccc2
N#Cc2[nH]nc3nc(N1CCNCC1)ccc23	ZINC000000018395	C3CN(c2ccc1c[nH]nc1n2)CCN3
CC(=O)N/C(=C/c1ccccc1)C(=O)NCc2ccco2	ZINC000000031331	O=C(NCc1ccco1)C=Cc2ccccc2
C1CCc2c(C1)n4CCNCc3cccc2c34	ZINC000000009262	C1CCc2c(C1)n4CCNCc3cccc2c34
CC(C)c2ncc(Cc1ccccc1)[nH]c2=O	ZINC000000018551	O=c2cncc(Cc1ccccc1)[nH]2
CN3CCC([N@@](C)C2CCN(Cc1ccccc1)CC2)CC3	ZINC000000280041	C3CC(NC2CCN(Cc1ccccc1)CC2)CCN3
CC[C@@H]3C[N+]2(C)CCc1cc(OC)c(OC)cc1[C@@H]2CC3=O	ZINC000000044568	O=C3CCN2CCc1ccccc1C2C3
CN(C)CCOC(=O)c2cn(Cc1ccccc1)c3ccccc23	ZINC000000493992	C(c1ccccc1)n2ccc3ccccc23
NC(=N)NN=Cc1ccc(Cl)c(Cl)c1	ZINC000000126782	c1ccccc1
CC1(C)COc2[n+]1c(=O)c3ccsc23	ZINC000000165373	O=c2[n+]1CCOc1c3sccc23
NCc1c(Cl)cccc1Oc2ccccc2	ZINC000000159665	O(c1ccccc1)c2ccccc2
CC(C)c3ccc(/C=C/C(=O)Nc2ccc(S(=O)(=O)Nc1nccs1)cc2)cc3	ZINC000000669734	O=C(Nc2ccc(S(=O)(=O)Nc1nccs1)cc2)C=Cc3ccccc3
CCN(CC)CC(=O)Nc2sc1CCCCc1c2C#N	ZINC000000208789	C2CCc1sccc1C2
CN4CCN(c2nc(C)nc3sc1CCCc1c23)CC4	ZINC000000215577	C4Cc3sc2ncnc(N1CCNCC1)c2c3C4
Clc2ccc(OCC1=NCCN1)cc2Cl	ZINC000000001435	C2CN=C(COc1ccccc1)N2
CCOc1ccccc1CN3CCC(C(=O)N2CCCC2)CC3	ZINC000000236163	O=C(C2CCN(Cc1ccccc1)CC2)N3CCCC3
C[C@@H]2C[N@@](C1CCCCC1)CCC2=O	ZINC000000129239	O=C2CCN(C1CCCCC1)CC2
Cc2ccc(S(=O)(=O)NCCc1ccccc1)c3nsnc23	ZINC000000033018	O=S(=O)(NCCc1ccccc1)c2cccc3nsnc23
O=C2CC[N@@](Cc1ccccc1)CCN2	ZINC000000077600	O=C2CCN(Cc1ccccc1)CCN2
Nc2cc(N1CCCCC1)cc(N)n2	ZINC000000008026	C2CCN(c1ccncc1)CC2
CCN2CCN(C(=S)NC1CCCCC1)CC2	ZINC000000300300	S=C(NC1CCCCC1)N2CCNCC2
CS(=O)(=O)N4CCN(c3ccnc(Nc2ncc(c1cncc(C(=O)NCCN)c1)s2)c3)CC4	ZINC000034839914	C4CN(c3ccnc(Nc2ncc(c1cccnc1)s2)c3)CCN4
C1NC[C@@H]3C[C@H]1CN(c2cccnc2)C3	ZINC000000026026	C1NCC3CC1CN(c2cccnc2)C3
COc2cc(Br)c1CCC(=O)c1c2OC	ZINC000000008028	O=C1CCc2ccccc12
CCN(CC)[C@@H]2CC(=O)N(c1cccc(N(=O)=O)c1)C2=O	ZINC000000093274	O=C1CCC(=O)N1c2ccccc2
COc3ccc(COC[C@@H](Cn1ccnc1)OCc2ccc(OC)cc2)cc3	ZINC000000596723	C(OCc1ccccc1)C(Cn2ccnc2)OCc3ccccc3
O[C@H](CN1CCCC1)Cn3c2ccccc2c4ccccc34	ZINC000000133763	C4CCN(CCCn2c1ccccc1c3ccccc23)C4
OCn1c(=O)oc2ccccc12	ZINC000000059328	O=c2[nH]c1ccccc1o2
NC1[C@H]3CC2C[C@@H]1CC(S)(C2)C3	ZINC000000244184	C1C2CC3CC1CC(C2)C3
CN(C)CCSc2nc1ccccc1[nH]2	ZINC000000182695	c2ccc1[nH]cnc1c2
NCCn2c(N)c(C#N)c3nc1ccccc1nc23	ZINC000000107333	c3ccc2nc1[nH]ccc1nc2c3
COC(=O)c2ccc(NC(=S)N1CCN(C)CC1)cc2	ZINC000000134398	S=C(Nc1ccccc1)N2CCNCC2
CN(C)CC[C@@]1(C)OCCC2=C1Cc3ccccc23	ZINC000000000635	C1CC2=C(CO1)Cc3ccccc23
CC(C)(C)NC[C@@H](O)c1ccc(O)c(CO)n1	ZINC000000000637	c1ccncc1
Nc2nc(N)nc(NC1CC1)n2	ZINC000000001239	C1CC1Nc2ncncn2
C3CCN(C[C@H]2COc1ccccc1O2)CC3	ZINC000000000631	C3CCN(CC2COc1ccccc1O2)CC3
COc4ccc3[C@@H]2COc1cc(O)ccc1[C@@H]2Oc3c4	ZINC000000011544	C3Oc1ccccc1C4Oc2ccccc2C34
OC([C@@H]1CCCCN1)(c2ccccc2)c3ccccc3	ZINC000000000633	C3CCC(C(c1ccccc1)c2ccccc2)NC3
CC(C)[C@H]([C@H](O)CCN1CCCCC1)c2ccccc2	ZINC000000000632	C2CCN(CCCCc1ccccc1)CC2
C[C@@H]([C@H](O)c1ccccc1)N(C)C	ZINC000000000491	c1ccccc1
CNC(=O)N=C(N)NCCC[C@H](NC(=O)[C@@H](C)NC(C)=O)C(=O)N(C)[C@@H](Cc1ccccc1)C(O)=O	ZINC000040428771	c1ccccc1
CN(C)CCOC(=O)Nc1sc(=S)n(C)c1C	ZINC000000196210	S=c1[nH]ccs1
C[N@]1[C@H]4CC[C@@H]1CC(NC(=O)c2cnn3ccc(C)cc23)C4	ZINC000000008332	O=C(NC1CC2CCC(C1)N2)c3cnn4ccccc34
O[C@@H]2CCC[N@@](CCc1ccccc1)C2	ZINC000000217849	C2CCN(CCc1ccccc1)CC2
C2CN(c1ncccn1)CCN2	ZINC000000066064	C2CN(c1ncccn1)CCN2
Cc2cccc(N1CCNCC1)c2	ZINC000000066066	C2CN(c1ccccc1)CCN2
CC(=O)Nc1ccc(OCC[N+](C)(C)CC=C)cc1	ZINC000000307736	c1ccccc1
COc1ccc(N(=O)=O)cc1NC(=O)c3ccc(c2ccccc2)cc3	ZINC000000066062	O=C(Nc1ccccc1)c3ccc(c2ccccc2)cc3
C[N@@]1[C@H]3C[C@@H](O)[C@@H]1C[C@H](OC(=O)[C@H](CO)c2ccccc2)C3	ZINC000000488597	O=C(Cc1ccccc1)OC2CC3CCC(C2)N3
Clc3ccc(OCC(=O)N2C[C@@H](c1ccccc1)CC2=O)cc3	ZINC000000020526	O=C(COc1ccccc1)N3CC(c2ccccc2)CC3=O
CC2(C)CC(NC(=O)c1ccccc1F)CC(C)(C)N2	ZINC000000186275	O=C(NC1CCNCC1)c2ccccc2
CCC(=O)N(C2CCN(CCc1cccs1)CC2)c3ccccc3	ZINC000000001442	C2CN(CCc1cccs1)CCC2Nc3ccccc3
CN(C)CCO[C@@H](c1ccc(Cl)cc1)c2ccccn2	ZINC000000000122	C(c1ccccc1)c2ccccn2
CC(C)(C)C(=O)Cn2nnc(N1CCOCC1)n2	ZINC000000089254	C2CN(c1nn[nH]n1)CCO2
Clc3ccc(N(=O)=O)c(CN2CCC(Cc1ccccc1)CC2)c3	ZINC000000207022	C2CN(Cc1ccccc1)CCC2Cc3ccccc3
Cn1ccnc1SCC(=O)Nc2ccccn2	ZINC000000051744	O=C(CSc1ncc[nH]1)Nc2ccccn2
CCN3CCN(c2ccc(NC(=O)c1cccnc1)cc2Cl)CC3	ZINC000000587321	O=C(Nc2ccc(N1CCNCC1)cc2)c3cccnc3
O=C(NCCc3nnc4CC[N@@](Cc2ccc(CN1CCCCC1)s2)CCn34)C5CCOCC5	ZINC000011970606	O=C(NCCc3nnc4CCN(Cc2ccc(CN1CCCCC1)s2)CCn34)C5CCOCC5
CN(C)C3=NC[C@@H](C(N)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)CN3	ZINC000096924170	O=C(CCc1ccccc1)NC3CNC=NCCNC(=O)C(Cc2ccccc2)NC(=O)CNC3=O
NNc4nc(N)nc(C23CC1CC(CC(C1)C2)C3)n4	ZINC000000163117	C1C3CC4CC1CC(c2ncncn2)(C3)C4
OC[C@@H]1CCCC[N@]1Cc2ccccc2Br	ZINC000000211735	C2CCN(Cc1ccccc1)CC2
CN(C)CCCN2C(=O)[C@@H]1CC3=C(C[C@@H]1C2=O)C(C)(C)CCC3	ZINC000000185837	O=C3NC(=O)C2CC1=C(CCCC1)CC23
CN3C[C@@H](CC[N@]2CCC(c1ccccc1)=CC2)OC3=O	ZINC000000000304	O=C3NCC(CCN2CCC(c1ccccc1)=CC2)O3
NCCC(=O)Nc3cccc(S(=O)(=O)N[C@@H](Cc1cccc(C(N)=N)c1)C(=O)N2CCCCC2)c3	ZINC000040955895	O=C(C(Cc1ccccc1)NS(=O)(=O)c2ccccc2)N3CCCCC3
CCC[N@]1[C@H]3CC[C@@H]1CC(OC(=O)c2ccc(OC)c(OC)c2)C3	ZINC000000488024	O=C(OC1CC2CCC(C1)N2)c3ccccc3
COc1ccccc1NC(=O)CSc2nc(N)cc(N)n2	ZINC000000379437	O=C(CSc1ncccn1)Nc2ccccc2
CCN(CC)c3ccc2[nH]c1nc(=O)[nH]c1cc2c3	ZINC000000002864	O=c3nc2[nH]c1ccccc1cc2[nH]3
CCc2ccc([C@H]1C(C#N)=C(N)OC(C)=C1C(=O)OC)s2	ZINC000000043737	O2C=CC(c1cccs1)C=C2
CCOC(=O)c2ccc(/N=C/c1cc(OC)c(OC)c(OC)c1)cc2	ZINC000000095989	C(=Nc1ccccc1)c2ccccc2
O=C(Cn2c(=O)c1ccccc1c2=O)NCCc3ccccc3	ZINC000000047099	O=C(Cn2c(=O)c1ccccc1c2=O)NCCc3ccccc3
COC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CC(C)C)NC(=O)CN2CCCNCCCNCCC2	ZINC000084602809	O=C(CNC(=O)CN1CCCNCCCNCCC1)NCCc2ccccc2
O=C(N2CCc1ccccc1C2)C(=C/c3c[nH]c4ccccc34)/C#N	ZINC000000029025	O=C(C=Cc1c[nH]c2ccccc12)N4CCc3ccccc3C4
Cc2cc(C)[n+]1nc(C)n(C)c1n2	ZINC000000230348	c2cnc1[nH]cn[n+]1c2
NC(=O)[C@@H]2[C@@H](c1ccccc1)C(C#N)=C(N)NC2=S	ZINC000000048843	S=C2CC(c1ccccc1)C=CN2
CSc3ccc(CNCc2ccc1OCOc1c2)cc3	ZINC000000172215	C3Oc2ccc(CNCc1ccccc1)cc2O3
C[N@@](Cc1ccccc1)Cc3c(O)ccc4c2CCCc2c(=O)oc34	ZINC000000122782	O=c4oc2c(CNCc1ccccc1)cccc2c3CCCc34
CCC[n+]1cnn(C=C)c1	ZINC000000047329	c1nc[nH]n1
CCOC(=O)Cc2csc(NC(=O)Cc1ccccc1N(=O)=O)n2	ZINC000000457007	O=C(Cc1ccccc1)Nc2nccs2
CN(C)C(=O)Oc3ccc(OCc2c[n+]1ccccc1n2C)cc3	ZINC000000387385	C(Oc1ccccc1)c3c[n+]2ccccc2[nH]3
CN(C)C(=O)Oc3ccc(OCc2n(C)c1ccccc1[n+]2C)cc3	ZINC000000387384	C(Oc1ccccc1)c3nc2ccccc2[nH]3
CCOC(=O)c3ccc(n1c(CCC(O)=O)ccc1c2ccc(F)cc2)cc3O	ZINC000000664065	c3ccc(c1cccn1c2ccccc2)cc3
CC3(C)CN(CCN2CCN(c1cccc(Cl)c1)C2=O)C3	ZINC000000002252	O=C2N(CCN1CCC1)CCN2c3ccccc3
Nc5nc4cc3N(Cc2ccc(S(=O)(=O)c1ccccc1)cc2)CCCc3cc4[nH]5	ZINC000000605223	O=S(=O)(c1ccccc1)c5ccc(CN3CCCc4cc2[nH]cnc2cc34)cc5
COc1ccc(CCN)cc1OC2CCCC2	ZINC000000006316	C2CCC(Oc1ccccc1)C2
Cc3ccc(S(=O)(=O)C[C@@H](N1CCCC1)c2ccccc2)cc3	ZINC000000467587	O=S(=O)(CC(N1CCCC1)c2ccccc2)c3ccccc3
CC(C)(C)c2cc(CCC(=O)N1CCNCC1)c(C(C)(C)C)cc2O	ZINC000000197926	O=C(CCc1ccccc1)N2CCNCC2
CC[C@H]1CO[C@](C)(CCC(C)C)N1	ZINC000000155951	C1COCN1
COc3cc2CC[N@](Cc1ccccc1N)Cc2cc3OC	ZINC000000002825	C2Cc1ccccc1CN2Cc3ccccc3
C2CO[C@H](CNCc1ccncc1)C2	ZINC000000266017	C2COC(CNCc1ccncc1)C2
C[N@@](C[C@@H](O)C(F)(F)F)C1CCCCC1	ZINC000000167457	C1CCCCC1
O=C(O[C@@H]1CN2CCC1CC2)c3cccc4nc[nH]c34	ZINC000000385645	O=C(OC1CN2CCC1CC2)c3cccc4nc[nH]c34
CCN2CCC(NCc1ccc(F)cc1)CC2	ZINC000000221117	C2CC(NCc1ccccc1)CCN2
O=CNN2CN[N+](Cc1ccccc1)=C2	ZINC000000401330	C2NC=[N+](Cc1ccccc1)N2
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
COc1ccccc1N(CC(=O)NCc2ccco2)S(C)(=O)=O	ZINC000000080522	O=C(CNc1ccccc1)NCc2ccco2
Cn1c(=O)[nH]c(=O)c2n(CC=C)c(=NN)[nH]c12	ZINC000000340932	N=c2[nH]c1[nH]c(=O)[nH]c(=O)c1[nH]2
Oc3ccc(C(=O)N2Cc1ccccc1NC2=S)cc3	ZINC000000031915	O=C(N2Cc1ccccc1NC2=S)c3ccccc3
Clc1ccccc1C(=O)O/N=C/c3ccc2OCOc2c3	ZINC000000041651	O=C(ON=Cc2ccc1OCOc1c2)c3ccccc3
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
COC(=O)c3ccc(C[n+]1c(C)n(N)c2ccccc12)cc3	ZINC000000386963	C(c1ccccc1)[n+]2c[nH]c3ccccc23
COc2cccc(NC(=S)N(C)C1CCN(C)CC1)c2	ZINC000000109220	S=C(NC1CCNCC1)Nc2ccccc2
CN3C(=O)N(c1ccccc1)C2(CCNCC2)C3=O	ZINC000000016722	O=C2NC(=O)C1(CCNCC1)N2c3ccccc3
COC(=O)C2[C@@H](c1ccc(OC)cc1)NC(=O)N=C2C	ZINC000000041493	O=C2NC(c1ccccc1)CC=N2
Cc3ccc(C)c(N=c1[nH]c(=N)c2ccccc12)c3	ZINC000000126802	N=c2[nH]c(=Nc1ccccc1)c3ccccc23
NC(=N)NC(=N)S[C@@H]2CC(=O)N(c1ccccc1)C2=O	ZINC000000051993	O=C1CCC(=O)N1c2ccccc2
COc3ccc(C[N+]12CCN(CC1)CC2)cc3	ZINC000000387542	C2C[N+]3(Cc1ccccc1)CCN2CC3
CN2CCC([N@@](C)Cc1cc(Br)cs1)CC2	ZINC000000199303	C2CC(NCc1cccs1)CCN2
COc2ccc(NC(=O)[C@@H](CC(O)=O)Cc1ccc(Br)cc1)cc2	ZINC000000662813	O=C(CCc1ccccc1)Nc2ccccc2
C[n+]3cccc(c2n[nH]c(c1ccccc1)n2)c3	ZINC000000173452	c3ccc(c2nc(c1cccnc1)n[nH]2)cc3
CN3CCC(N(C)c1ncnc2ccc(Br)cc12)CC3	ZINC000000099181	C3CC(Nc1ncnc2ccccc12)CCN3
COC(=O)c2ccc(CN(C)c1cc(OC)c(OC)c(OC)c1)cc2	ZINC000000015709	C(Nc1ccccc1)c2ccccc2
NCCc2c[nH]c3ccc(C1CCCCC1)cc23	ZINC000000077296	C3CCC(c2ccc1[nH]ccc1c2)CC3
COc2ccc(CNCc1cc(OC)c(O)c(OC)c1)cc2	ZINC000000172102	C(NCc1ccccc1)c2ccccc2
C[C@@H](c1ccccc1)n2cnc3cc(N)ccc23	ZINC000000056372	C(c1ccccc1)n2cnc3ccccc23
C2CCN(CCc1ccncc1)C2	ZINC000000163336	C2CCN(CCc1ccncc1)C2
CCOC(=O)[C@@H]2CCC[N@@](Cc1cccc(C(F)(F)F)c1)C2	ZINC000000239168	C2CCN(Cc1ccccc1)CC2
CCN(c1ccccc1C)S(=O)(=O)N(C)C	ZINC000000030632	c1ccccc1
C[N+]13CCC(CC1)[C@@](C#N)(N2CCOCC2)C3	ZINC000000178971	C3CN(C1CN2CCC1CC2)CCO3
Cc1ccccc1[N+](=O)Cc2ccncc2	ZINC000000084375	O=[N+](Cc1ccncc1)c2ccccc2
CN3CCN(C(=O)Nc1cccc2ccccc12)CC3	ZINC000000124869	O=C(Nc1cccc2ccccc12)N3CCNCC3
CNC(=O)Cn1cnc2n(C)c(=O)[nH]c(=O)c12	ZINC000000093085	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
COc4ccc([C@@H]1NCCc2c1[nH]c3ccccc23)c(OC)c4	ZINC000000188083	C4Cc1c([nH]c2ccccc12)C(c3ccccc3)N4
CCOC(=O)[C@@H](CN)c1ccccc1	ZINC000000383044	c1ccccc1
COc2cc(C(=O)O[C@@H](C)CN1CCCC1)cc(OC)c2OC	ZINC000000531404	O=C(OCCN1CCCC1)c2ccccc2
Cc3c(OCc1ccccc1)ccc4c(=O)cc(N2CCOCC2)oc34	ZINC000000604176	O=c3cc(N1CCOCC1)oc4cc(OCc2ccccc2)ccc34
Cc2csc3n(C)c1ccccc1[n+]23	ZINC000000005163	c1ccc2c(c1)[nH]c3scc[n+]23
CCC(=O)Nc2nc1ccccc1n2CCN(C)C	ZINC000000186879	c2ccc1[nH]cnc1c2
COc2ccc(CCNS(=O)(=O)c1ccc(C#N)cc1)cc2OC	ZINC000000087370	O=S(=O)(NCCc1ccccc1)c2ccccc2
CC(=C)CSc2nc1n(C)c(=O)n(C)c(=O)c1n2Cc3ccccc3	ZINC000000623302	O=c3[nH]c(=O)c2n(Cc1ccccc1)cnc2[nH]3
NC(=N)NC[C@@H](O)CN1CCCc2ccccc12	ZINC000000309678	C2CNc1ccccc1C2
COc4ccc3[nH]c2c(CCN1C(=O)N([C@@H](C)C(=O)N[C@@H](CCSC)C(O)=O)C(=O)[C@@]12C)c3c4	ZINC000008788768	O=C4NC(=O)N3CCc1c([nH]c2ccccc12)C34
O=C(NC(=S)N[C@@H]1CCSC1=O)c2ccco2	ZINC000000083872	O=C(NC(=S)NC1CCSC1=O)c2ccco2
NC(=N)NC(=N)Nc1cc(Cl)ccc1Cl	ZINC000000089404	c1ccccc1
CN(C)CCn1c(N)nc2ccccc12	ZINC000000186860	c2ccc1[nH]cnc1c2
COc3cc(c2n(C)c1ccccc1[n+]2C)ccc3O	ZINC000000225690	c3ccc(c2nc1ccccc1[nH]2)cc3
