Nc3c(Cl)cc(C(=O)N[C@H]1CN2CCC1CC2)c4OCCc34	ZINC000000005108	O=C(NC1CN2CCC1CC2)c4cccc3CCOc34
CCNC(=O)CN1CCN(C(=O)C(=O)N(C[C@@H](C)O)[C@@H](C)CO)CC1	ZINC000410866104	C1CNCCN1
Fc2ccc(NC(=O)CCC(=O)Nc1ccc(F)cc1F)cc2	ZINC000000031595	O=C(CCC(=O)Nc1ccccc1)Nc2ccccc2
CC(=O)Nc2ccc(OC(=O)[C@H]1CCC(=O)N1)cc2	ZINC000000004287	O=C2CCC(C(=O)Oc1ccccc1)N2
Cc1cc(=O)oc2cc(NC(=O)CN)ccc12	ZINC000000057339	O=c2ccc1ccccc1o2
Fc5ccc(n3cc(C2CCN(CCN1CCNC1=O)CC2)c4cc(Cl)ccc34)cc5	ZINC000000538337	O=C1NCCN1CCN5CCC(c3cn(c2ccccc2)c4ccccc34)CC5
Fc1cccc(Cl)c1CSc2ccccc2C3=NCCCN3	ZINC000000139184	C3CNC(c1ccccc1SCc2ccccc2)=NC3
OC(=O)c1cc(N(=O)=O)ccc1Sc2ccc(Cl)cc2	ZINC000000090487	S(c1ccccc1)c2ccccc2
CC(C)O[C@H]3C[C@@H]1CCCC[N+]1(Cc2ccccc2)O3	ZINC000000164095	C3CC[N+]2(Cc1ccccc1)OCCC2C3
COc1ccccc1C[N@]2C[C@@H]4C[C@H](C2)c3cccc(=O)n3C4	ZINC000000228620	O=c4cccc3C2CC(CN(Cc1ccccc1)C2)Cn34
Cc1ncc(CSC(N)=N)n1Cc2ccccc2	ZINC000003954518	C(c1ccccc1)n2ccnc2
C3CCCN(C2CCN(Cc1ccccn1)CC2)CC3	ZINC000000207669	C3CCCN(C2CCN(Cc1ccccn1)CC2)CC3
CC(C)OC(=O)C1=C(C)NC(=O)N[C@@H]1c2cccc(N(=O)=O)c2	ZINC000000042030	O=C2NC=CC(c1ccccc1)N2
OCCN(CCO)S(=O)(=O)c1ccc(/C=C/C(O)=O)cc1	ZINC000000266587	c1ccccc1
CN([C@@H]1CNC(=NC(N)=O)NC1=O)C(=O)C[C@@H](N)c2csc(CCN)n2	ZINC000026579837	N=C2NCC(NC(=O)CCc1cscn1)C(=O)N2
COc3cccc(C(=O)N2CCC(N1CCCCC1)(C(N)=O)CC2)c3	ZINC000000153848	O=C(N2CCC(N1CCCCC1)CC2)c3ccccc3
OC(=O)c3ccc(CNS(=O)(=O)c2ccc1[nH]c(=O)oc1c2)cc3	ZINC000002356845	O=c3[nH]c2ccc(S(=O)(=O)NCc1ccccc1)cc2o3
Nc2ccc(N1CCCCC1)cc2	ZINC000000152886	C2CCN(c1ccccc1)CC2
Cc2ccc(S(=O)(=O)NNC(=S)NC[C@@H]1CCCO1)cc2	ZINC000000419885	O=S(=O)(NNC(=S)NCC1CCCO1)c2ccccc2
Cn2c(CC(=O)c1ccc(O)cc1O)nc3ccccc23	ZINC000000042631	O=C(Cc2nc1ccccc1[nH]2)c3ccccc3
COc3ccc(CN([C@@H]2CC(=O)N(c1ccc(F)cc1)C2=O)C(=O)C=CC(O)=O)cc3	ZINC000000715147	O=C2CC(NCc1ccccc1)C(=O)N2c3ccccc3
COc2ccc(Nc1nc(NN)nc(OCC(F)(F)F)n1)cc2	ZINC000000032710	N(c1ccccc1)c2ncncn2
CC(=O)Nc3ccc(NC(=O)C[C@@H]2OC[C@@H]1CCCCN1C2=O)cc3	ZINC000000198079	O=C(CC2OCC1CCCCN1C2=O)Nc3ccccc3
NS(=O)(=O)NC3CCN(S(=O)(=O)c2ccc1CCNC(=O)c1c2)CC3	ZINC000625586170	O=C2NCCc3ccc(S(=O)(=O)N1CCCCC1)cc23
C[C@H]1CNCCCN1S(=O)(=O)c2cccc3cncc(C)c23	ZINC000000022706	O=S(=O)(N1CCCNCC1)c2cccc3cnccc23
CC(C)(C)c1nccn1C[C@@H]4CC(c2ccccc2)(c3ccccc3)C(=O)O4	ZINC000000599226	O=C2OC(Cn1ccnc1)CC2(c3ccccc3)c4ccccc4
COc1cc(C(O)=O)cc(OC)c1OC(C)=O	ZINC000000058194	c1ccccc1
COc3ccc2cc(C(N)=O)c(=N/c1ccc(C(N)=O)cc1)/oc2c3	ZINC000000191920	N(c1ccccc1)=c3ccc2ccccc2o3
COc3ccc2[nH]c1nc(SCCN(C)C)nnc1c2c3	ZINC000000175145	c1ccc2c(c1)[nH]c3ncnnc23
Cc3nn(c1ccccn1)c4C[C@H](c2ccco2)CC(=O)c34	ZINC000000038177	O=C2CC(c1ccco1)Cc3c2cnn3c4ccccn4
C2CCN=C(c1ccccc1)NC2	ZINC000000188448	C2CCN=C(c1ccccc1)NC2
Fc3nc(F)c(F)c(N2C(=O)c1ccccc1S2(=O)=O)c3F	ZINC000000033357	O=C2N(c1ccncc1)S(=O)(=O)c3ccccc23
COc3ccc(C[C@H]1NCC[C@@]2(O)CCCC[C@H]12)cc3	ZINC000000191928	C1CCC2C(C1)CCNC2Cc3ccccc3
Cc2c(C(=O)NCCCN1CCOCC1)oc3CCCC(=NNC(N)=N)c23	ZINC000040824717	N=C2CCCc3oc(C(=O)NCCCN1CCOCC1)cc23
C[C@H](CO)NC(=O)[C@@H]2C[N@@](C)[C@H]1Cc3c[nH]c4cccc(C1=C2)c34	ZINC000000057316	C4CC=C1C(Cc2c[nH]c3cccc1c23)N4
C[C@H]2CN(S(=O)(=O)c1ccc(S(N)(=O)=O)cc1)C[C@@H](C(N)=O)O2	ZINC000625371361	O=S(=O)(N1CCOCC1)c2ccccc2
Nc2nc(N)c(N)c(Nc1ccc(Br)cc1)n2	ZINC000000135678	N(c1ccccc1)c2ccncn2
CC(C)N2CCC(O)(CNS(=O)(=O)N1CCN(S(C)(=O)=O)CC1)CC2	ZINC000443503664	O=S(=O)(NCC1CCNCC1)N2CCNCC2
O=C(NC(=S)Nc1ccccc1C#N)c2ccccc2N(=O)=O	ZINC000000106616	O=C(NC(=S)Nc1ccccc1)c2ccccc2
CC(C)Oc3ccc(\C=N\CC2(c1ccccc1)CCOCC2)cc3	ZINC000000209044	C3CC(CN=Cc1ccccc1)(c2ccccc2)CCO3
CCOC(=O)c1c(CN(C)C)n(C)c2ccc(OC(C)=O)cc12	ZINC000000523645	c2ccc1[nH]ccc1c2
CC[N@@]2CCc1nc(N)oc1CC2	ZINC000000000982	C2Cc1ncoc1CCN2
CC(=O)O[C@@H](COCc1ccccc1)C[N+]2(C)CCOCC2	ZINC000000494171	C(COCc1ccccc1)CN2CCOCC2
CN2CCC(N(C)CC(/Br)=C/c1ccccc1)CC2	ZINC000000216869	C2CC(NCC=Cc1ccccc1)CCN2
Cc2cnc1cc(Cl)ccc1c2NCCNCCO	ZINC000001700233	c2ccc1ncccc1c2
CNC(=S)NS(=O)(=O)c2cc(CCNC(=O)c1cc(Cl)ccc1OC)ccc2OC	ZINC000000599915	O=C(NCCc1ccccc1)c2ccccc2
CCOC(=O)c2cn1[nH]c(=O)c(Br)c1nc2C	ZINC000000049633	O=c2cc1ncccn1[nH]2
CC2(C)CC(NCC(=O)OC1CCCCC1)CC(C)(C)N2	ZINC000000052222	O=C(CNC1CCNCC1)OC2CCCCC2
C[N@]3CCC[C@@H](NC(=O)NCCCN2CCN(c1ncccn1)CC2)C3	ZINC000052522560	O=C(NCCCN2CCN(c1ncccn1)CC2)NC3CCCNC3
O=C(CN1CCCCC1)N3CCN(S(=O)(=O)c2ccccc2)C3	ZINC000000193627	O=C(CN1CCCCC1)N3CCN(S(=O)(=O)c2ccccc2)C3
Fc4ccc3c1ccccc1[C@]2(NC(=O)NC2=O)c3c4	ZINC000000003857	O=C1NC(=O)C4(N1)c2ccccc2c3ccccc34
C3CN(CCN2CCC(Cc1ccccc1)CC2)CCN3	ZINC000020179785	C3CN(CCN2CCC(Cc1ccccc1)CC2)CCN3
Cc3cccc(N2CCN(CCc1cc(C)[nH]n1)CC2)c3	ZINC000000002195	C2CN(c1ccccc1)CCN2CCc3cc[nH]n3
COc4ccc3n(=O)ccc([C@@H](O)[C@@H]1C[C@@H]2CC[N@@]1C[C@H]2C=C)c3c4	ZINC000000398047	O=n3ccc(CC1CC2CCN1CC2)c4ccccc34
C[C@@H](O)CN2CCN(C[C@H](O)C[N@]1C[C@H](C)O[C@H](C)C1)C[C@@H]2C	ZINC000071876905	C(CN1CCNCC1)CN2CCOCC2
COc1ccccc1n3c(C)nc2ccccc2c3=O	ZINC000000033534	O=c2n(c1ccccc1)cnc3ccccc23
CN(C)CC[C@H](N)C(=O)NC[C@@H]1C[C@H](F)CN1c2ccnc(N(C)C)n2	ZINC000653160333	C2CCN(c1ccncn1)C2
CCOc2ccc(c1cnc(N)nc1N)cc2	ZINC000000374791	c2ccc(c1cncnc1)cc2
NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H]3CNCCN3C(=O)C4CCNCC4	ZINC000012605027	O=C(NCCc1c[nH]c2ccccc12)C3CNCCN3C(=O)C4CCNCC4
C[C@@H](CC(=O)c1ccc(Cl)c(Cl)c1)C(O)=O	ZINC000000022202	c1ccccc1
Brc3ccc2nc1CCCCc1n2c3	ZINC000000115904	C1CCc2c(C1)nc3ccccn23
CN(CC[N+]1(C)CCCC1)C(=O)[C@](O)(c2ccccc2)c3cccs3	ZINC000000607834	O=C(NCCN1CCCC1)C(c2ccccc2)c3cccs3
O=c2[nH]c1ccccc1n2C3=CCNCC3	ZINC000000394330	O=c2[nH]c1ccccc1n2C3=CCNCC3
CCC[N@@](C)CCN=CNc2sc1c(CC(C)(C)NC1(C)C)c2C#N	ZINC000005951840	C2Cc1ccsc1CN2
CN4CCN(c3ccc(NC(=O)c2cc1ccccc1o2)cc3)CC4	ZINC000000360002	O=C(Nc2ccc(N1CCNCC1)cc2)c4cc3ccccc3o4
Cc1nccn1CCCN2C(=O)CNC2=S	ZINC000000481630	O=C1CNC(=S)N1CCCn2ccnc2
Cc4ccc(C[N+]23CC[N+](Cc1ccc(C)cc1)(CC2)CC3)cc4	ZINC000001255409	C2C[N+]4(Cc1ccccc1)CC[N+]2(Cc3ccccc3)CC4
CC(C)c1cc(I)ccc1NC(=O)CSc2nc(N)cc(N)n2	ZINC000000622458	O=C(CSc1ncccn1)Nc2ccccc2
O=C(NC2CCN(Cc1ccccc1)CC2)c3ccco3	ZINC000000087347	O=C(NC2CCN(Cc1ccccc1)CC2)c3ccco3
NCc2ccc(N1CCN(CCO)CC1)cc2	ZINC000011757270	C2CN(c1ccccc1)CCN2
Nc2ncnc3[nH]c(SCCN1CCCCC1)nc23	ZINC000000280705	C3CCN(CCSc2nc1cncnc1[nH]2)CC3
CC[N@]2CCC[C@H](N1C(=O)OC(C)(C)[C@@]1(C)O)C2	ZINC000000086219	O=C1OCCN1C2CCCNC2
O=C(CCN1CCCC1)NC[C@@H]2OCCc3ccccc23	ZINC000000118778	O=C(CCN1CCCC1)NCC2OCCc3ccccc23
COC[n+]2cccc([C@@H]1CCC[N+]1(C)C)c2	ZINC000001563615	C2CNC(c1cccnc1)C2
C[C@@H](Cc1ccc(F)cc1)NC2CCC(O)CC2	ZINC000000214034	C2CCC(NCCc1ccccc1)CC2
CC(C)(C)NC(=O)Cn2c(=O)c1ccccc1c2=O	ZINC000000135075	O=c1[nH]c(=O)c2ccccc12
CN4CCN([C@@]13CCCCC1=Cc2cc(N(=O)=O)ccc2O3)CC4	ZINC000000080831	C4CCC3(N1CCNCC1)Oc2ccccc2C=C3C4
CCCN(CC(=O)N[C@@H](CCCNC(N)=N)C=O)C(=O)[C@H]1CCCCN1	ZINC000003823933	C1CCNCC1
Cn2c(N1CCNCC1)nc3ccccc23	ZINC000000005586	C3CN(c2nc1ccccc1[nH]2)CCN3
COC(=O)c3ccc(NC(=O)c2cc[n+](Cc1ccccc1)cc2)cc3	ZINC000000437692	O=C(Nc1ccccc1)c3cc[n+](Cc2ccccc2)cc3
C[C@@H]3C[C@@H]([N@]1CNc2c(C1)c(=O)n(C)c(=O)n2C)CC(C)(C)C3	ZINC000000070157	O=c3[nH]c2NCN(C1CCCCC1)Cc2c(=O)[nH]3
CN(C)CC(=O)Nc1ccc(Cl)cc1	ZINC000000310609	c1ccccc1
OC2CCN(Cc1ccc(F)c(F)c1)CC2	ZINC000000199366	C2CCN(Cc1ccccc1)CC2
COc2ccc(CN1CCSCC1)c(OC)c2C	ZINC000000207286	C2CN(Cc1ccccc1)CCS2
C[C@@H](C[N@@](C)CCCN(C)C)NC(=O)N1CCN(CC(N)=O)C(=O)C1	ZINC000665763991	O=C1CNCCN1
CCC[N@@]2CCc1cc(O)cc4c1[C@H]2Cc3ccc(O)c(O)c34	ZINC000000011665	C2Cc3cccc4c1ccccc1CC(N2)c34
O=[N+](Cc1ccco1)c2ccccc2	ZINC000000116162	O=[N+](Cc1ccco1)c2ccccc2
COc2ccc3C[N@@](C)CC[C@@]14C=C[C@@H](O)C[C@H]1Oc2c34	ZINC000000018473	C2CC14C=CCCC1Oc3cccc(CN2)c34
CC(C)OC(=O)c2c(N)sc1C[C@H](C)CCc12	ZINC000000035883	C2CCc1sccc1C2
CC(C)(C)N(O)C=c1cc[n+](=O)cc1	ZINC000000403577	C=c1cc[n+](=O)cc1
CCN(CC)CCn3nc2n(C)c1ccc(OC)cc1c(=O)c2c3C	ZINC000000390502	O=c2c1ccccc1[nH]c3n[nH]cc23
COC5=C[C@]14CCC[N@]1CCc3cc2OCOc2cc3[C@@H]4[C@H]5O	ZINC000000402821	C5CN4CCc2cc1OCOc1cc2C3CC=CC34C5
O=N(=O)c3ccc(CN2CCN(C[C@H]1CCC=CC1)CC2)cc3	ZINC000000178708	C3CC(CN2CCN(Cc1ccccc1)CC2)CC=C3
CN([C@@H]1CCCC[C@H]1N2CCCC2)C(=O)Cc3cccc4sccc34	ZINC000000607309	O=C(Cc1cccc2sccc12)NC3CCCCC3N4CCCC4
NS(=O)(=O)N3CCC(C(=O)N2CC(S(=O)(=O)N1CCNCC1)C2)CC3	ZINC000565003647	O=C(C1CCNCC1)N3CC(S(=O)(=O)N2CCNCC2)C3
CN4CCN(c2nsc3nc1ccccc1n23)CC4	ZINC000000022789	C4CN(c2nsc3nc1ccccc1n23)CCN4
CC(C)NC(=N)NC(=N)NCCNc1cccc2cccnc12	ZINC000001684793	c2ccc1ncccc1c2
COc2ccc(CCNC(=O)[C@@H]1CCCO1)cc2OC	ZINC000000083336	O=C(NCCc1ccccc1)C2CCCO2
Fc3ccc(N1C[C@H]2C[C@@H]1CN2)cc3	ZINC000000403199	C1NC3CC1N(c2ccccc2)C3
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
CN3[C@@H](CNC(=O)c1ccoc1)CN=C(c2ccccc2)c4ccc(F)cc34	ZINC000000607947	O=C(NCC3CN=C(c1ccccc1)c2ccccc2N3)c4ccoc4
O=C(N2CCN(CC1CCNCC1)CC2)c3ccccc3	ZINC000019680334	O=C(N2CCN(CC1CCNCC1)CC2)c3ccccc3
NC(=N)NCCC[C@@H]2NC(=O)c1cc(N(=O)=O)cc(F)c1NCCCC[C@@H](C(N)=O)NC(=O)CNC2=O	ZINC000008829329	O=C2CNC(=O)CNC(=O)c1ccccc1NCCCCCN2
CNS(=O)(=O)NC2CCN(C(=O)CNC(=O)c1ccncc1)CC2	ZINC000651952074	O=C(CNC(=O)c1ccncc1)N2CCCCC2
NC(=O)CN2CCN(C(=O)CNS(=O)(=O)c1cccnc1)CC2=O	ZINC000616225279	O=C2CN(C(=O)CNS(=O)(=O)c1cccnc1)CCN2
CN(C)Cc2coc1ccccc1c2=O	ZINC000000124378	O=c1ccoc2ccccc12
N[C@@H](Cc1ccccc1)C(=O)N[C@H]4[C@@H](O)[C@@H](n2cnc3c(N)ncnc23)O[C@H]4CO	ZINC000004824413	O=C(CCc1ccccc1)NC4COC(n2cnc3cncnc23)C4
Cc3ccnc(NS(=O)(=O)c2ccc(NC(=O)\C=C\c1cccc(Cl)c1)cc2)n3	ZINC000000673526	O=C(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)C=Cc3ccccc3
Nc1c(Br)cc(Br)cc1C(O)=O	ZINC000000056723	c1ccccc1
ONC(=O)CNC(=O)c1ccc(Cl)cc1	ZINC000000001008	c1ccccc1
COC(=O)[C@@H](Cc1ccc(O)c(O)c1)/N=C/c2ccc(N(C)C)cc2	ZINC000000517863	C(Cc1ccccc1)N=Cc2ccccc2
CNC(=O)[C@@H]1CCCN1C(=O)CNS(=O)(=O)c2nn(C)cc2N(=O)=O	ZINC000599233057	O=C(CNS(=O)(=O)c1cc[nH]n1)N2CCCC2
C[C@@](O)(CNC(=O)NC2CCN(C1CC1)CC2)CN3CCOCC3	ZINC000073570071	O=C(NCCCN1CCOCC1)NC3CCN(C2CC2)CC3
OC(=O)CC2(CC(=O)Nc1ccc(F)cc1)CCCC2	ZINC000000069291	O=C(CC1CCCC1)Nc2ccccc2
O=[N+](Cc1c[nH]c2ccccc12)c3ccccc3	ZINC000000079148	O=[N+](Cc1c[nH]c2ccccc12)c3ccccc3
Clc3ccc(c2noc(CN1CCCC1)n2)cc3	ZINC000000137850	C3CCN(Cc2nc(c1ccccc1)no2)C3
Cc4ccc(N3CCN(CCCN2C(=O)[C@@H]1CCCN1C2=O)CC3)cc4	ZINC000000633293	O=C2C1CCCN1C(=O)N2CCCN4CCN(c3ccccc3)CC4
CN(C)C[C@H](O)CN2C(=O)N(CN1C(=O)N(C[C@H](O)CN(C)C)C(=O)C1(C)C)C(C)(C)C2=O	ZINC000009057266	O=C2CN(CN1CC(=O)NC1=O)C(=O)N2
COc3nc(NCc1cccnc1)nc(N2CCC(C)CC2)n3	ZINC000000033266	C3CCN(c2ncnc(NCc1cccnc1)n2)CC3
CN(C)Cc3ccc(C(O)(c1ccccc1)c2ccc(CN(C)C)cc2)cc3	ZINC000004933546	c3ccc(C(c1ccccc1)c2ccccc2)cc3
CN(C)C(=O)[C@@H]1CCC[N@]1CCCNC(=O)NC2CCN(CCO)CC2	ZINC000601301600	O=C(NCCCN1CCCC1)NC2CCNCC2
C[C@@H](O)[C@@H](O)c1ccc(C#N)nc1	ZINC000000023802	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
COc2ccc([C@H](N1CCCC1)C(N)=O)cc2	ZINC000000393748	C2CCN(Cc1ccccc1)C2
COc5ccc4c2C[N@@]1CCC[C@H]1Cc2c3cc(OC)c(OC)cc3c4c5OC	ZINC000000608124	C2CC1Cc4c(CN1C2)c3ccccc3c5ccccc45
N[C@@H](Cc1ccc(O)cc1)C(=O)NO	ZINC000000009568	c1ccccc1
OC(=O)C[C@@H](NC(=O)c1cccs1)c2ccc(Cl)cc2	ZINC000000116294	O=C(NCc1ccccc1)c2cccs2
NC(=N)Nc2nc1ccc(Cl)cc1[nH]2	ZINC000000408378	c2ccc1[nH]cnc1c2
CN2CCC(NCCc1ccccc1)CC2	ZINC000000280637	C2CC(NCCc1ccccc1)CCN2
OC(=O)Cc2nn(CC(=O)Nc1cccc(F)c1)c(=O)c3ccccc23	ZINC000000599186	O=C(Cn2ncc1ccccc1c2=O)Nc3ccccc3
NC(=N)NC(=N)Nc1ccccc1C(F)(F)F	ZINC000018179618	c1ccccc1
C4CN(c2ncnc3n(c1ccccc1)ncc23)CCN4	ZINC000000410942	C4CN(c2ncnc3n(c1ccccc1)ncc23)CCN4
CS(=O)(=O)N2CCN(CCNC(=O)NCC(=O)N1CCOCC1)CC2	ZINC000678948756	O=C(NCCN1CCNCC1)NCC(=O)N2CCOCC2
COc3ccc2[nH]cc(C[C@@H]1CCC[N@]1C)c2c3	ZINC000000005452	C3CNC(Cc1c[nH]c2ccccc12)C3
Cc1[nH]c(=O)[nH]c(=O)c1S(=O)(=O)NC2CCCCC2	ZINC000000093299	O=c2[nH]cc(S(=O)(=O)NC1CCCCC1)c(=O)[nH]2
Cc3ccc(C2(CN1CCC(NS(C)(=O)=O)CC1)CCNCC2)nc3	ZINC000065395644	C3CCN(CC2(c1ccccn1)CCNCC2)CC3
NS(=O)(=O)c2ccc1c(C=CS1(=O)=O)c2	ZINC000000026296	O=S2(=O)C=Cc1ccccc12
Cn2ncc(NC(=O)c1ccccc1)c2C(N)=O	ZINC000000040636	O=C(Nc1cn[nH]c1)c2ccccc2
OCCN(CCO)Cc1ccc(Cl)c(Cl)c1	ZINC000000279720	c1ccccc1
CS(=O)(=O)c2ccc1nc(NC(=O)/C=C/C(O)=O)sc1c2	ZINC000002748072	c2ccc1scnc1c2
CN(C)CCc2c[nH]c3ccc(C[C@@H]1COC(=O)N1)cc23	ZINC000000005298	O=C3NC(Cc2ccc1[nH]ccc1c2)CO3
COc4cc1c(C[C@H]2[N@@](C)CCc3cc(O)c(OC)c1c23)cc4O	ZINC000000135453	C2Cc3cccc4c1ccccc1CC(N2)c34
C[C@@H]3Cc1scc[n+]1c2ccccc2N3C=O	ZINC000000112678	C3Cc1scc[n+]1c2ccccc2N3
CCOC(=O)c1nnn4c1nc(N2CCN(C)CC2)c3ccccc34	ZINC000000159244	C4CN(c2nc1cnnn1c3ccccc23)CCN4
COc1ccccc1C3(O)CCN(Cc2ccccc2)CC3	ZINC000000086089	C2CN(Cc1ccccc1)CCC2c3ccccc3
C[N@]3CCc2nc(C)nc(N1CCN(CCC(N)=O)CC1)c2CC3	ZINC000065468394	C3CN(c2ncnc1CCNCCc12)CCN3
CCOC(=O)c1c(CNC(C)C)oc2ccc(OC)cc12	ZINC000000036656	c2ccc1occc1c2
COc2ccc(CNC[C@@H](O)COc1ccc(C)cc1N(=O)=O)cc2	ZINC000000119359	C(CNCc1ccccc1)COc2ccccc2