C[C@@H](CN1CCCC1)NS(=O)(=O)N(C)CCCN	ZINC000049181470	C1CCNC1
Nc4c(Cl)cc(c3nn(C2CCN(CCc1ccccc1)CC2)c(=O)o3)c5OCCOc45	ZINC000000603773	O=c3oc(c2cccc1OCCOc12)nn3C5CCN(CCc4ccccc4)CC5
CCOC(=O)Cc1c(N)n[nH]c1c2ccccc2	ZINC000000015177	c2ccc(c1ccn[nH]1)cc2
O=c2n(C[C@@H]1CNCCO1)c(=O)c3ccccc23	ZINC000000160590	O=c2n(CC1CNCCO1)c(=O)c3ccccc23
Nc3noc([C@H]1CN2CCC1CC2)n3	ZINC000000003765	C1CN3CCC1C(c2ncno2)C3
CCOc4cc(OCC)cc(C(=O)Nc3cc2nn(c1ccccc1)nc2cc3Cl)c4	ZINC000000623786	O=C(Nc3ccc2nn(c1ccccc1)nc2c3)c4ccccc4
COc3cc(C2=NO[C@@](CC(O)=O)(C(=O)Nc1ccc(C(C)=O)cc1)C2)ccc3OCC(N)=O	ZINC000009130048	O=C(Nc1ccccc1)C3CC(c2ccccc2)=NO3
COC(=O)c3c(OC[C@@H]1CCC[N@@](C)C1)cc(=O)n4CCN(Cc2ccccc2OCC=C)CCc34	ZINC000012099811	O=c4cc(OCC1CCCNC1)cc3CCN(Cc2ccccc2)CCn34
Clc3ccc(c2noc(CSC1=NCCN1)n2)cc3	ZINC000000137811	C3CN=C(SCc2nc(c1ccccc1)no2)N3
CCOc2ccc(N=c1sc(C(C)=O)c(C)n1CCO)cc2	ZINC000000033578	N(c1ccccc1)=c2[nH]ccs2
CCOC(=O)C1=C(C)NC3=C([C@@H]1c2ccc(OC)c(C)c2)C(=O)CC(C)(C)C3	ZINC000000623415	O=C1CCCC3=C1C(c2ccccc2)C=CN3
Cc4ccc(C[N@]1C[C@@H]3C[C@H](C1)c2cccc(=O)n2C3)o4	ZINC000000228725	O=c4cccc3C2CC(CN(Cc1ccco1)C2)Cn34
CSCC[C@H](NS(=O)(=O)c1ccc(C)cc1)C(=O)N2CCC(C(=O)N(C)CC(O)=O)CC2	ZINC000008918270	O=C(CNS(=O)(=O)c1ccccc1)N2CCCCC2
Oc4c([C@@H](CC(=O)c1ccccc1)c2ccccc2)c(=O)n(c3ccccc3)c(=S)n4c5ccccc5	ZINC000000646876	O=C(CC(c1ccccc1)c4cn(c2ccccc2)c(=S)n(c3ccccc3)c4=O)c5ccccc5
Cc2onc(c1ccccc1)c2CN	ZINC000000158500	c2ccc(c1ccon1)cc2
CN2CCN(NC(=O)c1ccc(Cl)c(N(=O)=O)c1)CC2	ZINC000000369132	O=C(NN1CCNCC1)c2ccccc2
CCOC(=O)[C@@](NC(=O)CC)(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)C(F)(F)F	ZINC000003957239	O=S(=O)(Nc1ncccn1)c2ccccc2
CC2(C)C[C@H](O)[C@@H]([C@H](O)c1cccc(N(=O)=O)c1)C(C)(C)N2	ZINC000000205531	C2CNCC(Cc1ccccc1)C2
CN(Cc1ccccc1)Cc3nc2n(C)c(=O)n(C)c(=O)c2n3CCc4ccccc4	ZINC000000622564	O=c4[nH]c(=O)c3n(CCc1ccccc1)c(CNCc2ccccc2)nc3[nH]4
CCC(CC)Sc3nc2cc(N1CCNCC1)c(Cl)cc2[nH]3	ZINC000000003308	C3CN(c2ccc1[nH]cnc1c2)CCN3
CC[C@H](C)[C@H](NC(=O)[C@H](CC(C)C)NC(=O)Cn2c(=O)[nH]c1ccccc1c2=O)C(O)=O	ZINC000012888837	O=c2[nH]c(=O)c1ccccc1[nH]2
CN(C)CC#CC1(O)CCCCC1	ZINC000000123369	C1CCCCC1
CCOC(=O)c1c(C)c(C)sc1NC(=O)COc2cc(C)ccc2C(C)C	ZINC000000622560	O=C(COc1ccccc1)Nc2cccs2
Nc2c1CCNc1nc3ccccc23	ZINC000000015529	C3Cc2cc1ccccc1nc2N3
CN[C@@H](C)Cc2cc1OCOc1cc2O	ZINC000000057352	C2Oc1ccccc1O2
CN(C)CCNC(=O)Cn2cnc1sc(C)c(C)c1c2=O	ZINC000000109567	O=c1[nH]cnc2sccc12
CN4CCN(CCCNC(=O)CCc3c(CCC(=O)NCCCN1CCN(C)CC1)c(=O)c2c(O)cccc2c3=O)CC4	ZINC000027637783	O=C(CCc3c(CCC(=O)NCCCN1CCNCC1)c(=O)c2ccccc2c3=O)NCCCN4CCNCC4
CCOc1ccccc1N3CCN(C2CCN(C)CC2)CC3	ZINC000000279943	C3CC(N2CCN(c1ccccc1)CC2)CCN3
Clc1ccccc1c3nc(c2ccncc2)no3	ZINC000000001947	c3ccc(c2nc(c1ccncc1)no2)cc3
Cn2c([C@@H](O)c1ccccc1)[n+](C)c3ccccc23	ZINC000000231567	C(c1ccccc1)c3nc2ccccc2[nH]3
CN(C)C(=O)[n+]1ccc(N(C)C)cc1C	ZINC000000259951	c1ccncc1
NNC(=S)NCc1cccs1	ZINC000000039523	c1ccsc1
COc2ccc1[nH]cc(CCN)c1c2N(=O)=O	ZINC000000518941	c2ccc1[nH]ccc1c2
ClC1=CC[C@@H]3[C@H](C1)C(=O)N(CCNC2CCCCC2)C3=O	ZINC000000105276	O=C2C1CC=CCC1C(=O)N2CCNC3CCCCC3
CN(C)CCC(=O)c1ccccc1	ZINC000000079582	c1ccccc1
COC(=O)Nc2ccc(S(=O)(=O)Nc1ccc(C)cc1)cc2	ZINC000000041963	O=S(=O)(Nc1ccccc1)c2ccccc2
O=C(NC(=O)c1csnn1)N2CCOCC2	ZINC000000106108	O=C(NC(=O)c1csnn1)N2CCOCC2
OCCN(CCO)C(=O)CSc1nnc3c(n1)[nH]c2ccccc23	ZINC000000050131	c1ccc2c(c1)[nH]c3ncnnc23
Cc3cc(C)[n+]2c(c1ccccc1)csc2n3	ZINC000000041311	c3ccc(c1csc2nccc[n+]12)cc3
C2n1ccccc1=Nc3cccc[n+]23	ZINC000000369641	C2n1ccccc1=Nc3cccc[n+]23
COc4ccc(CCN3C(=O)NC(=O)[C@]2(CN(C)c1ccc(N(=O)=O)cc1C2)C3=O)cc4OC	ZINC000009129960	O=C3NC(=O)C2(CNc1ccccc1C2)C(=O)N3CCc4ccccc4
NC(N)=NN(CCN(N=O)N=C(N)N)N=O	ZINC000004771323	nonring
CN(CC#CCN1CCCC1)C(=O)CCCCN	ZINC000027857713	C1CCNC1
COc2ccc(CNC[C@@]1(O)CCOC(C)(C)C1)cc2	ZINC000000171758	C2CC(CNCc1ccccc1)CCO2
Clc1cccc(Cl)c1Cn3cc(c2ccccc2)c(C=O)n3	ZINC000000032370	C(c1ccccc1)n3cc(c2ccccc2)cn3
CC(C)C[C@@H](NC(=O)C2=C[C@@H](NC(=O)CC1(CC(O)=O)CCCC1)[C@@H](O)[C@H](O)C2)C(N)=O	ZINC000003840065	O=C(CC1CCCC1)NC2CCCC=C2
CC(C)(C)n2c[n+](c1ccccc1)nn2	ZINC000000071140	c2ccc([n+]1c[nH]nn1)cc2
COc3ccc(CC[C@@H]1NCCn2cccc12)cc3OC	ZINC000000214200	C3Cn1cccc1C(CCc2ccccc2)N3
CN(C)CCN(Cc1ccsc1)c2ccccn2	ZINC000000002149	C(Nc1ccccn1)c2ccsc2
Cc1cccc(C)c1Nc3nc2ccccc2[nH]3	ZINC000000003416	N(c1ccccc1)c3nc2ccccc2[nH]3
CN2CCN(C(=O)N1CCOCC1)CC2	ZINC000000152045	O=C(N1CCNCC1)N2CCOCC2
CC(C)c1cccc(C(C)C)c1NC(=O)CCSc3nc2ccccc2o3	ZINC000000578253	O=C(CCSc2nc1ccccc1o2)Nc3ccccc3
C2CC(N1CCOCC1)CCN2	ZINC000000299484	C2CC(N1CCOCC1)CCN2
CN2CCN(c1cc(C)ncn1)CC2	ZINC000000239976	C2CN(c1ccncn1)CCN2
C(Nc2nnc(Cc1ccncc1)c3ccccc23)c4ccccc4	ZINC000000017389	C(Nc2nnc(Cc1ccncc1)c3ccccc23)c4ccccc4
Cc2[nH]c1ccc(F)cc1c2SC3CCNCC3	ZINC000000018495	C3CC(Sc1c[nH]c2ccccc12)CCN3
CCC[C@@H](C)NCc1ccc(Cl)cc1	ZINC000000013372	c1ccccc1
COc3ccc(CNc2nc1ccccc1[nH]2)c(OC)c3	ZINC000000117991	C(Nc2nc1ccccc1[nH]2)c3ccccc3
O=C(CCN1CCNCC1)Nc5ccc4c(=O)c3ccc(NC(=O)CCN2CCNCC2)cc3c(=O)c4c5	ZINC000040936340	O=C(CCN1CCNCC1)Nc5ccc4c(=O)c3ccc(NC(=O)CCN2CCNCC2)cc3c(=O)c4c5
CCC(=O)O[C@@H]3CC[C@H]4[C@@H]2CC[C@H]1CC(=O)C=C[C@]1(C)[C@H]2CC[C@]34C	ZINC000000000947	O=C4CC3CCC2C1CCCC1CCC2C3C=C4
Cc2cc[n+](c1c(C=O)sc(=O)n1C)cc2	ZINC000000077765	O=c2[nH]c([n+]1ccccc1)cs2
C3CN=C(NCCc2ccc1OCOc1c2)N3	ZINC000000017382	C3CN=C(NCCc2ccc1OCOc1c2)N3
CC(C)(C#N)c2cc(Cn1cncn1)cc(C(C)(C)C#N)c2	ZINC000000000941	C(c1ccccc1)n2cncn2
O=C(CN1CCCC1)NCC3(c2ccccc2)CCCC3	ZINC000000209556	O=C(CN1CCCC1)NCC3(c2ccccc2)CCCC3
CN3CCN(C(=O)Cn2ccc1ccccc1c2=O)CC3	ZINC000000211604	O=C(Cn2ccc1ccccc1c2=O)N3CCNCC3
COC(=O)[C@H]2[C@H](C)CC(Nc1cc(C)on1)=CC2=O	ZINC000000021828	O=C2CCCC(Nc1ccon1)=C2
CN4CCN(c3cc(n1nc(C)cc1c2ccccc2)ncn3)CC4	ZINC000000102157	C4CN(c3cc(n1nccc1c2ccccc2)ncn3)CCN4
CCCC2=C[C@@](O)(C(F)(F)F)N(C(=O)c1ccccn1)N2	ZINC000000033393	O=C(N1CC=CN1)c2ccccn2
C[N+]1(CC#C)[C@H]3CC[C@@H]1CC(OC(=O)[C@H](CO)c2ccccc2)C3	ZINC000000519234	O=C(Cc1ccccc1)OC2CC3CCC(C2)N3
CC(=O)CSc1n(C)c(C)c(C)[n+]1C	ZINC000000004816	c1c[nH]cn1
O=C2Cc1ccccc1N2C3CCNCC3	ZINC000000154390	O=C2Cc1ccccc1N2C3CCNCC3
COc3cc2CC[N@](C)C[C@@H](c1ccccc1)c2cc3OC	ZINC000000000800	C3Cc1ccccc1C(c2ccccc2)CN3
C[N@]3CC[C@@H](COC(=O)C(O)(c1ccccc1)c2ccccc2)C3	ZINC000000000806	O=C(OCC1CCNC1)C(c2ccccc2)c3ccccc3
CN(C)CCNC(=O)c3ccc2sc1ccccc1c(=O)[nH]c2c3	ZINC000000216929	O=c2[nH]c1ccccc1sc3ccccc23
CC(C)NCCc1c[nH]c2ccccc12	ZINC000000068848	c2ccc1[nH]ccc1c2
Cc2ccc(S(=O)(=O)NCCn1cnc(N(=O)=O)n1)cc2	ZINC000000033621	O=S(=O)(NCCn1cncn1)c2ccccc2
CCOC(=O)[C@@H](C#N)[C@@]2(Cc1ccccc1)C[C@H](C)[N@@](C)C[C@@H]2C	ZINC000000341244	C2CC(Cc1ccccc1)CCN2
COc3ccc([C@@H]2NC(=O)c1ccccc1O2)cc3OC	ZINC000000033151	O=C2NC(c1ccccc1)Oc3ccccc23
CCN3CCN(c2cc(=O)n(c1ccc(OC)cc1)c(=O)[nH]2)CC3	ZINC000000252560	O=c2cc(N1CCNCC1)[nH]c(=O)n2c3ccccc3
COC(=O)[C@@H](C)Sc2nnc(c1ccncc1)o2	ZINC000000033546	c2cc(c1nnco1)ccn2
C3CN(c2nc(c1ccccc1)ns2)CCN3	ZINC000000117404	C3CN(c2nc(c1ccccc1)ns2)CCN3
CCCN(CCC)C[C@H](C)O	ZINC000000393673	nonring
C3CCC(NCCc1c[nH]c2ccccc12)CC3	ZINC000000068845	C3CCC(NCCc1c[nH]c2ccccc12)CC3
CCC(=O)NC[C@H]1CCc2c(OC)ccc3cccc1c23	ZINC000000023995	C1Cc2cccc3cccc(C1)c23
COc3ccc(c2cc(C#N)nc(N1CCN(C)CC1)n2)cc3	ZINC000000073403	C3CN(c2nccc(c1ccccc1)n2)CCN3
NNc1ncnc2ccsc12	ZINC000000160074	c2ncc1sccc1n2
Cc1cc(N(=O)=O)nn1C(=O)c2ccccc2F	ZINC000000037157	O=C(c1ccccc1)n2cccn2
CC3=C(C(=O)OC[C@@H]1CCCO1)[C@@H](c2ccccc2C)NC(=O)N3	ZINC000000036509	O=C3NC=C(C(=O)OCC1CCCO1)C(c2ccccc2)N3
CCn1c(C)[n+](CC)c2cc(S(N)(=O)=O)ccc12	ZINC000000236035	c2ccc1[nH]cnc1c2
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
CC[C@@H](C)OC(=O)C1=C(C)NC(=O)N[C@@H]1c2ccc(OC)c(O)c2	ZINC000000036500	O=C2NC=CC(c1ccccc1)N2
COc2cc(O)c([C@@H](C)c1cc(OC)c(OC)c(OC)c1)cc2O	ZINC000000044517	C(c1ccccc1)c2ccccc2
COC(=O)[C@H](CCCNC(N)=NN(=O)=O)NC(=O)c3cc(c2nc1cc(N(=O)=O)ccc1[nH]2)ccc3O	ZINC000028712802	c3ccc(c2nc1ccccc1[nH]2)cc3
CC(C)(C)c2ccc(C(=O)C[C@H](NCc1ccccc1)C(O)=O)cc2	ZINC000000049071	O=C(CCNCc1ccccc1)c2ccccc2
NC3CCN(C(=O)Nc2ncc(c1ccccc1)s2)CC3	ZINC000000009310	O=C(Nc2ncc(c1ccccc1)s2)N3CCCCC3
COC(=O)[C@H]1C[N@@](C)CC[C@]1(C)OC(=O)Oc2ccccc2	ZINC000000345614	O=C(OC1CCNCC1)Oc2ccccc2
CS(=O)(=O)c3ccc(c2nnn(CC(=O)NC1CCCC1)n2)cc3	ZINC000000111849	O=C(Cn2nnc(c1ccccc1)n2)NC3CCCC3
CN4CCN(/N=C/c2nc(c1ccccc1)n3ccccc23)CC4	ZINC000000079320	C4CN(N=Cc2nc(c1ccccc1)n3ccccc23)CCN4
NC(=N)NC(=N)Nc2nc(c1ccccc1)cs2	ZINC000000089397	c2ccc(c1cscn1)cc2
C/C=C(\C)CN2CCN(c1ccc(F)cc1)CC2	ZINC000000219618	C2CN(c1ccccc1)CCN2
FC(F)(F)c3ccc(CC(=O)N1CCCC[C@@H]1CN2CCCC2)cc3	ZINC000000596666	O=C(Cc1ccccc1)N2CCCCC2CN3CCCC3
COc2ccc(Cc1c(Cl)nc(SC)nc1NN)cc2	ZINC000000380806	C(c1ccccc1)c2cncnc2
CCN(CC)C[C@@H](O)CN1C(=O)NC(C)(C)C1=O	ZINC000000112249	O=C1CNC(=O)N1
COC(=O)[C@@H]1OC(C)(C)O[C@H]1C(=O)OC	ZINC000000056779	C1COCO1
NC[C@H]5O[C@@H](O[C@@H](CN2CCC(Cc1ccccc1)CC2)[C@@H]4C[C@@H](O)[C@H](n3ccc(=O)[nH]c3=O)O4)[C@H](O)[C@@H]5O	ZINC000028229388	O=c5ccn(C4CCC(C(CN2CCC(Cc1ccccc1)CC2)OC3CCCO3)O4)c(=O)[nH]5
C[N+](C)(CC=C)c1ccccc1O	ZINC000000027451	c1ccccc1
COc3ccc(S(=O)(=O)N1CCc2ccccc12)cc3OC	ZINC000000021732	O=S(=O)(N1CCc2ccccc12)c3ccccc3
COc1ccccc1[C@@]2(CCN)CCOC(C)(C)C2	ZINC000000244179	C2CC(c1ccccc1)CCO2
CN(C)c1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2	ZINC000000001167	O=C(NC(=O)c1ccccc1)Nc2ccccc2
CN(C)CCN2C(=O)C(=O)C(=C(O)c1ccc(S(=O)(=O)N(C)C)cc1)[C@@]24C(=O)N(C)c3ccccc34	ZINC000009110360	O=C4NC2(C(=O)Nc1ccccc12)C(=Cc3ccccc3)C4=O
O=C(NC1CCCCC1)C(/NC(=O)c2ccccc2)=C/c3ccccc3	ZINC000000045167	O=C(NC1CCCCC1)C(NC(=O)c2ccccc2)=Cc3ccccc3
COc2ccc1ccccc1c2CN3CCSCC3	ZINC000000183157	C3CN(Cc1cccc2ccccc12)CCS3
CN(C)Cc1cc(C(C)=O)n2ccccc12	ZINC000000179973	c2ccn1cccc1c2
Fc5ccc(N4CCN(CCCN3c1cccc2cccc(c12)S3(=O)=O)CC4)cc5	ZINC000000597400	O=S3(=O)N(CCCN2CCN(c1ccccc1)CC2)c4cccc5cccc3c45
CN(C)CCNc1c(N)c(=O)oc2ccccc12	ZINC000000272731	O=c2ccc1ccccc1o2
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
Cc1ccc(Cl)cc1N2CCNCC2	ZINC000000066075	C2CN(c1ccccc1)CCN2
Cc2ccc(N1CCNCC1)cc2C	ZINC000000066072	C2CN(c1ccccc1)CCN2
O=C(CN1CC[n+]2c1scc2c3cccs3)c4ccccc4	ZINC000000446922	O=C(CN1CC[n+]2c1scc2c3cccs3)c4ccccc4
C[N+]14CCCC[C@@H]1[C@H](OC(=O)C3(c2ccccc2)CCCC3)CCC4	ZINC000000234102	O=C(OC1CCCN2CCCCC12)C4(c3ccccc3)CCCC4
CNS(=O)(=O)CCc3ccc2[nH]cc(C1CCN(C)CC1)c2c3	ZINC000000004076	C3CC(c1c[nH]c2ccccc12)CCN3
CCOC(=O)c2ccc(NC(=O)COc1ccc(C(C)C)cc1)cc2	ZINC000000048077	O=C(COc1ccccc1)Nc2ccccc2
COc2cc(C[N@]1CCC[C@@H](O)C1)cc3OCOc23	ZINC000000210510	C3CCN(Cc2ccc1OCOc1c2)CC3
C[C@@H]2CCC[N@@](CCC(=O)Nc1ccccc1)C2	ZINC000000176341	O=C(CCN1CCCCC1)Nc2ccccc2
OC[C@@H]2CCC[N@@](Cc1cccs1)C2	ZINC000000211025	C2CCN(Cc1cccs1)CC2
NC(=O)Oc2ccc(Cc1ccccc1)cc2	ZINC000000001314	C(c1ccccc1)c2ccccc2
COc4ccc3n(CC1CC1)c(=O)nc(c2ccccc2)c3c4	ZINC000000000154	O=c3nc(c1ccccc1)c2ccccc2n3CC4CC4
COc3cccc2CC[C@H](NC(=O)C1CC1)Cc23	ZINC000000014122	O=C(NC2CCc1ccccc1C2)C3CC3
O=C(CNC(=O)C1CCNCC1)Nc5ccc4c(=O)c3cc(NC(=O)CNC(=O)C2CCNCC2)ccc3c(=O)c4c5	ZINC000653721354	O=C(CNC(=O)C1CCNCC1)Nc5ccc4c(=O)c3cc(NC(=O)CNC(=O)C2CCNCC2)ccc3c(=O)c4c5
NC(=O)c2ccc(n1c(=O)ccc1=O)cc2	ZINC000000051176	O=c1ccc(=O)n1c2ccccc2
O=C(N2CCC(Cc1ccccc1)CC2)c3cccnc3	ZINC000000029581	O=C(N2CCC(Cc1ccccc1)CC2)c3cccnc3
COC(=O)CNC(=O)COC(=O)c3cccc(NS(=O)(=O)c2ccc1OCCCOc1c2)c3	ZINC000003420158	O=S(=O)(Nc1ccccc1)c3ccc2OCCCOc2c3
C[n+]3cccc([C@H]1C(C#N)=C(N)Oc2cc(O)ccc12)c3	ZINC000000500498	O2C=CC(c1cccnc1)c3ccccc23
Cc1nc(N(=O)=O)cn1CC(=O)NCc2ccccc2	ZINC000000088446	O=C(Cn1ccnc1)NCc2ccccc2
NC[C@@H](c1ccccc1)c3ccc2OCCOc2c3	ZINC000000085167	C3COc2cc(Cc1ccccc1)ccc2O3
NC2=N[C@@H]1CCCC[C@@H]1CS2	ZINC000000021201	C2CCC1N=CSCC1C2
C(NCc1ccco1)c2ccccn2	ZINC000000185755	C(NCc1ccco1)c2ccccn2
CN(C)CCCn2cnc3c(=O)oc1ccccc1c23	ZINC000000302249	O=c2oc1ccccc1c3[nH]cnc23
Nc2cc(N)nc(SCC(=O)Nc1ccccn1)n2	ZINC000000468973	O=C(CSc1ncccn1)Nc2ccccn2
CN(C)C(=O)C(=Cc2ccc(c1ccc(C(C)=O)cc1)o2)C#N	ZINC000000037491	c2ccc(c1ccco1)cc2
C[C@H]2CCc3c(N1CCC(OC(=O)[C@@H](N)CCCNC(N)=NN(=O)=O)CC1)c(F)cc4c(=O)c(C(O)=O)cn2c34	ZINC000028466928	O=c2ccn4CCCc3c(N1CCCCC1)ccc2c34
FC(F)(F)C(=O)Nc1ccccc1c4nn(CN2CCNCC2)c(=S)n(CN3CCNCC3)c4=O	ZINC000019365209	O=c3c(c1ccccc1)nn(CN2CCNCC2)c(=S)n3CN4CCNCC4
O=c2n(CCN1CCCCC1)c(=O)c3ccccc23	ZINC000000271606	O=c2n(CCN1CCCCC1)c(=O)c3ccccc23
Cc2cc(C)[n+]1c(C)csc1n2	ZINC000000247196	c2cnc1scc[n+]1c2
COC(=O)N(C)c1ccccc1C(=O)N2CCOCC2	ZINC000000045744	O=C(N1CCOCC1)c2ccccc2
O[C@@H]3N=C(c1ccccc1)c2cc(Cl)ccc2NC3=O	ZINC000000000575	O=C3CN=C(c1ccccc1)c2ccccc2N3
C[N+]4(C[C@H]3CO[C@](C1CCCCC1)(c2ccccc2)O3)CCCCC4	ZINC000000000572	C4CCC(C3(c1ccccc1)OCC(CN2CCCCC2)O3)CC4
C[C@@H]2CCC[N@@](CCS(=O)(=O)c1ccccc1)C2	ZINC000000165089	O=S(=O)(CCN1CCCCC1)c2ccccc2
CC(C)NC[C@H]2CCc1cc(CO)c(N(=O)=O)cc1N2	ZINC000000000570	C2CNc1ccccc1C2
CN(C)CCNC(=O)c2ccc1nc(C)c(C)nc1c2	ZINC000000217453	c2ccc1nccnc1c2
C[N+](C)(C)CCOc2ccc1nc(N)sc1c2	ZINC000000216108	c2ccc1scnc1c2
CC2(C)CC(NCc1ccco1)CC(C)(C)N2	ZINC000000091494	C2CC(NCc1ccco1)CCN2
COc1ccccc1[C@@H](CCN)c2ccco2	ZINC000000141560	C(c1ccccc1)c2ccco2
CCOC(=O)c1cnc(SC)nc1Nc2cc(C(C)(C)C)nn2C	ZINC000000383913	N(c1ccncn1)c2ccn[nH]2
C[N+](C)(C)/C=C/C(=O)c1ccccc1	ZINC000000157963	c1ccccc1
CC(=O)Oc2ccc(C(=O)NC1CCCC1)cc2	ZINC000000030052	O=C(NC1CCCC1)c2ccccc2
CCN3CCN(c2ccc(NC(=O)c1cccnc1Cl)cc2)CC3	ZINC000000342347	O=C(Nc2ccc(N1CCNCC1)cc2)c3cccnc3
O[C@@H](COc3ccc(OC[C@H](O)CN2CCN(C1CCCCC1)CC2)cc3)CN5CCN(C4CCCCC4)CC5	ZINC000022465614	C5CCC(N4CCN(CCCOc3ccc(OCCCN2CCN(C1CCCCC1)CC2)cc3)CC4)CC5
CCOc4ccc([C@]2(O)CN1CCCCCC1=[N+]2c3ccccc3)cc4	ZINC000000627253	C4CCN3CC(c1ccccc1)[N+](c2ccccc2)=C3CC4
COC(=O)c2cc(Br)c(=O)n(CCN1CCCCC1)c2	ZINC000000536063	O=c1ccccn1CCN2CCCCC2
COc3cc(NC(=O)c2cccc(NC1=NCCCN1)c2)ccc3CCC(O)=O	ZINC000000578047	O=C(Nc1ccccc1)c3cccc(NC2=NCCCN2)c3
NC(=O)c3c(NC(=O)CN1CCCC1)sc2CCCCc23	ZINC000000081399	O=C(CN1CCCC1)Nc3cc2CCCCc2s3
O[C@@](C1=NCCN1)(c2ccc(Cl)cc2)c3ccccn3	ZINC000000000201	C3CN=C(C(c1ccccc1)c2ccccn2)N3
Clc2ccc(C(=O)CSC1=NCCN1)cc2	ZINC000000374911	O=C(CSC1=NCCN1)c2ccccc2
O[C@@H](COc1c(F)cc(Br)cc1F)CN2CCCC2	ZINC000000230599	C2CCN(CCCOc1ccccc1)C2
CC(C)(C)NC(=O)CSc1nc(N)cc(N)n1	ZINC000000417740	c1cncnc1
CCC(=O)Nc1sc(C(=O)OC)c(C)c1C(=O)OC	ZINC000000040736	c1ccsc1
Nc4nccc(c2c(c1ccc(F)cc1)ncn2C3CCNCC3)n4	ZINC000000007258	C4CC(n2cnc(c1ccccc1)c2c3ccncn3)CCN4
C4COc3cc(/N=C/c2ccc(OCc1ccccc1)cc2)ccc3O4	ZINC000000062195	C4COc3cc(N=Cc2ccc(OCc1ccccc1)cc2)ccc3O4
CCc1ccccc1N(CC(=O)NC[C@@H]2CCCO2)S(C)(=O)=O	ZINC000000037701	O=C(CNc1ccccc1)NCC2CCCO2
CN4CCC(N(C)c2nc(c1ccccc1)nc3ccccc23)CC4	ZINC000000132601	C4CC(Nc2nc(c1ccccc1)nc3ccccc23)CCN4
CC[C@H](C(=O)NCc1ccccn1)c2ccccc2	ZINC000000030434	O=C(Cc1ccccc1)NCc2ccccn2
CN2CCN(c1nc(N)c(C#N)c(CC#N)c1C#N)CC2	ZINC000000142726	C2CN(c1ccccn1)CCN2
CCOC(=O)C1=C(C)NC(CN(C)C)=C(C(=O)OCC)[C@H]1c2ccccc2C=CC(=O)OC(C)(C)C	ZINC000000599089	N2C=CC(c1ccccc1)C=C2
N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](Cc1ccccc1)C(N)=O	ZINC000002554967	c1ccccc1
CCCN2CCC(N1CCN(S(C)(=O)=O)CC1)CC2	ZINC000000268253	C2CC(N1CCNCC1)CCN2
CCCc3cc(C(=O)Cc2nc1ccccc1s2)c(O)cc3O	ZINC000000044344	O=C(Cc2nc1ccccc1s2)c3ccccc3
CN4CCN(c1ncnc3c1sc2nc(C)cc(C)c23)CC4	ZINC000000159160	C4CN(c2ncnc3c1cccnc1sc23)CCN4
COc1cc(CN)cc(OC)c1	ZINC000000389606	c1ccccc1
CCOc2ccc(S(=O)(=O)N(CC(=O)NC)c1ccccc1)cc2	ZINC000000080516	O=S(=O)(Nc1ccccc1)c2ccccc2
CC[C@@H](Sc1nc(C)cc(C)n1)C(=O)Nc2nnc(C)s2	ZINC000000052216	O=C(CSc1ncccn1)Nc2nncs2
OC2CCN(Cc1ccccc1F)CC2	ZINC000000238374	C2CCN(Cc1ccccc1)CC2
Cn3nc(O[C@@H]2c1cc(C#N)ccc1OC(C)(C)[C@@]2(C)O)ccc3=O	ZINC000000012426	O=c3ccc(OC1CCOc2ccccc12)n[nH]3
COc2ccc1ccccc1c2C[N@]3CCC[C@@H]3CO	ZINC000000212733	C3CCN(Cc1cccc2ccccc12)C3
O=C1NCc4c1cc3ccc2OCOc2c3c4c6ccc5OCOc5c6	ZINC000000007322	O=C1NCc4c1cc3ccc2OCOc2c3c4c6ccc5OCOc5c6
C[N+]4(Cc1cc(=O)[nH]c(=O)[nH]1)CCc3[nH]c2ccccc2c3C4	ZINC000000488961	O=c4cc(CN3CCc2[nH]c1ccccc1c2C3)[nH]c(=O)[nH]4
CN3CCN(C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCc1ccccc1)C=CS(=O)(=O)c2ccccc2)CC3	ZINC000006812386	O=C(CNC(=O)N1CCNCC1)NC(CCc2ccccc2)C=CS(=O)(=O)c3ccccc3
O=C(CCCC[C@@H]2SC[C@@H]1NC(=O)N[C@@H]12)NCCCn4cc(CN3CCCNCCNCCCNCC3)nn4	ZINC000653919129	O=C(CCCCC2SCC1NC(=O)NC12)NCCCn4cc(CN3CCCNCCNCCCNCC3)nn4
NCCc1c[nH]c2ccccc12	ZINC000000120144	c2ccc1[nH]ccc1c2
COc4ccc(Sc3cccc(CN(C)c1cc(C(O)=O)nc2cc(Cl)cc(Cl)c12)c3)cc4	ZINC000000702199	C(Nc1ccnc2ccccc12)c4cccc(Sc3ccccc3)c4
NC(=O)[C@H]1CCCN1C(=O)c4ccc[n+](CCCCCC[n+]3cccc(C(=O)N2CCC[C@H]2C(N)=O)c3)c4	ZINC000017141953	O=C(N1CCCC1)c4ccc[n+](CCCCCC[n+]3cccc(C(=O)N2CCCC2)c3)c4
FC(F)Oc2ccc(C[N+](=O)c1ccccc1)cc2	ZINC000000084388	O=[N+](Cc1ccccc1)c2ccccc2
COc3ccc(N2C(=O)C[C@H](NC[C@@H]1CCCO1)C2=O)cc3	ZINC000000084384	O=C2CC(NCC1CCCO1)C(=O)N2c3ccccc3
Fc3ccc(Sc2c(F)c(F)nc(N1CCNCC1)c2F)cc3	ZINC000000034600	C3CN(c2cc(Sc1ccccc1)ccn2)CCN3
CCn2c[n+](C[C@@H](O)COc1ccc(F)cc1)c3cc(C)c(C)cc23	ZINC000000268775	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
CC[C@@H]2CSC(Nc1c(C)cccc1C)=N2	ZINC000000071831	C2CN=C(Nc1ccccc1)S2
COc1cc(CCN)ccc1O	ZINC000000119675	c1ccccc1
CCOc2cc(CN)c(n1cccc1)cc2OCC	ZINC000000056345	c2ccc(n1cccc1)cc2
NCCc2cccc3n(S(=O)(=O)c1ccccc1)ccc23	ZINC000000008954	O=S(=O)(c1ccccc1)n2ccc3ccccc23
CCn2c(=S)sc3c(=O)[nH]c(SCC(=O)NCCc1ccc(S(N)(=O)=O)cc1)nc23	ZINC000017113108	O=C(CSc2nc1[nH]c(=S)sc1c(=O)[nH]2)NCCc3ccccc3
CC(C)(C)[C@H](N)Cn1ccnc1	ZINC000000111472	c1c[nH]cn1
CS(=O)(=O)c1cc(F)ccc1N2CCNCC2	ZINC000000154145	C2CN(c1ccccc1)CCN2
COc2ccc1c(C)c(CCC(=O)N[C@@H](CCCNC(N)=O)C(=O)NCC(O)=O)c(=O)oc1c2C	ZINC000008790482	O=c2ccc1ccccc1o2
COc4ccc(NC(=O)C3(C)c1ccccc1c2ccccc23)cc4	ZINC000000036746	O=C(Nc1ccccc1)C3c2ccccc2c4ccccc34
Cc1[nH]c(=O)[nH]c(=O)c1S(=O)(=O)NC2CC2	ZINC000000093092	O=c2[nH]cc(S(=O)(=O)NC1CC1)c(=O)[nH]2
CC2(C)CC(=O)C(=NNc1cccc(OC(F)F)c1)C(=O)C2	ZINC000000041951	O=C1CCCC(=O)C1=NNc2ccccc2
COC(=O)c2cccc(NS(=O)(=O)c1ccc(OC)c(C)c1)c2C	ZINC000000563039	O=S(=O)(Nc1ccccc1)c2ccccc2
C[C@H](N)C(=O)NCCC(=O)Nc3ccc2c(=O)c1cc(NC(=O)CCNC(=O)[C@H](C)N)ccc1c(=O)c2c3	ZINC000040860984	O=c2c1ccccc1c(=O)c3ccccc23
CN(c1ccccc1)c3nc(Nc2ccccc2C)nc4sccc34	ZINC000000013384	N(c1ccccc1)c4nc(Nc2ccccc2)c3ccsc3n4
COc3cc(Cc1nccc2cc(OC)c(OC)cc12)c(C(C)=O)cc3OC	ZINC000000604168	C(c1ccccc1)c2nccc3ccccc23
NNc1nc(N)c3c(n1)c2ccccc2CC34CCCC4	ZINC000000078979	C1CCC4(C1)Cc2ccccc2c3ncncc34
CC[C@@H](CO)Nc3nc(NCc1ccccc1)c2ncn(C(C)C)c2n3	ZINC000000602192	C(Nc1ncnc2[nH]cnc12)c3ccccc3
COC(=O)[C@H](Cc1ccccc1)N[P@](O)(=O)OC[C@@H]3O[C@@H](n2cc(I)c(=O)[nH]c2=O)C[C@H]3O	ZINC000006006168	O=P(NCCc1ccccc1)OCC3CCC(n2ccc(=O)[nH]c2=O)O3
CC(C)CNS(=O)(=O)c1cccc2cc(N)ccc12	ZINC000000032962	c2ccc1ccccc1c2
CCC[C@@H](N)C(=O)N1CCN(CC)CC1	ZINC000000252398	C1CNCCN1
COC(=O)[C@H]2[C@@H]4O[C@@]3(CN(Cc1ccco1)C(=O)[C@H]23)C=C4	ZINC000000203700	O=C2C1CC4OC1(CN2Cc3ccco3)C=C4
OCn3nc(Nc1ccccc1)n(c2ccccc2)c3=S	ZINC000000003575	S=c2[nH]nc(Nc1ccccc1)n2c3ccccc3
O=c2[nH]cc(N1CCCCC1)c(=O)[nH]2	ZINC000000186834	O=c2[nH]cc(N1CCCCC1)c(=O)[nH]2
COc2c(c1ccccc1)sc3nc(C)cc(C)[n+]23	ZINC000000128007	c3ccc(c2c[n+]1cccnc1s2)cc3
CC(C)(C)c1cc(CN(CCO)CCO)c(O)c(C(C)(C)C)c1	ZINC000000192157	c1ccccc1
C[C@@H]1[C@H](C)C(=O)CC[N@]1CCc2ccccc2	ZINC000000039082	O=C2CCN(CCc1ccccc1)CC2
COC[C@@H](C)NCc1ccc(Br)cc1	ZINC000000228089	c1ccccc1
Cc2cc(NCc1cccnc1)nc(N)n2	ZINC000000073355	C(Nc1ccncn1)c2cccnc2
Fc3ccc(S(=O)(=O)NCc2ccc1OCOc1c2)cc3	ZINC000000041266	O=S(=O)(NCc2ccc1OCOc1c2)c3ccccc3
O=C(N1CCOCC1)c3ccc(C(=O)c2ccccc2)o3	ZINC000000034276	O=C(N1CCOCC1)c3ccc(C(=O)c2ccccc2)o3
NNC(=S)N[C@H]1C[C@H]2C[C@@H]1C=C2	ZINC000000110011	C1CC2CC1C=C2
CCOC(=O)c2[nH]c1ccccc1c2NC(=O)CN(C)C	ZINC000000492531	c2ccc1[nH]ccc1c2
C[N@]3CCC[C@@H](OC(=O)C(c1ccccc1)c2ccccc2)C3	ZINC000000250438	O=C(OC1CCCNC1)C(c2ccccc2)c3ccccc3
CC(=O)N3CCC(N[C@@H]1CCCc2ccccc12)CC3	ZINC000000214172	C3CC(NC1CCNCC1)c2ccccc2C3
Clc3ccc(c2ccc(c1ncc[nH]1)o2)cc3	ZINC000000003793	c3ccc(c2ccc(c1ncc[nH]1)o2)cc3
CC(C)(C)CC[n+]1ccc(C(N)=O)cc1	ZINC000000254726	c1ccncc1
O[C@@H](CN2CCC([C@H](O)c1ccccc1)CC2)c3ccc(F)cc3	ZINC000000010549	C2CN(CCc1ccccc1)CCC2Cc3ccccc3
COC(=O)CC[C@]1(C)C[N@@](C)[C@H](C)CC1=O	ZINC000000208145	O=C1CCNCC1
CSc1nnc(SC)n1NC(=N)c2cccc(C(F)(F)F)c2	ZINC000000119925	N=C(Nn1cnnc1)c2ccccc2
C[C@@H](OC(=O)c1cccc(Cl)c1)c2ccc[n+](C)c2	ZINC000000136719	O=C(OCc1cccnc1)c2ccccc2
COc2ccc(N(CC(=O)Nc1cc(Cl)ccc1C)S(C)(=O)=O)cc2OC	ZINC000000622136	O=C(CNc1ccccc1)Nc2ccccc2
CCCN(c1ccncc1)n2cccn2	ZINC000000010546	N(c1ccncc1)n2cccn2
CCCN(c1ccncc1)n2ncc3ccccc23	ZINC000000010544	N(c1ccncc1)n2ncc3ccccc23
CCN(CC)Cc1c(O)c(CC)cc2c(C)cc(=O)oc12	ZINC000000137921	O=c2ccc1ccccc1o2
COC(=O)c4ccc(C[n+]3cc(c1ccccc1)n2CCCc23)cc4	ZINC000000408972	C1Cc3n(C1)c(c2ccccc2)c[n+]3Cc4ccccc4
CCCCCCCCn2c(=O)c(C(=O)Nc1ccccc1F)c(O)c3ccccc23	ZINC000002291827	O=C(Nc1ccccc1)c3cc2ccccc2[nH]c3=O
C[C@H]1C[N@@](C)CC[C@]1(O)c2ccccc2	ZINC000000236345	C2CC(c1ccccc1)CCN2
C[C@@H]([C@@H](O)c1ccccc1)[N+](C)(C)Cc2ccccc2	ZINC000000156772	C(Cc1ccccc1)NCc2ccccc2
Fc4ccc(c1cn3c(n1)sc2ccccc23)cc4	ZINC000000023691	c4ccc(c1cn3c(n1)sc2ccccc23)cc4
COc2ccc(CNC(=O)CN(c1ccc(OC)c(Cl)c1)S(C)(=O)=O)cc2	ZINC000000622227	O=C(CNc1ccccc1)NCc2ccccc2
Cc3ccc([C@@H]1SCC(=O)N1CCN2CCCCC2)cc3	ZINC000000072762	O=C2CSC(c1ccccc1)N2CCN3CCCCC3
O[C@H](Cn1c(=O)sc2ccccc12)C[n+]3ccccc3	ZINC000000405483	O=c2sc1ccccc1n2CCC[n+]3ccccc3
CC(C)[C@@H](NC(=O)Cn2c(c1ccccc1)ncc(N)c2=O)C(=O)c3nnc(C(C)(C)C)o3	ZINC000000602904	O=C(Cn2c(c1ccccc1)nccc2=O)NCC(=O)c3nnco3
Oc1ccccc1CN3CCC(C(=O)NC[C@@H]2CCCO2)CC3	ZINC000000317485	O=C(NCC1CCCO1)C3CCN(Cc2ccccc2)CC3
COc2cc(OC)nc(Oc1ccc(NC(C)=O)cc1)n2	ZINC000000041464	O(c1ccccc1)c2ncccn2
Cc2cc(N1CC[C@@H](N)C1)cnc2Cl	ZINC000000026491	C2CCN(c1cccnc1)C2
COc1ccccc1NC(=O)CSc3nnc(c2ccc(Br)cc2)n3c4ccccc4	ZINC000000623022	O=C(CSc2nnc(c1ccccc1)n2c3ccccc3)Nc4ccccc4
CN(C)C(=O)On1ccc(=[N+](C)C)cc1	ZINC000000259947	N=c1cc[nH]cc1
COc2cc(C(=O)NCc1ccc(C)nc1N)cc(OC)c2OC	ZINC000000002225	O=C(NCc1cccnc1)c2ccccc2