C[C@H]2[C@H]3Cc1ccc(O)cc1[C@]2(C)CCN3	ZINC000000005296	C3CC1CC(Cc2ccccc12)N3
CCOC(=O)Cc1csc2=NCCn12	ZINC000000091663	C2Cn1ccsc1=N2
OCCNCCNc2c1ccccc1nc3ccccc23	ZINC000004428560	c3ccc2nc1ccccc1cc2c3
CN(C)[C@H]3CCCN(C(=O)c1cn(C)c2ccccc12)C3	ZINC000000013634	O=C(N1CCCCC1)c2c[nH]c3ccccc23
OCc3cc(=O)c(O)c(CN2CCN(c1ccccc1)CC2)o3	ZINC000000121477	O=c3ccoc(CN2CCN(c1ccccc1)CC2)c3
CN(C)CCc1c[nH]c2ncccc12	ZINC000000010101	c2cnc1[nH]ccc1c2
CN4CCC(O)(c3nc(c1ccc(F)cc1)c(c2ccncc2)o3)CC4	ZINC000000602685	C4CC(c3nc(c1ccccc1)c(c2ccncc2)o3)CCN4
COc2ccc(C(=O)NC1CC(C)(C)NC(C)(C)C1)cc2	ZINC000000195334	O=C(NC1CCNCC1)c2ccccc2
COc1ccccc1OCC[N@@](C)CCC[C@@]3(C#N)CCOc2ccccc23	ZINC000000627634	C(CNCCOc1ccccc1)CC2CCOc3ccccc23
CN(C)CCNS(=O)(=O)c1ccc(N)cc1	ZINC000000392584	c1ccccc1
Cn3cc(S(=O)(=O)NCC(=O)N[C@@H]1CCC[C@@H]1[N@]2CC[C@@H](O)C2)cn3	ZINC000644226719	O=C(CNS(=O)(=O)c1cn[nH]c1)NC2CCCC2N3CCCC3
CNS(=O)(=O)c3ccc2nc(NC(=O)c1ccco1)sc2c3	ZINC000000150155	O=C(Nc2nc1ccccc1s2)c3ccco3
CCOC(=O)N2CCN(C1CCN(CC)CC1)CC2	ZINC000000280529	C2CC(N1CCNCC1)CCN2
Cn1cccc1c2ccccc2NCC3=NCCN3	ZINC000000026363	C3CN=C(CNc1ccccc1c2ccc[nH]2)N3
Fc1ccccc1N2CC(=O)NC2=O	ZINC000000022042	O=C2CN(c1ccccc1)C(=O)N2
C[N+](C)(C)c3nc(N1CCOCC1)nc(N2CCOCC2)n3	ZINC000000054244	C3CN(c2ncnc(N1CCOCC1)n2)CCO3
O[C@H](CNCc2ccc1OCOc1c2)CSc3cccs3	ZINC000000119187	C(CNCc2ccc1OCOc1c2)CSc3cccs3
CCOC(=O)N4CCN(C2C1CC3CC(C1)CC2C3)CC4	ZINC000000279617	C4CN(C2C1CC3CC(C1)CC2C3)CCN4
CCOC(=O)CN2N[C@@](CC)(c1ccccc1)NC2=S	ZINC000000053455	S=C2NNC(c1ccccc1)N2
CN(C)C[C@@H]1C[C@@H](O)[C@H](CN(C)C)C[C@@H]1O	ZINC000004962013	C1CCCCC1
CCN1C(=O)N(CCN(C)C)C(=O)C13CCN([C@@H](C)Cc2cccnc2)CC3	ZINC000014744928	O=C3NC(=O)C2(CCN(CCc1cccnc1)CC2)N3
Cc3ccc(C(=O)N2CCN(C(=O)CN1CCCC1)C2)cc3	ZINC000000063351	O=C(CN1CCCC1)N3CCN(C(=O)c2ccccc2)C3
Cc2cc(NC(=O)c1ccc(N(=O)=O)o1)no2	ZINC000000066729	O=C(Nc1ccon1)c2ccco2
CC(C)CCn1nnnc1[C@@H](C(C)C)N2CCC(C(N)=O)CC2	ZINC000000416788	C2CCN(Cc1nnn[nH]1)CC2
COc3cc2CC[N@@]1C[C@@H](CC(C)C)C(=O)C[C@@H]1c2cc3OC	ZINC000000000751	O=C3CCN2CCc1ccccc1C2C3
COCCOCCNC(=O)C(=O)N2CCN(C(=O)C(=O)NC1CC1)CC2	ZINC000284340096	O=C(NC1CC1)C(=O)N2CCNCC2
NC(=N)NCC[C@H](O)[C@@H]4O[C@H](Oc3ccc2c(=O)c1ccccc1c(=O)c2c3O)[C@@H](O)[C@H](O)[C@H]4O	ZINC000085593196	O=c3c1ccccc1c(=O)c4cc(OC2CCCCO2)ccc34
Cn3cc(CCN2CCN(c1ccccc1Cl)CC2)cn3	ZINC000000001356	C2CN(c1ccccc1)CCN2CCc3cn[nH]c3
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
NC(=O)c2cc[n+](CCC[n+]1ccc(\C=N\O)cc1)cc2C(N)=O	ZINC000066166298	C(C[n+]1ccccc1)C[n+]2ccccc2
CN(C)C(=O)CSc2nnc([C@@H](N)Cc1ccccc1)o2	ZINC000000531941	C(Cc1nnco1)c2ccccc2
CC[N@@](CCCC1CCN(CC(=O)NC(N)=O)CC1)CC(=O)NC(N)=O	ZINC000270880465	C1CCNCC1
Clc1cccc(Cl)c1N(CC=C)C2=NCCN2	ZINC000000003723	C2CN=C(Nc1ccccc1)N2
Cn3c(=O)n(C)c2ncn(CC(=O)NCc1ccco1)c2c3=O	ZINC000000117196	O=C(Cn1cnc2[nH]c(=O)[nH]c(=O)c12)NCc3ccco3
C[N+]2(C)CCO[C@@](O)(c1ccc(F)cc1)C2	ZINC000000162678	C2COC(c1ccccc1)CN2
CNc3nc(NCC[C@@]1(O)CCOC1)nc(NCC[C@@]2(O)CCOC2)n3	ZINC000651413759	C(CC1CCOC1)Nc3ncnc(NCCC2CCOC2)n3
C3CCN(CCOc2ccc(Cc1ccccc1)cn2)C3	ZINC000000021082	C3CCN(CCOc2ccc(Cc1ccccc1)cn2)C3
COc2ccc(/N=C/c1cc(Cl)cc(N(=O)=O)c1O)cc2OC	ZINC000000058799	C(=Nc1ccccc1)c2ccccc2
CC(=O)Nc2ccc(S(=O)(=O)Nc1nncs1)cc2	ZINC000000068398	O=S(=O)(Nc1nncs1)c2ccccc2
NC(=N)NN=C1CCOc2ccc(N(=O)=O)cc12	ZINC000000376663	N=C1CCOc2ccccc12
CCC(NCCN1CCNCC1)=c2c(=O)[nH]c(=O)n(CC=C)c2=O	ZINC000000530941	O=c2[nH]c(=O)c(=CNCCN1CCNCC1)c(=O)[nH]2
NC(=O)C2CCN(CC1CCCCC1)CC2	ZINC000000216363	C2CCC(CN1CCCCC1)CC2
CCNS(=O)(=O)c2ccc(CNC[C@@H](O)CN1CCN(C)CC1)cc2	ZINC000562995290	C(CNCc1ccccc1)CN2CCNCC2
CC2(C)C(c1ccccc1)[N+](=O)CN2O	ZINC000000300064	O=[N+]1CNCC1c2ccccc2
OC(=O)c2cc(=S)c1ccc(Cl)cc1[nH]2	ZINC000000005928	S=c1cc[nH]c2ccccc12
Nc1nonc1c3nc2ccccc2n3Cc4ccc(C#N)cc4	ZINC000000045659	C(c1ccccc1)n3c(c2cnon2)nc4ccccc34
CC2CCN(CCC(=O)Nc1ccc(F)cc1)CC2	ZINC000000176619	O=C(CCN1CCCCC1)Nc2ccccc2
CN(C2CCN(Cc1ccccc1)CC2)c3ncccc3C#N	ZINC000000021244	C2CN(Cc1ccccc1)CCC2Nc3ccccn3
CC(C)(C)C(=O)N[C@@H](n1cc(F)c(=O)[nH]c1=O)C(Cl)(Cl)Cl	ZINC000000820554	O=c1cc[nH]c(=O)[nH]1
Cn1cccc1C(=O)[C@H](C#N)C(=O)Nc2ccccc2	ZINC000000004247	O=C(CC(=O)c1ccc[nH]1)Nc2ccccc2
C[C@@H](CN1CCN(C)CC1)NC(=O)NCCC[N@]2CCC[C@@H](C(N)=O)C2	ZINC000592824057	O=C(NCCCN1CCCCC1)NCCN2CCNCC2
CN(C)CCO[C@H](c1cccs1)c2ccnn2C	ZINC000000007743	C(c1ccn[nH]1)c2cccs2
C[C@@H]1[C@@H](N)CN1c4c(F)cc3c(=O)c(C(O)=O)cn(C2CC2)c3c4F	ZINC000000012698	O=c3ccn(C1CC1)c4cc(N2CCC2)ccc34
CC2(C)CC(Nc1c(Cl)cc(Cl)cn1=O)CC(C)(C)N2	ZINC000000036908	O=n1ccccc1NC2CCNCC2
OCCS(=O)(=O)c1non(=O)c1c2ccccc2	ZINC000000017995	O=n1oncc1c2ccccc2
CN4CCC([N@]3CCC[C@@H](C(=O)NCc2cn1ccccc1n2)C3)CC4	ZINC000011819208	O=C(NCc2cn1ccccc1n2)C4CCCN(C3CCNCC3)C4
CNCc2cc1ccccc1s2	ZINC000000064947	c2ccc1sccc1c2
Clc3ccc(Oc1ccccc1C2=NCCN2)cc3	ZINC000000007981	C3CN=C(c1ccccc1Oc2ccccc2)N3
CC(C)[N@]2CCC[C@H](c1cccc(C#N)c1)C2	ZINC000000007986	C2CNCC(c1ccccc1)C2
C2CN(c1cccnc1)C[C@@H]3NC[C@H]23	ZINC000000009123	C2CN(c1cccnc1)CC3NCC23
COc3ccc([C@H](O)[C@@H](CN1CCCC1)c2ccccc2)cc3	ZINC000000340708	C3CCN(CC(Cc1ccccc1)c2ccccc2)C3
Cc1cccc(C)c1NC(=O)c2ccc[nH]c2=O	ZINC000000001591	O=C(Nc1ccccc1)c2ccc[nH]c2=O
Cn3cnn(c2ccc(NC(=O)C(=O)NCC[N@]1CC[C@H](O)C1)cc2)c3=O	ZINC000628104976	O=C(NCCN1CCCC1)C(=O)Nc3ccc(n2nc[nH]c2=O)cc3
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)[C@H]2CCC[N@@](C/C=C/c1ccc(N(C)C)cc1)C2	ZINC000000219400	C2CCN(CC=Cc1ccccc1)CC2
C[C@@H](C(=O)NN1CCN(C)CC1)c2ccc(N(=O)=O)cc2	ZINC000000471721	O=C(Cc1ccccc1)NN2CCNCC2
CC1(C)NC(=N)NC(=N)N1c2cccc(C(F)(F)F)c2	ZINC000000098181	N=C2NCN(c1ccccc1)C(=N)N2
COc1ncnc(N(C)C)c1NC(=O)C(=O)N2CCO[C@@H](C(N)=O)C2	ZINC000557472458	O=C(Nc1cncnc1)C(=O)N2CCOCC2
COc1cccc(OC)c1C(=O)N2CCOCC2	ZINC000000029650	O=C(N1CCOCC1)c2ccccc2
NC(=O)c2cc(c1ccccc1)sc2NC(=O)CN3CCCC3	ZINC000000090105	O=C(CN1CCCC1)Nc3ccc(c2ccccc2)s3
CCOC(=O)c2c(C)n(C)c3ccc(O)c(CN1CCCCC1)c23	ZINC000000547292	C3CCN(Cc1cccc2[nH]ccc12)CC3
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
C2CN=CN(Cc1cccnc1)C2	ZINC000000009127	C2CN=CN(Cc1cccnc1)C2
COc3ccc(CN2CCN(c1ccccc1)CC2)cc3C	ZINC000000237855	C2CN(c1ccccc1)CCN2Cc3ccccc3
C2CC(Cc1c[nH]cn1)CCN2	ZINC000000005777	C2CC(Cc1c[nH]cn1)CCN2
C[N@]1C[C@@H]3C[C@H](C1)c2cccc(=O)n2C3	ZINC000000031963	O=c3cccc2C1CNCC(C1)Cn23
C[C@@H]2C[C@H](OC(=O)[C@H](O)c1ccccc1)CC(C)(C)[N@]2C	ZINC000000000283	O=C(Cc1ccccc1)OC2CCNCC2
C[C@@H]1CC[N@](C(C)(C)C)CC1=O	ZINC000000062087	O=C1CCCNC1
CCC(=O)Nc3ccc(C(=O)Nn2c(=O)c1ccccc1c2=O)cc3	ZINC000000237505	O=C(Nn2c(=O)c1ccccc1c2=O)c3ccccc3
CN(C)C(=O)c3cccc(NC(=O)NCc2cccc(N1C(=N)NC(=N)NC1(C)C)c2)c3	ZINC000001728479	N=C3NCN(c2cccc(CNC(=O)Nc1ccccc1)c2)C(=N)N3
C[C@@H](O)CNC(=O)C3CCN(C2CCN(Cc1ccccc1C)CC2)CC3	ZINC000011839352	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
O=c4c1ccccc1c(=O)c5c3Cc2ccccc2Cn3cc45	ZINC000000001738	O=c4c1ccccc1c(=O)c5c3Cc2ccccc2Cn3cc45
CCN(CC)CC(=O)Nc3ccc2CCc1ccccc1Nc2c3	ZINC000000275611	C2Cc1ccccc1Nc3ccccc23
CN(C)c2c(C)cc(Cc1cnc(N)nc1N)c3cccnc23	ZINC000000000989	C(c1cncnc1)c2cccc3ncccc23
CC(C)C[N@]1CCN3[C@H](C1)C(=O)N[C@@H](Cc2cnc[nH]2)C3=O	ZINC000014752460	O=C3NC(Cc1cnc[nH]1)C(=O)N2CCNCC23
NC(=N)c3ccc(n2nc1ccc(C(N)=N)cc1n2)cc3	ZINC000006092672	c3ccc(n2nc1ccccc1n2)cc3
CN4CCN(c2nc(c1ccccc1F)nc3ccccc23)CC4	ZINC000000269160	C4CN(c2nc(c1ccccc1)nc3ccccc23)CCN4
OC[C@H]2O[C@@H](n1c(I)cc(=O)[nH]c1=O)[C@H](O)[C@@H]2O	ZINC000035259676	O=c2ccn(C1CCCO1)c(=O)[nH]2
CC(C)Nc1cccnc1N4CCN(C(=O)c3cc2ccccc2[nH]3)CC4	ZINC000000587534	O=C(N2CCN(c1ccccn1)CC2)c4cc3ccccc3[nH]4
CN(C)[C@H](C1COCOC1)c2cccnc2	ZINC000000000241	C2OCC(Cc1cccnc1)CO2
CN(C)CCO[C@@](C)(c1ccccc1)c2ccccn2	ZINC000000000242	C(c1ccccc1)c2ccccn2
CC(C)NC[C@@H](O)CC(c1ccccc1)c2ccccc2	ZINC000000000243	C(c1ccccc1)c2ccccc2
Cc2cc(\C=C\c1ccccc1OC[C@H](O)CNC(C)(C)C)on2	ZINC000000000406	C(=Cc1ccno1)c2ccccc2
CC2(C)OC(=O)N(c1ccccc1)/C2=C\C[N+](C)(C)C	ZINC000000123420	C=C1COC(=O)N1c2ccccc2
CN3CCN(C[C@@H](O)CNCCCN2C(=O)NC1(CCCC1)C2=O)CC3	ZINC000562984119	O=C2NC1(CCCC1)C(=O)N2CCCNCCCN3CCNCC3
O=S3(=O)N=C(N1CCNCC1)c2ccccc23	ZINC000000070380	O=S3(=O)N=C(N1CCNCC1)c2ccccc23
C[C@@H](CNC1CCN(C)CC1)c2ccccc2	ZINC000000757059	C2CC(NCCc1ccccc1)CCN2
Cc2ccc[n+](Oc1ncccc1N)c2	ZINC000000335036	O(c1ccccn1)[n+]2ccccc2
C3CCN(C[C@@H]2CO[C@@H](c1cccnc1)O2)CC3	ZINC000000187175	C3CCN(CC2COC(c1cccnc1)O2)CC3
O=C2CS[C@@H](c1cccc(N(=O)=O)c1)N2CCN3CCCCC3	ZINC000000208069	O=C2CSC(c1ccccc1)N2CCN3CCCCC3
NC(=N)NC(=N)Nc1ccccc1Br	ZINC000000406677	c1ccccc1
CN(CCCNC(=O)c1ccccc1Br)CCC[N@@](C)Cc2ccccc2	ZINC000002180665	O=C(NCCCNCCCNCc1ccccc1)c2ccccc2
COc1ccc(Cl)cc1c3nc(N)nc(NN2CCCCC2)n3	ZINC000000407473	C3CCN(Nc2ncnc(c1ccccc1)n2)CC3
NS(=O)(=O)c3ccc(NC(=O)c2cnc1ccccn1c2=O)cc3	ZINC000000253324	O=C(Nc1ccccc1)c3cnc2ccccn2c3=O
C3CN(c2nc(c1ccccc1)ns2)CCN3	ZINC000000117404	C3CN(c2nc(c1ccccc1)ns2)CCN3
CCNC(=O)NC(=O)CN2CCC(C[N@]1C[C@H](C)O[C@H](C)C1)CC2	ZINC000069456183	C2CC(CN1CCOCC1)CCN2
CCS(=O)(=O)N2CCN(C(=O)NC[C@@H]1CS(=O)(=O)CCO1)[C@H](C)C2	ZINC000557948856	O=C(NCC1CS(=O)(=O)CCO1)N2CCNCC2
Cc1ccc(Cl)cc1NC(=S)Nc2cnccn2	ZINC000000017809	S=C(Nc1ccccc1)Nc2cnccn2
CCc2ccc(OCC(=O)NC1CC(C)(C)NC(C)(C)C1)cc2	ZINC000000317821	O=C(COc1ccccc1)NC2CCNCC2
CN(C)C(C)(C)CNC(=O)CS(=O)(=O)CC(=O)NCC(C)(C)N(C)C	ZINC000654389743	nonring
Cc1csc2c(NN)ncnc12	ZINC000000159993	c2ncc1sccc1n2
O=C(CN3CCC(c1c[nH]c2ccccc12)CC3)Nc4ccccn4	ZINC000000024307	O=C(CN3CCC(c1c[nH]c2ccccc12)CC3)Nc4ccccn4
C[N@]1[C@H]3CC[C@@H]1CC(NC2CCCCC2)C3	ZINC000000027588	C3CCC(NC1CC2CCC(C1)N2)CC3
O[C@@H]1CCCNC[C@H]1NC(=O)c3ccc(OCCN2CCCC2)cc3	ZINC000015672146	O=C(NC1CCCCNC1)c3ccc(OCCN2CCCC2)cc3
CC1=CC(=O)Cc2cc(NC(=O)[C@@H](N)CCCN)ccc12	ZINC000002569725	O=C2Cc1ccccc1C=C2
Fc1ccccc1n3c(=S)[nH]c(=O)\c(=C/N2CCOCC2)c3=O	ZINC000000313219	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=CN3CCOCC3
Cc2ccc[n+](CCC[n+]1cccc(C)c1)c2	ZINC000004783062	C(C[n+]1ccccc1)C[n+]2ccccc2
C3CCN(C[C@@H]2COC1(CCCC1)O2)C3	ZINC000000185903	C3CCN(CC2COC1(CCCC1)O2)C3
Fc1ccccc1CSC2=NCCN2	ZINC000000122169	C2CN=C(SCc1ccccc1)N2
NC(=O)C3CCN(CC(=O)N1N=CC[C@@H]1c2ccccc2)CC3	ZINC000000538969	O=C(CN1CCCCC1)N2N=CCC2c3ccccc3
Cn1cccc1CNC3CCN(Cc2ccccc2)CC3	ZINC000005066045	C2CN(Cc1ccccc1)CCC2NCc3ccc[nH]3
O=c3c(=C/c1ccco1)/sc4nnc(c2ccccc2)n34	ZINC000000039171	O=c3c(=Cc1ccco1)sc4nnc(c2ccccc2)n34
CN(C)CCOc1ccccc1c3nc(c2ccccc2)no3	ZINC000000007363	c3ccc(c2noc(c1ccccc1)n2)cc3
CNCCCNCc1cc(Br)ccc1OCc2ccccc2F	ZINC000008377018	C(Oc1ccccc1)c2ccccc2
Cc3ccnc(NS(=O)(=O)c2ccc(NC(=O)[C@@H]1CCCNC1=O)cc2)n3	ZINC000000915623	O=C1NCCCC1C(=O)Nc3ccc(S(=O)(=O)Nc2ncccn2)cc3
NCCOc3ccc2oc1ccc(OCCN)cc1c(=O)c2c3	ZINC000004392753	O=c2c1ccccc1oc3ccccc23
Fc1ccc(N(=O)=O)cc1[C@@H]3NC(=O)c2ccccc2O3	ZINC000000031362	O=C2NC(c1ccccc1)Oc3ccccc23
COCCN2CCC(NC(=O)C(=O)NCCCCN1CCOCC1)CC2	ZINC000559832021	O=C(NCCCCN1CCOCC1)C(=O)NC2CCNCC2
C[C@@H]2C[C@@H](CCC(=O)NC(=S)Nc1ccc(Cl)cn1)C(=O)O2	ZINC000000207940	O=C(CCC1CCOC1=O)NC(=S)Nc2ccccn2
Cn3c1ccccc1c4cc2ccccc2c[n+]34	ZINC000000006766	c4ccc3c[n+]2[nH]c1ccccc1c2cc3c4
C3CN=C(NN=C1CCc2ccccc12)N3	ZINC000000145576	C3CN=C(NN=C1CCc2ccccc12)N3
OC(=O)c2ccc(NC(=S)NC(=O)Cc1ccccc1)cc2Cl	ZINC000000311504	O=C(Cc1ccccc1)NC(=S)Nc2ccccc2
C[C@H](NC(=O)C2CCN(S(=O)(=O)c1ccc(C)cc1)CC2)C(O)=O	ZINC000002393649	O=S(=O)(N1CCCCC1)c2ccccc2
OC[C@H]1C[C@]1(CO)Cn2cc(C=CBr)c(=O)[nH]c2=O	ZINC000000006344	O=c2ccn(CC1CC1)c(=O)[nH]2
Cn2c(c1ccc(NS(C)(=O)=O)cc1)c[n+]3ccccc23	ZINC000000387330	c3ccc(c2c[n+]1ccccc1[nH]2)cc3
c3cnn(c2cc(n1cccn1)ncn2)c3	ZINC000000003851	c3cnn(c2cc(n1cccn1)ncn2)c3
OC(=O)CNC(=O)c2ccc(NC=c1c(=O)[nH]c(=S)[nH]c1=O)cc2	ZINC000009061275	O=c1[nH]c(=S)[nH]c(=O)c1=CNc2ccccc2
Fc3cccc(NC2=NC1(CCCCC1)NC(=N)N2)c3	ZINC000000203736	N=C3NC(Nc1ccccc1)=NC2(CCCCC2)N3
COc3ccc(OC[C@@H](O)Cn1c(C)nc2ccccc12)cc3	ZINC000000243065	C(COc1ccccc1)Cn2cnc3ccccc23
C[C@H](NC(=O)CCCn2c(=O)[nH]c1ccccc1c2=O)C(O)=O	ZINC000002127205	O=c2[nH]c(=O)c1ccccc1[nH]2
Cc3ccc(C(=O)O[C@@H]1CN2CCC1CC2)cc3	ZINC000000135989	O=C(OC1CN2CCC1CC2)c3ccccc3
CCNC(=O)CN2CCN(C(=O)C(=O)N[C@@H]1CCC(=O)N[C@@H]1C)CC2	ZINC000558401997	O=C2CCC(NC(=O)C(=O)N1CCNCC1)CN2
CN(C)C[C@@]2(c1ccccc1)CC[N+](C)(C)C2	ZINC000001717939	C2CC(c1ccccc1)CN2
C[C@@H]3CCC[N@](C2CCN(S(=O)(=O)c1ccc(F)cc1)CC2)C3	ZINC000000316796	O=S(=O)(N2CCC(N1CCCCC1)CC2)c3ccccc3
Cc3n[nH]c(SCC(=O)Nc2nc(c1ccccc1)cs2)n3	ZINC000000051943	O=C(CSc1ncn[nH]1)Nc3nc(c2ccccc2)cs3
CCn2nc(C)cc(C)n3c1ccccc1nc23	ZINC000000051942	c1ccc2c(c1)nc3[nH]ncccn23
COC(=O)[C@@]1(O)CN2CCC1CC2	ZINC000000172620	C1CN2CCC1CC2
O=N(=O)c3cccc(\C=c2\sc(N1CCOCC1)nc2=O)c3	ZINC000000062393	O=c2nc(N1CCOCC1)sc2=Cc3ccccc3
COc3ccc([C@@H]1SCC(=O)N1C[C@@H](O)c2ccccc2)cc3	ZINC000000034641	O=C2CSC(c1ccccc1)N2CCc3ccccc3
COCC(=O)N4C[C@@H]1CN(CCO1)C(=O)[C@@H]2C[C@@H](C[N@@]2CC3CC3)NC(=O)C[C@@H]5O[C@H](C4)[C@@H](O)[C@H]5O	ZINC000097976629	O=C4CC5CCC(CNCC1CN(CCO1)C(=O)C2CC(CN2CC3CC3)N4)O5