N=C1NCCN1c2ccccc2	ZINC000000139150	N=C1NCCN1c2ccccc2
C[C@@H]2C(c1ccccc1)[N+](=O)C(C)(C)N2O	ZINC000000201551	O=[N+]1CNCC1c2ccccc2
Oc2cc(Cc1ccccc1)cnc2CN3CCCCC3	ZINC000000186208	C3CCN(Cc2ccc(Cc1ccccc1)cn2)CC3
Cn2cnc1ccc(N(=O)=O)cc1c2=O	ZINC000000032144	O=c1[nH]cnc2ccccc12
Cc3nnc(SCc2nnc(c1ccccc1)o2)s3	ZINC000000032143	C(Sc1nncs1)c3nnc(c2ccccc2)o3
C2CN=C(NCC1CC1)S2	ZINC000000100821	C2CN=C(NCC1CC1)S2
CON[C@@H]1CCCC[C@@H]1NOC	ZINC000000086522	C1CCCCC1
CC2(C)C[C@@](CCN)(c1ccc(F)cc1)CCO2	ZINC000000206875	C2CC(c1ccccc1)CCO2
CN(C)Cc1c(O)ccc2[nH]c(C)nc12	ZINC000000229665	c2ccc1[nH]cnc1c2
CCOC(=O)c4c(NC(=O)COc1ccc(Cl)cc1)sc3N2CCC(CC2)c34	ZINC000000622046	O=C(COc1ccccc1)Nc4cc3C2CCN(CC2)c3s4
O=C2C[C@@H](Cc1ccccc1)C(=O)N2C[C@@H]3CCCO3	ZINC000000033701	O=C2CC(Cc1ccccc1)C(=O)N2CC3CCCO3
OC3CN(C(c1ccccc1)c2ccccc2)C3	ZINC000000133425	C3CN(C(c1ccccc1)c2ccccc2)C3
Cc2[nH]c1ccccc1c2CCNC(=O)c3cc(F)c(F)cc3Cl	ZINC000000032812	O=C(NCCc1c[nH]c2ccccc12)c3ccccc3
Cc2[nH]c1ccc(N(=O)=O)cc1c2CCN	ZINC000000032541	c2ccc1[nH]ccc1c2
C4CCCN(c2nn1nnnc1c3ccccc23)CC4	ZINC000000032546	C4CCCN(c2nn1nnnc1c3ccccc23)CC4
Cn2c(=O)[nH]c3cc1nn[nH]c1cc23	ZINC000000002428	O=c3[nH]c2cc1nn[nH]c1cc2[nH]3
CN(C)CCNC(=O)CN1C(=O)CSc2ccccc12	ZINC000000218715	O=C2CSc1ccccc1N2
CN(C)CCn1c(C)cc(=S)cc1C	ZINC000000073566	S=c1cc[nH]cc1
CCN3CCN(C(=O)C2CCN(C[C@@H](C)c1ccccc1)CC2)CC3	ZINC000000299497	O=C(C2CCN(CCc1ccccc1)CC2)N3CCNCC3
CN3CCC([N@@](C)Cc1cccc2ccccc12)CC3	ZINC000000236337	C3CC(NCc1cccc2ccccc12)CCN3
NCCc2c[nH]c3ccc(OCc1ccccc1)cc23	ZINC000000057128	C(Oc2ccc1[nH]ccc1c2)c3ccccc3
Cc2nc(N1CCNCC1)nc3CCCCc23	ZINC000000010493	C3CCc2nc(N1CCNCC1)ncc2C3
CN2CCC(OC(=O)Nc1ccc(Cl)cc1)CC2	ZINC000000005501	O=C(Nc1ccccc1)OC2CCNCC2
Cc3cc(NS(=O)(=O)c2ccc(NC(=O)COc1ccc(C)c(C)c1)cc2)nc(C)n3	ZINC000000710185	O=C(COc1ccccc1)Nc3ccc(S(=O)(=O)Nc2ccncn2)cc3
CCN(CC)CCn3c1ccccc1n4cc(c2ccc(C)cc2)nc34	ZINC000000017119	c4ccc(c1cn3c(n1)[nH]c2ccccc23)cc4
NCCCC[C@@H](NS(=O)(=O)Cc1ccccc1)C(=O)N2CCC[C@H]2C(=O)NCc3ccc(C(N)=N)cc3	ZINC000072179813	O=C(CNS(=O)(=O)Cc1ccccc1)N2CCCC2C(=O)NCc3ccccc3
C[C@H](N2C(=O)c1ccccc1[C@]2(O)Cc3ccccc3)c4ccccc4	ZINC000000036286	O=C3N(Cc1ccccc1)C(Cc2ccccc2)c4ccccc34
CC(C)(C)NC(=O)C2CCN(Cc1ccccc1Cl)CC2	ZINC000000299305	C2CCN(Cc1ccccc1)CC2
Nc1nnnn1Cc3nc2ccccc2[nH]3	ZINC000000052017	C(c2nc1ccccc1[nH]2)n3cnnn3
C[n+]1cc(C(N)=O)ccc1\C=N\O	ZINC000000174403	c1ccncc1
Cc2nc1CCCCn1c(=O)c2CCN5CCC(c3noc4cc(F)ccc34)CC5	ZINC000000538312	O=c5c(CCN3CCC(c1noc2ccccc12)CC3)cnc4CCCCn45
NC(=O)C2CCN(Cc1cccc(Br)c1)CC2	ZINC000000277480	C2CCN(Cc1ccccc1)CC2
CCOC(=O)c4cnc(n3[nH]c(C)c(CCCn2c(=O)c1ccccc1c2=O)c3=O)[nH]c4=O	ZINC000012860331	O=c4ccnc(n3[nH]cc(CCCn2c(=O)c1ccccc1c2=O)c3=O)[nH]4
O=C(CN2N=C(c1ccccc1)CCC2=O)NCCN3CCCC3	ZINC000000219594	O=C(CN2N=C(c1ccccc1)CCC2=O)NCCN3CCCC3
CN(C)c3nc2ccc(OCCN1CCCCC1)cc2s3	ZINC000000275257	C3CCN(CCOc2ccc1ncsc1c2)CC3
CN(/N=C/c1ccc(C)o1)C2=NCCN2	ZINC000000255709	C2CN=C(NN=Cc1ccco1)N2
Clc2cc1NC(=O)Cc1cc2CCN5CCN(c3nsc4ccccc34)CC5	ZINC000000538550	O=C5Cc4cc(CCN3CCN(c1nsc2ccccc12)CC3)ccc4N5
CCCN(CCC)CCc1cccc2NC(=O)Cc12	ZINC000000002041	O=C2Cc1ccccc1N2
CCN1[C@H]2[C@@H](N(C)C1=O)N(CC)C(=O)N2C	ZINC000000073410	O=C2NC1NC(=O)NC1N2
Fc4ccc(C(=O)C3CCN(CCCn1c(=O)[nH]c2cc(Cl)ccc12)CC3)cc4	ZINC000000538006	O=C(C3CCN(CCCn1c(=O)[nH]c2ccccc12)CC3)c4ccccc4
CN3C(=O)CC2(CCN(CCCC(=O)c1ccc(F)cc1)CC2)C3=O	ZINC000000002045	O=C3CC2(CCN(CCCC(=O)c1ccccc1)CC2)C(=O)N3
CCOC(=O)Cc2csc(NC(=O)COc1c(C)cccc1C)n2	ZINC000000118047	O=C(COc1ccccc1)Nc2nccs2
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
C[N+](C)(C)Cc1ncccc1O	ZINC000000159649	c1ccncc1
CN(C)c2cc(n1nc(C)cc1C)nc(C)n2	ZINC000000209631	c2cnn(c1ccncn1)c2
OC(=O)[C@H]2CN[C@H](c1cccc(O)c1O)S2	ZINC000000053000	C2CSC(c1ccccc1)N2
COc2ccc(\C=N\[C@@H]1C[C@H](C)[N@@](C)C[C@@H]1C)cc2	ZINC000000244225	C2CC(N=Cc1ccccc1)CCN2
CN(C)CCN(C)n2cc(c1ccccc1)c3ccccc23	ZINC000000001032	c3ccc(c1c[nH]c2ccccc12)cc3
CN(C)CCSC(=O)N2c1ccccc1C(C)(C)c3ccccc23	ZINC000000001038	C2c1ccccc1Nc3ccccc23
CN2CCN(c1ncc(C#N)c(N)n1)CC2	ZINC000000159647	C2CN(c1ncccn1)CCN2
CC(C)Oc1ccccc1NC(=O)c3ccc(Oc2ccccc2)cc3	ZINC000000036044	O=C(Nc1ccccc1)c3ccc(Oc2ccccc2)cc3
CCOC(=O)Cc2cn1CCN=c1s2	ZINC000000039893	C2Cn1ccsc1=N2
CN4CCN(CCNCc2cn(c1ccc(F)cc1F)nc2c3ccc(S(=O)(=O)N(C)C)cc3)CC4	ZINC000096938556	C4CN(CCNCc2cn(c1ccccc1)nc2c3ccccc3)CCN4
CC(C)N(CCNS(=O)(=O)[C@@H]1CCCNC1)C(C)C	ZINC000019486680	C1CCNCC1
CCOC(CSc1nnc3c(n1)n(CC)c2ccccc23)OCC	ZINC000000078614	c1ccc2c(c1)[nH]c3ncnnc23
CC(=O)O[C@@H]1CN2CCC1CC2	ZINC000000492792	C1CN2CCC1CC2
CCN(CC)c2ccc(\C=N\N1CCOCC1)cc2	ZINC000000282514	C2CN(N=Cc1ccccc1)CCO2
CCOc3ccc(C(=O)OC1C[C@@H]2CC[C@H](C1)[N@]2C)cc3	ZINC000000174810	O=C(OC1CC2CCC(C1)N2)c3ccccc3
COc2ccc1c(CC[N+]1(C)C)c2	ZINC000000021691	C2Cc1ccccc1N2
O[C@H]2CO[C@H](Oc1ccccc1)[C@@H](O)[C@@H]2O	ZINC000000484599	C2CCC(Oc1ccccc1)OC2
Oc1ccc(Cl)cc1[C@]3(O)C(=O)Nc2c(C(F)(F)F)cccc23	ZINC000000021695	O=C2Nc1ccccc1C2c3ccccc3
CCOc4ccc(c2c(C)n1CCCc1[n+]2c3ccccc3)cc4	ZINC000000390680	C1Cc3n(C1)cc(c2ccccc2)[n+]3c4ccccc4
CN(C)C(=O)N2CCC(C(=O)NCCN1CCCC1)CC2	ZINC000000262335	O=C(NCCN1CCCC1)C2CCNCC2
C[N@]4CCC[C@H](C(=O)n2c1ccccc1[nH]c(=O)c3cccnc23)C4	ZINC000000004265	O=C(C1CCCNC1)n3c2ccccc2[nH]c(=O)c4cccnc34
CC2(C)CC(NC(=O)c1ccco1)CC(C)(C)N2	ZINC000000054270	O=C(NC1CCNCC1)c2ccco2
Cn3c(=O)n(C)c2ncn(CC(=N)N1CCCCC1)c2c3=O	ZINC000000054272	N=C(Cn1cnc2[nH]c(=O)[nH]c(=O)c12)N3CCCCC3
CC(C)NC(=N)CCn1cnc2n(C)c(=O)n(C)c(=O)c12	ZINC000000054273	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
CCOc2ccc(N(CC(=O)Nc1ccc(Br)c(C)c1)S(C)(=O)=O)cc2	ZINC000000621941	O=C(CNc1ccccc1)Nc2ccccc2
CC[N@]1CCC[C@@H]1CNC(=O)c2n[nH]c(=O)c3ccccc23	ZINC000000211527	O=C(NCC1CCCN1)c2n[nH]c(=O)c3ccccc23
Cc1ccccc1NC2=NC(C)(C)NC(=N)N2	ZINC000000203665	N=C2NCN=C(Nc1ccccc1)N2
COCC[N@@](C)CCNC(=O)C1(CN)CCOCC1	ZINC000061379865	C1CCOCC1
COc2ccc(CN[C@@H](CC(=O)c1ccc(F)cc1)C(O)=O)cc2	ZINC000000049114	O=C(CCNCc1ccccc1)c2ccccc2
C[N@]1CCc3c(C1)c2ccccc2n3C	ZINC000000036609	C3Cc2[nH]c1ccccc1c2CN3
CC(C)(C)c3ccc(C(=O)NC(=O)COC(=O)CCNC1=NS(=O)(=O)c2ccccc12)cc3	ZINC000009961610	O=C(COC(=O)CCNC1=NS(=O)(=O)c2ccccc12)NC(=O)c3ccccc3
COc2ccc(NC(=N)Nc1nc(C(F)(F)F)cc(=O)[nH]1)cc2	ZINC000000448892	N=C(Nc1ccccc1)Nc2nccc(=O)[nH]2
C[C@@H]3Cc1scc[n+]1c2ccccc2N3C=O	ZINC000000112678	C3Cc1scc[n+]1c2ccccc2N3
CN(C)CCOC(=O)c2oc1ccccc1c2C	ZINC000000177171	c2ccc1occc1c2
Clc2ccc(n1c(=O)ccc1=O)cc2C(=O)NCc3ccccc3	ZINC000000051766	O=C(NCc1ccccc1)c3cccc(n2c(=O)ccc2=O)c3
COc2cccc(NC(=O)CC[N@]1C[C@@H](C)C[C@@H](C)C1)c2	ZINC000000176488	O=C(CCN1CCCCC1)Nc2ccccc2
CNC2(COc1cccnc1)CC2	ZINC000000009156	C1CC1COc2cccnc2
CCOC(=O)[C@@H](C)Nc1n[nH]c(=S)[nH]c1=O	ZINC000000086838	O=c1cn[nH]c(=S)[nH]1
CCOC(=O)N3CCC(NCCc1c[nH]c2ccccc12)CC3	ZINC000000221604	C3CC(NCCc1c[nH]c2ccccc12)CCN3
CN(C)C(=NCCCC[C@H](N)C(=O)N[C@@H](Cc2c(Sc1ccccc1N(=O)=O)[nH]c3ccccc23)C(N)=O)N(C)C	ZINC000071331151	S(c1ccccc1)c3cc2ccccc2[nH]3
CC(C)N(Cc1ccccc1)C(=O)Cn3c(=O)c2ccccc2c3=O	ZINC000000030497	O=C(Cn2c(=O)c1ccccc1c2=O)NCc3ccccc3
CC(C)(C)OC(=O)NCC2CCN(Cc1ccccc1)CC2	ZINC000000130612	C2CCN(Cc1ccccc1)CC2
NC(=N)Nc2ccc(C(=O)Nc1cnccn1)cc2	ZINC000000011213	O=C(Nc1cnccn1)c2ccccc2
Cc2nc1scn[n+]1c(C)c2C	ZINC000000496266	c2cnc1scn[n+]1c2
O=C(CNC1CCCCC1)n3c2ccccc2ccc4ccccc34	ZINC000000184329	O=C(CNC1CCCCC1)n3c2ccccc2ccc4ccccc34
OC[C@H](Cc1ccccc1)Nc3ncnc4n(c2ccccc2)ncc34	ZINC000000012959	C(Cc1ccccc1)Nc3ncnc4n(c2ccccc2)ncc34
C[C@@H](N)C(=O)Nc1c(C)cccc1C	ZINC000000000786	c1ccccc1
C[N+](C)(C)Cc2ccc(C(=O)c1ccccc1)cc2	ZINC000000155088	O=C(c1ccccc1)c2ccccc2
Nc3cc(Cl)cc4nc(Cc2nc1ccccc1[nH]2)[nH]c34	ZINC000000026559	C(c2nc1ccccc1[nH]2)c4nc3ccccc3[nH]4
CCN2CCC(N1CCOCC1)CC2	ZINC000000280483	C2CC(N1CCOCC1)CCN2
CC(C)N(CCNC(=O)[C@@H]1CCCNC1)C(C)C	ZINC000019411247	C1CCNCC1
CCOC(=O)c4ccc3N[C@H](c1cccnc1)[C@H]2CC=C[C@H]2c3c4	ZINC000000037714	C1C=CC3C1C(c2cccnc2)Nc4ccccc34
C4CN=C([C@H]1CC1(c2ccccc2)c3ccccc3)N4	ZINC000000000145	C4CN=C(C1CC1(c2ccccc2)c3ccccc3)N4
Fc4ccc(C(=O)Cn2c1=NCCCn1c3ccccc23)cc4	ZINC000000116373	O=C(Cn2c1=NCCCn1c3ccccc23)c4ccccc4
CC(=O)Nc3ccc(N2C(=O)C[C@H](N1CCCC1)C2=O)cc3	ZINC000000121686	O=C2CC(N1CCCC1)C(=O)N2c3ccccc3
CC(C)CN[C@@H]2CC(=O)N(c1ccc(Cl)cc1)C2=O	ZINC000000342233	O=C1CCC(=O)N1c2ccccc2
CCOC(=O)c2sc(NC(=O)COc1ccc(CC)cc1)nc2C	ZINC000000178999	O=C(COc1ccccc1)Nc2nccs2
COc3ccc(S(=O)(=O)N1CCCc2ccccc12)cc3	ZINC000000029592	O=S(=O)(N1CCCc2ccccc12)c3ccccc3
COc1ccccc1n3c(=O)c2ccc(NC(C)=O)cc2c3=O	ZINC000000033098	O=c2n(c1ccccc1)c(=O)c3ccccc23
CC[C@@]3(c1ccccc1)C(=N)Nc2ccccc23	ZINC000000173423	N=C2Nc1ccccc1C2c3ccccc3
COC[C@@H]3CN(c2ccc(OCc1cccc(C#N)c1)cc2)C(=O)O3	ZINC000000000149	O=C1OCCN1c3ccc(OCc2ccccc2)cc3
C[C@H](CCN(C)C)Nc1cc(O)cc2cccnc12	ZINC000000000148	c2ccc1ncccc1c2
COc1ccccc1C(=O)N2CCN(C(C)C)CC2	ZINC000000300506	O=C(N1CCNCC1)c2ccccc2
CN(C)CCNC(=O)CN(C)C(=O)c3ccc(N1CCNCC1)c(NS(=O)(=O)c2ccccc2C)c3	ZINC000033033520	O=S(=O)(Nc1ccccc1N2CCNCC2)c3ccccc3
COc1ccccc1N([C@H]2CN3CCC2CC3)C(=O)c4ccccc4	ZINC000000173295	O=C(N(C1CN2CCC1CC2)c3ccccc3)c4ccccc4
Oc3cc(O)c2C(=O)C[C@H](c1ccccc1)Oc2c3	ZINC000000004935	O=C2CC(c1ccccc1)Oc3ccccc23
CCN1CCC2(CC1)NC(CO)(CO)CO2	ZINC000000214770	C2COC1(CCNCC1)N2
COc4nc(Nc3ccc(c2nc1ccccc1o2)cc3)nc(OC)n4	ZINC000000099011	N(c3ccc(c2nc1ccccc1o2)cc3)c4ncncn4
NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@]2(O)C[C@@H](O)[C@H](O)[C@@H](NS(=O)(=O)c1cccc(C(F)(F)F)c1)C2	ZINC000004221896	O=S(=O)(NC1CCCCC1)c2ccccc2
COc4ccc([C@@H]2Sc1ccccc1NC(=O)[C@H]2OC(=O)CN3CCN(C)CC3)cc4	ZINC000000638704	O=C(CN1CCNCC1)OC4C(c2ccccc2)Sc3ccccc3NC4=O
CCN(CC)CCn2c(c1ccccc1)noc2=N	ZINC000000001560	N=c2[nH]c(c1ccccc1)no2
CC(=O)N[C@@H]2[C@@H](Oc1ccccc1C(O)=O)O[C@@H](COC(C)=O)[C@@H](OC(C)=O)[C@@H]2OC(C)=O	ZINC000008834425	C2CCC(Oc1ccccc1)OC2
COc2cc(C)c(Cc1cnc(N)nc1N)cc2OC	ZINC000000000562	C(c1ccccc1)c2cncnc2
CN1CCCCC/C1=N\CCn2cnc3n(C)c(=O)n(C)c(=O)c23	ZINC000000090157	O=c3[nH]c(=O)c2n(CCN=C1CCCCCN1)cnc2[nH]3
Cc1ccccc1OCC(=O)Nc4ccc(S(=O)(=O)Nc2cccc3ccccc23)cc4	ZINC000000660548	O=C(COc1ccccc1)Nc4ccc(S(=O)(=O)Nc2cccc3ccccc23)cc4
CCn1c(C)[n+](CC(=O)OC)c2ccccc12	ZINC000000407334	c2ccc1[nH]cnc1c2
CSc3nc(N)c2c1CC[N+](C)(C)Cc1sc2n3	ZINC000000496104	C1Cc2c(CN1)sc3ncncc23
OCCN(CCO)CC=C	ZINC000000157975	nonring
N[C@@H](Cc1ccc(C(N)=N)cc1)C(=O)[C@@H]2CCCCN2C(=O)[C@@H](N)S(=O)(=O)c3cccc4ccccc34	ZINC000026664019	O=C(CCc1ccccc1)C2CCCCN2C(=O)CS(=O)(=O)c3cccc4ccccc34
NS(=O)(=O)c2ccc(NC(=O)\C=C\c1ccccc1)cc2	ZINC000000038708	O=C(Nc1ccccc1)C=Cc2ccccc2
CN[C@@H](C)[C@@H](O)c1ccccc1	ZINC000000020259	c1ccccc1
Cc2cc(=N)n1CCSc1n2	ZINC000000093626	N=c2ccnc1SCCn12
CC(C)[N@@](C)C2CCN(S(=O)(=O)c1ccc(N(=O)=O)cc1)CC2	ZINC000000260971	O=S(=O)(N1CCCCC1)c2ccccc2
N[C@@H]1CCCc2c1[nH]c3ccc(Br)cc23	ZINC000000131414	C1CCc2c(C1)[nH]c3ccccc23
Nn2cnn3c(SCC(=O)c1ccccc1)nnc23	ZINC000000036437	O=C(CSc1nnc2[nH]cnn12)c3ccccc3
Cc3ccc(N(CC1=NCCN1)c2cccc(O)c2)cc3	ZINC000000020251	C3CN=C(CN(c1ccccc1)c2ccccc2)N3
CCOC(=O)C1=C(C)NC(=O)C[C@@H]1c2ccc(C#N)cc2	ZINC000000042722	O=C2CC(c1ccccc1)C=CN2
CCNc1nc(NCC)nc(C(N)=O)n1	ZINC000000246495	c1ncncn1
C[C@@H](N)COc1c(C)cccc1C	ZINC000000020257	c1ccccc1
COc3ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)Nc1cccc(C)c1)cc2)c(Cl)c3Cl	ZINC000000628038	O=S(=O)(Nc2ccc(S(=O)(=O)Nc1ccccc1)cc2)c3ccccc3
C[C@H](N(C)C)C(=O)Nc2cc(c1ccccc1)nn2c3ccccc3	ZINC000000000217	c3ccc(c2ccn(c1ccccc1)n2)cc3
CC(C)(C)c3ccc(c2n/c(=C/c1ccco1)c(=O)o2)cc3	ZINC000000027991	O=c2oc(c1ccccc1)nc2=Cc3ccco3
COc1ccccc1CNC(N)=N	ZINC000000235180	c1ccccc1
CCc4ccc([C@@H]2NCCc3cc1OCCOc1cc23)cc4	ZINC000000140544	C4Cc2cc1OCCOc1cc2C(c3ccccc3)N4
Nc1nnnn1/N=C/c2cc(Br)ccc2O	ZINC000000027999	C(=Nn1cnnn1)c2ccccc2
COc1cc(OC)c(C[N+](=O)C(C)(C)C)c(OC)c1	ZINC000000006331	c1ccccc1
C[N@]1CC[C@]25[C@@H]3Oc4c(O)ccc(C[C@@H]1[C@H]2C=C[C@H]3O)c45	ZINC000000006428	C5CC14C2CC=CC1C(Cc3cccc(O2)c34)N5
COc1cccc(CN)c1OC	ZINC000000406937	c1ccccc1
CC(=O)O[C@@H](C[N+]1(C)CCCCCC1)c2ccccc2	ZINC000000185815	C2CCCN(CCc1ccccc1)CC2
Cc2cc(C)c(NC(=O)[C@@H]1CCC[N@]1CCO)c(C)c2	ZINC000000185814	O=C(Nc1ccccc1)C2CCCN2
CCCC(CCC)C(=O)N2C[C@@H](c1ccccc1)[C@@H](C(=O)OCC)C2=O	ZINC000000601626	O=C2CC(c1ccccc1)CN2
NCCc2ccc(S(=O)(=O)N1CCOCC1)cc2	ZINC000000056364	O=S(=O)(N1CCOCC1)c2ccccc2
O=C(Nc1ccccc1)O[C@@H]2CN3CCC2CC3	ZINC000000050683	O=C(Nc1ccccc1)OC2CN3CCC2CC3
CN(C)P(N(C)C)N(C)C	ZINC000000154689	nonring
Cc2nc(C1=CCCNC1)cs2	ZINC000000010804	C2CC=C(c1cscn1)CN2
COC(=O)c2[nH]c1ccccc1c2NC(=O)C[N@]3CCCC(C)(C)C3	ZINC000000546771	O=C(CN1CCCCC1)Nc2c[nH]c3ccccc23
C[C@@H]1CCCC[N@]1CCNC(=O)c3ccc2SCC(=O)Nc2c3	ZINC000000217641	O=C3CSc2ccc(C(=O)NCCN1CCCCC1)cc2N3
CCOC(=O)COc2ccc(S(=O)(=O)Nc1ccccc1C)cc2	ZINC000000479316	O=S(=O)(Nc1ccccc1)c2ccccc2
Clc3ccc(NCn2nnc(c1ccc(N(=O)=O)cc1)n2)cc3	ZINC000000032939	C(Nc1ccccc1)n3nnc(c2ccccc2)n3
Fc1ccccc1CSC2=NCCN2	ZINC000000122169	C2CN=C(SCc1ccccc1)N2
CCc2c(C)sc(NC(=O)c1ccc(OC)c(OC)c1)c2C(N)=O	ZINC000000043182	O=C(Nc1cccs1)c2ccccc2
COc2ccc(NC(=O)c1ccc(Cl)c(Cl)c1)cc2OC	ZINC000000043180	O=C(Nc1ccccc1)c2ccccc2
CS(=O)(=O)c2ccc(N1CCNCC1)c(F)c2	ZINC000000154119	C2CN(c1ccccc1)CCN2
CCOC(=O)c2c(N)n(CCN(C)C)c3nc1ccccc1nc23	ZINC000000148197	c3ccc2nc1[nH]ccc1nc2c3
NC(=O)Cn2nnc(c1ccccc1)n2	ZINC000000114531	c2ccc(c1nn[nH]n1)cc2
CN3CCC(c1c[nH]c2ccc(O)cc12)CC3	ZINC000000007339	C3CC(c1c[nH]c2ccccc12)CCN3
O=c2[nH]c1ccccc1n2C3CCNCC3	ZINC000000119391	O=c2[nH]c1ccccc1n2C3CCNCC3
Cc2cccc(NC(=O)CSc1nc(N)cc(N)n1)c2	ZINC000000077124	O=C(CSc1ncccn1)Nc2ccccc2
CCN(CC)C[C@@H](O)Cn1c(C)c(C)c2ccccc12	ZINC000000096632	c2ccc1[nH]ccc1c2
NC(=O)COc3ccc(\C=N/c2ccc(Oc1ccccc1)cc2)cc3	ZINC000000459767	O(c1ccccc1)c3ccc(N=Cc2ccccc2)cc3
O=C2C[C@@H](C(=O)NCCN1CCCC1)CN2C3CCCCC3	ZINC000000220427	O=C2CC(C(=O)NCCN1CCCC1)CN2C3CCCCC3
CC(C)N(C(=O)CSc2nnc(c1ccccc1)n2CC=C)c3ccccc3	ZINC000000623099	O=C(CSc2nnc(c1ccccc1)[nH]2)Nc3ccccc3
CC2(C)C(c1ccccc1)[N+](=O)CN2O	ZINC000000300064	O=[N+]1CNCC1c2ccccc2
C[C@@H](NC(=O)CN1CCCCC1)[C@@H]3COc2ccccc2O3	ZINC000000380916	O=C(CN1CCCCC1)NCC3COc2ccccc2O3
CCC(=O)N2[C@@H](C)C[C@H](N(C(C)=O)c1ccccc1)c3ccccc23	ZINC000000031399	C3CC(Nc1ccccc1)c2ccccc2N3
CC4=C(C(N)=O)[C@@H](c1ccc(N(=O)=O)cc1)C(C(=O)NCCCN3CCC(c2ccccc2)CC3)=C(COCCN)N4	ZINC000026727249	O=C(NCCCN2CCC(c1ccccc1)CC2)C3=CNC=CC3c4ccccc4
CCOC(=O)c1c(C)nc(C)cc1Nc2ccccc2N	ZINC000000243014	N(c1ccccc1)c2ccncc2
NC(=O)CCNC23CC1CC(CC(C1)C2)C3	ZINC000000034638	C1C2CC3CC1CC(C2)C3
CC1(C)[C@H]3CC[C@]1(C)[C@H](NC(=O)CC[N+](C)(C)Cc2ccccc2)C3	ZINC000000206512	O=C(CCNCc1ccccc1)NC2CC3CCC2C3
COc2ccc([C@@H](CC(=O)OC1CCCCC1)CN(=O)=O)cc2	ZINC000000028311	O=C(CCc1ccccc1)OC2CCCCC2
C[C@@H](CN1CCCCC1)OC(=O)[C@@H]3COc2ccccc2O3	ZINC000000316374	O=C(OCCN1CCCCC1)C3COc2ccccc2O3
Clc3ccc(\C=C\c2cc[n+](C(=O)N1CCOCC1)cc2)cc3	ZINC000000173476	O=C(N1CCOCC1)[n+]3ccc(C=Cc2ccccc2)cc3
CC4(C)N(CN2C(=O)N(C[C@@H](O)CN1CCCCC1)C(=O)C2(C)C)C(=O)N(C[C@@H](O)CN3CCCCC3)C4=O	ZINC000029747439	O=C3CN(CN2CC(=O)N(CCCN1CCCCC1)C2=O)C(=O)N3CCCN4CCCCC4
CN3CCN(NC(=O)c2sc1ccccc1c2Cl)CC3	ZINC000000334738	O=C(NN1CCNCC1)c3cc2ccccc2s3
NC(=O)[C@@H]2CCC[N@@](Cc1ccc(F)cc1)C2	ZINC000000278813	C2CCN(Cc1ccccc1)CC2
COc2ccc(NC(=S)N(C(C)C)C1CCN(C(C)C)CC1)cc2	ZINC000000261485	S=C(NC1CCNCC1)Nc2ccccc2
CC(C)N2CCC(N(C(C)C)C(=S)Nc1ccccc1C)CC2	ZINC000000261484	S=C(NC1CCNCC1)Nc2ccccc2
CC(C)NC[C@@H](O)c1ccc(N)c(C#N)c1	ZINC000000002307	c1ccccc1
Fc4ccc([C@@H]1CCNC[C@@H]1COc3ccc2OCOc2c3)cc4	ZINC000000527387	C4CC(c1ccccc1)C(COc3ccc2OCOc2c3)CN4
COc4ccc(c3c[n+]2cn(Cc1ccccc1)c(C)c2c(=O)[nH]3)cc4	ZINC000000161368	O=c3[nH]c(c1ccccc1)c[n+]4cn(Cc2ccccc2)cc34
Fc3ccc(NC(=O)N2CCN(CCc1ccccc1)CC2)cc3	ZINC000000146033	O=C(Nc1ccccc1)N3CCN(CCc2ccccc2)CC3
CCOC(=O)c1ncn3c1CN(C)C(=O)c2cc(C#C)ccc23	ZINC000000019654	O=C2NCc1cncn1c3ccccc23
CN(C)CCC(=O)Nc2nc(c1ccc(Cl)cc1)cs2	ZINC000000073771	c2ccc(c1cscn1)cc2
CN(C)Cc2ccc1OCOc1c2CO	ZINC000000336954	C2Oc1ccccc1O2
C3CN=C(Nc2ccc1nccnc1c2)N3	ZINC000000014042	C3CN=C(Nc2ccc1nccnc1c2)N3
OC2CCN(Cc1ccc(F)cc1)CC2	ZINC000000240508	C2CCN(Cc1ccccc1)CC2
CN2CCN(c1ccc(CN)cc1)CC2	ZINC000000158909	C2CN(c1ccccc1)CCN2
O=C(CN(Cc1ccccc1)S(=O)(=O)c2ccccc2)NC3CC3	ZINC000000079959	O=C(CN(Cc1ccccc1)S(=O)(=O)c2ccccc2)NC3CC3
CC(=O)Nc2ccc(CN1CCSCC1)cc2	ZINC000000199508	C2CN(Cc1ccccc1)CCS2
C[N+](C)(C)C[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000000236833	c1ccccc1
OC(CN1CCCCC1)CN2CCCCC2	ZINC000000348106	C2CCN(CCCN1CCCCC1)CC2
CN2CCN(c1ccc(CO)cc1)CC2	ZINC000000158907	C2CN(c1ccccc1)CCN2
CN2CCN(c1ccc(C=O)cc1)CC2	ZINC000000158906	C2CN(c1ccccc1)CCN2
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
OC14CC3C[C@@H](C1)C2(NCCS2)[C@H](C3)C4	ZINC000000225126	C1CSC3(N1)C2CC4CC(C2)CC3C4
O=C(CN1CCCC1=O)NCC23CCCN2CCC3	ZINC000000005883	O=C(CN1CCCC1=O)NCC23CCCN2CCC3
COC(=O)C(C(=O)OC)c1ccc(N(=O)=O)cn1	ZINC000000153469	c1ccncc1
Cn3c(=O)n(C)c2nc(Nc1ccccc1)n(CCO)c2c3=O	ZINC000000032603	O=c3[nH]c(=O)c2[nH]c(Nc1ccccc1)nc2[nH]3
CN3CCN(c2ccc(NC(=O)c1ccc(N(=O)=O)cc1)cc2)CC3	ZINC000000556335	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
COc2ccc(CCNC(=S)Nc1cc(OC)ccc1OC)cc2	ZINC000000306292	S=C(NCCc1ccccc1)Nc2ccccc2
COc1ccc(Cl)cc1NC(=O)Oc2ccc(CC=C)cc2OC	ZINC000000399640	O=C(Nc1ccccc1)Oc2ccccc2
CN(C1CCCCC1)S(=O)(=O)Cc2ccccc2	ZINC000000029850	O=S(=O)(Cc1ccccc1)NC2CCCCC2
CN4CCN(c2ncnc3n(Cc1ccccc1Cl)nnc23)CC4	ZINC000000159225	C4CN(c2ncnc3n(Cc1ccccc1)nnc23)CCN4
CN(C)CCNc2ncnc3n(c1ccccc1)ncc23	ZINC000000487759	c3ccc(n1ncc2cncnc12)cc3
CN(C)CCN(CCC(=O)N1CCNCC1)S(C)(=O)=O	ZINC000015862663	C1CNCCN1
COc1cc(OC)c(OC)cc1C[N@@]4CCc3nnc([C@@H](C)NC(=O)C2CCN(C)CC2)n3CC4	ZINC000012195248	O=C(NCc3nnc2CCN(Cc1ccccc1)CCn23)C4CCNCC4
COc5ccc4CN(C[C@@]3(C#Cc2ccc([C@@H](CN)N1CC[C@@H](N)C1)cc2)NC(=O)NC3=O)C(=O)c4c5	ZINC000149600155	O=C5NC(=O)C(CN2Cc1ccccc1C2=O)(C#Cc4ccc(CN3CCCC3)cc4)N5
Fc1ccccc1CCN[C@@H]3CC(=O)N(c2ccc(Cl)cc2)C3=O	ZINC000000100485	O=C2CC(NCCc1ccccc1)C(=O)N2c3ccccc3
NCCc2c[nH]c3c(OCc1ccccc1)cccc23	ZINC000000039096	C(Oc1cccc2cc[nH]c12)c3ccccc3
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
COc3ccc(S(=O)(=O)N2CCC(N1CCCCC1)CC2)cc3	ZINC000000317101	O=S(=O)(N2CCC(N1CCCCC1)CC2)c3ccccc3
O=C(Oc2ccc(OCc1ccccc1)cc2)c3ccc(N(=O)=O)cc3	ZINC000000060380	O=C(Oc2ccc(OCc1ccccc1)cc2)c3ccccc3
CC(C)(C)Nc3nc(n1ccnc1)nc(n2ccnc2)n3	ZINC000000110724	c3cn(c2ncnc(n1ccnc1)n2)cn3
Nc2c(Cl)cc(CC1=NCCN1)cc2Cl	ZINC000000001790	C2CN=C(Cc1ccccc1)N2
C[C@@H](CC[N@]1C[C@@H]3C[C@H](C1)c2cccc(=O)n2C3)c4ccccc4	ZINC000000228709	O=c4cccc3C2CC(CN(CCCc1ccccc1)C2)Cn34
CNS(=O)(=O)c1cccnc1N2CCN(C(C)C)CC2	ZINC000000481382	C2CN(c1ccccn1)CCN2
COc3cc2C[N@](C)CC1(CCOCC1)c2cc3OC	ZINC000000343465	C1CC3(CCO1)CNCc2ccccc23
C(Oc3ccc(Nc1ncnc2ccccc12)cc3)c4ccccc4	ZINC000000006629	C(Oc3ccc(Nc1ncnc2ccccc12)cc3)c4ccccc4
Cc1occc1C(=O)Nc2ccc(Br)cn2	ZINC000000033559	O=C(Nc1ccccn1)c2ccoc2
CC(C)(C)c2cc(C(=O)N1CCCNCC1)cc(C(C)(C)C)c2O	ZINC000000004734	O=C(N1CCCNCC1)c2ccccc2
Cc3cc(NC(=O)CN1CCCCC1)n(c2ccccc2)n3	ZINC000000159418	O=C(CN1CCCCC1)Nc2ccnn2c3ccccc3
CN2CCC(OC(=O)c1ccccc1OC(C)=O)CC2	ZINC000000362695	O=C(OC1CCNCC1)c2ccccc2
CCC(CC)NCc1cccc(N(=O)=O)c1	ZINC000000169417	c1ccccc1
CCN1C[C@H]2C[N@@](C)C[C@@H](C1)C2OC(=O)c3ccc(Cl)cc3	ZINC000000001034	O=C(OC1C2CNCC1CNC2)c3ccccc3
O=C(CSc2nc1ccccc1[nH]2)Nc3ncccn3	ZINC000000049877	O=C(CSc2nc1ccccc1[nH]2)Nc3ncccn3
O=N(=O)c1ccccc1C=NNC2=NCCN2	ZINC000000477435	C2CN=C(NN=Cc1ccccc1)N2
CN(C1CC(C)(C)N(C)C(C)(C)C1)S(=O)(=O)c2ccc(C)cc2	ZINC000000052954	O=S(=O)(NC1CCNCC1)c2ccccc2
C3C[C@@H](NCc1ccccn1)c2ccccc2C3	ZINC000000227855	C3CC(NCc1ccccn1)c2ccccc2C3
O=N(=O)c2ccc(\C=c1\[nH]c(=O)[nH]c1=O)cc2	ZINC000000073083	O=c2[nH]c(=O)c(=Cc1ccccc1)[nH]2
Cc3ccc(NS(=O)(=O)c2ccc(CCC(=O)NCc1cccnc1)cc2)cc3	ZINC000000667667	O=C(CCc2ccc(S(=O)(=O)Nc1ccccc1)cc2)NCc3cccnc3
S=C(NCc1ccco1)Nc3ccc2[nH]ccc2c3	ZINC000000026959	S=C(NCc1ccco1)Nc3ccc2[nH]ccc2c3
Cc3cccc(N2C(=O)C[C@H](N1CCC(C(N)=O)CC1)C2=O)c3	ZINC000000181377	O=C2CC(N1CCCCC1)C(=O)N2c3ccccc3
COc1ccccc1C2=CN3CCC2CC3	ZINC000000013755	C1CN3CCC1C(c2ccccc2)=C3
Cc1cc(=O)oc2cc(NC(=O)CN)ccc12	ZINC000000057339	O=c2ccc1ccccc1o2
C3CCN(CCSc1nnnn1c2ccccc2)CC3	ZINC000000188469	C3CCN(CCSc1nnnn1c2ccccc2)CC3
CN2C(C)(C)CC(=NOC(=O)c1ccccc1)CC2(C)C	ZINC000000053007	O=C(ON=C1CCNCC1)c2ccccc2
C4CN(c2cc(c1ccncc1)nc3ccccc23)CCO4	ZINC000000163656	C4CN(c2cc(c1ccncc1)nc3ccccc23)CCO4
CC2(C)CC(N1CCC(=O)NC1=S)CC(C)(C)N2	ZINC000000053123	O=C2CCN(C1CCNCC1)C(=S)N2
COc2ccc(NCC(C#N)C(=O)NCc1ccc(Cl)cc1)cc2	ZINC000000031603	O=C(CCNc1ccccc1)NCc2ccccc2
C[N@]1[C@H]3CC[C@@H]1CC(OC(=O)C(=C)c2ccccc2)C3	ZINC000000000961	C=C(C(=O)OC1CC2CCC(C1)N2)c3ccccc3
CO[C@H](C(=O)NCc1ccc(OC)cc1)c2ccccc2	ZINC000000039402	O=C(Cc1ccccc1)NCc2ccccc2
O=c3ccc(=O)n2Cc1ccccc1Cn23	ZINC000000049617	O=c3ccc(=O)n2Cc1ccccc1Cn23
CC(=O)N(c2ccc(NS(=O)(=O)c1c(C)noc1C)cn2)S(=O)(=O)c3c(C)noc3C	ZINC000008636656	O=S(=O)(Nc2ccc(NS(=O)(=O)c1cnoc1)nc2)c3cnoc3
CC(=O)CSc1n(C)cc[n+]1C	ZINC000000013518	c1c[nH]cn1
CCOC(=O)c3c(c1ccccc1)oc4ccc(O)c(CSCC(=O)Nc2ccccc2)c34	ZINC000000622057	O=C(CSCc2cccc3oc(c1ccccc1)cc23)Nc4ccccc4
C[C@@H]2CN=C(NCc1ccccn1)S2	ZINC000000063638	C2CN=C(NCc1ccccn1)S2
COc4ccc(CCc2c(c1ccccc1)[nH]c3ccc(CC(O)=O)cc23)cc4	ZINC000000602332	C(Cc2c(c1ccccc1)[nH]c3ccccc23)c4ccccc4
CCOC(=O)[C@@H]1CCC[N@]1Cc2ccccc2	ZINC000000056824	C2CCN(Cc1ccccc1)C2
COc3ccc(CCN2CCN(c1ccc(C)c(C)c1)CC2)cc3OC	ZINC000000625015	C2CN(c1ccccc1)CCN2CCc3ccccc3
CN3[C@@H](CCNC(=O)c1cccs1)CN=C(c2ccccc2)c4ccccc34	ZINC000000593691	O=C(NCCC3CN=C(c1ccccc1)c2ccccc2N3)c4cccs4
FC(F)(F)c2cccc(CN1CCCCC1)c2	ZINC000000002941	C2CCN(Cc1ccccc1)CC2
CC1(C)[C@@H](C=C(Cl)Cl)[C@H]1C(=O)Nc3nc2ccccc2s3	ZINC000000032802	O=C(Nc2nc1ccccc1s2)C3CC3
CC(C)(C)[C@H](CN1CCCC1)OC(=O)c2ccccc2	ZINC000000111481	O=C(OCCN1CCCC1)c2ccccc2
CN(C)CCn1c(N)c(C#N)c2nc(C#N)c(C#N)nc12	ZINC000000118758	c2cnc1[nH]ccc1n2
C1CCc2c(C1)cccc2CC3=NCCN3	ZINC000000002128	C1CCc2c(C1)cccc2CC3=NCCN3
CN2CCN(c1nc(C(C)(C)C)cs1)CC2	ZINC000000002127	C2CN(c1nccs1)CCN2
C[C@@H]2[C@@H](C)[N@@](CCc1ccccc1)CC[C@@H]2OC(C)=O	ZINC000000111488	C2CCN(CCc1ccccc1)CC2