CNC(=S)NCCN1CCCCC1	ZINC000000414894	C1CCNCC1
Cc1[nH]c(=O)sc1S(=O)(=O)NCCNC(=O)[C@@H]2C[N@@]3CCCN2CC3	ZINC000681090222	O=C(NCCNS(=O)(=O)c1c[nH]c(=O)s1)C2CN3CCCN2CC3
NS(=O)(=O)c3ccc(NC(=O)[C@H]2[C@@H]1C[C@@H](C=C1)[C@@H]2C(O)=O)cc3	ZINC000002202942	O=C(Nc1ccccc1)C2CC3CC2C=C3
N#Cc3ccc(CN2CC1(CCNCC1)C2)cc3	ZINC000003956258	C1CC3(CCN1)CN(Cc2ccccc2)C3
O=C(NCCN1CCCC1)C3c2ccccc2Oc4ccccc34	ZINC000000099861	O=C(NCCN1CCCC1)C3c2ccccc2Oc4ccccc34
NC(=N)c1cc(Cl)c(Cl)cc1C(N)=N	ZINC000001444980	c1ccccc1
O=C(NCC[n+]2ccc1ccccc1c2)c3ccccc3	ZINC000000028223	O=C(NCC[n+]2ccc1ccccc1c2)c3ccccc3
OC1C[C@@H]2CC[C@H](C1)[N@]2CCc3ccccc3	ZINC000000027584	C1CC2CCC(C1)N2CCc3ccccc3
CCN3CCN(c1nc(C)nc2n(C)c(=S)sc12)CC3	ZINC000000118187	S=c3[nH]c2ncnc(N1CCNCC1)c2s3
Cc3cnc(C(=O)N[C@@H]2CCc1ccccc1C2)cn3	ZINC000000003555	O=C(NC2CCc1ccccc1C2)c3cnccn3
N[C@@H](Cc1ccccn1)c2ccccc2	ZINC000000006163	C(Cc1ccccn1)c2ccccc2
COc2ccc3C[N+](C)(C)CC[C@@]14C=CC[C@@H](O)[C@H]1Oc2c34	ZINC000000487786	C2CC14C=CCCC1Oc3cccc(CN2)c34
C[N+](C)(Cc1ccccc1)Cc2sc(Cl)c(Cl)c2Cl	ZINC000000054884	C(NCc1cccs1)c2ccccc2
NC2=C(C#N)[C@@H](c1ccncc1)c4c(O2)c3ccccc3[nH]c4=O	ZINC000000036197	O=c4[nH]c1ccccc1c3OC=CC(c2ccncc2)c34
Cc4cc(C)c(c3c(O)[n+]2CCCN1CCCn(c12)c3=O)c(C)c4	ZINC000000344143	O=c2c(c1ccccc1)c[n+]4CCCN3CCCn2c34
Fc3ccc(C(=O)NC(=S)Nc2ccc1[nH]c(=O)[nH]c1c2)cc3	ZINC000000107828	O=C(NC(=S)Nc2ccc1[nH]c(=O)[nH]c1c2)c3ccccc3
NS(=O)(=O)N2CCN(CCCN1CCN(S(N)(=O)=O)CC1)CC2	ZINC000489459755	C(CN1CCNCC1)CN2CCNCC2
COc2cc[n+](OC(=O)N1CCCCC1)c(C)c2	ZINC000000172287	O=C(O[n+]1ccccc1)N2CCCCC2
CC(=O)c3cccc2Oc1ccccc1S(=O)(=O)c23	ZINC000000016263	O=S3(=O)c1ccccc1Oc2ccccc23
NCc1ccc(F)cc1C(F)(F)F	ZINC000000157362	c1ccccc1
CCOC(=O)COc1ccccc1\C=c2/c(=O)[nH]c(=S)n(CC=C)c2=O	ZINC000001153898	O=c1[nH]c(=S)[nH]c(=O)c1=Cc2ccccc2
C[N+]2(CC#CC[N+]1(C)CCCC1)CCCC2	ZINC000001571283	C2CCN(CC#CCN1CCCC1)C2
Cc2cc(C)cc(NC(=O)CSc1nc(C)cc(C)n1)c2	ZINC000000031564	O=C(CSc1ncccn1)Nc2ccccc2
O[C@@]([C@@H]1CN2CCC1CC2)(c3ccccc3)c4cccs4	ZINC000000204014	C1CN4CCC1C(C(c2ccccc2)c3cccs3)C4
CCc3ccc(c2cn1CCSc1n2)cc3	ZINC000000027925	C3Cn2cc(c1ccccc1)nc2S3
CCN(CC)CCN=C2CCCc1ccccc1N2	ZINC000000196628	N=C2CCCc1ccccc1N2
COc2cc(CN1CCCCCC1)c(N(=O)=O)cc2OC	ZINC000000239065	C2CCCN(Cc1ccccc1)CC2
CC(=O)OCC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000000115943	c1ccccc1
CC[N@]1CCC[C@H]1CNc3ncnc4c2cc(OC)ccc2[nH]c34	ZINC000000539022	C4CNC(CNc2ncnc3c1ccccc1[nH]c23)C4
CN3CCN(c2nc1ccc(N(=O)=O)cc1s2)CC3	ZINC000000066588	C3CN(c2nc1ccccc1s2)CCN3
CCN(CC)CCc2c(C)c1ccc(O)cc1oc2=O	ZINC000000032923	O=c2ccc1ccccc1o2
Cc1ncc(CO[C@H](O)C(O)=O)c(CO)c1O	ZINC000000000639	c1ccncc1
OC(=O)c2cc(=O)c1c(I)cc(Cl)cc1[nH]2	ZINC000000025328	O=c1cc[nH]c2ccccc12
CN3CCN(c2ccc(C(=O)c1ccc(F)cc1)cc2)CC3	ZINC000000129115	O=C(c1ccccc1)c3ccc(N2CCNCC2)cc3
CN(C)CCNc2cnn(c1ccccc1)c(=O)c2Cl	ZINC000000118611	O=c1cccnn1c2ccccc2
Cc2cc(NS(=O)(=O)Cc1ccccc1)ccc2Br	ZINC000000029863	O=S(=O)(Cc1ccccc1)Nc2ccccc2
Cn1cccc1C(=O)NC(=O)Cn3nc(C(O)=O)c2ccccc2c3=O	ZINC000003513096	O=C(Cn2ncc1ccccc1c2=O)NC(=O)c3ccc[nH]3
C[N@]2CC[C@@]14CCCC[C@H]1[C@@H]2Cc3ccc(O)cc34	ZINC000000002433	C4CCC23CCNC(Cc1ccccc12)C3C4
O=c2n(CN1CCCCC1)c4cccc3cccc2c34	ZINC000000125964	O=c2n(CN1CCCCC1)c4cccc3cccc2c34
Cc2nn(C)c3NCCN=C(c1cccc(Cl)c1)c23	ZINC000000002263	C3CN=C(c1ccccc1)c2cn[nH]c2N3
CC(C)[C@H](N)C(=O)N1CCCC1	ZINC000000007335	C1CCNC1
CN(C)CCNC(C)=c1c(=O)[nH]c(=O)n(CC=C)c1=O	ZINC000000531789	C=c1c(=O)[nH]c(=O)[nH]c1=O
CCc1cccc2cc([C@@H](O)CNC(C)(C)C)oc12	ZINC000000002269	c2ccc1occc1c2
NCCC[N@]1C[C@H]3C[C@@H](C1)c2cccc(=O)n2C3	ZINC000011919735	O=c3cccc2C1CNCC(C1)Cn23
Cn3c(=O)n(C)c2ncn(C[C@@H](O)CN1CCCC1)c2c3=O	ZINC000000164087	O=c3[nH]c(=O)c2n(CCCN1CCCC1)cnc2[nH]3
CCOC(=O)N2CCN(C[C@H]1CCC=CC1)CC2	ZINC000000278281	C2CN(CC1CCC=CC1)CCN2
O[C@@H](COc2ccc1CCCc1c2)C[N@]4CCc3ccccc3C4	ZINC000000236243	C(COc2ccc1CCCc1c2)CN4CCc3ccccc3C4
O=C(NC[C@H]1C[C@@H]2CCN1C[C@@H]2CN4CCN(c3ccccc3)CC4)Nc5ccccc5	ZINC000008636246	O=C(NCC1CC2CCN1CC2CN4CCN(c3ccccc3)CC4)Nc5ccccc5
COC(=O)C[C@@H](N)c1ccccc1	ZINC000000286961	c1ccccc1
O=C2CCC(NCc1ccccc1)=C2	ZINC000000018991	O=C2CCC(NCc1ccccc1)=C2
O[C@@]3(c1ccccc1)CN2CCCCCC2=[N+]3c5ccc4OCCOc4c5	ZINC000000623445	C5CCN4CC(c1ccccc1)[N+](c3ccc2OCCOc2c3)=C4CC5
CC(C)(C)NC[C@@H](O)c1ccc(O)c(CO)n1	ZINC000000000637	c1ccncc1
O=c3n(c1ccccc1)c(C[n+]2ccccc2)nc4ccccc34	ZINC000000175086	O=c3n(c1ccccc1)c(C[n+]2ccccc2)nc4ccccc34
CN(C)CCn3cc2[nH]c([C@@H]1CCC[N@]1CC(N)=O)ccc2c3=O	ZINC000072355313	O=c2[nH]cc3[nH]c(C1CCCN1)ccc23
CC(C)CNCC2OCc1ccccc1CO2	ZINC000000195221	C2OCc1ccccc1CO2
CC(C)\C=c2/[nH]c(=O)c(=C/c1ccccc1)\[nH]c2=O	ZINC000000000889	C=c2[nH]c(=O)c(=Cc1ccccc1)[nH]c2=O
O=C3OC1(CCCCC1)C(N2CCOCC2)=C3	ZINC000000050688	O=C3OC1(CCCCC1)C(N2CCOCC2)=C3
O=C(N1CCc2ccccc12)c3c[nH]c4ncccc34	ZINC000000006618	O=C(N1CCc2ccccc12)c3c[nH]c4ncccc34
CN(C)CCC(=O)c1ccc(C)o1	ZINC000000268396	c1ccoc1
CC[N@]2CCC[C@@H](NC(=O)c1cc(NC)ccc1OC)C2	ZINC000000347685	O=C(NC1CCCNC1)c2ccccc2
CN(C)CCNC(=O)c1c(C)c(C)sc1NC(=O)c2ccccc2	ZINC000000293595	O=C(Nc1cccs1)c2ccccc2
CN2CCN(CCCNC(=O)C(=O)Nc1c[nH]c(=O)[nH]c1=O)CC2	ZINC000020713856	O=C(NCCCN1CCNCC1)C(=O)Nc2c[nH]c(=O)[nH]c2=O
COc2ccc(N1CCNCC1)cc2	ZINC000000157604	C2CN(c1ccccc1)CCN2
COc3ccc(CNc2nc1ccccc1[nH]2)c(OC)c3	ZINC000000117991	C(Nc2nc1ccccc1[nH]2)c3ccccc3
O=C2C[C@@H](C(=O)NCCN1CCCC1)CN2C3CCCCC3	ZINC000000220427	O=C2CC(C(=O)NCCN1CCCC1)CN2C3CCCCC3
CCN3CCN(c2ccc(/N=C/c1ccc(N(=O)=O)cc1)cc2)CC3	ZINC000000353102	C3CN(c2ccc(N=Cc1ccccc1)cc2)CCN3
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
CCOC(=O)c3ccc(Nc2cc(C)nc(N1CCOCC1)n2)cc3	ZINC000000123030	C3CN(c2nccc(Nc1ccccc1)n2)CCO3
COC(=O)Cn2c(=N)n(CCN1CCCCC1)c3ccccc23	ZINC000000274208	N=c2[nH]c1ccccc1n2CCN3CCCCC3
COc2cc(CC1=NCCN1)cc(OC)c2OC	ZINC000000001914	C2CN=C(Cc1ccccc1)N2
C2CCC(=Nn1cnnc1)CC2	ZINC000000061067	C2CCC(=Nn1cnnc1)CC2
Oc1c4CCCN3CCCc(cc1\C=N\N2CCOCC2)c34	ZINC000000239457	C2CN3CCCc4cc(C=NN1CCOCC1)cc(C2)c34
C=CCNC(=N)SCCSC(=N)NCC=C	ZINC000001665849	nonring
CN2CCC([N@@](C)Cc1ccccc1C)CC2	ZINC000000239455	C2CC(NCc1ccccc1)CCN2
Cc2ccc(C)c(CN1CCC(C(N)=O)CC1)c2	ZINC000000277629	C2CCN(Cc1ccccc1)CC2
CCCN2CCC(NC1CC1)CC2	ZINC000000153948	C2CC(NC1CC1)CCN2
C[C@@H]1C[N@@](C)[C@@H](C)C[C@H]1OC(=O)c2ccco2	ZINC000000210031	O=C(OC1CCNCC1)c2ccco2
CN(C(C)=O)c1cccc(CN)c1	ZINC000000153946	c1ccccc1
CCOC(=O)Cn3c1CCCc1c(=N)c2CCCc23	ZINC000000198621	N=c3c1CCCc1[nH]c2CCCc23
COc3ccc(C(=O)N2CCC(N1CCC(C)CC1)CC2)cc3	ZINC000000207726	O=C(N2CCC(N1CCCCC1)CC2)c3ccccc3
Cn2c(=O)n(C)c3cc(C=c1c(=O)[nH]c(=S)[nH]c1=O)ccc23	ZINC000000207727	O=c3[nH]c2ccc(C=c1c(=O)[nH]c(=S)[nH]c1=O)cc2[nH]3
OC(=O)\C=C\c2nc(c1ccccc1)n3ccccc23	ZINC000000070013	c3ccc(c1ncc2ccccn12)cc3
CC(C)NS(=O)(=O)N1CCN(C(=O)CNS(=O)(=O)N(C)C)CC1	ZINC000616206667	C1CNCCN1
CN2[C@@H]([N+](=O)Cc1ccccc1)C(C)(C)SC2=S	ZINC000000070542	O=[N+](Cc1ccccc1)C2CSC(=S)N2
Clc4ccc3nc(N1CCNCC1)nc(c2ccccc2)c3c4	ZINC000000275717	C4CN(c3nc(c1ccccc1)c2ccccc2n3)CCN4
CCN3CCN(c2ccc(NC(=O)c1ccc(F)cc1)cc2)CC3	ZINC000000588156	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
CCN(CC)c1ccc(N)c(C)c1	ZINC000000056876	c1ccccc1
O=C(N2CCN(CCc1ccccc1)CC2)c3ccco3	ZINC000000012724	O=C(N2CCN(CCc1ccccc1)CC2)c3ccco3
O=C(CCN2[C@H]1CS(=O)(=O)C[C@@H]1NC2=O)N[C@@H]3CCS(=O)(=O)C3	ZINC000040169181	O=C(CCN2C1CS(=O)(=O)CC1NC2=O)NC3CCS(=O)(=O)C3
COc2cc(NC(=O)Oc1ccccc1)ccc2C#N	ZINC000000033984	O=C(Nc1ccccc1)Oc2ccccc2
Oc4cccc(C[N@]1C[C@@H]3C[C@H](C1)c2cccc(=O)n2C3)c4	ZINC000000228628	O=c4cccc3C2CC(CN(Cc1ccccc1)C2)Cn34
COc4ccc3[nH]c2[C@H](Cc1ccc(OC)c(OC)c1)NCCc2c3c4	ZINC000000622003	C4Cc1c([nH]c2ccccc12)C(Cc3ccccc3)N4
CN(C)c2ncnc3n(Cc1ccccc1)cnc23	ZINC000000002918	C(c1ccccc1)n2cnc3cncnc23
COc2cc(CNCc1ccccc1)cc(OC)c2OC	ZINC000000152525	C(NCc1ccccc1)c2ccccc2
CCCc3nnc4c(N1CCN(C)CC1)nc2ccc(Cl)cc2n34	ZINC000000366942	C4CN(c2nc1ccccc1n3cnnc23)CCN4
N[C@H]1[C@@H](O)[C@@H](O)[C@H](CO)O[C@@H]1OCc2ccccc2	ZINC000000391447	C2CCC(OCc1ccccc1)OC2
COc4cccc(C(=O)N3CCN(C[C@H]1C[C@H]2C[C@@H]1C=C2)CC3)c4OC	ZINC000000783063	O=C(N3CCN(CC1CC2CC1C=C2)CC3)c4ccccc4
CCN2CCC(NCCc1ccc(F)cc1)CC2	ZINC000000279888	C2CC(NCCc1ccccc1)CCN2
CN4CCN(c2c1CCCc1nc3ncnn23)CC4	ZINC000000156088	C4Cc3nc1ncnn1c(N2CCNCC2)c3C4
C[C@@H]4CCCN(C(=O)C3CCN(Cc2ccc1OCOc1c2)CC3)C4	ZINC000000317563	O=C(C3CCN(Cc2ccc1OCOc1c2)CC3)N4CCCCC4
C[N@](c1ccncc1)n2ccc3ccccc23	ZINC000000003997	N(c1ccncc1)n2ccc3ccccc23
CN2CCN(c1ccc(C(F)(F)F)cc1N)CC2	ZINC000000065173	C2CN(c1ccccc1)CCN2
CC2CCN(C[C@@H](O)COCc1ccc(Cl)cc1)CC2	ZINC000000240346	C2CCN(CCCOCc1ccccc1)CC2
NCC(=O)NCC(=O)NCCNS(=O)(=O)c1ccc(N(=O)=O)cc1	ZINC000274433721	c1ccccc1
CCC[N@](c1ccncc1F)n2cc(C)c3cc(OC(=O)NC)ccc23	ZINC000000598070	N(c1ccncc1)n2ccc3ccccc23
CCC3CCC(N2CCN(c1ccc(Cl)cc1)CC2)CC3	ZINC000000212517	C3CCC(N2CCN(c1ccccc1)CC2)CC3
CN(C)CC(=O)c1c(C)[nH]c2cc(C)ccc12	ZINC000000117507	c2ccc1[nH]ccc1c2
CN(C)CC(=O)c1c[nH]c2ccccc12	ZINC000000117500	c2ccc1[nH]ccc1c2
CCN(CC)CC(=O)c1c(C)[nH]c2ccccc12	ZINC000000117502	c2ccc1[nH]ccc1c2
C2CCN(CCSCCN1CCCCC1)CC2	ZINC000005375627	C2CCN(CCSCCN1CCCCC1)CC2
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
CC(=O)Oc2ccc1cc(C(O)=O)c(=O)oc1c2	ZINC000000057540	O=c2ccc1ccccc1o2
CC3CCC(NC(=O)NS(=O)(=O)c2ccc(CCNC(=O)N(C)c1ccccn1)cc2)CC3	ZINC000000537797	O=C(NCCc2ccc(S(=O)(=O)NC(=O)NC1CCCCC1)cc2)Nc3ccccn3
CC(CO)(CO)NS(=O)(=O)c1ccc(Cl)cc1	ZINC000000051304	c1ccccc1
COC(=O)c2csc3c(C(F)(F)F)cc(N1CCNCC1)nc23	ZINC000000082952	C3CN(c2ccc1sccc1n2)CCN3
Fc1cccc(F)c1C(=O)Nc2nnc(C(F)(F)F)s2	ZINC000000094441	O=C(Nc1nncs1)c2ccccc2
NC(=O)[C@@H]3C[C@@]1(NC(=O)NC1=O)c2cc(F)ccc2O3	ZINC000000002486	O=C3NC(=O)C2(CCOc1ccccc12)N3
CNS(=O)(=O)[C@@H]2CCN(C(=O)NCCC(=O)N1CCOCC1)C2	ZINC000533391179	O=C(CCNC(=O)N1CCCC1)N2CCOCC2
NC(=O)C4(N1CCCCC1)CCN(CCC(C#N)(c2ccccc2)c3ccccc3)CC4	ZINC000000538198	C4CCN(C3CCN(CCC(c1ccccc1)c2ccccc2)CC3)CC4
C[N+]14CCC(CC1)[C@@H]([C@@](O)(c2ccccc2)c3cccs3)C4	ZINC000000204030	C1CN4CCC1C(C(c2ccccc2)c3cccs3)C4
Oc1ccccc1c2nnco2	ZINC000000001423	c2ccc(c1nnco1)cc2
CN(C)c3cc(NC(=O)CN1CCCCC1)c2ccccc2n3	ZINC000000171273	O=C(CN1CCCCC1)Nc2ccnc3ccccc23
Cc2csc(NC(=O)CNC1CC1)n2	ZINC000000325404	O=C(CNC1CC1)Nc2nccs2
CN[C@@H](C)Cc2cc1OCOc1cc2O	ZINC000000057352	C2Oc1ccccc1O2
c3ccc2oc(c1ccncc1)cc2c3	ZINC000000002007	c3ccc2oc(c1ccncc1)cc2c3
COC(=O)[C@H]1[C@H]3CC[C@@H](C[C@H]1c2ccc(I)cc2)[N@]3C	ZINC000000598412	C2CC3CC(c1ccccc1)CC2N3
O=N(=O)c3cccc([C@@H]2CN1CCSC1=N2)c3	ZINC000000000547	C3CN2CC(c1ccccc1)N=C2S3
COc3cccc(CNCc2ccc1OCOc1c2)c3	ZINC000000200703	C3Oc2ccc(CNCc1ccccc1)cc2O3
CC(C)[N@]3C[C@H]2C[C@H](CN(C(=O)c1ccccc1)C2)C3	ZINC000000005064	O=C(N2CC1CNCC(C1)C2)c3ccccc3
O[C@H]3CN[C@@H](C(=O)Nc2ccc1ccccc1c2)C3	ZINC000000402963	O=C(Nc2ccc1ccccc1c2)C3CCCN3
COC(=O)c2[nH]c1ccccc1c2NC(=O)C[N@@](C)C3CCCCC3	ZINC000000522387	O=C(CNC1CCCCC1)Nc2c[nH]c3ccccc23
CC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N2CC(N1CC[C@@H](O)C1)C2	ZINC000628005216	C2CCN(C1CNC1)C2
CCc1ccccc1NC(=O)[C@H]2SC(=N)NC(O)=C2	ZINC000000543516	N=C2NC=CC(C(=O)Nc1ccccc1)S2
CC(C)C[C@H](N)C(=O)N1CCOCCOCCOCC1	ZINC000000244261	C1COCCOCCOCCN1
COc4cccc(N3CCN(C[C@@H]1C[C@@H]2C[C@H]1C=C2)CC3)c4	ZINC000000277130	C2CN(c1ccccc1)CCN2CC3CC4CC3C=C4
OC(CNC1CCCCC1)CNC2CCCCC2	ZINC000000227390	C2CCC(NCCCNC1CCCCC1)CC2
Cc3cc2nc(Sc1c(N(=O)=O)ncn1C)[nH]c2cc3C	ZINC000000033273	S(c1cnc[nH]1)c3nc2ccccc2[nH]3
COC(=O)C2CCN(Cc1cccc(F)c1)CC2	ZINC000000170047	C2CCN(Cc1ccccc1)CC2
CC(=O)Nc2nc(SCc1ccc(N(=O)=O)cc1)n(C(C)=O)n2	ZINC000000033276	C(Sc1ncn[nH]1)c2ccccc2
CCN(CC)CCn1c(=N)n(CC(=O)OC)c2ccccc12	ZINC000000274214	N=c2[nH]c1ccccc1[nH]2
O=C1CCC(=O)N1OC(N2CCCC2)=[N+]3CCCC3	ZINC000000391931	O=C1CCC(=O)N1OC(N2CCCC2)=[N+]3CCCC3
COc2cc(C)nc(n1cccn1)n2	ZINC000000009772	c2cnc(n1cccn1)nc2
COc5cc4nc(N1CCc2c(C1)ccc3ccccc23)nc(N)c4cc5OC	ZINC000000601652	C1Cc4c(CN1c3ncc2ccccc2n3)ccc5ccccc45
C4CCN(CCc3nc(CC(c1ccccc1)c2ccccc2)no3)CC4	ZINC000000538227	C4CCN(CCc3nc(CC(c1ccccc1)c2ccccc2)no3)CC4
CNc3nc(N[C@@H]1CCOC[C@@H]1O)nc(N[C@@H]2CCOC[C@@H]2O)n3	ZINC000624686949	C3CC(Nc2ncnc(NC1CCOCC1)n2)CCO3
C[C@@H]2CN(C1CC(C)(C)NC(C)(C)C1)CCC2=O	ZINC000000129256	O=C2CCN(C1CCNCC1)CC2
CN(c1ccccc1)S(=O)(=O)c2ccc(F)cc2	ZINC000000029464	O=S(=O)(Nc1ccccc1)c2ccccc2
C[C@@]34CC(=O)[C@H]1[C@@H](CCC2=CC(=O)C=C[C@]12C)[C@H]3CC[C@]4(O)C(=O)CO	ZINC000000538220	O=C4CC1CCCC1C3CCC2=CC(=O)C=CC2C34
C[N@]1CCc4c(C1)sc3N[C@H](c2ccc(O)c(O)c2)NC(=O)c34	ZINC000000535963	O=C3NC(c1ccccc1)Nc4sc2CNCCc2c34
CC2(C)N=C(N)NC(NCCCOc1ccc(N(=O)=O)cc1)=N2	ZINC000001577779	C(CNC1=NCN=CN1)COc2ccccc2
COC(=O)c3c(NC(=O)CN1CCCCCC1)sc2C[C@H](C)CCc23	ZINC000000710278	O=C(CN1CCCCCC1)Nc3cc2CCCCc2s3
Clc3ccc(c2noc(C1CCNCC1)n2)cc3	ZINC000000112709	C3CC(c2nc(c1ccccc1)no2)CCN3
O=C(CC[C@H]2CCC[N@@](Cc1ccco1)C2)N4CCN(Cc3ccccc3)CC4	ZINC000011873706	O=C(CCC2CCCN(Cc1ccco1)C2)N4CCN(Cc3ccccc3)CC4