CN(C)CCn3nc(Cc1ccccc1)c2ccccc2c3=O	ZINC000000002122	O=c2[nH]nc(Cc1ccccc1)c3ccccc23
C(N[n+]2cnn(Cc1ccccc1)c2)c3ccccc3	ZINC000000242786	C(N[n+]2cnn(Cc1ccccc1)c2)c3ccccc3
C[N+]15CCC(CC1)[C@H](Cn3c2ccccc2sc4ccccc34)C5	ZINC000000005659	C1CN5CCC1C(Cn3c2ccccc2sc4ccccc34)C5
C[N@]2CC[C@@]14CCCC[C@H]1[C@@H]2Cc3ccc(O)cc34	ZINC000000002433	C4CCC23CCNC(Cc1ccccc12)C3C4
CCN(CC)C(=O)[C@@H]2CCC[N@@](Cc1ccco1)C2	ZINC000000238952	C2CCN(Cc1ccco1)CC2
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(=O)c3ccc(N2CCN(C(=O)c1cccnc1)CC2)cc3	ZINC000000010484	O=C(N2CCN(c1ccccc1)CC2)c3cccnc3
COc3ccc(Nc2nc(N)nc(C[N@@](C)C1CCCCC1)n2)cc3	ZINC000000200068	C3CCC(NCc2ncnc(Nc1ccccc1)n2)CC3
Cc2nc(c1cccnc1)nc(NN)c2Cl	ZINC000000162839	c2cnc(c1cccnc1)nc2
C3C[C@H](C1=NCCN1)c2ccccc2C3	ZINC000000113428	C3CC(C1=NCCN1)c2ccccc2C3
CCCC2=C(C(=O)OCC)[C@@H](c1cccc(OC)c1OC)NC(=O)N2	ZINC000000175947	O=C2NC=CC(c1ccccc1)N2
O=N(=O)c3ccc(CN2CCN(C1CCCCC1)CC2)cc3	ZINC000000178723	C3CCC(N2CCN(Cc1ccccc1)CC2)CC3
Clc3ccc(CCNS(=O)(=O)c1cccc2cccnc12)cc3	ZINC000000423479	O=S(=O)(NCCc1ccccc1)c2cccc3cccnc23
COc2cc1nc(N)nc(N)c1cc2OC	ZINC000000389291	c2ccc1ncncc1c2
COc1ccc(C)cc1C(=O)CSc2nc(N)cc(N)n2	ZINC000000411984	O=C(CSc1ncccn1)c2ccccc2
COC(=O)CN3[C@@H](c1ccccc1)c2cc(Cl)ccc2N=C3C	ZINC000000069847	N2C=Nc1ccccc1C2c3ccccc3
COc4ccc(C(=O)Nc2c(c1cccs1)nc3ccccn23)cc4	ZINC000000456317	O=C(Nc2c(c1cccs1)nc3ccccn23)c4ccccc4
CN(C)CCCN2C[C@@H](c1ccccc1)CC2=O	ZINC000000189939	O=C2CC(c1ccccc1)CN2
Cc1ccccc1CSc4nnc3c2ccccc2n(CC=C)c3n4	ZINC000000094072	C(Sc1nnc3c(n1)[nH]c2ccccc23)c4ccccc4
CC(C)OC(=O)c2nnn(c1nonc1N)c2CN3CCCCCC3	ZINC000000076697	C3CCCN(Cc1cnnn1c2cnon2)CC3
CCNC2(c1cccc(Cl)c1)CCC2	ZINC000000033730	C2CC(c1ccccc1)C2
CC[C@H](C)N2[C@@H]1NC(=O)N[C@@H]1NC2=O	ZINC000000073423	O=C2NC1NC(=O)NC1N2
CCN3CCN(c2ccc(/N=C/c1ccc(O)cc1O)cc2)CC3	ZINC000000353118	C3CN(c2ccc(N=Cc1ccccc1)cc2)CCN3
NC[C@H](N)C(=O)NCC(=O)Nc3ccc2c(=O)c1cc(NC(=O)CNC(=O)[C@@H](N)CN)ccc1c(=O)c2c3	ZINC000653721993	O=c2c1ccccc1c(=O)c3ccccc23
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
Fc1ccccc1N3CCN(CCc2ccccc2)CC3	ZINC000000218187	C2CN(c1ccccc1)CCN2CCc3ccccc3
CCOC(=O)C(C(C)N)=C2CC(=O)N(c1ccccc1)C2=O	ZINC000000067619	C=C2CC(=O)N(c1ccccc1)C2=O
Cc2cc(C(=O)NCCN1CCCCC1)no2	ZINC000000128537	O=C(NCCN1CCCCC1)c2ccon2
Cc4ccc(S(=O)(=O)N3CCN(C[C@@H]1C[C@@H]2C[C@H]1C=C2)CC3)cc4	ZINC000000115850	O=S(=O)(N3CCN(CC1CC2CC1C=C2)CC3)c4ccccc4
CCc2nn(C1CCCC1)c4c2CCn5c(c3ccsc3)nnc45	ZINC000000021911	C5CCC(n4ncc3CCn2c(c1ccsc1)nnc2c34)C5
C4Cc1ccccc1[C@@H](CNC[C@@H]3COc2ccccc2O3)O4	ZINC000000186665	C4Cc1ccccc1C(CNCC3COc2ccccc2O3)O4
COc1cc(C)ccc1S(=O)(=O)N2CCCCCC2	ZINC000000036384	O=S(=O)(N1CCCCCC1)c2ccccc2
C[n+]3cccc([C@H]1C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2)c3	ZINC000000500269	O=C1CCCC3=C1C(c2cccnc2)C=CO3
O=N(=O)c1ccccc1CN4CCN(C[C@H]2C[C@H]3C[C@@H]2C=C3)CC4	ZINC000000178656	C2CN(Cc1ccccc1)CCN2CC3CC4CC3C=C4
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc3ccco3	ZINC000000329110	O=C(CCc1c[nH]c2ccccc12)NCc3ccco3
Cc2c(CCN)c1ccccc1n2C	ZINC000000129265	c2ccc1[nH]ccc1c2
C2CN=C(Cc1ccccc1)N2	ZINC000000125006	C2CN=C(Cc1ccccc1)N2
COc2ccc(OC)c(/C=C/C(=O)Nc1nccs1)c2	ZINC000000022066	O=C(Nc1nccs1)C=Cc2ccccc2
S=c2oc1ccccc1n2CNc3ccccn3	ZINC000000058591	S=c2oc1ccccc1n2CNc3ccccn3
CC(C)N(Cc1ccccc1)S(=O)(=O)c2ccc(NC(C)=O)cc2	ZINC000000029694	O=S(=O)(NCc1ccccc1)c2ccccc2
CN(C)CCNC(=O)CN1C(=O)COc2ccc(C(C)(C)C)cc12	ZINC000000218699	O=C2COc1ccccc1N2
COC(=O)c2ccc(C[n+]1ccccc1)cc2	ZINC000000321223	C(c1ccccc1)[n+]2ccccc2
O[C@@H]([C@H]1C[C@@H]2CC[N@]1C[C@H]2C=C)c3ccnc4ccccc34	ZINC000000001153	C1CN2CCC1CC2Cc3ccnc4ccccc34
CCN(CC)Cc2ccc(NC(=O)c1ccc(C#N)cc1F)cc2	ZINC000000568300	O=C(Nc1ccccc1)c2ccccc2
CCOC(Cc2nnc(SCC(=O)c1ccccc1)n2C)OCC	ZINC000000124077	O=C(CSc1nnc[nH]1)c2ccccc2
CSc1nc(N(C)N)cc(=O)n1C	ZINC000000330448	O=c1ccnc[nH]1
CCCCCC(=NNC(N)=N)C(C)N=NC(N)=N	ZINC000008622384	nonring
C[N+](C)(C)C/C=C1/COCO1	ZINC000000251364	C=C1COCO1
NCC[C@@H](NC(=O)c4ccc(c3cccc(NS(=O)(=O)c2ccc1[nH]c(=O)c(=O)[nH]c1c2)c3)o4)C(=O)N5CCNCC5	ZINC000028397772	O=C(CNC(=O)c4ccc(c3cccc(NS(=O)(=O)c2ccc1[nH]c(=O)c(=O)[nH]c1c2)c3)o4)N5CCNCC5
C[C@@H](NCCn1cnc2c(N)ncnc12)c3ccccc3	ZINC000000158697	C(Cn1cnc2cncnc12)NCc3ccccc3
Cc4ccc(CCNC[C@H](O[C@@H]1O[C@H](CN)[C@@H](O)[C@H]1O)[C@@H]3C[C@@H](O)[C@H](n2ccc(=O)[nH]c2=O)O3)cc4	ZINC000028225383	O=c4ccn(C3CCC(C(CNCCc1ccccc1)OC2CCCO2)O3)c(=O)[nH]4
COc3ccc(N2CCN(CCC1=C(C)CCCC1(C)C)CC2)cc3	ZINC000000212210	C3CCC(CCN2CCN(c1ccccc1)CC2)=CC3
C3CCN(Nc1ncnc2ccsc12)CC3	ZINC000000116566	C3CCN(Nc1ncnc2ccsc12)CC3
COc2cc1CCN[C@](C)(C(C)(C)O)c1cc2OC	ZINC000000129466	C2Cc1ccccc1CN2
NC(=S)Nc2nsc(c1ccccc1)n2	ZINC000000009161	c2ccc(c1ncns1)cc2
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
Cc4ccc3n(C[C@@H](O)Cn1ccnc1C)c2C(=O)CCCc2c3c4	ZINC000000572134	O=C1CCCc3c1n(CCCn2ccnc2)c4ccccc34
Oc2ccc(NS(=O)(=O)c1ccccc1)cc2CN3CCCCC3	ZINC000000114704	O=S(=O)(Nc2cccc(CN1CCCCC1)c2)c3ccccc3
CC[N+]1=C(C)OCC1(COC(C)=O)COC(C)=O	ZINC000000394220	C1CN=CO1
CC(=O)c4cccc(N3C(=O)[C@@H]1[C@@H](CCN1C(=O)COCC(O)=O)N(Cc2cccc(F)c2)C3=O)c4	ZINC000004260468	O=C3C1NCCC1N(Cc2ccccc2)C(=O)N3c4ccccc4
Oc2ccc1C4=[N+](CCc1c2)[C@H]3CCC[C@@H]3CC4	ZINC000000000685	C4CC3CCC1=[N+](CCc2ccccc12)C3C4
C[n+]1ccccc1CC(=O)c2ccc(Br)cc2	ZINC000000026307	O=C(Cc1ccccn1)c2ccccc2
CN(C)CCOC(=O)c1ccccc1	ZINC000000301115	c1ccccc1
CN2CCC([N@@](C)Cc1cccc(N(=O)=O)c1)CC2	ZINC000000201850	C2CC(NCc1ccccc1)CCN2
CN(C)CCc2c[nH]c3ccc(Cn1cncn1)cc23	ZINC000000005895	C(c2ccc1[nH]ccc1c2)n3cncn3
CC(C)CC[N@]1CCC[C@@H](C(N)=O)C1	ZINC000000394425	C1CCNCC1
NCc1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000000120199	c1ccccc1
CCOc2cc(C(=O)NC1CCCCCC1)cc(OCC)c2OCC	ZINC000000484058	O=C(NC1CCCCCC1)c2ccccc2
CCN2CCN(C(=S)c1ccc(OC)cc1)CC2	ZINC000000093761	S=C(N1CCNCC1)c2ccccc2
O=C(CCN2CCN(c1ccccc1)CC2)Nc3ccccc3	ZINC000000176362	O=C(CCN2CCN(c1ccccc1)CC2)Nc3ccccc3
COc4ccc(Cc3nn2c([C@@H](CCCc1ccccc1)[C@@H](C)O)nc(C)c2c(=O)[nH]3)cc4OC	ZINC000000596596	O=c3[nH]c(Cc1ccccc1)nn4c(CCCCc2ccccc2)ncc34
CC(C)(C)[C@@H](O)Cn2c1=NCCn1c3ccccc23	ZINC000000116367	C1Cn2c(=N1)[nH]c3ccccc23
Clc3ccc(C[C@H]2CC[C@@H]1CCCC[N@]1C2)cc3	ZINC000000000172	C3CCN2CC(Cc1ccccc1)CCC2C3
CN3CCN(C(=O)c2ccc1SCC(=O)Nc1c2)CC3	ZINC000000216059	O=C3CSc2ccc(C(=O)N1CCNCC1)cc2N3
COc1cc(OC)c(CN)c(OC)c1	ZINC000000056681	c1ccccc1
FC(F)(F)c2cccc(NC(=O)CSC1=NCCN1)c2	ZINC000000141834	O=C(CSC1=NCCN1)Nc2ccccc2
CCN1CCC(O)(CC(C)=C)CC1	ZINC000000335495	C1CCNCC1
COc2cccc(CCN1CCCC1)c2N	ZINC000000154212	C2CCN(CCc1ccccc1)C2
CCOC(=O)c1cnc(CN)c2c(OC)cc(OC)cc12	ZINC000000008765	c2ccc1cnccc1c2
CC(=O)Nc2cccc(C(=O)Oc1ccc(Cl)cc1C(C)=O)c2O	ZINC000000054477	O=C(Oc1ccccc1)c2ccccc2
NC(=O)c1cnc3n1CCc2ccccc2C34CCNCC4	ZINC000000008768	C1CC4(CCN1)c2ccccc2CCn3ccnc34
CCOc1ccccc1CN2CCC(O)CC2	ZINC000000240923	C2CCN(Cc1ccccc1)CC2
CN(C)c2nc(N(C)C)nc(n1nc(C)cc1C)n2	ZINC000000246559	c2cnn(c1ncncn1)c2
CN(C)[C@H]3CCc2[nH]c1ccccc1c2C3	ZINC000000000192	C1CCc2c(C1)[nH]c3ccccc23
NC(=O)c2cc[n+](Cc1ccccc1Cl)cc2	ZINC000000347495	C(c1ccccc1)[n+]2ccccc2
CC(C)(C)c1nc(N)nc(NN)n1	ZINC000000163128	c1ncncn1
OCC2CCN(CCCN1CCC(CO)CC1)CC2	ZINC000005847391	C2CCN(CCCN1CCCCC1)CC2
NNc2nc(N)nc(C1CC1)n2	ZINC000000163124	C1CC1c2ncncn2
CCOc3ccc(N2C(=O)C[C@H](NCc1cccnc1)C2=O)cc3	ZINC000000062422	O=C2CC(NCc1cccnc1)C(=O)N2c3ccccc3
NC(=S)N/N=C/c2ccc(S(=O)(=O)NCCNS(=O)(=O)c1ccc(\C=N\NC(N)=S)c(O)c1)cc2O	ZINC000006147951	O=S(=O)(NCCNS(=O)(=O)c1ccccc1)c2ccccc2
CCCN(CCC)[C@H]1Cc2c[nH]c3ccc(OC)c(C1)c23	ZINC000000004696	C1Cc2cccc3[nH]cc(C1)c23
C4CN(CCn2c(NCc1ccco1)nc3ccccc23)CCO4	ZINC000000350258	C4CN(CCn2c(NCc1ccco1)nc3ccccc23)CCO4
OC2(c1ccc(Cl)cc1)CCNCC2	ZINC000000132448	C2CC(c1ccccc1)CCN2
CNc3nc(c1ccccc1)[n+](c2ccccc2)s3	ZINC000000041847	c3ccc(c1ncs[n+]1c2ccccc2)cc3
COc3ccc(CC/N=C(\C)c2ccc1ccccc1c2)cc3OC	ZINC000000099159	C(Cc1ccccc1)N=Cc3ccc2ccccc2c3
COc3ccc([C@@H]1SCC(=O)N1c2ccc(NC(C)=O)cc2)cc3	ZINC000000031852	O=C2CSC(c1ccccc1)N2c3ccccc3
CC[N@]3CCC[C@H](NC1=CC(=O)OC12CCCCC2)C3	ZINC000000140231	O=C3OC1(CCCCC1)C(NC2CCCNC2)=C3
C[C@H]1CC(=O)NN=C1c3cc(n2ccnc2)cs3	ZINC000000000517	O=C3CCC(c2cc(n1ccnc1)cs2)=NN3
Brc1ccccc1CN3CCC(Cc2ccccc2)CC3	ZINC000000291956	C2CN(Cc1ccccc1)CCC2Cc3ccccc3
Fc2ccc(C1=CC[N@@](CC=C)CC1)cc2	ZINC000000010230	C2CC(c1ccccc1)=CCN2
Clc4cccc(N3CCN(CCCn2nc1ccccn1c2=O)CC3)c4	ZINC000000538483	O=c3n(CCCN2CCN(c1ccccc1)CC2)nc4ccccn34
NC(=O)c1ccccc1NC(=O)\C=C\c2ccccc2	ZINC000000038713	O=C(Nc1ccccc1)C=Cc2ccccc2
Nn1cc(C(F)(F)F)ccc1=[N+]2CCNCC2	ZINC000000157900	C2C[N+](=c1cccc[nH]1)CCN2
Cc2cc(C)[n+]1ccccc1n2	ZINC000000040083	c2cc[n+]1cccnc1c2
CCOC(=O)C2CCN(Cc1cc(C)ccc1C)CC2	ZINC000000237786	C2CCN(Cc1ccccc1)CC2
CCN1CCC3(CC1)NC(=O)c2ccccc2O3	ZINC000000103698	O=C2NC1(CCNCC1)Oc3ccccc23
Cc2cc(OCC(=O)Nc1cccc(F)c1)ccc2Br	ZINC000000051560	O=C(COc1ccccc1)Nc2ccccc2
CN3CCN(C(=O)c2ccc(CNS(=O)(=O)c1cccc(Cl)c1)cc2)CC3	ZINC000000630924	O=C(N1CCNCC1)c3ccc(CNS(=O)(=O)c2ccccc2)cc3
Nc3c(C#N)c1CCCCc1c(c2ccc(O)cc2)c3C#N	ZINC000000029116	C1CCc2c(C1)cccc2c3ccccc3
CN(C)CC(=O)c1c[nH]c2ccccc12	ZINC000000117500	c2ccc1[nH]ccc1c2
COc2cccc(NC(=S)N1CCC([N@@](C)CCC(C)C)CC1)c2	ZINC000000261563	S=C(Nc1ccccc1)N2CCCCC2
C/C=C/c2n(C)c1ccccc1[n+]2C	ZINC000000040719	c2ccc1[nH]cnc1c2
CC(C)c2ccc(NC(=O)N1CCOCC1)cc2	ZINC000000030382	O=C(Nc1ccccc1)N2CCOCC2
CC3(C)CCCN(c1ncnc2[nH]ccc12)C3	ZINC000000024367	C3CCN(c1ncnc2[nH]ccc12)CC3
NC(=N)NC[C@H]2COc1ccccc1O2	ZINC000000000357	C2COc1ccccc1O2
COc1ccc(Cl)c2[C@@H](N(C)C)CCCc12	ZINC000000000426	C2CCc1ccccc1C2
Oc1[nH]c(=O)n(CC=C)c(=O)c1[C@@H]3c2cc(N(=O)=O)ccc2Oc4[nH]c(=O)n(CC=C)c(=O)c34	ZINC000009233218	O=c4[nH]cc(C2c1ccccc1Oc3[nH]c(=O)[nH]c(=O)c23)c(=O)[nH]4
CN(C)C(On1ccccc1=O)=[N+](C)C	ZINC000000156072	O=c1cccc[nH]1
N=C3N[C@H](c1ccccc1)N(c2ccccc2)C(=N)N3	ZINC000000063592	N=C3NC(c1ccccc1)N(c2ccccc2)C(=N)N3
COC(=O)c1ccc(C(=O)OC)c(NC(=O)CC(C)(C)C)c1	ZINC000000030410	c1ccccc1
O[C@H]1C[C@@H]3CC[C@H]1[N@@](Cc2ccccc2)C3	ZINC000000173605	C1CC2CCC1CN2Cc3ccccc3
CC[C@@H](C)C(=O)N2CCN(c1ccccc1)CC2	ZINC000000030417	C2CN(c1ccccc1)CCN2
CCC(C)(C)C(=O)N2CCN(c1ccccc1)CC2	ZINC000000030414	C2CN(c1ccccc1)CCN2
CC[N+]3(C)CCC[C@H](OC(=O)C(O)(c1ccccc1)c2ccccc2)C3	ZINC000000601314	O=C(OC1CCCNC1)C(c2ccccc2)c3ccccc3
C[N@]1[C@H]4CCC[C@@H]1CC(NC(=O)c2cccc3nc[nH]c23)C4	ZINC000000385631	O=C(NC1CC2CCCC(C1)N2)c3cccc4nc[nH]c34
CCOC(=O)Cc1cc(=O)[nH]c(N)n1	ZINC000000401672	O=c1ccnc[nH]1
COc2cc(C(=O)C#Cc1ccccc1)cc(OC)c2OC	ZINC000000015754	O=C(C#Cc1ccccc1)c2ccccc2
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC=c4c(=O)[nH]c(=O)n(c3cc(OC)ccc3OC)c4=O	ZINC000002448004	O=c3[nH]c(=O)c(=CNCCc1c[nH]c2ccccc12)c(=O)n3c4ccccc4
CNCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1	ZINC000000015752	c1ccccc1
COc3ccc(CCNc2nc(c1cccnc1)cs2)cc3OC	ZINC000000088626	C(Cc1ccccc1)Nc3nc(c2cccnc2)cs3
N[C@H]2CCN(c1ccc(Cl)nc1)C2	ZINC000000026489	C2CCN(c1cccnc1)C2
CN(C)C[C@@H](O)[C@H]1CCOC(C)(C)C1	ZINC000000374801	C1CCOCC1