CS(=O)(=O)NC2CN(C(=O)CSCC(=O)N1CCOCC1)C2	ZINC000600349187	O=C(CSCC(=O)N1CCOCC1)N2CCC2
CC2(C)CC(/N=C/c1ccccc1O)CC(C)(C)N2	ZINC000000135682	C2CC(N=Cc1ccccc1)CCN2
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
CCN(CC)Cc1c(O)ccc2c(C)cc(=O)oc12	ZINC000000068811	O=c2ccc1ccccc1o2
COc3ccc(CCN1C(=O)N(CCN(C)C)C(=O)C12CCN(C)CC2)cc3	ZINC000014749831	O=C2NC(=O)C1(CCNCC1)N2CCc3ccccc3
Nc3ncc(Cc2ccc1OCOc1c2)c(N)n3	ZINC000000010465	C3Oc2ccc(Cc1cncnc1)cc2O3
CNS(=O)(=O)C[C@@H]1CCCN1C(=O)C(=O)N[C@@H]2CS(=O)(=O)C[C@@H]2OC	ZINC000612196829	O=C(NC1CCS(=O)(=O)C1)C(=O)N2CCCC2
Nc3ccc2nc4c(=O)c1cccnc1c5nccc(c2c3)c45	ZINC000000026777	O=c3c1cccnc1c5nccc4c2ccccc2nc3c45
CCn1c(NCCN(C)C)nc2n(C)c(=O)n(C)c(=O)c12	ZINC000000067718	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
CCOc2cc(CN1CCC(C(=O)NCC(C)C)CC1)ccc2O	ZINC000000236111	C2CCN(Cc1ccccc1)CC2
C4CN=C(NC[C@@H]2c1ccccc1CSc3ccccc23)N4	ZINC000000346608	C4CN=C(NCC2c1ccccc1CSc3ccccc23)N4
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
CN(CCN)C[C@H]3O[C@@H](n1c(C)nc2c(N)ncnc12)[C@H](O)[C@@H]3O	ZINC000040873942	C3COC(n1cnc2cncnc12)C3
Cn1cc(I)c(C(O)=O)n1	ZINC000000049157	c1cn[nH]c1
CC(=C)C[C@@H]1C(Br)=CCC[N+]1(C)C	ZINC000000055886	C1CC=CCN1
C[C@@](O)(CNC(=O)NC[C@H]1CCCN1S(C)(=O)=O)CN2CCOCC2	ZINC000533578584	O=C(NCCCN1CCOCC1)NCC2CCCN2
CN(N)c1ccc(C(F)(F)F)cn1	ZINC000000165261	c1ccncc1
O[C@@H](CC2CCN(Cc1ccccc1)CC2)c3ccc(F)cc3	ZINC000000014992	C2CN(Cc1ccccc1)CCC2CCc3ccccc3
Fc2cccc(NC(=O)CCN1CCCCCC1)c2	ZINC000000178114	O=C(CCN1CCCCCC1)Nc2ccccc2
COc1ccccc1n3cc(c2ccccc2)[n+]4c3SC[C@@]4(O)c5ccccc5	ZINC000000643793	C4Sc3n(c1ccccc1)cc(c2ccccc2)[n+]3C4c5ccccc5
C[C@@H]1OCCN(C(=N)NC(N)=N)[C@@H]1c2ccccc2	ZINC000019898969	C2COCC(c1ccccc1)N2
COc3cccc(C(=O)N[C@H]1C[C@@H]2N(C1)C(=O)[C@H](CO)NC2=O)c3	ZINC000014742709	O=C3CNC(=O)C2CC(NC(=O)c1ccccc1)CN23
C[N@@](Cc1ccccc1)[C@@H]3CC(=O)N(c2ccccc2)C3=O	ZINC000000207046	O=C2CC(NCc1ccccc1)C(=O)N2c3ccccc3
Cc2cc1scnc1cc2NC(N)=N	ZINC000000010110	c2ccc1scnc1c2
C[N@]1[C@H]3CC[C@@H]1CC(OC(=O)CCN2CCOCC2)C3	ZINC000000235628	O=C(CCN1CCOCC1)OC2CC3CCC(C2)N3
COCC(=O)N(C2CCN(CCc1ccccc1)CC2)c3ccccc3	ZINC000000585304	C2CN(CCc1ccccc1)CCC2Nc3ccccc3
C[C@H](CN[C@H]2CC(=O)N(c1ccc(C)cc1)C2=O)c3ccccc3	ZINC000000183104	O=C2CC(NCCc1ccccc1)C(=O)N2c3ccccc3
NC(=O)C2(NC1CCCCC1)CCCCC2	ZINC000000066771	C2CCC(NC1CCCCC1)CC2
COc3ccc(C(=O)N2C[C@@H](c1ccccc1)CC2=O)cc3	ZINC000000020524	O=C2CC(c1ccccc1)CN2C(=O)c3ccccc3
O[C@@H](COc2ccc(C(=O)N1CCCCC1)cc2)CN3CCCCC3	ZINC000000380785	O=C(N1CCCCC1)c3ccc(OCCCN2CCCCC2)cc3
Cn2cnc(S(=O)(=O)NCC(=O)N[C@@H](CO)CN1CCCC1)c2	ZINC000647712124	O=C(CNS(=O)(=O)c1c[nH]cn1)NCCN2CCCC2
CCCN3CCC(N2CCN(c1ccccn1)CC2)CC3	ZINC000000219953	C3CC(N2CCN(c1ccccn1)CC2)CCN3
Cc3cc2C1CCC(CC1)c2cc3CC4=NCCN4	ZINC000000001725	C4CN=C(Cc3ccc2C1CCC(CC1)c2c3)N4
Fc3ccc(S(=O)(=O)n1cnc2ccccc12)cc3	ZINC000000051402	O=S(=O)(c1ccccc1)n2cnc3ccccc23
COC(=O)[C@@H]1CCC(=O)NCCCC[C@@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)N1	ZINC000011612876	O=C1CCCCCNC(=O)CCCN1
COc1ccc(O)c([C@H](N)C(O)=O)c1	ZINC000000021859	c1ccccc1
CN(C)C[C@]1(C)OC(=O)C(Cl)=C1C	ZINC000000085686	O=C1OCC=C1
CCN(CC)Cc1cc(NC(C)=O)ccc1O	ZINC000000041095	c1ccccc1
Cc3[nH]c2ncnc(NCc1ccccc1)c2c3C	ZINC000000022051	C(Nc1ncnc2[nH]ccc12)c3ccccc3
CC(=O)COc2cc1c(C)cc(=O)oc1cc2Cl	ZINC000000036225	O=c2ccc1ccccc1o2
CNC(=O)NC(=O)CN2CCC(CN1CCCCCC1)CC2	ZINC000045806433	C2CCCN(CC1CCNCC1)CC2
CN(C)CCO[C@H](NC(=O)OCCN(C)C)C(Cl)(Cl)Cl	ZINC000003167902	nonring
NCCNC(=O)c3ccc2c(=O)c1ccc(C(=O)NCCN)cc1c(=O)c2c3	ZINC000029059851	O=c2c1ccccc1c(=O)c3ccccc23
C[C@@H]3C[C@@](O)(CC(O)(c1ccccc1)c2ccccc2)[C@@H](C)C[N@]3C	ZINC000000036733	C3CC(CC(c1ccccc1)c2ccccc2)CCN3
CCC(=O)N(c1ccccc1)C3(COC)CCN(CCn2cccn2)CC3	ZINC000000603904	C2CN(CCn1cccn1)CCC2Nc3ccccc3
CN4CCN(c2nnc(c1ccccc1)c3ccccc23)CC4	ZINC000000126549	C4CN(c2nnc(c1ccccc1)c3ccccc23)CCN4
NC(=O)COc1cc(OCC(N)=O)c3c(c1)oc(=O)c2ccccc23	ZINC000000134008	O=c2oc1ccccc1c3ccccc23
COC(=O)CCC(=O)N1CCC[C@@H]([N@@](C)CCCN(C)C)C1	ZINC000012443767	C1CCNCC1
CCN2CCC(N[C@@H]1CCCCNC1=O)CC2	ZINC000003683622	O=C1NCCCCC1NC2CCNCC2
C[N@]3CCC(c1c[nH]c2ccc(NC(C)=O)cc12)=CC3	ZINC000000021585	C3CC(c1c[nH]c2ccccc12)=CCN3
C[C@@H](NC(=O)C(=O)N2CC(S(=O)(=O)N1CCNCC1)C2)[C@@H]3CCCO3	ZINC000642781985	O=C(NCC1CCCO1)C(=O)N3CC(S(=O)(=O)N2CCNCC2)C3
N=c3n(CCOc1ccccc1)c2ccccc2n3CCN4CCCCC4	ZINC000000716198	N=c3n(CCOc1ccccc1)c2ccccc2n3CCN4CCCCC4
O=N(=O)c5ccc(c4cn3c1ccccc1n(CCN2CCCCC2)c3n4)cc5	ZINC000000716199	C5CCN(CCn3c1ccccc1n4cc(c2ccccc2)nc34)CC5
CNS(=O)(=O)N2CCN(C(=O)CCN1CCCS1(=O)=O)CC2	ZINC000559250055	O=C(CCN1CCCS1(=O)=O)N2CCNCC2
O=N(=O)c3cccc(c1ncc2ccccn12)c3	ZINC000000126044	c3ccc(c1ncc2ccccn12)cc3
CN3CCN(c1cccc2[nH]c(=O)oc12)CC3	ZINC000000008736	O=c3[nH]c2cccc(N1CCNCC1)c2o3
CCOC(=O)c3ccc([n+]1nnc2ccccn12)cc3	ZINC000000048712	c3ccc([n+]1nnc2ccccn12)cc3
NC(=O)[C@@H]2CCC[N@@](Cc1ccccc1F)C2	ZINC000000183077	C2CCN(Cc1ccccc1)CC2
O=C(Nc1ccccc1)N2CCN3CCC2CC3	ZINC000000026226	O=C(Nc1ccccc1)N2CCN3CCC2CC3
Clc2ccc(OCC1=NCCN1)cc2Cl	ZINC000000001435	C2CN=C(COc1ccccc1)N2
CCn1c(=O)c(N(C)C)nc2ccccc12	ZINC000000021500	O=c2cnc1ccccc1[nH]2
CC(C)c1ccccc1OCC2=NCCN2	ZINC000000001437	C2CN=C(COc1ccccc1)N2
OC(=O)CCC(=O)Nc2ccc(C(=O)OC1CCCCC1)cc2	ZINC000000064841	O=C(OC1CCCCC1)c2ccccc2
CC(C)=c3oc2c(ccc1cc(C)ncc12)c3=O	ZINC000000007754	C=c3oc2c(ccc1ccncc12)c3=O
COCCN2CCC[C@@](O)(CN1CCN(S(N)(=O)=O)CC1)C2=O	ZINC000067805380	O=C1NCCCC1CN2CCNCC2
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
O[C@@]3(C(F)(F)F)CC(c2ccc1ccccc1c2)=NO3	ZINC000000061022	C3CC(c2ccc1ccccc1c2)=NO3
CC(=O)Nc2n[n+]1c(C)cc(C)nc1c3ccccc23	ZINC000000041891	c1ccc2c(c1)cn[n+]3cccnc23
O=C1CS[C@@H]2N1CCCNC23CCCCC3	ZINC000000102284	O=C1CSC2N1CCCNC23CCCCC3
CC(C)(C)NC[C@@H](O)COc2ccc(O)c3C1CCC(CC1)c23	ZINC000000000527	C1CC2CCC1c3ccccc23
CS(=O)(=O)N3CCN(CC(=O)N[C@@H]1C[C@H](O)[C@H]1n2cccn2)CC3	ZINC000616772899	O=C(CN1CCNCC1)NC2CCC2n3cccn3
CCOC(=O)c3ccc2[n+](c1ccccc1)c(C)n(CC)c2c3	ZINC000000243470	c3ccc([n+]1c[nH]c2ccccc12)cc3
C[C@@H](N)[C@@H](O)c1ccc(O)cc1	ZINC000000154803	c1ccccc1
CC(=O)N2CCN(CC(\C)=C/c1ccccc1)CC2	ZINC000000219534	C2CN(CC=Cc1ccccc1)CCN2
CN(C)CCn1c(C#N)cc2ccccc12	ZINC000000129803	c2ccc1[nH]ccc1c2
C2CO[C@H](CNCc1ccncc1)C2	ZINC000000266017	C2COC(CNCc1ccncc1)C2
CN2CCO[C@H](CNC(=O)C(=O)N1CCO[C@@H](CN(C)CC(N)=O)C1)C2	ZINC000560907424	O=C(NCC1CNCCO1)C(=O)N2CCOCC2
COc2ccc(CN1CCC(O)CC1)c(C)c2C	ZINC000000237536	C2CCN(Cc1ccccc1)CC2
O=C1CCCCN1CN2CCCCC2	ZINC000000165580	O=C1CCCCN1CN2CCCCC2
CCN(CC)C(=O)c2cnc1ccccc1c2O	ZINC000000043492	c2ccc1ncccc1c2
CCN(CC)Cn1cccc(C)c1=O	ZINC000000165586	O=c1cccc[nH]1
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
CCN4CCN(C(=O)c3ccc(N1CCNCC1)c(NS(=O)(=O)c2ccc(CC)cc2)c3)CC4	ZINC000033033451	O=C(N1CCNCC1)c4ccc(N2CCNCC2)c(NS(=O)(=O)c3ccccc3)c4
CCOc2ccc(CN1CCCC1)cc2OC	ZINC000000042940	C2CCN(Cc1ccccc1)C2
O=C(COC(=O)c1ccco1)OCn3c(=O)c2ccccc2c3=O	ZINC000000062257	O=C(COC(=O)c1ccco1)OCn3c(=O)c2ccccc2c3=O
COc1ccccc1CCN[C@H]3CC(=O)N(c2ccc(C)cc2)C3=O	ZINC000000339240	O=C2CC(NCCc1ccccc1)C(=O)N2c3ccccc3
COc4ccc3[C@@H]2CC[C@]1(C)[C@H](CC[C@@]1(O)C#C)[N@]2CCc3c4	ZINC000000000259	C4CC3CCC1N(CCc2ccccc12)C3C4
Clc3ccc(N(=O)=O)c(CN2CCC(Cc1ccccc1)CC2)c3	ZINC000000207022	C2CN(Cc1ccccc1)CCC2Cc3ccccc3
C[N@]1[C@H]3CC[C@@H]1CC(=NOC(=O)c2ccc(F)cc2)C3	ZINC000000191120	O=C(ON=C1CC2CCC(C1)N2)c3ccccc3
Cc2cc(C)c(S(=O)(=O)NC1CC(C)(C)NC(C)(C)C1)cc2C	ZINC000000079781	O=S(=O)(NC1CCNCC1)c2ccccc2
NS(=O)(=O)N3CCC[C@@H](C(=O)N2CCN(Cc1nnc[nH]1)CC2)C3	ZINC000616551347	O=C(C1CCCNC1)N3CCN(Cc2nnc[nH]2)CC3
CC[N@]1CCC[C@@H]1CNC(=O)C(O)(c2ccccc2)c3ccccc3	ZINC000000000251	O=C(NCC1CCCN1)C(c2ccccc2)c3ccccc3
Clc2nc(N1CCCNCC1)c(Cl)c(C#N)c2Cl	ZINC000000092777	C2CNCCN(c1ccccn1)C2
COc1ccccc1CC(=O)NC2C[C@@H]3CC[C@H](C2)[N@]3C	ZINC000000132892	O=C(Cc1ccccc1)NC2CC3CCC(C2)N3
COC(=O)n1c(SCC(=O)N(C)C)nc2ccccc12	ZINC000000062412	c2ccc1[nH]cnc1c2
Ic1ccccc1C(=O)n2cccn2	ZINC000000037174	O=C(c1ccccc1)n2cccn2
C3CC(c1c[nH]c2ccccc12)=CCN3	ZINC000000154399	C3CC(c1c[nH]c2ccccc12)=CCN3
COc3ccc(OC)c(Nc2cc(c1ccccc1)nc(N)n2)c3	ZINC000000092771	N(c1ccccc1)c3cc(c2ccccc2)ncn3
C[C@@H]([C@@H]2OC[C@H](CN1CCCCC1)O2)c3ccccc3	ZINC000000187167	C3CCN(CC2COC(Cc1ccccc1)O2)CC3
C[C@@H]2[C@@H]4N(CC1CC1)CC[C@@]2(C)c3cc(O)ccc3C4=O	ZINC000000000410	O=C3C1CC(CCN1CC2CC2)c4ccccc34
CCC[C@@H](O)c1ccccc1OCCN(C(C)C)C(C)C	ZINC000000000413	c1ccccc1
Nc4ccc(CN3CCN(c2ccc1ccccc1n2)CC3)cc4	ZINC000000110981	C3CN(c2ccc1ccccc1n2)CCN3Cc4ccccc4
CCN3CCN(C(=O)CCC2CCN(C[C@H]1CCC=CC1)CC2)CC3	ZINC000011840886	O=C(CCC2CCN(CC1CCC=CC1)CC2)N3CCNCC3
CC[C@@H](N)Cc1ccc(C)c(O)c1	ZINC000000056470	c1ccccc1
COC(=O)C[C@@H](O)CNC(=O)[C@H]2CN(CCN1CCOCC1)C(=O)C2	ZINC000600470236	O=C1CCCN1CCN2CCOCC2
Cc1ccccc1C2(O)CCNCC2	ZINC000000347518	C2CC(c1ccccc1)CCN2
CC(C)[C@H](N)C(=O)N2CCN(C1CCCC1)CC2	ZINC000019687690	C2CCC(N1CCNCC1)C2
NCCc3ccc(OCc1ccccc1)c(OCc2ccccc2)c3	ZINC000000056477	C(Oc1ccccc1OCc2ccccc2)c3ccccc3
CN(C)CCC[N@@](C)Cc1cc(I)cc(C)c1O	ZINC000002390008	c1ccccc1
COc4cc3CCn2c(cc(N1CCNCC1)nc2=O)c3cc4OC	ZINC000000534361	O=c4nc(N1CCNCC1)cc3c2ccccc2CCn34
C3CO[C@H](CN[C@@H]2CCc1ccccc1C2)C3	ZINC000000221378	C3COC(CNC2CCc1ccccc1C2)C3
CN(C)CCNC(=O)c3ccc2sc1ccccc1c(=O)[nH]c2c3	ZINC000000216929	O=c2[nH]c1ccccc1sc3ccccc23
CCOC(=O)c2c(NC(=O)CNC(C)C)sc1CCCCc12	ZINC000000131692	C2CCc1sccc1C2
OC[C@@H]2CCC[N@@](Cc1cc(F)ccc1F)C2	ZINC000000217681	C2CCN(Cc1ccccc1)CC2
CCOC(=O)c2oc1ccccc1c2NC(=O)CCN(CC)CC	ZINC000000051444	c2ccc1occc1c2
C4CN(c2ncnc3scc(c1ccccc1)c23)CCN4	ZINC000000066573	C4CN(c2ncnc3scc(c1ccccc1)c23)CCN4
CNc2cc(C)nc(NCc1ccccc1)n2	ZINC000000073447	C(Nc1ncccn1)c2ccccc2
Cc2cc(C(F)(F)F)nc(NC(=O)NC(=O)c1cccc(F)c1)n2	ZINC000000056318	O=C(NC(=O)c1ccccc1)Nc2ncccn2
COc3ccc(NS(=O)(=O)c2ccc(NC(=O)c1ccccc1OC)cc2)c(OC)c3	ZINC000000983194	O=C(Nc2ccc(S(=O)(=O)Nc1ccccc1)cc2)c3ccccc3
CN2CCc3c(N)c1cc(C)cc(C)c1nc23	ZINC000000104448	C3Cc2cc1ccccc1nc2N3
Clc1ccccc1C(=O)NCc2ccccn2	ZINC000000029251	O=C(NCc1ccccn1)c2ccccc2
CN2CCC([N@@](C)Cc1ccccc1)CC2	ZINC000000202093	C2CC(NCc1ccccc1)CCN2
CC(C)c1ccc(C)c(CN(C)C)c1OC(=O)N(C)C	ZINC000000187952	c1ccccc1
CCOc1cc(CNCCCNC)ccc1OCc2ccccc2	ZINC000008254625	C(Oc1ccccc1)c2ccccc2
COc2ccc1ccccc1c2CN(CCCN(C)C)CCCN(C)C	ZINC000002489947	c2ccc1ccccc1c2
Cc2cccc3c(N)c1cccc(C(=O)NCCNCCN)c1nc23	ZINC000019372561	c3ccc2nc1ccccc1cc2c3
Nc2c(c1ccccc1)nc3ccccn23	ZINC000000032671	c3ccc(c2cn1ccccc1n2)cc3
CCOC(=O)N2CCC(NCc1ccc(F)cc1)CC2	ZINC000000220176	C2CC(NCc1ccccc1)CCN2
CCN1CCC2(CC1)OC(=O)C(C)=C2C(=O)NCCCN3CCCCC3	ZINC000020531741	O=C3OC1(CCNCC1)C(C(=O)NCCCN2CCCCC2)=C3
CCOC(=O)C1[C@@H](CC(C)=O)[C@H](C(=O)OCC)O[N+]1=O	ZINC000000246187	O=[N+]1CCCO1
CN(C)CCN3C=C(O)C(c2nc1ccc(C)cc1[nH]2)C3=N	ZINC000011906259	N=C1NC=CC1c3nc2ccccc2[nH]3
C[C@H](C[N@]1CCC[C@H](O)C1)c2ccccc2	ZINC000000217118	C2CCN(CCc1ccccc1)CC2
COc4cc3C[C@H](Cc2cc[n+](Cc1ccccc1)cc2)C(=O)c3cc4OC	ZINC000000603084	O=C3C(Cc2cc[n+](Cc1ccccc1)cc2)Cc4ccccc34
CC(=O)c2ccc(NC(=O)C(=O)NNC(=O)c1ccccc1S(N)(=O)=O)cc2	ZINC000048547474	O=C(NNC(=O)c1ccccc1)C(=O)Nc2ccccc2
Cc1cc(=O)oc(C)c1C(=O)NC2CC(C)(C)NC(C)(C)C2	ZINC000000521842	O=C(NC1CCNCC1)c2ccc(=O)oc2
Nc4cc(N2CCc1ccccc1C2)c3ccccc3n4	ZINC000000026869	C2Cc1ccccc1CN2c3ccnc4ccccc34
C[N@]1[C@H]4CC[C@@H]1CC(NC(=O)c2cc(C)c3ccccn23)C4	ZINC000000003818	O=C(NC1CC2CCC(C1)N2)c3ccc4ccccn34
CC(=O)Nc3ccc(S(=O)(=O)Nc2ccc1ccccc1n2)cc3	ZINC000000152058	O=S(=O)(Nc2ccc1ccccc1n2)c3ccccc3
CC(C)c3cc(\C=C1/CN2CCC1CC2)on3	ZINC000000006806	C1CN3CCC1C(=Cc2ccno2)C3
C[C@@H](N)Cn1ccc2cc(F)c(Cl)cc12	ZINC000000006375	c2ccc1[nH]ccc1c2
NNc1nc(N)c3c(n1)c2ccccc2CC34CCCC4	ZINC000000078979	C1CCC4(C1)Cc2ccccc2c3ncncc34
CC(C)Nc2nc(N1CCNCC1)nc(Cl)c2C	ZINC000000004468	C2CN(c1ncccn1)CCN2
Nc3nc(c1cccnc1)nc4c2ccccc2oc(=O)c34	ZINC000000051936	O=c3oc1ccccc1c4nc(c2cccnc2)ncc34
NC(=O)c2cc[n+](COC[n+]1ccccc1\C=N\O)cc2	ZINC000000005077	C(OC[n+]1ccccc1)[n+]2ccccc2
Cc1ccccc1NC(=O)Nc2ccccc2Cl	ZINC000000028358	O=C(Nc1ccccc1)Nc2ccccc2
CCN1CCC(N[C@@H](C)CCCC(C)(C)O)CC1	ZINC000000221181	C1CCNCC1
C[N@@](CCO)Cc1csc2ccc(Br)cc12	ZINC000000338993	c2ccc1sccc1c2
CN4Cc3cc(Cn2c(=O)c1ccccc1c2=O)ccc3NC4=O	ZINC000000034419	O=C4NCc3cc(Cn2c(=O)c1ccccc1c2=O)ccc3N4
CCOC(=O)c1ccccc1NCn3c(=O)c2ccccc2c3=O	ZINC000000044284	O=c2n(CNc1ccccc1)c(=O)c3ccccc23
CN2CCC(N(C)S(=O)(=O)c1ccc(F)cc1)CC2	ZINC000000111161	O=S(=O)(NC1CCNCC1)c2ccccc2
COc3ccc(n2c(Nc1nc(C)cc(C)n1)nc(C)cc2=O)cc3	ZINC000000069460	O=c2ccnc(Nc1ncccn1)n2c3ccccc3
COc2ccc(C(=S)N1CCN(C)CC1)cc2Br	ZINC000000313662	S=C(N1CCNCC1)c2ccccc2
CCOC(=O)C(=C/c1ccccc1)/C#N	ZINC000000028235	c1ccccc1
CC(=O)CC(=O)Nc1nccs1	ZINC000000028233	c1cscn1
CCn2cc(C[N@]1CCC[C@@H](N(C)CCN(C)C)C1)c(C)n2	ZINC000019224399	C2CCN(Cc1cn[nH]c1)CC2