OCCN2CNC(SCc1ccccc1)=NC2	ZINC000000180372	C2NCN=C(SCc1ccccc1)N2
CCOc2cc(C(=O)Nc1nnn(CC)n1)cc(OCC)c2OCC	ZINC000000557694	O=C(Nc1nn[nH]n1)c2ccccc2
O=S(=O)(N[C@@H]1CCCC[C@@H]1NCc2ccco2)c3ccccc3	ZINC000000317243	O=S(=O)(NC1CCCCC1NCc2ccco2)c3ccccc3
CCOc3ccc(NC(=O)CSc2nnc(c1ccncc1)n2CC=C)cc3	ZINC000000623088	O=C(CSc2nnc(c1ccncc1)[nH]2)Nc3ccccc3
CCC[C@@H](C)C(=O)Nc1ccc(NC(C)=O)cc1	ZINC000000030897	c1ccccc1
CCOC(=O)c3ccc2nc(C)cc(Nc1ccc(O)cc1)c2c3	ZINC000000081069	N(c1ccccc1)c2ccnc3ccccc23
CCc3ccc(OC[C@@H](O)Cn1c(SCCC(O)=O)nc2n(C)c(=O)[nH]c(=O)c12)cc3	ZINC000008654134	O=c3[nH]c(=O)c2n(CCCOc1ccccc1)cnc2[nH]3
Nc3c(Cl)cc(C(=O)NCCC12CCCN1CCC2)c4OCCc34	ZINC000000006321	O=C(NCCC12CCCN1CCC2)c4cccc3CCOc34
O=N(=O)c1cccnc1Sc2ccccc2C3=NCCCN3	ZINC000000139953	C3CNC(c1ccccc1Sc2ccccn2)=NC3
NCCCCCC(=O)N[C@@H]1CN2CCC1CC2	ZINC000019505827	C1CN2CCC1CC2
C(Sc1ccccn1)c3cccc(CSc2ccccn2)n3	ZINC000000043147	C(Sc1ccccn1)c3cccc(CSc2ccccn2)n3
Cc2cc(Nc1ccc(F)c(Cl)c1)nc(N)n2	ZINC000000089184	N(c1ccccc1)c2ccncn2
Cc3cc(NCc1ccco1)c2ccccc2n3	ZINC000000120722	C(Nc1ccnc2ccccc12)c3ccco3
COc3cc(C(O)=C(C)C(=O)N(Cc1ccccc1)Cc2ccccc2)cc(OC)c3OC	ZINC000000634138	O=C(C=Cc1ccccc1)N(Cc2ccccc2)Cc3ccccc3
OCC[N@@](Cc1ccccc1)Cc2ccc(F)c(F)c2	ZINC000000217097	C(NCc1ccccc1)c2ccccc2
C=CCN(CC=C)C(=O)c3ccc(n2c(=O)c1ccccc1c2=O)cc3	ZINC000000293150	O=c2n(c1ccccc1)c(=O)c3ccccc23
Cc1cc(C)n(C)c(=O)c1C(=O)Nc2ccccc2Cl	ZINC000000034621	O=C(Nc1ccccc1)c2ccc[nH]c2=O
Cc1cc(C)c(S(N)(=O)=O)cc1S(N)(=O)=O	ZINC000000050943	c1ccccc1
O=c2oc1ccccc1n2CN3CCCCC3	ZINC000000051418	O=c2oc1ccccc1n2CN3CCCCC3
COc3ccc(OCc2nc(C#N)c(N[C@@H](C)c1ccccc1)o2)cc3	ZINC000000108176	C(Nc2cnc(COc1ccccc1)o2)c3ccccc3
CN(C)CCNS(=O)(=O)c2ccc(c1csc(C)n1)s2	ZINC000000066520	c2csc(c1cscn1)c2
CC[C@@H]1CCCCN1C(=O)CSc3nnc(c2ccc(F)cc2)o3	ZINC000000415873	O=C(CSc2nnc(c1ccccc1)o2)N3CCCCC3
CC(=O)NCC(=O)NCc1ccccc1	ZINC000000024095	c1ccccc1
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[C@@H](Cn2c1=NCCn1c3ccccc23)c5ccc4OCOc4c5	ZINC000000548452	C5Oc4ccc(CCn2c1=NCCn1c3ccccc23)cc4O5
NC[C@@H](O)c1ccc(N(=O)=O)cc1	ZINC000000374248	c1ccccc1
Cc2ncc(C[n+]1csc(C)c1C)c(N)n2	ZINC000000278001	C(c1cncnc1)[n+]2ccsc2
Cc1ccccc1CNc2nccc3ccccc23	ZINC000000013165	C(Nc1nccc2ccccc12)c3ccccc3
COc4ccc3nc(C)cc(Nc2ccc(N1CCOCC1)cc2)c3c4	ZINC000000143895	C4CN(c3ccc(Nc1ccnc2ccccc12)cc3)CCO4
Cn3c(=O)[nH]c(=O)c4n(CCc1ccccc1)c(N2CCN(C(=O)CCC(O)=O)CC2)nc34	ZINC000008926314	O=c4[nH]c(=O)c3n(CCc1ccccc1)c(N2CCNCC2)nc3[nH]4
FC(F)(F)c3ccc2n(C1CCNCC1)nnc2c3	ZINC000000161651	C3CC(n1nnc2ccccc12)CCN3
COc3ccc2ccc1cnn(C[C@@H](C)N)c1c2c3	ZINC000000020873	c1ccc3c(c1)ccc2cn[nH]c23
CN2CCC(N(C)Cc1c(F)cccc1Cl)CC2	ZINC000000278862	C2CC(NCc1ccccc1)CCN2
CC[C@@H](C)Oc2ccc(C(=O)NC(=S)Nc1ccc(C(C)=O)cc1)cc2	ZINC000000623550	O=C(NC(=S)Nc1ccccc1)c2ccccc2
COc2cc(NC(=S)NC(=O)c1cccc(C)c1OC)ccc2NC(=O)c3ccco3	ZINC000000623553	O=C(NC(=S)Nc2ccc(NC(=O)c1ccco1)cc2)c3ccccc3
Cc2cc(NCc1ccco1)ncn2	ZINC000000126854	C(Nc1ccncn1)c2ccco2
COc1cc(N)c(Cl)cc1C(=O)NC3CCN(Cc2ccccc2)CC3	ZINC000000608261	O=C(NC2CCN(Cc1ccccc1)CC2)c3ccccc3
COc5cc(C(=O)N4CCN(C2C1CC3CC(C1)CC2C3)CC4)cc(OC)c5OC	ZINC000000652166	O=C(N4CCN(C2C1CC3CC(C1)CC2C3)CC4)c5ccccc5
C[C@@H](CN1CCCC1)OC(=O)COc2ccccc2	ZINC000000383100	O=C(COc1ccccc1)OCCN2CCCC2
C2CCN(C1=NCCS1)CC2	ZINC000000172809	C2CCN(C1=NCCS1)CC2
CN(C)CCNC(=O)NC2(C(F)(F)F)Oc1ccccc1O2	ZINC000000212686	C2Oc1ccccc1O2
COc2cc(CNc1ccc(C)cc1)ccc2OCC(=O)Nc3cccc(C)c3	ZINC000000622338	O=C(COc2ccc(CNc1ccccc1)cc2)Nc3ccccc3
Clc1ccc(N(=O)=O)cc1c3n/c(=C/c2ccco2)c(=O)o3	ZINC000000027944	O=c2oc(c1ccccc1)nc2=Cc3ccco3
O=C(c1ccccc1)c3cc[n+](Cc2ccccn2)cc3	ZINC000000028248	O=C(c1ccccc1)c3cc[n+](Cc2ccccn2)cc3
ClC1=CC[C@@H]3[C@@H](C1)C(=O)N(CC[n+]2ccccc2)C3=O	ZINC000000105262	O=C2C1CC=CCC1C(=O)N2CC[n+]3ccccc3
COc3cccc(C(=O)Nc2ccc(N1CCN(C)CC1)cc2)c3	ZINC000000556328	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
Fc3cccc(NC2CCN(Cc1ccccc1)CC2)c3C#N	ZINC000000139174	C2CN(Cc1ccccc1)CCC2Nc3ccccc3
COC4(c3cc(F)cc(OCc2ccc1n(C)c(=O)ccc1c2)c3)CCOCC4	ZINC000000597477	O=c4ccc3cc(COc2cccc(C1CCOCC1)c2)ccc3[nH]4
Cc2cc(Nc1ccc(F)cc1F)nc(N)n2	ZINC000000089189	N(c1ccccc1)c2ccncn2
O=c2ccc(c1ccncc1)n[nH]2	ZINC000000080910	O=c2ccc(c1ccncc1)n[nH]2
COC(=O)c1ccccc1CS(=O)(=O)N[C@H](C[C@@H]2CCCN(C(N)=N)C2)C(=O)NCC(=O)N[C@H]3CCCN(C(N)=N)[C@@H]3O	ZINC000027869014	O=C(CNC(=O)C(CC1CCCNC1)NS(=O)(=O)Cc2ccccc2)NC3CCCNC3
COc2ccc(CC(=O)O[C@@H]1CCC[N@@](C)C1)cc2	ZINC000000250411	O=C(Cc1ccccc1)OC2CCCNC2
CC2(C)C[C@]1(CCC[N@@](CCC(N)=O)C1)CCO2	ZINC000000330629	C1CNCC2(C1)CCOCC2
COc1ccccc1CNC(=O)[C@@H](NC(=O)C2CCCCC2)C(C)C	ZINC000000248203	O=C(CNC(=O)C1CCCCC1)NCc2ccccc2
COc2cc(C(=O)NN1CCN(C)CC1)cc(OC)c2OC	ZINC000000168530	O=C(NN1CCNCC1)c2ccccc2
CN3C(=O)C[C@H](NCc2ccc1OCOc1c2)C3=O	ZINC000000049269	O=C3CC(NCc2ccc1OCOc1c2)C(=O)N3
O=Cc3ccc(N2CCN(Cc1ccccc1)CC2)nc3	ZINC000000169336	C2CN(c1ccccn1)CCN2Cc3ccccc3
CN(C)CC(C)(C)CNC(=O)C1(N)CCCCC1	ZINC000019439170	C1CCCCC1
COC(=O)CN(c2ccc(OCc1ccccc1)cc2)S(C)(=O)=O	ZINC000000582600	C(Oc1ccccc1)c2ccccc2
ClC3(NC(=O)c1ccccc1)C(=O)c2ccccc2C3=O	ZINC000000042152	O=C(NC2C(=O)c1ccccc1C2=O)c3ccccc3
CNC(=O)c3cccc(NC(=O)COc1cccc2ccccc12)c3	ZINC000000017448	O=C(COc1cccc2ccccc12)Nc3ccccc3
O=S(=O)(N[C@@H]1CCCC[C@@H]1N2CCCCC2)c3ccccc3	ZINC000000204580	O=S(=O)(NC1CCCCC1N2CCCCC2)c3ccccc3
CNC(=O)c3cccc(NC(=O)Cc1csc2ccccc12)c3	ZINC000000017446	O=C(Cc1csc2ccccc12)Nc3ccccc3
CN2C(C)(C)CC(NC(=O)c1ccccn1)CC2(C)C	ZINC000000269207	O=C(NC1CCNCC1)c2ccccn2
CC(C)[C@@](O)([C@H](C)O)C(=O)OCC2=CC[N@]1CC[C@@H](O)[C@H]12	ZINC000000525679	C2CC1C=CCN1C2
CC[C@@H](N)Cc1c[nH]c2ccccc12	ZINC000000139370	c2ccc1[nH]ccc1c2
N=C2CC(C=O)=Cc1ccccc1N2	ZINC000000023320	N=C2CC=Cc1ccccc1N2
C[N@]3CCO[C@@H](c1ccccc1)c2ccccc2C3	ZINC000000120181	C3COC(c1ccccc1)c2ccccc2CN3
O=N(=O)c3ccc2c(=O)n(C[C@@H]1CCCO1)c(=O)c2c3	ZINC000000069503	O=c2n(CC1CCCO1)c(=O)c3ccccc23
COc2ccc(CSC1=NCCN1)cc2N(=O)=O	ZINC000000179282	C2CN=C(SCc1ccccc1)N2
O=C(CN2CC[n+]3cc(c1ccccc1)sc23)c4ccccc4	ZINC000000161782	O=C(CN2CC[n+]3cc(c1ccccc1)sc23)c4ccccc4
C[n+]1ccccc1COc2ccc(\C=N\O)cc2	ZINC000000337568	C(Oc1ccccc1)c2ccccn2
CC(C)Oc1ccc(CN)cc1	ZINC000000153926	c1ccccc1
Cc3ccc(CN(CC(=O)Nc1ccccc1F)S(=O)(=O)c2ccc(Br)cc2)cc3	ZINC000000622594	O=C(CN(Cc1ccccc1)S(=O)(=O)c2ccccc2)Nc3ccccc3
C1C[n+]2c(S1)sc3ccccc23	ZINC000000053150	C1C[n+]2c(S1)sc3ccccc23
NC(=N)NC(=N)Nc1ccccc1S	ZINC000000164150	c1ccccc1
Cn1ccnc1SCC(=O)Nc2nccs2	ZINC000000053153	O=C(CSc1ncc[nH]1)Nc2nccs2
CC(C)c3ccc(C(=O)Cn2nc(COc1cc(C)ccc1C(C)C)oc2=S)cc3	ZINC000000622842	O=C(Cn2nc(COc1ccccc1)oc2=S)c3ccccc3
CCn1nccc1CNC	ZINC000000034156	c1cn[nH]c1
CCN(CC)S(=O)(=O)c2cccc(C(=O)NCc1ccccc1)c2	ZINC000000192897	O=C(NCc1ccccc1)c2ccccc2
CN(C)Cc2nc(c1c(Cl)cccc1Cl)no2	ZINC000000165973	c2ccc(c1ncon1)cc2
CCSc2nnc(NC(=O)[C@@H](C)c1ccc(CC(C)C)cc1)s2	ZINC000000363646	O=C(Cc1ccccc1)Nc2nncs2
Cn2nc(CN)c1ccccc1c2=O	ZINC000000193381	O=c1[nH]ncc2ccccc12
COC(=O)C3CCN(C(=O)c2ccc(N(Cc1ccccc1Cl)S(C)(=O)=O)cc2)CC3	ZINC000000622110	O=C(N1CCCCC1)c3ccc(NCc2ccccc2)cc3
CNCCCNCc1cc(OC)c(OC)c(OC)c1	ZINC000008376966	c1ccccc1
Cc2c(CNc1ccccc1)cnc3nc(N)nc(N)c23	ZINC000000023781	C(Nc1ccccc1)c3cnc2ncncc2c3
COC(=O)C1[C@@H](C)NC(=S)N=C1C	ZINC000000123244	S=C1NCCC=N1
C[N@]1CCC[C@H]1Cc3c[nH]c4ccc(CCS(=O)(=O)c2ccccc2)cc34	ZINC000000607845	O=S(=O)(CCc3ccc2[nH]cc(CC1CCCN1)c2c3)c4ccccc4
CN(C)CCCN2C(=O)CCn3c1CCCCc1c4cccc2c34	ZINC000000403639	O=C2CCn3c1CCCCc1c4cccc(N2)c34
CC(=O)N3CCN(c1ccnc2cc(Cl)ccc12)CC3	ZINC000000171631	C3CN(c1ccnc2ccccc12)CCN3
Cc5ccnc(N4CCN(CCc1c(C)n3CCCc2cccc1c23)CC4)c5	ZINC000000598506	C3Cc4cccc5c(CCN2CCN(c1ccccn1)CC2)cn(C3)c45
O=C(NC3CCN(Cc2ccc1ccccc1c2)CC3)NC(=O)c4ccccc4	ZINC000000538150	O=C(NC3CCN(Cc2ccc1ccccc1c2)CC3)NC(=O)c4ccccc4
CN(C)Cc2cc(CCNC(=O)c1ccc(Cl)cc1)ccc2O	ZINC000000210059	O=C(NCCc1ccccc1)c2ccccc2
COc2cccc(OC[C@@H](O)CN1C(C)(C)CC(O)CC1(C)C)c2	ZINC000000240321	C2CCN(CCCOc1ccccc1)CC2
O=c2oc1cccnc1n2CCN4CCN(c3ccccc3)CC4	ZINC000000005314	O=c2oc1cccnc1n2CCN4CCN(c3ccccc3)CC4
CN2CCC[C@@]1(CCCNC1)C2	ZINC000000106624	C1CNCC2(C1)CCCNC2
Nc3ccc(S(=O)(=O)Nc1ccnn1c2ccccc2)cc3	ZINC000000057490	O=S(=O)(Nc1ccnn1c2ccccc2)c3ccccc3
Clc2ccc(NC(=O)N1CNC(=NN(=O)=O)NC1)cc2	ZINC000000089185	N=C2NCN(C(=O)Nc1ccccc1)CN2
CCOC(=O)[C@@H]2CCC[N@@](Cc1ccoc1)C2	ZINC000000240227	C2CCN(Cc1ccoc1)CC2
COc4ccc(C[N@]3C[C@@H](CN1CCN(C)CC1)C[C@@H](C(=O)NC[C@@H]2CCCO2)C3)cc4OC	ZINC000023353899	O=C(NCC1CCCO1)C4CC(CN2CCNCC2)CN(Cc3ccccc3)C4
Cn2c(=O)[nH]c(=O)c3n1CCNNc1nc23	ZINC000000039709	O=c3[nH]c(=O)c2n1CCNNc1nc2[nH]3
Cc1oncc1C(=O)Nc2ccc(C(F)(F)F)cc2	ZINC000000004840	O=C(Nc1ccccc1)c2cnoc2
OC[C@@H]2CCC[N@@](Cc1ccncc1)C2	ZINC000000216911	C2CCN(Cc1ccncc1)CC2
C1CN3CCC1C(c2ccccn2)=C3	ZINC000000004847	C1CN3CCC1C(c2ccccn2)=C3
Cc1ccccc1[N+](=O)Cc2cccs2	ZINC000000116170	O=[N+](Cc1cccs1)c2ccccc2
C[N+](C)(C)[C@@H]2[C@@H](O)O[C@H]1[C@@H](O)CO[C@H]12	ZINC000000039940	C2CC1OCCC1O2
COc1ccccc1CN3CCC(N2CCCCC2)CC3	ZINC000000243796	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
Nn2cn[n+](CC(=O)c1ccccc1)c2	ZINC000000262283	O=C(C[n+]1c[nH]cn1)c2ccccc2
Cn1ccnc1CC(O)(c2ccccc2)c3ccccc3	ZINC000000255276	C(C(c1ccccc1)c2ccccc2)c3ncc[nH]3
C\C(=C\CCN1CCC3(CC1)N(c2ccccc2)CNC3=O)c4ccc(F)cc4	ZINC000000538370	O=C2NCN(c1ccccc1)C24CCN(CCC=Cc3ccccc3)CC4
CCOC(=O)c2ccc(CNCc1ccc(Br)cc1)cc2	ZINC000000259100	C(NCc1ccccc1)c2ccccc2
CC[C@@]2(OC(=O)c1ccccc1)C[C@@H](C)[N@@](C)C[C@@H]2C	ZINC000000079792	O=C(OC1CCNCC1)c2ccccc2
Brc4cc(C(=O)N[C@@H]1CN2CCC1CC2)c3[nH]cnc3c4	ZINC000000385643	O=C(NC1CN2CCC1CC2)c3cccc4nc[nH]c34
Oc2cnc(=c1ccc(=O)cc1)[nH]c2	ZINC000000403188	O=c2ccc(=c1nccc[nH]1)cc2
CCOC(=O)CCN1CCC1	ZINC000000389483	C1CNC1
ON=C2CCN(Cc1ccccc1)CC2	ZINC000000184878	N=C2CCN(Cc1ccccc1)CC2
Oc1ccccc1\C=N\NC(=O)c2ccncc2	ZINC000000002061	O=C(NN=Cc1ccccc1)c2ccncc2
FC(F)(F)c3cc(N1CCNCC1)c2ccccc2n3	ZINC000000170653	C3CN(c1ccnc2ccccc12)CCN3
CN3CCN(c2nc1n(C)c(=O)[nH]c(=O)c1n2CC(C)=C)CC3	ZINC000000189490	O=c3[nH]c(=O)c2[nH]c(N1CCNCC1)nc2[nH]3
O=C3C[C@H](Nc2ccc(N1CCCCC1)cc2)C(=O)N3Cc4ccccc4	ZINC000000639860	O=C3CC(Nc2ccc(N1CCCCC1)cc2)C(=O)N3Cc4ccccc4
Nc3nc(N)c2nc(c1ccco1)c(N)nc2n3	ZINC000000001499	c3coc(c2cnc1ncncc1n2)c3
CN3CCN(c1ccccc1Cc2ccccc2)CC3	ZINC000000002068	C3CN(c1ccccc1Cc2ccccc2)CCN3
CN(C)CCOC(=O)CCOCCN1CC1	ZINC000001667836	C1CN1
Cc1nccn1CCC(N)=O	ZINC000000244205	c1c[nH]cn1
C[N@]3CCC[C@H](OC(=O)[C@](O)(C1CCCCC1)c2ccccc2)C3	ZINC000000000667	O=C(OC1CCCNC1)C(C2CCCCC2)c3ccccc3
COc2ccc(NS(=O)(=O)c1c(F)c(F)c(F)c(F)c1F)cc2NC(=O)[C@@H](NC(C)=O)[C@@H](C)O	ZINC000001550374	O=S(=O)(Nc1ccccc1)c2ccccc2
COc4ccc3nc2n(SCc1c(C)c(OC)c(C)c[n+]12)c3c4	ZINC000000000728	C3Sn1c(nc2ccccc12)[n+]4ccccc34
CC(=NNC(=O)COc1ccc(Cl)cc1)c2ccc(N(=O)=O)cc2	ZINC000000060072	O=C(COc1ccccc1)NN=Cc2ccccc2
CC[N@]3CCC[C@@H](OC(=O)C(O)(c1ccccc1)c2ccccc2)C3	ZINC000000390428	O=C(OC1CCCNC1)C(c2ccccc2)c3ccccc3
CCn3cc(C(=O)NCCc1ccncc1)c(=O)c4cnc(N2CCCC2)nc34	ZINC000000602073	O=C(NCCc1ccncc1)c4c[nH]c3nc(N2CCCC2)ncc3c4=O