Cc4ccc(C(=O)NCCN1CCCC1)c5nc3c(C(=O)NCCN2CCCC2)c(N)c(=O)c(C)c3oc45	ZINC000005124470	O=C(NCCN1CCCC1)c4cccc5oc3cc(=O)cc(C(=O)NCCN2CCCC2)c3nc45
C5CCN(C1C2CC3CC1CC(C2)C3N4CCCC4)C5	ZINC000004727684	C5CCN(C1C2CC3CC1CC(C2)C3N4CCCC4)C5
CCC[N@@](CCO)Cc1cc(Br)ccc1OC	ZINC000000277485	c1ccccc1
CCN2CCC(N[C@@H](C)c1ccc(F)cc1)CC2	ZINC000000213540	C2CC(NCc1ccccc1)CCN2
O=C(OC(CN1CCCCC1)CN2CCCCC2)c3ccccc3	ZINC000000173906	O=C(OC(CN1CCCCC1)CN2CCCCC2)c3ccccc3
OC(=O)CN2CSC(=S)N(Cc1ccccc1)C2	ZINC000000001005	S=C1SCNCN1Cc2ccccc2
Oc3ccc(c2cc(=O)c1ccccc1o2)c(O)c3	ZINC000000039293	O=c2cc(c1ccccc1)oc3ccccc23
N=C1NC[C@H]3N1c2ccccc2Cc4ccccc34	ZINC000000006157	N=C1NCC3N1c2ccccc2Cc4ccccc34
Cn3cnc2C[N@](C[C@H](O)c1ccc(Br)cc1)CCc23	ZINC000000408249	C(Cc1ccccc1)N3CCc2[nH]cnc2C3
C[C@@](Cc1ccccc1)(NC(=O)CN)c2ccccc2	ZINC000000228297	C(Cc1ccccc1)c2ccccc2
COC(=O)c2ccc(C[N+](=O)c1ccccc1)cc2	ZINC000000080322	O=[N+](Cc1ccccc1)c2ccccc2
CN(CCCNC(=O)CN2CC(N1CCNC1=O)C2)S(C)(=O)=O	ZINC000660686426	O=C1NCCN1C2CNC2
NC(=N)SCCNC2C1CC3CC(C1)CC2C3	ZINC000004012298	C1C2CC3CC1CC(C2)C3
CSC1=NCCN1CC(=O)c2ccc(C)cc2	ZINC000000167185	O=C(CN1CCN=C1)c2ccccc2
Cc1cccc2c(=O)[nH]cc(Br)c12	ZINC000000011581	O=c1[nH]ccc2ccccc12
CCN4CCN(c2ncnc3sc1CCCc1c23)CC4	ZINC000000127392	C4Cc3sc2ncnc(N1CCNCC1)c2c3C4
C[C@@](O)(C#CCN1CCCCC1)C2CC2	ZINC000000139697	C2CCN(CC#CCC1CC1)CC2
COc3ccc2[nH]cc([C@@H](O)CN1CCC(C(N)=O)CC1)c2c3	ZINC000000541327	C3CCN(CCc1c[nH]c2ccccc12)CC3
Nc4nc(c1ccccn1)c(c3ccc2ncccc2n3)s4	ZINC000000003548	c4ccc(c1ncsc1c3ccc2ncccc2n3)nc4
C[N@]2CC[C@@](OC(C)=O)(c1ccccc1)C(C)(C)C2	ZINC000000097856	C2CC(c1ccccc1)CCN2
NCC2CCN(CCOc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000044514163	C2CCN(CCOc1ccccc1)CC2
OC2(c1cccc(C(F)(F)F)c1)CCNCC2	ZINC000000266400	C2CC(c1ccccc1)CCN2
CCOC(=O)c1c(CN(C)C)oc2ccc(O)cc12	ZINC000000067908	c2ccc1occc1c2
CC(=O)Nc4ccc(C(=O)N(CC(=O)N1CCNCC1)C3CCN(Cc2ccccc2)CC3)cc4	ZINC000015864143	O=C(CN(C2CCN(Cc1ccccc1)CC2)C(=O)c3ccccc3)N4CCNCC4
C/C(=N\O)c2ccc1ccccc1c2O	ZINC000000025885	c2ccc1ccccc1c2
O=C(N1CCNCC1)c2ccccc2	ZINC000000235748	O=C(N1CCNCC1)c2ccccc2
COc2ccc(NC(=O)C(=S)NCc1ccccc1)cc2	ZINC000000042720	O=C(Nc1ccccc1)C(=S)NCc2ccccc2
CC3(C)CC(Nc2noc(c1ccccc1)n2)CC(C)(C)N3	ZINC000000092195	C3CC(Nc2noc(c1ccccc1)n2)CCN3
CC[C@](COC(=O)c1cc(OC)c(OC)c(OC)c1)(N(C)C)c2ccccc2	ZINC000000608117	O=C(OCCc1ccccc1)c2ccccc2
CCc3nc(C)nc(N2CCN(C(=O)c1ccccc1Cl)CC2)c3Cc4ccc(C)cc4	ZINC000000697358	O=C(N3CCN(c1ncncc1Cc2ccccc2)CC3)c4ccccc4
CN3CCN([C@H]2C[N@@](Cc1c(C)cc(C)c(CO)c1C)C[C@@H]2O)CC3	ZINC000055227200	C3CN(C2CCN(Cc1ccccc1)C2)CCN3
CC24CN1CC[N@@](CC(C1)/C2=N/N=C/c3ccc(N(=O)=O)cc3)C4	ZINC000000027973	C1CN2CC3CN1CC(C2)C3=NN=Cc4ccccc4
O=c2nc1cccccc1n2Cc3ccccc3	ZINC000000001002	O=c2nc1cccccc1n2Cc3ccccc3
CCC(=O)Nc2sc1c(CC(C)(C)NC1(C)C)c2C#N	ZINC000000180754	C2Cc1ccsc1CN2
Cc2cccc(NC(=O)CSc1nc(N)cc(N)n1)c2	ZINC000000077124	O=C(CSc1ncccn1)Nc2ccccc2
COc3ccc(N2C(=O)C[C@H](NCc1ccncc1)C2=O)cc3	ZINC000000181404	O=C2CC(NCc1ccncc1)C(=O)N2c3ccccc3
NCCNC(=O)[C@@H]2CCCN(S(=O)(=O)c1ccc(S(N)(=O)=O)cc1)C2	ZINC000647204406	O=S(=O)(N1CCCCC1)c2ccccc2
Cc2cc(C)nc(SCC(=O)Nc1cccc(N(=O)=O)c1)n2	ZINC000000041416	O=C(CSc1ncccn1)Nc2ccccc2
Fc3ccc(N2CC(=O)N(NC(=O)CN1CCCCC1)CC2=O)cc3	ZINC000000131357	O=C(CN1CCCCC1)NN3CC(=O)N(c2ccccc2)CC3=O
C2CCN(CCc1ccncc1)C2	ZINC000000163336	C2CCN(CCc1ccncc1)C2
COC(=O)c2ccc(CN1CCCC1)cc2	ZINC000000213438	C2CCN(Cc1ccccc1)C2
CCS(=O)(=O)N2CCC[C@@H](C(=O)NCCN1CCCC1)C2	ZINC000000220603	O=C(NCCN1CCCC1)C2CCCNC2
CN(C)Cc1c[nH]c2ccccc12	ZINC000000073686	c2ccc1[nH]ccc1c2
CCOc2ccc(n1c(=O)[nH]c(C(O)=O)c(CC)c1=O)cc2	ZINC000000405163	O=c1cc[nH]c(=O)n1c2ccccc2
CC(=O)O[C@@]2(c1ccccc1)C[C@H](C(C)(C)C)C[N@](C(C)(C)C)C2	ZINC000000049434	C2CNCC(c1ccccc1)C2
CSc2nc(C)cc(n1cc(Br)c(=O)[nH]c1=O)n2	ZINC000000118979	O=c2ccn(c1ccncn1)c(=O)[nH]2
COC(=O)CC1CC(C)(C)NC(C)(C)C1	ZINC000000103960	C1CCNCC1
COc3ccc(N2CCN([C@@H](C)Cc1cccc(C(F)(F)F)c1)CC2)cc3	ZINC000000756593	C2CN(c1ccccc1)CCN2CCc3ccccc3
Fc1ccccc1C(=O)N3CCC(N2CCCCCC2)CC3	ZINC000000207601	O=C(N2CCC(N1CCCCCC1)CC2)c3ccccc3
CCC[N@]2CC[C@@H](CNC(=O)NCCC(=O)N1CCN(C)CC1)C2	ZINC000054511216	O=C(NCCC(=O)N1CCNCC1)NCC2CCNC2
Cc2nn(c1ccccc1)nc2CN	ZINC000000158831	c2ccc(n1nccn1)cc2
O=C(Cc1cccs1)N3CCN(c2ccccc2)CC3	ZINC000000030412	O=C(Cc1cccs1)N3CCN(c2ccccc2)CC3
C[C@@H](C(=O)NC(C)(C)C)n2c(=O)c1ccccc1c2=O	ZINC000000042055	O=c1[nH]c(=O)c2ccccc12
CCOC(=O)c2oc1ccccc1c2CN3CCC(C(N)=O)CC3	ZINC000000118667	C3CCN(Cc1coc2ccccc12)CC3
N=C(NCCCN1CCOCC1)NC[C@@]3(N2CCOCC2)CCCOC3	ZINC000365049122	N=C(NCCCN1CCOCC1)NCC3(N2CCOCC2)CCCOC3
C[n+]2cc(C(=O)NCC[N+](C)(C)Cc1ccccc1)ccc2\C=N\O	ZINC000000174443	O=C(NCCNCc1ccccc1)c2cccnc2
O=C3CC[C@H]2N1CCC(CC1)C2=C3	ZINC000000260945	O=C3CCC2N1CCC(CC1)C2=C3
CC(=O)N2c1ccccc1S(=O)(=O)c3cc(Cl)ccc23	ZINC000000041137	O=S3(=O)c1ccccc1Nc2ccccc23
CN(C)CCNC(=O)c2cccc3ccc(c1ccncc1)nc23	ZINC000000024932	c3ccc2nc(c1ccncc1)ccc2c3
COc3cc2CC1(CCCCC1)N[C@@H](CC=C)c2cc3OC	ZINC000000228108	C1CCC3(CC1)Cc2ccccc2CN3
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
Cc1ccccc1c4nc(C[N@]3CCC[C@@H](C(=O)NCCN2CCCC2)C3)c(C)o4	ZINC000005055847	O=C(NCCN1CCCC1)C4CCCN(Cc3coc(c2ccccc2)n3)C4
CCCn2c(=S)[nH]c(=Cc1ccc(O)c(N(=O)=O)c1)c2=O	ZINC000000202782	O=c1[nH]c(=S)[nH]c1=Cc2ccccc2
CNC(=O)NC(=O)Cc2cc1OCOc1cc2Cc3ccc(N)cc3	ZINC000000003612	C3Oc2ccc(Cc1ccccc1)cc2O3
CCCCCCn2cc(CCCN[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](O)[C@@H]1O)nn2	ZINC000101345256	C2CCC(NCCCc1c[nH]nn1)CC2
Nc1nonc1c3noc(c2cc(F)c(F)cc2Cl)n3	ZINC000000032733	c3ccc(c2nc(c1cnon1)no2)cc3
CN3C[C@@H](CC[N@]2CCC(c1ccccc1)=CC2)OC3=O	ZINC000000000304	O=C3NCC(CCN2CCC(c1ccccc1)=CC2)O3
CN(C)\C=N\c2ccn(Cc1ccccc1)c(=O)c2C#N	ZINC000000208480	O=c1ccccn1Cc2ccccc2
COc3ccc(CC[C@@H]1NCCn2cccc12)cc3OC	ZINC000000214200	C3Cn1cccc1C(CCc2ccccc2)N3
CC(C)CC[C@@]2(CCNC1CCN(C)CC1)CCO[C@@H](C(C)C)C2	ZINC000008992495	C2CC(NCCC1CCOCC1)CCN2
CC3CCC(N2CCN(C(=O)c1ccc(N(=O)=O)cc1)CC2)CC3	ZINC000000285157	O=C(N2CCN(C1CCCCC1)CC2)c3ccccc3
O[C@@H]4[C@@H](Cn2cc(CN1CCS(=O)(=O)CC1)nn2)C[C@@H](NCc3cccnc3)[C@@H]4O	ZINC000225501259	O=S4(=O)CCN(Cc3cn(CC2CCC(NCc1cccnc1)C2)nn3)CC4
O=C4CN(S(=O)(=O)c3ccc(NS(=O)(=O)c2ccc1ccccc1c2)cc3)CC(=O)N4	ZINC000000783494	O=C4CN(S(=O)(=O)c3ccc(NS(=O)(=O)c2ccc1ccccc1c2)cc3)CC(=O)N4
CN(C)CC/C=C2/c1ccccc1CS(=O)(=O)c3ccccc23	ZINC000000346582	C=C2c1ccccc1CS(=O)(=O)c3ccccc23
O=C(N4CCN(C2C1CC3CC(C1)CC2C3)CC4)c5cccs5	ZINC000000239195	O=C(N4CCN(C2C1CC3CC(C1)CC2C3)CC4)c5cccs5
Cc2n(N)c1ccccc1[n+]2CC#C	ZINC000000337513	c2ccc1[nH]cnc1c2
NCc1ccsc1Br	ZINC000000166970	c1ccsc1
COc1cccc(OC)c1OC[C@@H](O)CN2CCCCC2	ZINC000000166973	C2CCN(CCCOc1ccccc1)CC2
CC[N@]1CCc2c(C1)sc(N)c2C(=O)OC	ZINC000000265910	C2Cc1ccsc1CN2
OC(=O)c3ccc(NC2=N[C@@H]1CS(=O)(=O)C[C@@H]1S2)cc3	ZINC000002462039	O=S3(=O)CC2SC(Nc1ccccc1)=NC2C3
CCOC(=O)CNC(=O)C2CCN(CCC(=O)N1CCN(C)CC1)CC2	ZINC000514083354	O=C(CCN1CCCCC1)N2CCNCC2
CCNC(=O)CCN2CCC(CC(=O)N1CCN(CC)CC1)CC2	ZINC000066568211	O=C(CC1CCNCC1)N2CCNCC2
C[C@H](NS(C)(=O)=O)C(=O)N2CCN(c1ccc(S(N)(=O)=O)cc1)CC2	ZINC000516802462	C2CN(c1ccccc1)CCN2
COC(=O)c1cccc(CN)c1	ZINC000000153955	c1ccccc1
Cc3cccc(NC(=O)CCN2CCN(c1ccccc1F)CC2)c3	ZINC000000255177	O=C(CCN2CCN(c1ccccc1)CC2)Nc3ccccc3
CC(=O)Nc1cccc(CN)c1	ZINC000000153951	c1ccccc1
CS(=O)(=O)NCCN2CCCC1(CCC[N@@](CCNS(C)(=O)=O)C1)C2	ZINC000377725497	C1CNCC2(C1)CCCNC2
CN4CCN(c3nnc(c1ccccc1)c(c2ccccc2)n3)CC4	ZINC000000159566	C4CN(c3nnc(c1ccccc1)c(c2ccccc2)n3)CCN4
OC(=O)\C=C\C(=O)N3CCN(Cc2ccc1OCOc1c2)CC3	ZINC000000032116	C3CN(Cc2ccc1OCOc1c2)CCN3
OC(=O)c3ccc(CSc1nnnn1C2CCCCC2)cc3	ZINC000000033468	C3CCC(n1nnnc1SCc2ccccc2)CC3
Cc2ccc(S(=O)(=O)Nc1ccc(C)c(N(=O)=O)c1)cc2	ZINC000000067943	O=S(=O)(Nc1ccccc1)c2ccccc2
COc3cc2CC(C)(C)N=C(Nc1cc(C)ccc1C)c2cc3OC	ZINC000000371925	C3Cc1ccccc1C(Nc2ccccc2)=N3
Cc3cnc(NC(=O)C(c1ccccc1)c2ccccc2)o3	ZINC000000026288	O=C(Nc1ncco1)C(c2ccccc2)c3ccccc3
CC[C@]2(c1ccccc1)NC(=O)NC2=O	ZINC000000000546	O=C2NC(c1ccccc1)C(=O)N2
Cc3c(NS(=O)(=O)c1ccc(NC(=O)CCC(O)=O)cc1)c(=O)n(c2ccccc2)n3C	ZINC000000833225	O=c2c(NS(=O)(=O)c1ccccc1)c[nH]n2c3ccccc3
C[C@H]2CC1=CC(=O)CCN1c3ccc(Cl)cc23	ZINC000000025479	O=C1CCN2C(=C1)CCc3ccccc23
CC(C)(C)NC[C@@H](O)COc1nsnc1N2CCOCC2	ZINC000000403609	C2CN(c1cnsn1)CCO2
CC(C)[N@]1CCc2c(C1)sc(N)c2C#N	ZINC000000049943	C2Cc1ccsc1CN2
C[C@H]3CN(C(=O)NC1C[C@@H]2CC[C@H](C1)[N@]2C)c4ccccc34	ZINC000000002904	O=C(NC1CC2CCC(C1)N2)N3CCc4ccccc34
COc2cc(OC)c(C(=O)CCCN1CCCC1)c(OC)c2	ZINC000000005191	O=C(CCCN1CCCC1)c2ccccc2
O=C(CC[N@]2CCC(c1ccccc1)=CC2)NCc3ccccc3	ZINC000000410092	O=C(CCN2CCC(c1ccccc1)=CC2)NCc3ccccc3
C[C@H]2C[N@@](Cc1ccccc1)CCN2C(C)=O	ZINC000000408099	C2CN(Cc1ccccc1)CCN2
Fc3ccc(C(=O)CCN2CCN(Cc1ccccc1)CC2)cc3	ZINC000000408098	O=C(CCN2CCN(Cc1ccccc1)CC2)c3ccccc3
C[C@@H](NC(C)(C)C)C(=O)c1cccc(Cl)c1	ZINC000000057206	c1ccccc1
COc1cc(NC(=O)CCN)cc2ccccc12	ZINC000000057200	c2ccc1ccccc1c2
Cn1cnnc1c3cccc(NC(=O)\C=C\c2ccc(F)cc2)c3	ZINC000000032594	O=C(Nc2cccc(c1nnc[nH]1)c2)C=Cc3ccccc3
COc2ccc(S(=O)(=O)Nc1ccc(I)cc1C)cc2OC	ZINC000001130694	O=S(=O)(Nc1ccccc1)c2ccccc2
O=C(COc2ccc(\C=c1\[nH]c(=O)[nH]c1=O)cc2)N3CCOCC3	ZINC000000571853	O=C(COc2ccc(C=c1[nH]c(=O)[nH]c1=O)cc2)N3CCOCC3
Brc5ccc(C4=NN(C(=O)CN1CCCCC1)[C@@H](c3nc2ccccc2[nH]3)C4)cc5	ZINC000000755011	O=C(CN1CCCCC1)N3N=C(c2ccccc2)CC3c5nc4ccccc4[nH]5
CN2CCC(NCc1cccc(Cl)c1)CC2	ZINC000000279896	C2CC(NCc1ccccc1)CCN2
CN(C)[C@H](CNC(=S)NC1CCCCC1)c2cccnc2	ZINC000000245176	S=C(NCCc1cccnc1)NC2CCCCC2
CC(=N)Nc2cc(c1ccccc1)n[nH]2	ZINC000000165879	c2ccc(c1cc[nH]n1)cc2
Fc3ccc(O[C@H](C1CCNCC1)c2ccccc2)cc3	ZINC000000025764	C3CC(C(Oc1ccccc1)c2ccccc2)CCN3
O[C@@H](CNC[C@H]1CCCO1)Cn3c2ccccc2c4ccccc34	ZINC000000277126	C(CNCC1CCCO1)Cn3c2ccccc2c4ccccc34
CN(C)c3ccc(\C=c2/c(c1cccc(N(=O)=O)c1)noc2=O)cc3	ZINC000000032204	O=c2onc(c1ccccc1)c2=Cc3ccccc3
Cc1ccccc1n3c(=O)cc(N2CCC(C(N)=O)CC2)[nH]c3=O	ZINC000000252646	O=c2cc(N1CCCCC1)[nH]c(=O)n2c3ccccc3
COC(=O)C2C(c1ccc(C)cc1)C(C(=O)OC)C(=C)NC2=C	ZINC000000229038	C=C2CC(c1ccccc1)CC(=C)N2
NC(=O)C4CCN(CCCn2c1ccccc1sc3ccc(Cl)cc23)CC4	ZINC000000538183	C4CCN(CCCn2c1ccccc1sc3ccccc23)CC4
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
CC(C)NC(=O)COc2ccc(C=c1c(=O)[nH]c(=O)[nH]c1=O)cc2	ZINC000002957125	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)[nH]2
C[C@H]2CN(CCCCC[N@]1C[C@@H](C)O[C@H](C(N)=O)C1)C[C@@H](C(N)=O)O2	ZINC000625740163	C(CCN1CCOCC1)CCN2CCOCC2
O[C@@H](COc2ccc([C@H]1CCC=C1)cc2)CN3CCCCC3	ZINC000000302646	C3CCN(CCCOc2ccc(C1CCC=C1)cc2)CC3
CCN3CCC(N2CCN(c1ccc(F)cc1)CC2)CC3	ZINC000000279502	C3CC(N2CCN(c1ccccc1)CC2)CCN3
CN(C)CCNc2cc(c1ccco1)nc3ccccc23	ZINC000000018410	c3ccc2nc(c1ccco1)ccc2c3
CCc1cccc(CC)c1N2C(=N)NC(=N)NC2(C)C	ZINC000000071379	N=C2NCN(c1ccccc1)C(=N)N2
C[C@H](CCc1ccccc1)N[C@@H](C)[C@@H](O)c2ccc(O)cc2	ZINC000000057422	C(CNCCc1ccccc1)Cc2ccccc2
COCC[N@]2CC[C@@H](NC(=O)C(=O)N1CCO[C@@H](CCCN(C)C)C1)C2	ZINC000668840163	O=C(NC1CCNC1)C(=O)N2CCOCC2
CNc1ccccc1C[S@@](=O)c3nc2ccccc2[nH]3	ZINC000000002870	O=S(Cc1ccccc1)c3nc2ccccc2[nH]3
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
CCN2CCN(Cc1ccc(N(=O)=O)cc1)CC2	ZINC000000294057	C2CN(Cc1ccccc1)CCN2
CC34CN(Cc1ccccc1)CC(C)(CN(Cc2ccccc2)C3)C4O	ZINC000000755166	C2C4CN(Cc1ccccc1)CC2CN(Cc3ccccc3)C4
COc2ccc(CN(CCN(C)C)c1ncccn1)cc2	ZINC000000057513	C(Nc1ncccn1)c2ccccc2
COc1ccc(Cl)cc1NC(=O)c2nn(C)cc2N(=O)=O	ZINC000000069716	O=C(Nc1ccccc1)c2cc[nH]n2
CC(C)(C)NCC(=O)Nc3c2CCN(Cc1ccccc1)c2nc4ccccc34	ZINC000000755160	C3Cc2cc1ccccc1nc2N3Cc4ccccc4
CC(C)C(=O)N2CCN(CC1CCNCC1)CC2	ZINC000019680312	C2CC(CN1CCNCC1)CCN2
CC(C)[C@@H](NC(=O)[C@@H](C)N)C(=O)N[C@@H]1[C@@H](O)O[C@@H](CO)[C@@H](O)[C@H]1O	ZINC000005733377	C1CCOCC1
CCN(CC)C(=O)N[C@H]2C[N@@](C)[C@H]1Cc3c[nH]c4cccc(C1=C2)c34	ZINC000000001623	C4CC=C1C(Cc2c[nH]c3cccc1c23)N4
CC(C)(CN1CCCCC1)NS(=O)(=O)c2ccc(Cl)cc2	ZINC000000284040	O=S(=O)(NCCN1CCCCC1)c2ccccc2
C[C@@H]2C[N@@](C)[C@H](c1ccccc1)CC2=O	ZINC000000184840	O=C2CCNC(c1ccccc1)C2
CCN(CC)CCn3cnc2c1cc(OC)c(OC)cc1[nH]c2c3=O	ZINC000000487070	O=c2[nH]cnc3c1ccccc1[nH]c23
COc3cc([C@@H]1SCC(=O)N1Cc2ccccc2)ccc3O	ZINC000000045571	O=C2CSC(c1ccccc1)N2Cc3ccccc3
CC(C)NS(=O)(=O)NCCNC(=O)C(=O)N1CCN(C)C[C@@H]1CN	ZINC000580173940	C1CNCCN1
CN2[C@@H]([N+](=O)Cc1c(F)cccc1Cl)C(C)(C)SC2=S	ZINC000000070485	O=[N+](Cc1ccccc1)C2CSC(=S)N2
O[C@H](COc1cccc(N(=O)=O)c1)CN2CCCCC2	ZINC000000244271	C2CCN(CCCOc1ccccc1)CC2
CC(NNc1nncc2ccccc12)=C3C(=O)CC(C)(C)CC3=O	ZINC000000268723	O=C1CCCC(=O)C1=CNNc2nncc3ccccc23
COC(=O)c1c(C)oc2ccc(OCC(N)=O)cc12	ZINC000000071208	c2ccc1occc1c2
CC(=O)C2(c1ccccc1)CCNCC2	ZINC000000120675	C2CC(c1ccccc1)CCN2
Clc1cc(N(=O)=O)ccc1Oc3ccc(C2=NCCN2)cc3	ZINC000000349349	C3CN=C(c2ccc(Oc1ccccc1)cc2)N3
OC(=O)CSc2nnc(c1cccnc1)n2Cc3ccco3	ZINC000000091645	C(c1ccco1)n2cnnc2c3cccnc3
Cc1ccc(F)cc1NC(=O)CSc2nnnn2C	ZINC000000031456	O=C(CSc1nnn[nH]1)Nc2ccccc2
CC[C@@H](C)NCC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000000174588	c1ccccc1
O=C(CN1CCCCCC1)Nc2sccc2C#N	ZINC000000127954	O=C(CN1CCCCCC1)Nc2cccs2
CCOC(=O)c2csc(Nc1ccncc1)n2	ZINC000000113044	N(c1ccncc1)c2nccs2
CN2CCN(c1cc(C)c(C#N)c(Cl)n1)CC2	ZINC000000162906	C2CN(c1ccccn1)CCN2
CN(C)c2nc1nonc1nc2Nc3cccc(Cl)c3	ZINC000000033249	N(c1ccccc1)c3cnc2nonc2n3
CCN(CC)CCN2C(=O)[C@@H]1CN(C(=O)[C@@H](N)C(C)C)C[C@]1(C)NC(=O)c3ccccc23	ZINC000019526384	O=C3Nc1ccccc1C(=O)NC2CNCC23
Clc1ccccc1CC2=NCCN2	ZINC000000071199	C2CN=C(Cc1ccccc1)N2
COc3cc(CN2CCc1cc(OC)c(OC)cc1C2)cc(Br)c3O	ZINC000000755742	C2Cc1ccccc1CN2Cc3ccccc3
COc2cc(OC)c(CN1CCCC1)cc2Br	ZINC000000218160	C2CCN(Cc1ccccc1)C2
CN(C)CCNC(=O)C2CCN(S(=O)(=O)N1CCOCC1)CC2	ZINC000000218161	O=S(=O)(N1CCCCC1)N2CCOCC2
COc1ccccc1CNc3ccc2n(C)cnc2c3	ZINC000000170024	C(Nc2ccc1[nH]cnc1c2)c3ccccc3
CCC2CCC(N1CCC(C(N)=O)CC1)CC2	ZINC000000212146	C2CCC(N1CCCCC1)CC2
C[C@H]3CCC[C@@H](N2CCN(c1ccc(Cl)cc1)CC2)C3	ZINC000000221414	C3CCC(N2CCN(c1ccccc1)CC2)CC3
CN(C)CCCn2cnc3n(Cc1ccccc1)c(=O)[nH]c(=O)c23	ZINC000000485754	O=c2[nH]c(=O)c1[nH]cnc1n2Cc3ccccc3
COCCCNCC(=O)N1CCN(C(=O)CNCCCOC)CC1	ZINC000004946098	C1CNCCN1
C[n+]3c1ccccc1nc4ccc(N[C@@H]2CCCC[C@@H]2N)cc34	ZINC000004172225	C4CCC(Nc3ccc2nc1ccccc1nc2c3)CC4
N[C@H]2c1ccccc1CS(=O)(=O)c3ccccc23	ZINC000000390523	O=S3(=O)Cc1ccccc1Cc2ccccc23
CN3CCN(C(=O)Nc1c(C)noc1c2ccccc2)CC3	ZINC000000129821	O=C(Nc1cnoc1c2ccccc2)N3CCNCC3
O=C(NC(=S)Nc2ccc(CN1CCCC1)cc2)c3ccco3	ZINC000000514891	O=C(NC(=S)Nc2ccc(CN1CCCC1)cc2)c3ccco3
CCOC(=O)C2=C(N)Oc1cc(C)oc(=O)c1[C@@H]2c3cccs3	ZINC000000061398	O=c3occc2OC=CC(c1cccs1)c23
CN(C)C[C@H](c1ccc(O)cc1)C2(O)CCCCC2	ZINC000000009342	C2CCC(Cc1ccccc1)CC2
CN(C)CCC[N@@](C)[C@@H]2CCCN(C(=O)c1ccnc(Cl)c1)C2	ZINC000011814189	O=C(N1CCCCC1)c2ccncc2
CCN(c1ccccc1C)S(=O)(=O)N(C)C	ZINC000000030632	c1ccccc1
COc4ccc3[nH]c(=O)n(C(=O)OC1C[C@@H]2CC[C@H](C1)[N@]2C)c3c4	ZINC000000005122	O=C(OC1CC2CCC(C1)N2)n3c(=O)[nH]c4ccccc34
Cc1ccccc1OC[C@@H]3CN(CN2CCCCC2)C(=O)O3	ZINC000000090378	O=C2OC(COc1ccccc1)CN2CN3CCCCC3
CN(C)CCc1c[nH]c2ccc(O)cc12	ZINC000000001070	c2ccc1[nH]ccc1c2
Clc2ccc(C1=NCCCN1)cn2	ZINC000000027341	C2CNC(c1cccnc1)=NC2
CC2(C)[C@H]3CC=C(C[N@]1CCC[C@@H](O)C1)[C@@H]2C3	ZINC000000219789	C3CCN(CC1=CCC2CC1C2)CC3
O=C(Cn1cc(C#N)c2ccccc12)NCCc3c[nH]c4ccccc34	ZINC000000029027	O=C(Cn1ccc2ccccc12)NCCc3c[nH]c4ccccc34
CC(=O)NCCn3c(=S)[nH]c2ccc(N1CCOCC1)cc2c3=O	ZINC000000425109	O=c2[nH]c(=S)[nH]c3ccc(N1CCOCC1)cc23
Fc3ccc(n2[nH]c(=O)\c(=C/c1cccc(N(=O)=O)c1)c2=O)cc3	ZINC000000106018	O=c2[nH]n(c1ccccc1)c(=O)c2=Cc3ccccc3
CCOc1ccccc1NC(=O)C[C@@H]3N[C@H]2CCCC[C@H]2NC3=O	ZINC000000536822	O=C(CC2NC1CCCCC1NC2=O)Nc3ccccc3
CC[n+]2ccc(C(=O)Nc1cccc(C(=O)OC)c1)cc2	ZINC000000437048	O=C(Nc1ccccc1)c2ccncc2
C[N@]4CCc1cc(Cl)c(O)cc1[C@H](c3cccc2CCOc23)C4	ZINC000000005515	C4Cc1ccccc1C(c3cccc2CCOc23)CN4
C5CCN(CCn3c1ccccc1c4nc2ccccc2nc34)CC5	ZINC000000067762	C5CCN(CCn3c1ccccc1c4nc2ccccc2nc34)CC5
O=CNc3ncc(c2nc1ccccc1[nH]2)s3	ZINC000000034294	c3ccc2[nH]c(c1cncs1)nc2c3
C[C@@H]2C[N@](C(C)(C)C)C[C@](O)(c1ccccc1)C2	ZINC000000051110	C2CNCC(c1ccccc1)C2
Nc2ccc(N1CCNCC1)cc2	ZINC000000265626	C2CN(c1ccccc1)CCN2
CNCCN(C)C(=O)C(=O)NCCN2CCN(Cc1ccccc1)CC2	ZINC000418837918	C2CN(Cc1ccccc1)CCN2
FC(F)(F)c3cccc(OC[C@@H]2CNC[C@H](C(=O)NCCc1cnc[nH]1)C2)c3	ZINC000014731604	O=C(NCCc1cnc[nH]1)C3CNCC(COc2ccccc2)C3
Cc3nc2n(C)c1ccccc1n2c3C(=O)OCCN4CCCCC4	ZINC000000255157	O=C(OCCN1CCCCC1)c3cnc4[nH]c2ccccc2n34
CC(C)NC[C@@H](O)COc1cccc2[nH]ccc12	ZINC000000056646	c2ccc1[nH]ccc1c2
COc2ccc([C@@H]1CNC(=O)C1)cc2OC3CCCC3	ZINC000000004982	O=C3CC(c2cccc(OC1CCCC1)c2)CN3
COC(=O)c1ccc([C@@H](C)N(C)C)o1	ZINC000000182990	c1ccoc1
Cc2c(c1ccccc1)[nH]c(=O)n2C4CCN(CCc3ccccc3)CC4	ZINC000000592274	O=c2[nH]c(c1ccccc1)cn2C4CCN(CCc3ccccc3)CC4
O=c3n([C@H]1CCC[N@]2CCCC[C@@H]12)c(=O)c4ccccc34	ZINC000000049578	O=c3n(C1CCCN2CCCCC12)c(=O)c4ccccc34
CCC(=O)Nc2ccc(S(=O)(=O)Nc1nnc(CC)s1)cc2	ZINC000000048142	O=S(=O)(Nc1nncs1)c2ccccc2
CN(C)C(=O)c2ccc(CC1CCNCC1)cc2	ZINC000000008347	C2CC(Cc1ccccc1)CCN2
Cc3cccc(N2CCC(/N=C/N1CCCCC1)=N2)c3	ZINC000000048140	C3CCN(C=NC2=NN(c1ccccc1)CC2)CC3
COc2cccc(CN1CCC(C(=O)NCCC(C)C)CC1)c2OC	ZINC000000299578	C2CCN(Cc1ccccc1)CC2
CCCc2nn(c1ccc(F)cc1)c(=O)c2=CNCC3CCNCC3	ZINC000000054352	O=c2n(c1ccccc1)ncc2=CNCC3CCNCC3
COC(=O)c3cc(=O)c2c(SC)nc(c1ccccc1)nc2[nH]3	ZINC000000054350	O=c2cc[nH]c3nc(c1ccccc1)ncc23
OC(=O)C4(NC(=O)OCC2c1ccccc1c3ccccc23)CC4	ZINC000000105368	O=C(NC1CC1)OCC3c2ccccc2c4ccccc34
CCOc2ccc(NC(=O)NCC[N@]1[C@@H](C)CCC[C@H]1C)cc2	ZINC000000250022	O=C(NCCN1CCCCC1)Nc2ccccc2
CC(=O)[C@@H]2[C@H](c1cccs1)NC(=O)N[C@@]2(O)C(F)(F)F	ZINC000000079347	O=C2NCCC(c1cccs1)N2
OCc1cccc[n+]1Cc2ccccc2	ZINC000000480067	C(c1ccccc1)[n+]2ccccc2
C[C@H](N1CCCC1)C(=O)NCC3(c2ccccc2)CCCC3	ZINC000000177859	O=C(CN1CCCC1)NCC3(c2ccccc2)CCCC3
CCCN3CCC(N2CCC(C(=O)N1CCOCC1)CC2)CC3	ZINC000020455878	O=C(C2CCN(C1CCNCC1)CC2)N3CCOCC3
NCC(O)(c1ccc(Cl)cc1)c2ccc(Cl)cc2	ZINC000000053230	C(c1ccccc1)c2ccccc2
CCc1c(C)nc(N)nc1N2CCCC2	ZINC000000448934	C2CCN(c1ccncn1)C2
FC(F)(F)S(=O)(=O)c2cccc(NC1CCNCC1)c2	ZINC000000154322	C2CC(Nc1ccccc1)CCN2
C[n+]2ccc(\C=C\c1cccs1)cc2	ZINC000000055356	C(=Cc1cccs1)c2ccncc2
NC(N)=NN2Cc1c(Cl)ccc(Cl)c1C2	ZINC000000000886	C1NCc2ccccc12
C[N@]1CCN3[C@@H](C1)c2cccn2Cc4ccccc34	ZINC000000000050	C1CN3C(CN1)c2cccn2Cc4ccccc34
CNC[C@@H](O)c1ccc(O)cc1	ZINC000000000733	c1ccccc1
CCN(CC)CC(=O)Nc1cc(C)nn1c2ccccc2	ZINC000000159018	c2ccc(n1cccn1)cc2
Nc2nnc(SCC(=O)NC1CCCC1)s2	ZINC000000036102	O=C(CSc1nncs1)NC2CCCC2
O[C@@H]3O[C@@H](OCCC(=O)N(C1CCNCC1)c2ccccc2)[C@@H](O)[C@@H](O)[C@@H]3O	ZINC000077300779	O=C(CCOC1CCCCO1)N(C2CCNCC2)c3ccccc3
CNC(=O)CN2CCN(S(=O)(=O)c1cccc(S(N)(=O)=O)c1)CC2	ZINC000530669594	O=S(=O)(N1CCNCC1)c2ccccc2
CC(C)NC[C@@H](O)COc1nccs1	ZINC000000000738	c1cscn1
O=C3C[C@H](N1CCCc2ccccc12)C(=O)N3c4ccccc4	ZINC000000044671	O=C3CC(N1CCCc2ccccc12)C(=O)N3c4ccccc4
CCN2CCN(C(=N)Nc1nc(C)cc(C)n1)CC2	ZINC000004975232	N=C(Nc1ncccn1)N2CCNCC2
CS(=O)(=O)N3CC[C@@H](NC(=O)N2CC(S(=O)(=O)N1CCNCC1)C2)C3	ZINC000579602687	O=C(NC1CCNC1)N3CC(S(=O)(=O)N2CCNCC2)C3
CCn1c(C)[n+](CC)c2cc(C(=O)OC)c(C(=O)OC)cc12	ZINC000000499609	c2ccc1[nH]cnc1c2
COc2cc(C[N+](=O)c1ccccc1)ccc2O	ZINC000000159379	O=[N+](Cc1ccccc1)c2ccccc2
Cn4c3C(=O)N(CCCN2CCN(c1ccccc1)CC2)CCc3c5ccccc45	ZINC000000597292	O=C3N(CCCN2CCN(c1ccccc1)CC2)CCc4c3[nH]c5ccccc45
NC(=O)C[C@@]2(O)CCCN(C(=O)Cn1cc(Br)c(=O)[nH]c1=O)C2	ZINC000643995479	O=C(Cn1ccc(=O)[nH]c1=O)N2CCCCC2
Nc4nc(c1ccco1)c3ncn(C(=O)NCc2ccccc2)c3n4	ZINC000000003638	O=C(NCc1ccccc1)n3cnc4c(c2ccco2)ncnc34
COc3ccc2n(C)c(c1cccc(OC(=O)N(C)C)c1)c[n+]2c3	ZINC000000387379	c3ccc(c2c[n+]1ccccc1[nH]2)cc3
CCOC(=O)c2cnc1c(CC)cccc1c2N3CCN(C)CC3	ZINC000000131539	C3CN(c1ccnc2ccccc12)CCN3
CN([C@@H]1CCN(CC=C)C1=O)C(=O)C(=O)N2CCO[C@H](CC(N)=O)C2	ZINC000625570421	O=C1NCCC1NC(=O)C(=O)N2CCOCC2
C[C@H]2OC1(CCN(C)CC1)CC2=C	ZINC000000004140	C=C2COC1(CCNCC1)C2
Cc2ccc(NNC=c1c(C)c(C#N)c(=O)n(C)c1=O)cc2C	ZINC000000482688	O=c2ccc(=CNNc1ccccc1)c(=O)[nH]2
CCN(C)C(=O)Oc1cccc([C@H](C)N(C)C)c1	ZINC000000004413	c1ccccc1
C[C@@H](C(=O)NCCc1ccccc1F)n3c(=O)c2ccccc2c3=O	ZINC000000133734	O=C(Cn2c(=O)c1ccccc1c2=O)NCCc3ccccc3
Cc3ccc(S(=O)(=O)N1CCC[C@H]1c2ccsc2)cc3	ZINC000000026230	O=S(=O)(N1CCCC1c2ccsc2)c3ccccc3
COc1ccc(CC(=O)OCCN(C)C)cc1OC	ZINC000000379343	c1ccccc1
CN(C)CCN(Cc1ccccc1)Cc2ccc(N(=O)=O)cc2	ZINC000000234500	C(NCc1ccccc1)c2ccccc2
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
C[N@]1[C@H]5CC[C@@H]1CC(NC(=O)N3CC2(CC2)c4ccccc34)C5	ZINC000000024877	O=C(NC1CC2CCC(C1)N2)N4CC3(CC3)c5ccccc45
CN(C)C(=O)Oc3ccc(OCc2n(C)c1ccccc1[n+]2C)cc3	ZINC000000387384	C(Oc1ccccc1)c3nc2ccccc2[nH]3
Cc1noc(C)c1S(=O)(=O)NCc2ccccn2	ZINC000000111919	O=S(=O)(NCc1ccccn1)c2cnoc2
Cc4ccc3n2CCN[C@H]1CCCc(c12)c3c4	ZINC000000000641	C2CC1NCCn3c1c(C2)c4ccccc34
C[N@](Cc1ccccc1)Cc2cccn2CCN3CCOCC3	ZINC000004715644	C3CN(CCn1cccc1CNCc2ccccc2)CCO3
COc4ccc3cc2c1cc(O)c(O)cc1CC[n+]2cc3c4OC	ZINC000000338118	C3C[n+]2cc1ccccc1cc2c4ccccc34
N[C@@H](CC(=O)c1cc(Cl)ccc1N)C(O)=O	ZINC000000007614	c1ccccc1
Cc2cccc(NC(=O)CCN1CCC(C(N)=O)CC1)c2	ZINC000000176292	O=C(CCN1CCCCC1)Nc2ccccc2
FC(F)(F)c3nccc(N2CCC(CN1CCCC1=O)CC2)n3	ZINC000000004091	O=C1CCCN1CC3CCN(c2ccncn2)CC3
CCC[N@]1CCC[C@H]2[C@H]1COc3ccc(O)cc23	ZINC000000004090	C3CNC2COc1ccccc1C2C3
COCCN2C(=O)[C@@H]1[C@@H](CC(N)=O)N[C@@]4([C@@H]1C2=O)C(=O)Nc3ccccc34	ZINC000016021941	O=C1NC(=O)C2C1CNC24C(=O)Nc3ccccc34
CC[N@]1CCC[C@@H]1CNC(=O)c3ccc(OC2CCN(C)CC2)c(OC)c3	ZINC000012573547	O=C(NCC1CCCN1)c3ccc(OC2CCNCC2)cc3
Cc1cc(\C=N\NC(N)=O)c(C)n1c3sc2CCCCc2c3C#N	ZINC000000037507	C3CCc2sc(n1cccc1)cc2C3
CCOC(=O)c3c(NC(=O)NCC1CCNCC1)sc2CCCCc23	ZINC000000734250	O=C(NCC1CCNCC1)Nc3cc2CCCCc2s3
CCn1c(C)[n+](CC)c2cc(C(=O)N(C)C)ccc12	ZINC000000243465	c2ccc1[nH]cnc1c2
CN3CCC(N(C)C(=O)c2cnn(c1ccc(F)cc1)c2C)CC3	ZINC000000153689	O=C(NC1CCNCC1)c3cnn(c2ccccc2)c3
Cn2oc1CCNCCc1c2=O	ZINC000000011255	O=c2[nH]oc1CCNCCc12
O=c2c1CCNCCc1on2Cc3ccccc3	ZINC000000011254	O=c2c1CCNCCc1on2Cc3ccccc3
CC(C)NC(=O)c2ccc(N1CCN(C(C)C)CC1)nc2	ZINC000000480516	C2CN(c1ccccn1)CCN2
COc1ccccc1CCNC2CCN(C(C)=O)CC2	ZINC000000217698	C2CC(NCCc1ccccc1)CCN2
Cc2ccc(S(=O)(=O)NCCNC(=O)C(=O)N1CCO[C@@H](CN)C1)s2	ZINC000419147776	O=C(NCCNS(=O)(=O)c1cccs1)C(=O)N2CCOCC2
CN(C)C(=O)Oc3cccc(OCc2c[n+]1ccccc1n2C)c3	ZINC000000387382	C(Oc1ccccc1)c3c[n+]2ccccc2[nH]3
Clc3ccc(NCn1nnc2ccccc12)cc3N(=O)=O	ZINC000000031909	C(Nc1ccccc1)n2nnc3ccccc23
NC[C@H](CC(O)=O)c1ccc(Cl)cc1	ZINC000000000061	c1ccccc1
CC(C)NC[C@@H](O)COc1cccc2cc(C(C)=O)oc12	ZINC000000000063	c2ccc1occc1c2
CN3CCC([N@@]2CCC[C@@H](O)[C@H](NC(=O)c1ccc(OCC#C)cc1)C2)CC3	ZINC000015672090	O=C(NC2CCCCN(C1CCNCC1)C2)c3ccccc3
O=C(Nc1c[nH]c(=O)[nH]c1=O)C(c2ccccc2)c3ccccc3	ZINC000000138799	O=C(Nc1c[nH]c(=O)[nH]c1=O)C(c2ccccc2)c3ccccc3
CC(C)(C)OC(=O)CCN1CCC(C(N)=O)CC1	ZINC000000053539	C1CCNCC1
CN(C)CCn2c1CC[N@](C)Cc1c3ccccc23	ZINC000003600656	C3Cc2[nH]c1ccccc1c2CN3
CC(C)n3c(=O)n(Cc2nc1ccccc1n2CCN(C)C)c4ccccc34	ZINC000000594344	O=c2[nH]c1ccccc1n2Cc4nc3ccccc3[nH]4
Cn3c(c1cc[n+](C)c2ccccc12)[n+](C)c4ccccc34	ZINC000000246425	c4ccc3[nH]c(c1ccnc2ccccc12)nc3c4
CC2(C)CC(NC(=O)c1ccco1)CC(C)(C)N2	ZINC000000054270	O=C(NC1CCNCC1)c2ccco2
COc2cc(Br)cc(\C=c1\[nH]c(=S)[nH]c1=O)c2OC	ZINC000000451816	O=c1[nH]c(=S)[nH]c1=Cc2ccccc2
CN(CCN(CCN1CCCC1)C(=O)CNC(N)=O)C(=O)CNC(N)=O	ZINC000672466586	C1CCNC1
Clc2cnn(C(=O)c1cccc(N(=O)=O)c1)c2	ZINC000000037160	O=C(c1ccccc1)n2cccn2
CC(C)NC[C@@H](O)c1cc(O)cc(O)c1	ZINC000000000469	c1ccccc1
CC1(C)[C@@H](C=C(Cl)Cl)[C@@H]1C(=O)Nc3ccc(S(=O)(=O)Nc2ncccn2)cc3	ZINC000000913103	O=C(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)C3CC3
CN[C@@H](C)[C@@H](O)c1ccc(NS(C)(=O)=O)cc1	ZINC000000000465	c1ccccc1
CC[C@@H](CNS(C)(=O)=O)NC(=O)N2CC(S(=O)(=O)N1CCNCC1)C2	ZINC000418257193	O=S(=O)(C1CNC1)N2CCNCC2
CN(C)c2cccc(C(=O)NCc1ccc(S(N)(=O)=O)cc1)c2	ZINC000000030345	O=C(NCc1ccccc1)c2ccccc2
COC(=O)[C@@H](CN)c1c[nH]c2ccc(OC)cc12	ZINC000000000392	c2ccc1[nH]ccc1c2
CN2CCC(NC1CCN(C)CC1)CC2	ZINC000000154382	C2CC(NC1CCNCC1)CCN2
NCCc1c[nH]c2c(O)cc(O)cc12	ZINC000000388557	c2ccc1[nH]ccc1c2
Brc3cc(NCn1cnc(N(=O)=O)n1)c2ncccc2c3	ZINC000000032833	C(Nc1cccc2cccnc12)n3cncn3
CC(C)n3c(=O)c2ccc(c1ccc(C=O)o1)cc2c3=O	ZINC000000037766	O=c2[nH]c(=O)c3cc(c1ccco1)ccc23
COc3ccc([C@@H]2OC[C@@H](CN1CCCCC1)O2)cc3	ZINC000000187157	C3CCN(CC2COC(c1ccccc1)O2)CC3
FC(F)(F)c2cccc(N1CCNCC1)c2	ZINC000000056464	C2CN(c1ccccc1)CCN2
CC(C)=C(NC(=O)c1ccccc1)C(=O)Nc2ccc(C(O)=O)cc2	ZINC000000173645	C=C(NC(=O)c1ccccc1)C(=O)Nc2ccccc2
FC(F)(F)c4cccc(N3CCN(C2CCN(CCc1ccccc1)CC2)CC3)c4	ZINC000000757726	C2CN(CCc1ccccc1)CCC2N4CCN(c3ccccc3)CC4
C4CCN(CNc2ncnc3n(CN1CCCCC1)cnc23)CC4	ZINC000000077342	C4CCN(CNc2ncnc3n(CN1CCCCC1)cnc23)CC4
O[C@@H](CNCc2ccc1OCOc1c2)COc3ccccc3	ZINC000000119165	C(CNCc2ccc1OCOc1c2)COc3ccccc3
Cn1cnc(N(=O)=O)c1SC[C@@H](O)CN2CCCCC2	ZINC000000346175	C2CCN(CCCSc1cnc[nH]1)CC2
NCc1c(Cl)cc(C(F)(F)F)cc1Cl	ZINC000000110953	c1ccccc1
Nc3ccc(S(=O)(=O)Nc1ccnn1c2ccccc2)cc3	ZINC000000057490	O=S(=O)(Nc1ccnn1c2ccccc2)c3ccccc3
O=C([C@@H]2CCC[N@@](Cc1ccncc1)C2)N3CCCCC3	ZINC000000212558	O=C(C2CCCN(Cc1ccncc1)C2)N3CCCCC3
Cc2cc(S(=O)(=O)N[C@@H]1CCCCNC1=O)c(C(F)(F)F)o2	ZINC000000131019	O=C1NCCCCC1NS(=O)(=O)c2ccoc2
Oc3ccc(c2oc1ccccc1c(=O)c2O)cc3	ZINC000000057750	O=c2cc(c1ccccc1)oc3ccccc23
COc2cc(CNCc1ccc(OC)c(C)c1)cc(OC)c2	ZINC000000172197	C(NCc1ccccc1)c2ccccc2
CCN(CC)CCn2c(N)[n+](CC(=O)c1ccc(Br)cc1)c3ccccc23	ZINC000004551904	O=C(C[n+]1c[nH]c2ccccc12)c3ccccc3
CCN2CCN(C(=O)c1cccc(N(=O)=O)c1)CC2	ZINC000000127890	O=C(N1CCNCC1)c2ccccc2
CC[N@]2CCO[C@@H](C(=O)NCC1CCN(CC(=O)NC(C)(C)C)CC1)C2	ZINC000079992910	O=C(NCC1CCNCC1)C2CNCCO2
Clc1cncc(Cl)c1N2CCNCC2	ZINC000000127219	C2CN(c1ccncc1)CCN2
CC(C)NC(=O)C3CCN(C2CCN(C(=O)[C@@H]1CCCC[N@]1C)CC2)CC3	ZINC000011839086	O=C(C1CCCCN1)N3CCC(N2CCCCC2)CC3