COc1ccccc1C(=O)n3c2CCCCc2nc3SCC(=O)N(C(C)C)c4ccccc4	ZINC000000623465	O=C(CSc2nc1CCCCc1n2C(=O)c3ccccc3)Nc4ccccc4
CCC[C@]2(c1cccc(O)c1)CC[N@@](C)C2	ZINC000000000663	C2CC(c1ccccc1)CN2
C[C@@H](NC(=O)CSc1nc(N)cc(N)n1)c2ccccc2	ZINC000000377122	O=C(CSc1ncccn1)NCc2ccccc2
Cc3ccc(C(=O)c2oc1nc(C)ccc1c2NC(N)=O)c(C)n3	ZINC000000023188	O=C(c1cccnc1)c3cc2cccnc2o3
CCOC(=O)c2[nH]c(C)c(C(=O)Nc1ccc(OC)c(OC)c1)c2C	ZINC000000253738	O=C(Nc1ccccc1)c2cc[nH]c2
COc1ccccc1[C@@H](CCN)c3ccc2OCOc2c3	ZINC000000287376	C3Oc2ccc(Cc1ccccc1)cc2O3
C[N+]2(C)CCc1cc(Br)ccc12	ZINC000000021672	C2Cc1ccccc1N2
CNc2nc1n(C)c(=O)[nH]c(=O)c1n2CCCc3ccccc3	ZINC000000042880	O=c3[nH]c(=O)c2n(CCCc1ccccc1)cnc2[nH]3
CSc2nn(c1ccccc1)c(C)[n+]2c3ccccc3	ZINC000000156078	c3ccc(n2c[n+](c1ccccc1)cn2)cc3
CSCC[C@@H](NC(=O)CN2C(=O)[C@H](N(C)C(=O)[C@@H](N)CS)N=C(c1ccccc1)c3ccccc23)C(O)=O	ZINC000028762777	O=C3CN=C(c1ccccc1)c2ccccc2N3
CCN4CCC(COc2nc1ccsc1n3cccc23)CC4	ZINC000000026795	C4CC(COc2nc1ccsc1n3cccc23)CCN4
CCOc3ccc(CC1=NCCc2cc(OC(C)C)c(OC(C)C)cc12)cc3OCC	ZINC000000597672	C3Cc1ccccc1C(Cc2ccccc2)=N3
CC(=O)SCC[N+](C)(C)C	ZINC000000163689	nonring
COc5ccc3c(cn(C)c4c2cc1OCOc1cc2ccc34)c5=O	ZINC000000004996	O=c1cccc2c1c[nH]c5c2ccc4cc3OCOc3cc45
Cn3c(=O)n(C)c2ncn(CN1CCCC1)c2c3=O	ZINC000000394504	O=c3[nH]c(=O)c2n(CN1CCCC1)cnc2[nH]3
C[N@]3CC[C@H]2Nc1ccc(C)cc1[C@@H]2C3	ZINC000000001161	C3CC2Nc1ccccc1C2CN3
CC(=O)c1cc(C(N)=O)c(=O)[nH]c1C	ZINC000000170381	O=c1cccc[nH]1
CN(C)CCC(=O)c1ccco1	ZINC000000036665	c1ccoc1
CC3CCN(CCCn2c(=S)[nH]c1ccccc1c2=O)CC3	ZINC000000313911	O=c2n(CCCN1CCCCC1)c(=S)[nH]c3ccccc23
O=C(N(C2CCN(CCc1ccccc1)CC2)c3cccnc3)c4ccco4	ZINC000000596859	O=C(N(C2CCN(CCc1ccccc1)CC2)c3cccnc3)c4ccco4
COc2cc1[nH]c(=O)[nH]c(=O)c1cc2OC	ZINC000000120622	O=c2[nH]c(=O)c1ccccc1[nH]2
O=C(CN1CCSCC1)N4CCc3[nH]c2ccccc2c3C4	ZINC000000526606	O=C(CN1CCSCC1)N4CCc3[nH]c2ccccc2c3C4
O=C(NCC1CCNCC1)Nc3nc2ccccc2s3	ZINC000000252732	O=C(NCC1CCNCC1)Nc3nc2ccccc2s3
COc2cccc(NC(=O)N(CCN(C)C)[C@@H](C)c1cccnc1)c2	ZINC000000262112	O=C(NCc1cccnc1)Nc2ccccc2
COc2ccc(/C=C/C(=O)NCCc1ccc(OC)c(OC)c1)cc2	ZINC000000094243	O=C(NCCc1ccccc1)C=Cc2ccccc2
Cc3ccc(N2C(=O)C[C@H](NC1CCCC1)C2=O)cc3	ZINC000000183123	O=C2CC(NC1CCCC1)C(=O)N2c3ccccc3
CCN(CC)CCn2c(C)nn3c1ccccc1nc23	ZINC000000085349	c1ccc2c(c1)nc3[nH]cnn23
COc3cc(c2nnc(Sc1ncccn1)o2)cc(OC)c3OC	ZINC000000183431	S(c1ncccn1)c3nnc(c2ccccc2)o3
COc3ccc(C(=O)N2CCN(C[C@H]1CCC=CC1)CC2)cc3	ZINC000000300455	O=C(N2CCN(CC1CCC=CC1)CC2)c3ccccc3
CN3CCN(c2ccc(S(=O)(=O)N1CCCCC1)cc2)CC3	ZINC000000151772	O=S(=O)(N1CCCCC1)c3ccc(N2CCNCC2)cc3
O=C(OC[C@H]1CCC[N@]2CCCC[C@H]12)c4cc3ccccc3oc4=O	ZINC000000052742	O=C(OCC1CCCN2CCCCC12)c4cc3ccccc3oc4=O
NC(=O)c1c[nH]c2ccc(N)cc12	ZINC000000058149	c2ccc1[nH]ccc1c2
CN2CCN(Cc1ccc(N(=O)=O)o1)CC2	ZINC000000237666	C2CN(Cc1ccco1)CCN2
COCCn3c(=S)[nH]c(=O)\c(=C/N2CCN(S(=O)(=O)c1ccc(Cl)cc1)CC2)c3=O	ZINC000009705286	O=c1[nH]c(=S)[nH]c(=O)c1=CN3CCN(S(=O)(=O)c2ccccc2)CC3
COc3cncc(N1[C@H]2CCNC[C@@H]1CC2)c3	ZINC000000026373	C1CC2CCC(CN1)N2c3cccnc3
CN4CCN(c2nsc3nc1ccccc1n23)CC4	ZINC000000022789	C4CN(c2nsc3nc1ccccc1n23)CCN4
O[C@@H](CNCc1ccc(Cl)c(Cl)c1)Cn2ccc3ccccc23	ZINC000000117348	C(CNCc1ccccc1)Cn2ccc3ccccc23
O=C(CCC1CCCC1)N2CCNCC2	ZINC000000245523	O=C(CCC1CCCC1)N2CCNCC2
C3CN(c2cccc1OCCOc12)CCN3	ZINC000000001347	C3CN(c2cccc1OCCOc12)CCN3
CC[N+](C)(C)Cc1cccc(OC)c1	ZINC000000001348	c1ccccc1
CC(C)[C@@](C)(O)C#CCN1CCCCC1	ZINC000000296444	C1CCNCC1
CN(C)C[C@@H](O)[C@H](c1ccccc1)c2cccc(Cl)c2	ZINC000000000161	C(c1ccccc1)c2ccccc2
CCOc1c(N)cc(N)cc1C(N)=O	ZINC000000341598	c1ccccc1
Cc2cc(NC(=O)c1cccs1)no2	ZINC000000030970	O=C(Nc1ccon1)c2cccs2
COC(OC)c3ccc2c(N)c(C(=O)Nc1ccccc1)sc2n3	ZINC000000123530	O=C(Nc1ccccc1)c3cc2cccnc2s3
N[C@@H](CO)C23CC1CC(CC(C1)C2)C3	ZINC000000289775	C1C2CC3CC1CC(C2)C3
Fc3ccc(Nc2nc(Cl)nc(NCCC1=CCCCC1)n2)cc3	ZINC000000053807	C3CCC(CCNc2ncnc(Nc1ccccc1)n2)=CC3
COc1ccccc1OC(=O)CNC(=O)Cc3ccc(C(=O)c2ccc(C)cc2)n3C	ZINC000000596929	O=C(Cc2ccc(C(=O)c1ccccc1)[nH]2)NCC(=O)Oc3ccccc3
Nc2nc1ccccc1n2CC=C	ZINC000000233303	c2ccc1[nH]cnc1c2
CCN(CC)C(=O)[C@@]2(c1ccccc1)C[C@H]2CN	ZINC000000000506	C1CC1c2ccccc2
C3CN=C(C[C@@H](c1ccccc1)c2ccccn2)N3	ZINC000000000505	C3CN=C(CC(c1ccccc1)c2ccccn2)N3
C[N@]1CCN3[C@@H](C1)c2ccccc2Cc4ccccc34	ZINC000000000504	C1CN3C(CN1)c2ccccc2Cc4ccccc34
CC(C)COC(=O)c1ccc(N)cc1	ZINC000000001586	c1ccccc1
CN(C)CCn1cnc2ccccc12	ZINC000000315185	c2ccc1[nH]cnc1c2
COc1ccccc1C(=O)Nc2ccc(NC(C)=O)cc2	ZINC000000031844	O=C(Nc1ccccc1)c2ccccc2
CC1=NCCc2c1[nH]c3cc(O)ccc23	ZINC000000058176	C1Cc2c(C=N1)[nH]c3ccccc23
Clc2cccc(SC1CCNCC1)n2	ZINC000000000958	C2CC(Sc1ccccn1)CCN2
Fc3ccc(OCC2CCN(CC1CC1)CC2)cc3	ZINC000000013938	C1CC1CN3CCC(COc2ccccc2)CC3
CCCCN2CCC(NC(=O)CN1CCNCC1)CC2	ZINC000037631388	O=C(CN1CCNCC1)NC2CCNCC2
C[N@]1CC[C@H]3[C@@H](C1)c2cc(C)ccc2N3C(=O)C4CC4	ZINC000000052225	O=C(C1CC1)N3C2CCNCC2c4ccccc34
CN2CCN(NC(=O)c1cccc(F)c1)CC2	ZINC000000483671	O=C(NN1CCNCC1)c2ccccc2
Nc2nc1ccccc1n2CCOc3ccc(N(=O)=O)cc3	ZINC000000239238	C(Cn1cnc2ccccc12)Oc3ccccc3
COCc3cc(C)nc(N2CCN(Cc1ccccc1)CC2)c3C#N	ZINC000000350608	C2CN(c1ccccn1)CCN2Cc3ccccc3
FC(F)(F)c1ccccc1CN3CCC(N2CCCCC2)CC3	ZINC000000276866	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
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
FC(F)(F)c2nc1ccccc1c(=O)n2c3ccccc3	ZINC000000004739	O=c2n(c1ccccc1)cnc3ccccc23
Nc2cc(Cl)c(NC1=NCCN1)c(Cl)c2	ZINC000000020231	C2CN=C(Nc1ccccc1)N2
CC[C@@H](C)OC(=O)CSc1ccc(S(C)(=O)=O)cc1N(=O)=O	ZINC000000072202	c1ccccc1
Clc3cncc([C@@H]1CN2CCC1CC2)n3	ZINC000000005359	C1CN3CCC1C(c2cnccn2)C3
CCN(CC)Cc1cc(Cl)nc(Cl)c1	ZINC000000163067	c1ccncc1
COc3ccc2n(C)c(c1ccc(C=O)cc1)c[n+]2c3	ZINC000000337629	c3ccc(c2c[n+]1ccccc1[nH]2)cc3
Nc3cc(N)nc(SCc2nc(c1ccccc1)no2)n3	ZINC000000092402	C(Sc1ncccn1)c3nc(c2ccccc2)no3
COc2cccc([n+]1noc(=O)[nH]1)c2	ZINC000000050758	O=c2[nH][n+](c1ccccc1)no2
CNC(=O)CN1CCC(NC(=O)CCNC(C)C)CC1	ZINC000037618613	C1CCNCC1
CN(C)C(ON3C(=O)[C@H]2[C@H]1C[C@H](C=C1)[C@H]2C3=O)=[N+](C)C	ZINC000000154918	O=C3NC(=O)C2C1CC(C=C1)C23
C[N+]3(C)CC[C@H](OC(=O)[C@@](O)(C1CCCC1)c2ccccc2)C3	ZINC000000000346	O=C(OC1CCNC1)C(C2CCCC2)c3ccccc3
C(Sc1nnnn1c2ccccc2)c4ccc3nonc3c4	ZINC000000034379	C(Sc1nnnn1c2ccccc2)c4ccc3nonc3c4
CN2[C@@H]([N+](=O)Cc1c(F)cccc1Cl)C(C)(C)SC2=S	ZINC000000070485	O=[N+](Cc1ccccc1)C2CSC(=S)N2
O=C(N[C@H]2CCN(C(=O)c1ccccn1)C2)c3ccccn3	ZINC000000006914	O=C(NC2CCN(C(=O)c1ccccn1)C2)c3ccccn3
C[N@]1[C@H]3CC[C@@H]1CC(=NOC(=O)c2ccco2)C3	ZINC000000135880	O=C(ON=C1CC2CCC(C1)N2)c3ccco3
COC(=O)c1c[n+](C)ccc1SC	ZINC000000335004	c1ccncc1
CC1(C)OCO/C1=C\C[N+](C)(C)C	ZINC000000123406	C=C1COCO1
COC[C@@H](C)NCc1ccc(OC)c(C)c1	ZINC000000275581	c1ccccc1
O=C(CC(c1ccccc1)c2ccccc2)Nc3cccnc3	ZINC000000030155	O=C(CC(c1ccccc1)c2ccccc2)Nc3cccnc3
Cc2ccc1[nH]cc(CCN)c1c2	ZINC000000066085	c2ccc1[nH]ccc1c2
COc3ccc([C@H]2CC(c1cc(OC)cc(OC)c1)=NC(=N)N2)cc3	ZINC000000031979	N=C3NC(c1ccccc1)CC(c2ccccc2)=N3
CCOC(=O)c1ccccc1NC(=O)c2cc(N(=O)=O)ccc2Cl	ZINC000000103067	O=C(Nc1ccccc1)c2ccccc2
CCOC(=O)N3CCN(C(=O)CSc2nc(N)c(NC(=O)c1cccs1)c(=O)[nH]2)CC3	ZINC000009599473	O=C(CSc2ncc(NC(=O)c1cccs1)c(=O)[nH]2)N3CCNCC3
Cc1nc(C)c(I)c(NN)n1	ZINC000000153443	c1cncnc1
Fc3ccc(C(=O)C2CCN(CCc1ccccc1)CC2)cc3	ZINC000000011266	O=C(C2CCN(CCc1ccccc1)CC2)c3ccccc3
C[C@@H](O)\C=C\c2ccc1ccccc1[n+]2C	ZINC000000047472	c2ccc1ncccc1c2
Brc2ccc(C(=O)Nc1ccc(C#N)cc1)o2	ZINC000000038391	O=C(Nc1ccccc1)c2ccco2
NC(=O)CC[N@]1C[C@@H]3C[C@H](C1)c2cccc(=O)n2C3	ZINC000000486175	O=c3cccc2C1CNCC(C1)Cn23
C[C@@](N)(Cc2ccc1OCOc1c2)C(N)=O	ZINC000000096871	C2Oc1ccccc1O2
CC(C)C[C@H]2NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](N)CCCCNC(=O)[C@@H](CCCNC(N)=N)NC2=O	ZINC000027109516	O=C2CCCCCNC(=O)CNC(=O)CNC(=O)CNC(=O)C(Cc1ccccc1)N2
CC(=O)NCCSSCCNC(=O)C2CCC(NC(=O)c1nccnc1C(O)=O)CC2	ZINC000012502356	O=C(NC1CCCCC1)c2cnccn2
Clc4ccc(c3noc(CSC2=NC[C@@H]1CCC[C@@H]1N2)n3)cc4	ZINC000000137824	C4CC3CN=C(SCc2nc(c1ccccc1)no2)NC3C4
C[C@H](N)Cn1nc(C)c2cc(F)c(F)cc12	ZINC000000025572	c2ccc1[nH]ncc1c2
CN(C(C)=O)c2ccc(NC(=O)COc1ccccc1C)cc2	ZINC000000038864	O=C(COc1ccccc1)Nc2ccccc2
Fc2cccc3C=C(CCN1CCCC1)CCc23	ZINC000000021689	C3CCN(CCC2=Cc1ccccc1CC2)C3
C[C@H]2N(CC1=NCCN1)Cc3ccccc23	ZINC000000024559	C3CN=C(CN2Cc1ccccc1C2)N3
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1\C=C\c2ccccc2	ZINC000000048954	O=C2NC=CC(C=Cc1ccccc1)N2
CN(C)C(=O)CC[C@H](NC(=O)OC(C)(C)C)C(=O)Cn2[nH]c(=O)c1c(F)c(F)c(F)c(F)c1c2=O	ZINC000013585502	O=c1[nH][nH]c(=O)c2ccccc12
Cc3ccc(S(=O)(=O)N2CCN(C(=O)CN1CCCC1)C2)cc3	ZINC000000048959	O=C(CN1CCCC1)N3CCN(S(=O)(=O)c2ccccc2)C3
Fc3ccc(NC(=O)CCN2CCN(c1ccccn1)CC2)cc3	ZINC000000224521	O=C(CCN2CCN(c1ccccn1)CC2)Nc3ccccc3
C[C@H]2C[C@](O)(c1ccc(C)cc1)[C@@H](C)C[N@]2C	ZINC000000051420	C2CC(c1ccccc1)CCN2
C[C@H]2C[C@](O)(Cc1ccc(C)cc1)[C@@H](C)C[N@]2C	ZINC000000051421	C2CC(Cc1ccccc1)CCN2
CCN(CC)c2nc1ccccc1n3cnnc23	ZINC000000012507	c1ccc3c(c1)ncc2nncn23
Nc2ccc(OC[C@@H](O)C[n+]1ccccc1)cc2	ZINC000000028255	C(COc1ccccc1)C[n+]2ccccc2
Cc2cc[n+](CCOc1ccc(N)cc1)cc2	ZINC000000028254	C(C[n+]1ccccc1)Oc2ccccc2
C3CCN(Cc1csc2ccccc12)C3	ZINC000000164331	C3CCN(Cc1csc2ccccc12)C3
O=C1CCC(=O)N1CCSC(=S)N2CCOCC2	ZINC000000241080	O=C1CCC(=O)N1CCSC(=S)N2CCOCC2
CN1C2C(N(CO)C1=O)N(CO)C(=O)N2C	ZINC000000052038	O=C2NC1NC(=O)NC1N2
CN(C)CC(=O)Nc3ccc2[nH]c(=O)c1ccccc1c2c3	ZINC000000008960	O=c2[nH]c1ccccc1c3ccccc23
O=C2C[C@@H](N1CCCCC1)C=C2Nc3ccccc3	ZINC000000118195	O=C2CC(N1CCCCC1)C=C2Nc3ccccc3
Cc3ccnc(NC2CCN(C(=O)c1ccoc1)CC2)c3	ZINC000000025792	O=C(N2CCC(Nc1ccccn1)CC2)c3ccoc3
COC(=O)[C@@H](CNCc1ccccc1)n4c(=O)n3CC=C[C@H](C(=O)NCc2ccc(N)nc2C)n3c4=O	ZINC000013489357	O=C(NCc1cccnc1)C2C=CCn4n2c(=O)n(CCNCc3ccccc3)c4=O
CCSc1sc(CN(C)C)cc1\C=N\O	ZINC000000042380	c1ccsc1
CC[C@@]4(CO)CCC[N@]3CCc1c([nH]c2ccccc12)[C@@H]34	ZINC000000000839	C4CCN3CCc1c([nH]c2ccccc12)C3C4
C4CN(CCn2c(c1ccccc1)cs/c2=N/c3ccccc3)CCO4	ZINC000000623181	C4CN(CCn2c(c1ccccc1)csc2=Nc3ccccc3)CCO4
CC(=O)O[C@@H](CN1CCCC1)C(C)(C)C	ZINC000000106432	C1CCNC1
CCN(CC)C(=O)N1CCN(C)CC1	ZINC000000001288	C1CNCCN1
COc3ccc(NC(=O)CSc2nnc(c1ccc(Br)cc1)n2N)cc3	ZINC000000623524	O=C(CSc2nnc(c1ccccc1)[nH]2)Nc3ccccc3
COc1ccc(N(=O)=O)cc1NCc2cc(OC)c(OC)c(OC)c2	ZINC000000243101	C(Nc1ccccc1)c2ccccc2
NC(=O)c4ccc(n1nnnc1Oc3ccc2ccc(=O)oc2c3)cc4	ZINC000000529098	O=c4ccc3ccc(Oc1nnnn1c2ccccc2)cc3o4
C[N@]1CC[C@@](C)(O)[C@@H](C(C)=O)C1	ZINC000000195129	C1CCNCC1
Nc1ccccc1C(=O)OCC[C@@H]2CCCCN2	ZINC000000000638	O=C(OCCC1CCCCN1)c2ccccc2
CCN3CCC(N2CCN(c1cccc(Cl)c1)CC2)CC3	ZINC000000220390	C3CC(N2CCN(c1ccccc1)CC2)CCN3
CC(C)(C)OC(=O)[C@H]1CCCN1	ZINC000000156852	C1CCNC1
CNCC(=O)N2CCc1ccccc1[C@@H]2C	ZINC000000250981	C2Cc1ccccc1CN2
Cc2cccc(NCN1C(=O)CCC1=O)n2	ZINC000000138632	O=C1CCC(=O)N1CNc2ccccn2
COc2ccc(c1nnc(SCC(=O)N(C(C)C)C(C)C)o1)cc2	ZINC000000415791	c2ccc(c1nnco1)cc2
COC(=O)c3ccc(C(=O)OC)c(NC(=O)[C@@H](CC(C)C)n2c(=O)c1ccccc1c2=O)c3	ZINC000000622325	O=C(Cn2c(=O)c1ccccc1c2=O)Nc3ccccc3
NC(=O)C2CCN(C[C@@H](O)c1ccccc1)CC2	ZINC000000118354	C2CCN(CCc1ccccc1)CC2