CN5CCN(c4ccc3nc(c2c(N)c1ncccc1[nH]c2=O)[nH]c3c4)CC5	ZINC000000594205	O=c2[nH]c1cccnc1cc2c5nc4ccc(N3CCNCC3)cc4[nH]5
COC(=O)CCNC(=O)CCNC(=O)N1CCC[C@@H](C(=O)NCCN)C1	ZINC000599934587	C1CCNCC1
CSc2nc(c1ccccc1)nc(SC)c2C(C)=O	ZINC000000034196	c2ccc(c1ncccn1)cc2
Cc3ccc(CC2(O)CCN(CCOc1ccc(O)cc1)CC2)cc3	ZINC000000007382	C(CN2CCC(Cc1ccccc1)CC2)Oc3ccccc3
CC(C)(C)OC(=O)Nc1ccc(Br)cc1C(O)=O	ZINC000000128432	c1ccccc1
C[N@]2CCc1cccc4c1[C@H]2Cc3ccc(C)c(O)c34	ZINC000000006368	C2Cc3cccc4c1ccccc1CC(N2)c34
OC2CCN(Cc1cc(Br)cs1)CC2	ZINC000000040751	C2CCN(Cc1cccs1)CC2
CN(C)CCCN2C[C@@H](COc1ccccc1)O[C@@H]2c3ccccc3	ZINC000000517202	C2NC(c1ccccc1)OC2COc3ccccc3
CC[N@@](CC(C)=C)C1CCN(C)CC1	ZINC000000279504	C1CCNCC1
NC2(CNC(=O)C(=O)NCCS(=O)(=O)N1CCSCC1)CCOCC2	ZINC000627386302	O=C(NCCS(=O)(=O)N1CCSCC1)C(=O)NCC2CCOCC2
O[C@H](C(=O)c1ccc3c(c1)c(=O)c2ccccc23)S(O)(=O)=O	ZINC000002324960	O=c2c1ccccc1c3ccccc23
O=C3N([C@H]1CN2CCC1CC2)C[C@@H]4CCCc5cccc3c45	ZINC000000006363	O=C3N(C1CN2CCC1CC2)CC4CCCc5cccc3c45
COc3cc2c1ccc(O)cc1oc(=O)c2c(OC)c3OC	ZINC000000084122	O=c2oc1ccccc1c3ccccc23
C[C@@]3(CNC(=O)C(=O)N2CCN(C(=O)Cn1cnnn1)CC2)CCCO3	ZINC000583339880	O=C(Cn1cnnn1)N3CCN(C(=O)C(=O)NCC2CCCO2)CC3
CN(C)S(=O)(=O)N2CCC(Cc1ccccc1)CC2	ZINC000000030521	C2CC(Cc1ccccc1)CCN2
Cc2ccc(S(=O)(=O)N/N=C/c1cccc(N(=O)=O)c1)cc2	ZINC000000028349	O=S(=O)(NN=Cc1ccccc1)c2ccccc2
CCOC(=O)COc3ccc(\C=c2\c(=O)[nH]c(=O)n(c1ccc(F)cc1)c2=O)cc3Br	ZINC000001199247	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)n2c3ccccc3
CC(C)Oc1ccc(C[N+](C)(C)C)cc1C[N+](C)(C)C	ZINC000000487549	c1ccccc1
CC[N@@](CCO)Cc1csc2c(Br)cccc12	ZINC000000338987	c2ccc1sccc1c2
Cn2cc(C(=O)NCN1CCCCC1)c3ccccc23	ZINC000000507270	O=C(NCN1CCCCC1)c2c[nH]c3ccccc23
CCOC(=O)c1ccc(CN)o1	ZINC000000031836	c1ccoc1
O=C(NC1CCCCCC1)c2cccnc2	ZINC000000029331	O=C(NC1CCCCCC1)c2cccnc2
CCOC(=O)N2CCC(=O)N(c1ccccc1)c3cc(Cl)ccc23	ZINC000000000965	O=C2CCNc1ccccc1N2c3ccccc3
C[C@H](N)Cn1ccc3c1c2cc(C)ccc2C3(C)C	ZINC000000006387	C2c1ccccc1c3[nH]ccc23
Cc1cc[n+](CCO)c2ccccc12	ZINC000000294862	c2ccc1ncccc1c2
CN(C)C(=O)c3cccc(COc2ccc(N1C(=N)NC(=N)NC1(C)C)cc2Cl)c3	ZINC000000538490	N=C3NCN(c2ccc(OCc1ccccc1)cc2)C(=N)N3
CN(C)S(=O)(=O)NC[C@@]2(O)CCCN(C(=O)CCn1cnnn1)CC2	ZINC000072476452	O=C(CCn1cnnn1)N2CCCCCC2
COc2ccc1[nH]cc(CCNC(N)=N)c1c2	ZINC000000094217	c2ccc1[nH]ccc1c2
Cn1cccc1CNC[C@@H]2CCCO2	ZINC000000360271	C2COC(CNCc1ccc[nH]1)C2
CN(C)CCNc3ncnc4c2cc1COC(C)(C)Cc1nc2sc34	ZINC000000779510	C4Cc3nc2sc1cncnc1c2cc3CO4
CC2(C)CN(C(=O)C(=O)N1CCO[C@@H](CC(N)=O)C1)CCN2CCO	ZINC000625780006	O=C(N1CCNCC1)C(=O)N2CCOCC2
O=c2oc1ncccc1n2CCN3CCCC3	ZINC000000016339	O=c2oc1ncccc1n2CCN3CCCC3
Clc4ccc3nc(CSc2nc1ccccn1n2)cn3c4	ZINC000000084651	C(Sc2nc1ccccn1n2)c4cn3ccccc3n4
COc2ccc([C@@H](N)Cc1ccccc1)cc2OC	ZINC000000173910	C(Cc1ccccc1)c2ccccc2
Fc3ccc([C@H](OCCN1CCCC1)c2ccc(Br)cc2)cc3	ZINC000000702119	C3CCN(CCOC(c1ccccc1)c2ccccc2)C3
CS(=O)(=O)Nc3ccc(C(=O)NC[C@@]1(O)CN2CCC1CC2)cc3	ZINC000000605457	O=C(NCC1CN2CCC1CC2)c3ccccc3
CNC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]2CCCCN2S(C)(=O)=O	ZINC000600128120	O=C(CNC(=O)C1CCCCN1)N2CCCC2
C[N@@](C[C@@H]1COCCO1)Cc2ccccc2c3nc(CN)cc(=O)[nH]3	ZINC000023541980	O=c3ccnc(c1ccccc1CNCC2COCCO2)[nH]3
OC2CCN(Cc1ccccc1)CC2	ZINC000000119568	C2CCN(Cc1ccccc1)CC2
Cc3cc(C)n2nc(S(=O)(=O)Nc1cccc(F)c1)nc2n3	ZINC000000081537	O=S(=O)(Nc1ccccc1)c3nc2ncccn2n3
C[C@H]([C@H](O)c1ccc(O)cc1)N3CCC(Cc2ccccc2)CC3	ZINC000000014551	C2CN(CCc1ccccc1)CCC2Cc3ccccc3
Clc2cccc(C1=CCCNC1)c2	ZINC000000019097	C2CC=C(c1ccccc1)CN2
NCCc1cc(O)c(O)c(O)c1	ZINC000000119563	c1ccccc1
CC2(C)C[C@@H]([C@@H](CCN)c1ccc(F)cc1)CCO2	ZINC000000171699	C2CC(Cc1ccccc1)CCO2
Oc2ccc(CCc1ccc(O)c(O)c1)cc2O	ZINC000000014991	C(Cc1ccccc1)c2ccccc2
CC1(C)NC(=N)NC(=N)N1c3ccc(CCC(=O)N2CCOCC2)cc3	ZINC000016954278	N=C3NCN(c2ccc(CCC(=O)N1CCOCC1)cc2)C(=N)N3
Cn3c(=O)n(C)c2nc(N1CCCCC1)n(CCN)c2c3=O	ZINC000000089498	O=c3[nH]c(=O)c2[nH]c(N1CCCCC1)nc2[nH]3
CNS(=O)(=O)NCC(=O)NCC(=O)NCCN1CCCCCC1	ZINC000562183950	C1CCCNCC1
NS(=O)(=O)c2ccc(NC(=O)c1cccc(F)c1)cc2	ZINC000000035620	O=C(Nc1ccccc1)c2ccccc2
C[C@H](Nc1ccc(Cl)cc1)c2ccncc2	ZINC000000006038	C(Nc1ccccc1)c2ccncc2
Cc2ccc1sc(N)nc1c2C	ZINC000000008889	c2ccc1scnc1c2
CN(C)CCOc1ccccc1Cc2ccccc2	ZINC000000001931	C(c1ccccc1)c2ccccc2
CC(=O)N2CCC(NCc1cccc(Cl)c1)CC2	ZINC000000213441	C2CC(NCc1ccccc1)CCN2
CN[C@@H](CC(C)C)C(=O)N[C@H]2C[C@@](O)(C(=O)N[C@H]1CCCNC1=O)C[C@@H](O)[C@@H]2O	ZINC000003840198	O=C1NCCCC1NC(=O)C2CCCCC2
C2CNCCNCC(CCc1ccccn1)CNCCNC2	ZINC000040641533	C2CNCCNCC(CCc1ccccn1)CNCCNC2
COC(=O)[C@@H]1C[C@]45CC[C@@]13Nc2ccccc2[C@@]36CC[N@@](CC=C4)[C@@H]56	ZINC000000338360	C1CC36C2N1CC=CC24CCC3(CC4)Nc5ccccc56
C[N@]1C[C@@H]2[C@H](C1)[C@@](CO)(CCO)N[C@@H]2c4cccc(n3cccn3)c4	ZINC000065452966	C1NCC2C1CNC2c4cccc(n3cccn3)c4
C3CN(Cc2ccc(c1nn[nH]n1)cc2)CCO3	ZINC000000419922	C3CN(Cc2ccc(c1nn[nH]n1)cc2)CCO3
CN2C=[N+](S(=O)(=O)c1ccc(C)cc1)CC2(C)C	ZINC000000409385	O=S(=O)([N+]1=CNCC1)c2ccccc2
CCOC(=O)C2C(c1ccc(Br)o1)C(C(=O)OCC)C(=C)NC2=C	ZINC000000623263	C=C2CC(c1ccco1)CC(=C)N2
CCOc3ccc(C(=O)Nc2ccc(N1CCN(C)CC1)cc2)cc3	ZINC000000359996	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
C3C[C@@H](NC2CCN(Cc1ccccc1)CC2)CS3	ZINC000000757852	C3CC(NC2CCN(Cc1ccccc1)CC2)CS3
Clc2ccc(CCCC(=O)Nn1cnnc1)c(Cl)c2	ZINC000000049424	O=C(CCCc1ccccc1)Nn2cnnc2
CC[C@@]4(CO)CCC[N@]3CCc1c([nH]c2ccccc12)[C@@H]34	ZINC000000000839	C4CCN3CCc1c([nH]c2ccccc12)C3C4
CC2(C)C[C@@]1(CCCNC1)CCO2	ZINC000000198738	C1CNCC2(C1)CCOCC2
CCOC(=O)C2CCN(CCC(=O)c1ccc(OCC)cc1)CC2	ZINC000000206117	O=C(CCN1CCCCC1)c2ccccc2
COC(=O)c1ccc(S(=O)(=O)NC(C)(C)C)n1C	ZINC000000119789	c1cc[nH]c1
O=C(CCN(C2CCN(Cc1ccccc1)CC2)S(=O)(=O)c3ccccc3)N4CCNCC4	ZINC000015862692	O=C(CCN(C2CCN(Cc1ccccc1)CC2)S(=O)(=O)c3ccccc3)N4CCNCC4
Cc2ccc(C)c(COc1ccc(C)nc1N)c2	ZINC000000083201	C(Oc1cccnc1)c2ccccc2
NCc2ccc(c1csnn1)cc2	ZINC000000158841	c2ccc(c1csnn1)cc2
CC2(C)CC(N1C(=O)OC(C)(C)[C@@]1(C)O)CC(C)(C)N2	ZINC000000127761	O=C1OCCN1C2CCNCC2
COC(=O)CNC(=O)CCN2CCN(C(=O)CN1CCOCC1)CC2	ZINC000521059614	O=C(CN1CCOCC1)N2CCNCC2
NC(=N)SCc2nc(c1ccc(Cl)cc1)no2	ZINC000000137780	c2ccc(c1ncon1)cc2
COc3cc2CCN[C@H](c1ccccc1O)c2cc3OC	ZINC000000034444	C3Cc1ccccc1C(c2ccccc2)N3
COc2cc(CNCc1cc(F)ccc1F)cc(OC)c2OC	ZINC000000172172	C(NCc1ccccc1)c2ccccc2
CCN(CC)CCOC(=O)[C@@H](CNCc1ccccc1)c2ccccc2	ZINC000001593620	C(Cc1ccccc1)NCc2ccccc2
CN(C)CCOc3ccc(CN2CC[C@@H](N1CCC(O)CC1)[C@H](O)C2)cc3	ZINC000012199342	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
CN(CC(=O)NCCNC(=O)C[N@](C)C1CCCCCC1)C2CCCCCC2	ZINC000009500475	O=C(CNC1CCCCCC1)NCCNC(=O)CNC2CCCCCC2
CN[C@@H](C)Cc1ccccc1OC	ZINC000000000487	c1ccccc1
CN(C)CCO[C@@H]1COCc2ccccc12	ZINC000000377854	C2Cc1ccccc1CO2
CN(C)Cc2cc(C)cc(C1(C)CCCCC1)c2O	ZINC000000109660	C2CCC(c1ccccc1)CC2
COc3cccc(CNc2nc1ccccc1n2C)c3O	ZINC000000111513	C(Nc2nc1ccccc1[nH]2)c3ccccc3
N[C@H](C[C@H](Cc2cccc(c1ccco1)c2)C(O)=O)C(O)=O	ZINC000000003600	c2ccc(c1ccco1)cc2
CCCC12CNCC(C)(CNC1)C2=O	ZINC000000213686	O=C1C2CNCC1CNC2
CCc1ccccc1NC(=S)NNS(=O)(=O)c2ccc(C)cc2	ZINC000000072504	O=S(=O)(NNC(=S)Nc1ccccc1)c2ccccc2
NC(=O)[C@@H](CCCNC(N)=NN(=O)=O)NC(=O)[C@H]1C[C@H](N=N#N)CN1	ZINC000027764872	C1CCNC1
Cc1nnc(C)n1/N=C/c2ccc(OCC(N)=O)cc2	ZINC000000039335	C(=Nn1cnnc1)c2ccccc2
C[C@H](NC1CCC2(CC1)OCCO2)c3ccccc3	ZINC000000163524	C3COC2(CCC(NCc1ccccc1)CC2)O3
COc2ccc(C[N@]1CCCC[C@@H]1CO)cc2C	ZINC000000210370	C2CCN(Cc1ccccc1)CC2
NC(=N)NN=Cc1ccccc1N(=O)=O	ZINC000000128278	c1ccccc1
O=C(Nc1cccnc1)c3cccc(S(=O)(=O)N2CCCC2)c3	ZINC000000103490	O=C(Nc1cccnc1)c3cccc(S(=O)(=O)N2CCCC2)c3
CC(=O)C1=C(O)C(=O)N(CO)[C@@H]1c2ccc(F)cc2	ZINC000000077820	O=C2NC(c1ccccc1)C=C2
C[C@@H](Cc1cccc(C(F)(F)F)c1)NC[C@@H]2CCCO2	ZINC000000214006	C2COC(CNCCc1ccccc1)C2
CCOC(=O)c2cccc(NC(=O)c1ccc(N(C)C)cc1)c2	ZINC000000031656	O=C(Nc1ccccc1)c2ccccc2
OC[C@@H]2CCC[N@@](Cc1ccccc1)C2	ZINC000000210014	C2CCN(Cc1ccccc1)CC2
COC[C@@]1(C(N)=O)CCCN1CC(O)C[N@]2CCC[C@@]2(COC)C(N)=O	ZINC000643823324	C2CCN(CCCN1CCCC1)C2
O=C(Cc1ccccc1)Nc4c2CCCCc2nc3CCCc34	ZINC000000198606	O=C(Cc1ccccc1)Nc4c2CCCCc2nc3CCCc34
CCN(CC)[C@H]3CC(=O)N(c2ccc(N1C(=O)C[C@H](N(CC)CC)C1=O)cc2)C3=O	ZINC000000688210	O=C1CCC(=O)N1c3ccc(N2C(=O)CCC2=O)cc3
Cc2ccc(NS(=O)(=O)c1ccc(Cl)cc1)c(N)c2	ZINC000000067950	O=S(=O)(Nc1ccccc1)c2ccccc2
OCCN(CCO)C[C@]2(O)CN(S(=O)(=O)c1ccccc1)C[C@H]2O	ZINC000585290597	O=S(=O)(N1CCCC1)c2ccccc2
COc3ccc([C@H]2C[C@@]1(O)C[C@](C#N)(C(=O)N1)C2(C#N)C#N)cc3	ZINC000000128475	O=C1NC3CC1CC(c2ccccc2)C3
Cc2ccc(NC(=O)[C@H]1CC1(C)C)cc2	ZINC000000003263	O=C(Nc1ccccc1)C2CC2
CCOC(=O)C2CCN(c1ccc(N)cc1)CC2	ZINC000000169809	C2CCN(c1ccccc1)CC2
COCC[N@@](C)CCNC(=O)C(=O)N2CCC[C@H]([C@@H]1C[C@@H](N)CCO1)C2	ZINC000652681886	C2CCC(C1CCCNC1)OC2
CN(C)Cc3ccc(CNC[C@@H](O)CO[C@H]1CCCc2ccccc12)cc3	ZINC000008428557	C(CNCc1ccccc1)COC2CCCc3ccccc23
CC[C@](C)(OC(=O)c1ccccc1C(O)=O)C#C	ZINC000000000616	c1ccccc1
Cc1csc(Cl)c1NC2=NCCN2	ZINC000000002646	C2CN=C(Nc1ccsc1)N2
NC(=O)C2CCN(C[C@@H](O)COc1ccc(F)cc1)CC2	ZINC000000118412	C2CCN(CCCOc1ccccc1)CC2
O=C(CSc1ncnc2[nH]cnc12)NC[C@@H]3CCCO3	ZINC000000033507	O=C(CSc1ncnc2[nH]cnc12)NCC3CCCO3
O=C(CCN1CCCCC1)c3ccc2OCCOc2c3	ZINC000000296967	O=C(CCN1CCCCC1)c3ccc2OCCOc2c3
O=c\2[nH]c1ccccc1c/2=N/N=C/c4ccc3OCOc3c4	ZINC000000032058	O=c2[nH]c1ccccc1c2=NN=Cc4ccc3OCOc3c4
CC(C)NCc1ccc(N(C)C)cc1	ZINC000000152549	c1ccccc1
Cc1ccccc1NC(=O)CC[N@]3CCc2ccccc2C3	ZINC000000256788	O=C(CCN2CCc1ccccc1C2)Nc3ccccc3
CC(C)(C)C(=O)OC[C@H]2O[C@@H](n1ccc(=O)[nH]c1=O)[C@H](O)[C@@H]2O	ZINC000000041578	O=c2ccn(C1CCCO1)c(=O)[nH]2
Nc2[nH]c(c1ccccc1)cc2C#N	ZINC000000021888	c2ccc(c1ccc[nH]1)cc2
O=C(NCCN1CCCC1)c2n[nH]c(=O)c3ccccc23	ZINC000000211519	O=C(NCCN1CCCC1)c2n[nH]c(=O)c3ccccc23
C[N+](C)(C)CC#CCCCC#CC[N+](C)(C)C	ZINC000001803543	nonring
CN5CCN(CCNCc1cccn1c4nnc(N3CCN(Cc2ccccc2)CC3)s4)CC5	ZINC000020576342	C5CN(CCNCc1cccn1c4nnc(N3CCN(Cc2ccccc2)CC3)s4)CCN5
C[C@@H]([C@@H](O)c1ccccc1)[N@@](C)CC(=O)N2CCOCC2	ZINC000000525526	O=C(CNCCc1ccccc1)N2CCOCC2
COC(=O)c2[nH]c1ccc(Cl)cc1c2NC(=O)CN3CCCC3	ZINC000000506250	O=C(CN1CCCC1)Nc2c[nH]c3ccccc23
CC[C@@]2(C)C[C@](CCN)(c1ccc(C)cc1)CCO2	ZINC000000171675	C2CC(c1ccccc1)CCO2
COc3ccc(OC)c([C@H]1[N@@](C)CCc2cc(OC)c(OC)cc12)c3	ZINC000000197203	C3Cc1ccccc1C(c2ccccc2)N3
Cc2nc(c1ccccc1)nc(NN)c2CC=C	ZINC000000244240	c2ccc(c1ncccn1)cc2
COC(=O)c2cc(NC(=O)c1cccnc1)cc(C(=O)OC)c2	ZINC000000170980	O=C(Nc1ccccc1)c2cccnc2
O=C(NC[n+]1ccccc1)c2ccccc2	ZINC000000408574	O=C(NC[n+]1ccccc1)c2ccccc2
CCN(CC)[C@@H](CNC(=O)C(=O)NCC(=O)N1CCNCC1)CC(C)C	ZINC000563615419	C1CNCCN1
C3CN(c2nc(c1ccccc1)cs2)CCN3	ZINC000000105414	C3CN(c2nc(c1ccccc1)cs2)CCN3
C[C@@H](CNC(=O)CN2CCN(Cc1ccccc1)CC2)N(C)C	ZINC000063732311	C2CN(Cc1ccccc1)CCN2
CN(C1CC(C)(C)NC(C)(C)C1)C(=O)c2ccco2	ZINC000000036880	O=C(NC1CCNCC1)c2ccco2
CN(C)CCCOC1CC(C)(C)N(C)C(C)(C)C1	ZINC000004217247	C1CCNCC1
C1CN4CCC1C(c3nc2ccccc2s3)=C4	ZINC000000017172	C1CN4CCC1C(c3nc2ccccc2s3)=C4
C1CN4CCC1C(c3cc2ccccc2s3)=C4	ZINC000000017171	C1CN4CCC1C(c3cc2ccccc2s3)=C4
CN4CCN(c2cc(c1cccnc1)nc3ccccc23)CC4	ZINC000000018409	C4CN(c2cc(c1cccnc1)nc3ccccc23)CCN4
Cc2nnc(OCc1cccc(N(=O)=O)c1)c3ccccc23	ZINC000000032551	C(Oc1nncc2ccccc12)c3ccccc3
CCOc3ccc2c(C)nc(NC1=NC(C)(C)C=C(C)N1)nc2c3	ZINC000000028976	C3C=CNC(Nc2ncc1ccccc1n2)=N3
COc1c(C)cnc(CO)c1C	ZINC000000169159	c1ccncc1
C[N@@](C[C@@H](O)COc2ccc1OCOc1c2)C3CCCCC3	ZINC000000307778	C3CCC(NCCCOc2ccc1OCOc1c2)CC3
COc3ccc2n1CCNC(=N)c1cc2c3	ZINC000000379046	N=C1NCCn2c1cc3ccccc23
O=C3Cc1ccccc1Sc4c(OCCN2CCCCC2)cccc34	ZINC000000726335	O=C3Cc1ccccc1Sc4c(OCCN2CCCCC2)cccc34
CCOC(=O)c2[nH]c1ccc(OC)cc1c2NC(=O)CNC	ZINC000000294041	c2ccc1[nH]ccc1c2
COC(=O)c3ccc(C[n+]1c(C)n(N)c2ccccc12)cc3	ZINC000000386963	C(c1ccccc1)[n+]2c[nH]c3ccccc23
Cc3cn([C@@H]2CN(C(=O)C1CCN(CCC(N)=O)CC1)C[C@H]2O)c(=O)[nH]c3=O	ZINC000257260264	O=C(C1CCNCC1)N3CCC(n2ccc(=O)[nH]c2=O)C3
COc3cc2CCn1c(cc(OCCN(C)C)nc1=O)c2cc3OC	ZINC000000490931	O=c3nccc2c1ccccc1CCn23
CN(C)c2c(C(C#N)=C(C#N)C#N)c1ccccc1n2C	ZINC000000052752	c2ccc1[nH]ccc1c2
COc2ccc(NC(=S)NC1CC(C)(C)NC(C)(C)C1)c(OC)c2	ZINC000000787362	S=C(NC1CCNCC1)Nc2ccccc2
N[C@@H](Cc1c[nH]c2ccccc12)C(N)=O	ZINC000000057505	c2ccc1[nH]ccc1c2
CN2CCN(c1nc(C(C)(C)C)cs1)CC2	ZINC000000002127	C2CN(c1nccs1)CCN2
C3CN(c2ccc1ccccc1n2)CCN3	ZINC000000002020	C3CN(c2ccc1ccccc1n2)CCN3
CCOC(=O)[C@@H]1CCCC[N@]1Cc2cc(C)c(OC)cc2C	ZINC000000239875	C2CCN(Cc1ccccc1)CC2
Nc2ncnc(N1CCCCC1)c2N	ZINC000000284052	C2CCN(c1ccncn1)CC2
Cc2nn(Cc1nn[nH]n1)c(C)c2Br	ZINC000000125980	C(c1nn[nH]n1)n2cccn2
OCCN2CCC(C1CCN(CCO)CC1)CC2	ZINC000001584237	C2CC(C1CCNCC1)CCN2
NCCCC[C@H](N)c2nnc([C@H](CC(O)=O)NC(=O)C1CCNCC1)o2	ZINC000013478154	O=C(NCc1nnco1)C2CCNCC2
CCC[N@]3CCC[C@@H]2Cc1nc(N)ncc1C[C@H]23	ZINC000000005041	C3CNC2Cc1cncnc1CC2C3
CCN(CC)CCOc1cc(C)ccc1C(C)C	ZINC000000002125	c1ccccc1
COc3ccc(N2CCN(C[C@@H](O)COc1ccc(N(=O)=O)cc1)CC2)cc3	ZINC000000719709	C(COc1ccccc1)CN3CCN(c2ccccc2)CC3
OC[C@@H]1CCCC[N@]1Cc2ccccc2F	ZINC000000215191	C2CCN(Cc1ccccc1)CC2
NC(=N)NCCC[C@@H]2NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC=O)NC(=O)CCCCCCNC(=O)C2=O	ZINC000027876064	O=C2CCCCCCNC(=O)C(=O)CNC(=O)C1CCCN1C(=O)CN2
CC(C)(C)OC(=O)N(CCCN)CCCCN(CCCN)C(=O)OC(C)(C)C	ZINC000005713956	nonring
CN(C)C(=O)OCCC1(N(C)C)CC1	ZINC000000009283	C1CC1
NCc2nc1ccccc1s2	ZINC000000158627	c2ccc1scnc1c2
CC(=O)OC1CC(C)(C)N(C(C)=O)C(C)(C)C1	ZINC000000027758	C1CCNCC1
NC(=O)[C@H](CC1CCCCC1)NC(=O)[C@H]2CNCCN2C(=O)C3CCNCC3	ZINC000004277905	O=C(NCCC1CCCCC1)C2CNCCN2C(=O)C3CCNCC3
C[N@]1CCC[C@H]1CCSc2ccncc2	ZINC000000023851	C2CNC(CCSc1ccncc1)C2
Nc2ccc(S(=O)(=O)Nc1ccc(Cl)nn1)cc2	ZINC000000049140	O=S(=O)(Nc1cccnn1)c2ccccc2
FC(F)(F)c4cccc(N3CCN(CCc2ccc1[nH]c(=O)sc1c2)CC3)c4	ZINC000000604739	O=c4[nH]c3ccc(CCN2CCN(c1ccccc1)CC2)cc3s4
CCN3CCN(CCN2CC1(CCN(C(CO)CO)CC1)OC2=O)CC3	ZINC000072453561	O=C2OC1(CCNCC1)CN2CCN3CCNCC3
O=C3C[C@H](n1c(=S)oc2ccccc12)[C@H]4CO[C@@H]3O4	ZINC000000058322	O=C3CC(n1c(=S)oc2ccccc12)C4COC3O4
CCOC(=O)N3CCN(CC1=CC[C@H]2C[C@@H]1C2(C)C)CC3	ZINC000000218173	C3CN(CC1=CCC2CC1C2)CCN3
COc3cc2CC[N@](Cc1ccccc1N)Cc2cc3OC	ZINC000000002825	C2Cc1ccccc1CN2Cc3ccccc3
CC(C)N3CCC([N@]2CCC[C@@H](C(=O)NCC1(C)COC1)C2)CC3	ZINC000012757968	O=C(NCC1COC1)C3CCCN(C2CCNCC2)C3
Cc4ccc(N3CCN(Cc2ccc1OCC(=O)Nc1c2)CC3)cc4C	ZINC000000578176	O=C4COc3ccc(CN2CCN(c1ccccc1)CC2)cc3N4
COC(=O)c1cc(NC(=N)NC(N)=N)cc(C(=O)OC)c1	ZINC000018169298	c1ccccc1
CC3CCN(C[C@H](O)CN(c1ccc(C)cc1)S(=O)(=O)c2ccccc2)CC3	ZINC000000787217	O=S(=O)(N(CCCN1CCCCC1)c2ccccc2)c3ccccc3
Cc4nc3n(CCN1CCCCC1)c2ccccc2n3c4C(=O)c5cccs5	ZINC000000727441	O=C(c1cccs1)c4cnc5n(CCN2CCCCC2)c3ccccc3n45
COc3cc2cc(c1ccc(OC)c(OC)c1C)nc(N)c2cc3OC	ZINC000000664885	c3ccc(c2cc1ccccc1cn2)cc3
Clc4cc3nc(C1CCNCC1)n(CC(=O)NNC(=S)NCCCN2CCOCC2)c3cc4Cl	ZINC000028229460	O=C(Cn2c(C1CCNCC1)nc3ccccc23)NNC(=S)NCCCN4CCOCC4
CCOC(=O)Cn2cccc(NC(=O)C(=O)N1CCNC(=O)C1)c2=O	ZINC000533591978	O=C2CN(C(=O)C(=O)Nc1ccc[nH]c1=O)CCN2
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
CC(C)CCc3c(C)c(C#N)c2nc1ccccc1n2c3n4ccnc4C	ZINC000000638082	c1ccc4c(c1)nc3cccc(n2ccnc2)n34
CN(C)CCN(Cc1ccc(Cl)s1)c2ccccn2	ZINC000000001128	C(Nc1ccccn1)c2cccs2
N[C@@H](CCc1ccc(F)cc1)c3ccc2OCCOc2c3	ZINC000000173917	C(Cc1ccccc1)Cc3ccc2OCCOc2c3
CN4CCN(c2nc(Nc1ccc(O)cc1)nc3ccccc23)CC4	ZINC000000250305	C4CN(c2nc(Nc1ccccc1)nc3ccccc23)CCN4
CCN(CC(C)=C)C(=O)C2CCN(C[C@H]1CCC=CC1)CC2	ZINC000000236133	C2CCN(CC1CCC=CC1)CC2
O=C(NCCNS(=O)(=O)c1ccc(N(=O)=O)cc1)C(=O)NC2CNC2	ZINC000581181373	O=C(NCCNS(=O)(=O)c1ccccc1)C(=O)NC2CNC2
CCOC(=O)c1c(C)oc2ccc(O)c(CN(C)C)c12	ZINC000000083554	c2ccc1occc1c2
COc2ccc(C1(CNC(N)=N)CCCC1)cc2OC	ZINC000000488194	C2CCC(c1ccccc1)C2
NC(=O)C([C@H]3CC[N@@](CCc2ccc1OCCc1c2)C3)(c4ccccc4)c5ccccc5	ZINC000000597532	C5Cc4cc(CCN3CCC(C(c1ccccc1)c2ccccc2)C3)ccc4O5
Nc2cc(c1ccc(F)cc1)nc(N)n2	ZINC000000082203	c2ccc(c1ccncn1)cc2
Nc2n(CCO)c1ccccc1[n+]2N	ZINC000000274868	c2ccc1[nH]cnc1c2
COc2cc1OC(C)(C)CC(=O)c1cc2OC	ZINC000000056676	O=C1CCOc2ccccc12
O=C(Nc2cccc(NC(=O)c1ccccn1)c2)c3ccccn3	ZINC000000022436	O=C(Nc2cccc(NC(=O)c1ccccn1)c2)c3ccccn3
CC2CCC(N1CCN(C=O)CC1)CC2	ZINC000000279796	C2CCC(N1CCNCC1)CC2
Clc1ccccc1C(=O)NC2CCCC2	ZINC000000029530	O=C(NC1CCCC1)c2ccccc2
CN(C)C[C@H]1CCc3c(C1=O)c2ccccc2n3C	ZINC000000164458	O=C2CCCc3[nH]c1ccccc1c23
CC(C)(C)c1cc(N)nc(N)n1	ZINC000000082209	c1cncnc1
O=C(c1cccs1)c3cnc2ccccn2c3=O	ZINC000000094756	O=C(c1cccs1)c3cnc2ccccn2c3=O
COc4ccc3[C@@H]2C[C@H]1[C@H](CCCN1S(C)(=O)=O)C[N@]2CCc3c4	ZINC000000597368	C4CNC3CC1N(CCc2ccccc12)CC3C4
CNS(=O)(=O)[C@@H]1CCN(C(=O)NCC(=O)NCC(F)(F)F)C1	ZINC000533392132	C1CCNC1
CN(C)C[C@@H]1CCCC[C@@H]1c2cccc(O)c2	ZINC000000021740	C2CCC(c1ccccc1)CC2
CCN2CCN(CC(=O)N1CCC[C@@H](CS(N)(=O)=O)C1)C(=O)C2=O	ZINC000558052455	O=C(CN1CCNC(=O)C1=O)N2CCCCC2
COc4ccc(CN2c1cccc[n+]1C[C@]2(O)c3ccc(Cl)cc3)cc4	ZINC000000787817	C3C(c1ccccc1)N(Cc2ccccc2)c4cccc[n+]34
Cc2ccc(S(=O)(=O)Nc1cccc(C(O)=O)c1)cc2	ZINC000000058794	O=S(=O)(Nc1ccccc1)c2ccccc2
Cc2nc(C1=CCCNC1)cs2	ZINC000000010804	C2CC=C(c1cscn1)CN2
C2CN(c1ccccc1)CCN2C/C=C/c3ccccc3	ZINC000000183277	C2CN(c1ccccc1)CCN2CC=Cc3ccccc3
CN(C)c2cc(NC(=O)C(=O)NC1CN(S(=O)(=O)N(C)C)C1)ncn2	ZINC000628032366	O=C(NC1CNC1)C(=O)Nc2ccncn2
Clc1cc(N(=O)=O)ccc1SC2=NCCN2	ZINC000000145426	C2CN=C(Sc1ccccc1)N2
Fc1ccccc1C(=O)OCCN2CCCCC2	ZINC000000210741	O=C(OCCN1CCCCC1)c2ccccc2
C[C@@H]1OC(C)(C)N[C@@H]1CNC(=O)C(=O)N[C@@H]3C[C@@H]2CCCCN2C3=O	ZINC000521363789	O=C(NCC1COCN1)C(=O)NC3CC2CCCCN2C3=O
NCCc1c[nH]c2c(Cl)ccc(Cl)c12	ZINC000000185700	c2ccc1[nH]ccc1c2
C[N@@](CC(=O)N1CCCC1=O)Cc2ccccc2	ZINC000000027591	O=C1CCCN1C(=O)CNCc2ccccc2
O=C(Oc2ccc(Oc1ccccc1)cc2)N3CCOCC3	ZINC000000014497	O=C(Oc2ccc(Oc1ccccc1)cc2)N3CCOCC3
COc2cc(Br)cc(CNc1cc(C)ccn1)c2O	ZINC000000135852	C(Nc1ccccn1)c2ccccc2
CCN(CC)C(=O)[C@@H]2CCC[N@@](Cc1ccc(Br)s1)C2	ZINC000000755595	C2CCN(Cc1cccs1)CC2
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
Cc2ccc(OC[C@@H](O)CN1CCCC1)cc2	ZINC000000177590	C2CCN(CCCOc1ccccc1)C2
NC(=O)OC[C@@H](O)c1ccccc1	ZINC000000000725	c1ccccc1
O[C@@H](COCc1ccccc1)CN2CCCC2	ZINC000000177592	C2CCN(CCCOCc1ccccc1)C2
O=C(N1CCNCC1)N2CCOCC2	ZINC000000079633	O=C(N1CCNCC1)N2CCOCC2
C4CCN3C[C@@H]1C[C@@H](C[N@]2CCCC[C@H]12)[C@H]3C4	ZINC000000000721	C4CCN3CC1CC(CN2CCCCC12)C3C4
COc3ccc(C(=O)OC[C@@H]1CCC[N+]2(C)CCCC[C@@H]12)cc3	ZINC000000343988	O=C(OCC1CCCN2CCCCC12)c3ccccc3
O[C@@H](COC[C@H]1CCC=CC1)CN2CCCCC2	ZINC000000177598	C2CCN(CCCOCC1CCC=CC1)CC2
O=c3cccc2[C@@H]1CNC[C@@H](C1)Cn23	ZINC000000049583	O=c3cccc2C1CNCC(C1)Cn23
COc1ccccc1CN2CCSCC2	ZINC000000240006	C2CN(Cc1ccccc1)CCS2
COc4ccc3nc2n(SCc1c(C)c(OC)c(C)c[n+]12)c3c4	ZINC000000000728	C3Sn1c(nc2ccccc12)[n+]4ccccc34
CC(C)(C)[C@H](N)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)[C@H](CO)[C@H](Cc2ccccc2)NC(=O)[C@@H](N)C(C)(C)C	ZINC000026728131	C(CCCc1ccccc1)CCc2ccccc2
COC(=O)c3n[nH]c(NC(=O)[C@@H](C(C)C)n2c(=O)c1ccccc1c2=O)n3	ZINC000000945067	O=C(Cn2c(=O)c1ccccc1c2=O)Nc3ncn[nH]3
CN2CCO[C@@H](CNC(=O)C(=O)NCCC[N@]1CCC[C@@H](C(N)=O)C1)C2	ZINC000560892858	O=C(NCCCN1CCCCC1)C(=O)NCC2CNCCO2
NC(COCc1ccccc1)COCc2ccccc2	ZINC000000097135	C(COCc1ccccc1)COCc2ccccc2
NC(=N)c3ccc(N2CCC(C1CCN(CC(O)=O)CC1)CC2)cc3	ZINC000000015847	C3CC(C2CCN(c1ccccc1)CC2)CCN3
CN[C@@H](C)[C@@H](O)c1ccc(O)c(O)c1	ZINC000000005957	c1ccccc1
CCOc3cc([C@@H]1NCCc2cc(OCC)c(OCC)cc12)ccc3O	ZINC000000718277	C3Cc1ccccc1C(c2ccccc2)N3
Cc2nc1cc(N)ccc1n2CCO	ZINC000000366336	c2ccc1[nH]cnc1c2
N[C@@H](CCCNC(N)=N)C(=O)N(CCc1c[nH]c2ccccc12)CC(=O)NCCc3c[nH]c4ccccc34	ZINC000028824978	O=C(CNCCc1c[nH]c2ccccc12)NCCc3c[nH]c4ccccc34
NC(=N)NCCCc2cccc3[nH]cc(OC(=O)[C@@H]1O[C@@](O)(CO)[C@H](O)[C@H]1O)c23	ZINC000085569285	O=C(Oc1c[nH]c2ccccc12)C3CCCO3
CN2CCC(NS(=O)(=O)CCCS(=O)(=O)NC1CCN(C)CC1)CC2	ZINC000331571272	O=S(=O)(CCCS(=O)(=O)NC1CCNCC1)NC2CCNCC2
O=C2C=CC[C@H]1[C@H]3CCC[N@]4CCC[C@H](CN12)[C@H]34	ZINC000000008712	O=C2C=CCC1C3CCCN4CCCC(CN12)C34
Brc1ccccc1OCC(=O)NCCc2ccccc2	ZINC000000037979	O=C(COc1ccccc1)NCCc2ccccc2
COc2cc(CNCc1cc(F)ccc1C)ccc2OC[C@@H](O)CN3CCC(O)CC3	ZINC000011774144	C3CCN(CCCOc2ccc(CNCc1ccccc1)cc2)CC3
CCCC(=O)Nc2c1CCCCc1nc3ccccc23	ZINC000000004173	C3CCc2nc1ccccc1cc2C3
CC2[C@H](C(=O)N1CCOC[C@@H]1C(N)=O)[C@H]2C(=O)N3CCOC[C@@H]3C(N)=O	ZINC000613203601	O=C(C1CC1C(=O)N2CCOCC2)N3CCOCC3
CN(C)CCCn2c(=O)c1ccccc1c3ccccc23	ZINC000000001418	O=c2[nH]c1ccccc1c3ccccc23
CN(C)CCNS(=O)(=O)c1cc(C)sc1C	ZINC000000117014	c1ccsc1
CC(C)(C)NC[C@@H](O)COc1ccccc1c2ccc(NN)nn2	ZINC000000000658	c2ccc(c1cccnn1)cc2
CC(C)(C)N(Cc1ccccc1)C(=O)CSc2nc(N)cc(N)n2	ZINC000000417999	O=C(CSc1ncccn1)NCc2ccccc2
Cc2c(CC(O)=O)c1ccccc1n2C(=O)c3ccccc3	ZINC000000001256	O=C(c1ccccc1)n2ccc3ccccc23
CN(C)S(=O)(=O)N2CCCN(C(=O)NCCN1CCNC(=O)C1)CC2	ZINC000642736323	O=C2CN(CCNC(=O)N1CCCNCC1)CCN2
CC2(C)N(O)CC(c1cccs1)[N+]2=O	ZINC000000438673	O=[N+]1CNCC1c2cccs2
C[N+]1(C)CCC[C@@H]1COC(=O)C(O)(c2ccccc2)c3ccccc3	ZINC000000000651	O=C(OCC1CCCN1)C(c2ccccc2)c3ccccc3
CNCCCNC[C@H]3O[C@@H](n1cnc2c(N)ncnc12)[C@H](O)[C@@H]3O	ZINC000049089131	C3COC(n1cnc2cncnc12)C3
CC(=O)c2nnn(c1ccc(Cl)cc1C#N)c2C	ZINC000000141993	c2ccc(n1ccnn1)cc2
Clc2ccc(OCC(=O)NC[C@@H]1CCCO1)c(Cl)c2	ZINC000000037574	O=C(COc1ccccc1)NCC2CCCO2
O=C(NCCCN1CCOCC1)[C@@]24CNC[C@@H]2C[N@](C3CCCC3)C4	ZINC000065468366	O=C(NCCCN1CCOCC1)C24CNCC2CN(C3CCCC3)C4
NC(=O)C2CCN(CCC(=O)Nc1ccccc1Cl)CC2	ZINC000000253798	O=C(CCN1CCCCC1)Nc2ccccc2
NC(=O)c3ccc(N2CCN(C(=O)[C@@H]1CC(=O)NC(=O)N1)CC2)nc3	ZINC000616486086	O=C3CC(C(=O)N2CCN(c1ccccn1)CC2)NC(=O)N3
O=C(Nc2ccc(S(=O)(=O)Nc1nccs1)cc2)C4(c3ccccc3)CCOCC4	ZINC000001120787	O=C(Nc2ccc(S(=O)(=O)Nc1nccs1)cc2)C4(c3ccccc3)CCOCC4
CC(=O)N[C@@H](Cc1cc(C)c(O)c(I)c1)C(O)=O	ZINC000001713869	c1ccccc1
C[N@]1C[C@@H](CO)C[C@H]2[C@H]1Cc3c[nH]c4cccc2c34	ZINC000000487953	C2CNC1Cc3c[nH]c4cccc(C1C2)c34
CC2(C)CC(NC(=O)Cn1cccc(N(=O)=O)c1=O)CC(C)(C)N2	ZINC000000104899	O=C(Cn1ccccc1=O)NC2CCNCC2
COC3CCN(C[C@H]2CCN(c1ccc(Cl)cc1)C2=O)CC3	ZINC000000020541	O=C2C(CN1CCCCC1)CCN2c3ccccc3
CS(=O)(=O)N2CCN(CCNC(=O)N1CCC[C@@](O)(C(N)=O)C1)CC2	ZINC000671568887	O=C(NCCN1CCNCC1)N2CCCCC2
O=C(CNS(=O)(=O)c1ccccc1)N3CCc2ccccc2C3	ZINC000000037630	O=C(CNS(=O)(=O)c1ccccc1)N3CCc2ccccc2C3
NS(=O)(=O)c2ccc(Oc1ccc(S(N)(=O)=O)cc1)cc2	ZINC000000366429	O(c1ccccc1)c2ccccc2
CCOC(=O)c1ccc(NC(=O)NC(=O)C(F)(F)F)cc1	ZINC000000107038	c1ccccc1
COC(=O)[C@@H]1CNC(=O)CN1S(=O)(=O)N2CCS(=O)(=O)CC2	ZINC000447929759	O=C2CN(S(=O)(=O)N1CCS(=O)(=O)CC1)CCN2
Oc2ccc(\C=N\c1nccs1)c(O)c2	ZINC000000123449	C(=Nc1nccs1)c2ccccc2
C4CN(C3CCN(Cc1c[nH]c2ccccc12)CC3)CCO4	ZINC000000199173	C4CN(C3CCN(Cc1c[nH]c2ccccc12)CC3)CCO4
CC1(C)NC(=N)NC(=N)N1c2ccc(F)cc2F	ZINC000000203659	N=C2NCN(c1ccccc1)C(=N)N2
c4ccc(c3nc(n1ccnc1)nc(n2ccnc2)n3)cc4	ZINC000000056296	c4ccc(c3nc(n1ccnc1)nc(n2ccnc2)n3)cc4
O=C(Nc1cccnc1)Nc2cccc(N(=O)=O)c2	ZINC000000040583	O=C(Nc1ccccc1)Nc2cccnc2
C/C(C[N@]1C[C@@H]3C[C@H](C1)c2cccc(=O)n2C3)=C/c4ccccc4	ZINC000000234604	O=c4cccc3C2CC(CN(CC=Cc1ccccc1)C2)Cn34
CCN3CCN(c1c(Cl)cccc1NC(=O)c2ccco2)CC3	ZINC000000528737	O=C(Nc1ccccc1N2CCNCC2)c3ccco3
COc4ccc(n3c(=S)[nH]c(=O)\c(=C/c1cccn1c2cccc(C)c2)c3=O)c(OC)c4	ZINC000001127264	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc3cccn3c4ccccc4
Cn2c(N1CCNCC1)nc3n(C)c(=O)n(C)c(=O)c23	ZINC000000092355	O=c3[nH]c(=O)c2[nH]c(N1CCNCC1)nc2[nH]3
NC(=O)C2CCN(C[C@@H](O)CSc1ccccc1)CC2	ZINC000000119051	C2CCN(CCCSc1ccccc1)CC2
Cc3ccc(CNc2ccc1n(C)c(C)nc1c2)cc3	ZINC000000170069	C(Nc2ccc1[nH]cnc1c2)c3ccccc3
CCn1nncc1CNS(=O)(=O)N2CCN(S(C)(=O)=O)CC2	ZINC000528440983	O=S(=O)(NCc1cnn[nH]1)N2CCNCC2
CN3CCN(Cc2cccc(NC(=O)C(=O)NC[C@@H]1CC[N@](C)C1)c2)CC3	ZINC000077817452	O=C(NCC1CCNC1)C(=O)Nc3cccc(CN2CCNCC2)c3
CN(C)CCNC(=O)c2ccc(S(=O)(=O)N1CCCCC1)cc2	ZINC000000306410	O=S(=O)(N1CCCCC1)c2ccccc2
CS(=O)(=O)N2CCN(CCNC(=O)NC1CCN(CCO)CC1)CC2	ZINC000601296610	O=C(NCCN1CCNCC1)NC2CCNCC2
CN(C)CCCNC(=O)c3cc(NC(=O)c2cc(NC(=O)c1cc(NC(C)=N)cn1C)cn2C)cn3C	ZINC000028863993	O=C(Nc2c[nH]c(C(=O)Nc1cc[nH]c1)c2)c3ccc[nH]3
O[C@H](Cn2c(=N)n(CCN1CCCC1)c3ccccc23)c4ccco4	ZINC000000241422	N=c3n(CCN1CCCC1)c2ccccc2n3CCc4ccco4
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)NCc3ccco3	ZINC000000329110	O=C(CCc1c[nH]c2ccccc12)NCc3ccco3
O=N(=O)c3cccc(c2noc(CN1CCCC1)n2)c3	ZINC000000139011	C3CCN(Cc2nc(c1ccccc1)no2)C3
NC(=O)COc3ccc(\C=c2/c(=O)[nH]c(=O)n(Cc1ccco1)c2=O)cc3	ZINC000000876909	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)n2Cc3ccco3
CN3CCC(N2CCC(NC(=O)N[C@@H]1CCC[N@@](C)C1)CC2)CC3	ZINC000051777726	O=C(NC2CCN(C1CCNCC1)CC2)NC3CCCNC3
CC(=O)Nc3ccc(S(=O)(=O)NC2Cc1ccccc1C2)cc3	ZINC000000171422	O=S(=O)(NC2Cc1ccccc1C2)c3ccccc3
C[C@@H]3CCCN(Cc2nc1n(C)c(=O)n(C)c(=O)c1n2CC(N)=O)C3	ZINC000000245709	O=c3[nH]c(=O)c2[nH]c(CN1CCCCC1)nc2[nH]3
NCC3(c2ccc1OCCOc1c2)CCOCC3	ZINC000000207082	C3COc2cc(C1CCOCC1)ccc2O3
O[C@@H](CNC1CCCCC1)c2ccccc2	ZINC000000157267	C2CCC(NCCc1ccccc1)CC2
C[C@H](O)CN([C@@H](C)CO)C(=O)C(=O)NCCC[N@]1CCC[C@@H](C(N)=O)C1	ZINC000560893107	C1CCNCC1
CC(C)Cc1ccc([C@H](C)C(=O)NO)cc1	ZINC000000000381	c1ccccc1
COc5ccc4C[C@@H]2[N@@](C)CCc3cc1OCOc1c(c23)c4c5O	ZINC000000000103	C3Cc4cc1OCOc1c5c2ccccc2CC(N3)c45
C[C@@H]2OCc1c[n+](C)c(C)c(OC(C)=O)c1CO2	ZINC000000187146	C2OCc1ccncc1CO2
CC2(C)CC(NC(=O)Cc1ccccc1)CC(C)(C)N2	ZINC000000217350	O=C(Cc1ccccc1)NC2CCNCC2
C3CN2[C@H](c1ccccc1)CNC2=N3	ZINC000000000384	C3CN2C(c1ccccc1)CNC2=N3
C[C@@H](NCC2OCc1ccccc1CO2)c3ccccc3	ZINC000000203094	C(NCc1ccccc1)C3OCc2ccccc2CO3
OC3(c1ccc(Br)cc1)CCN([C@@H]2CCSC2)CC3	ZINC000000219997	C3CC(N2CCC(c1ccccc1)CC2)CS3
CC(C)NC[C@@H](O)COc2cccc1CC=Cc12	ZINC000000000389	C1C=Cc2ccccc12
CC[C@@H](N)C2(O)Cc1ccccc1C2	ZINC000000000388	C2Cc1ccccc1C2
CN1CCN(CCC[N@](C)CC(=O)NCCCN(C)S(C)(=O)=O)CC1	ZINC000492662102	C1CNCCN1
CN1CCS(=O)(=O)C[C@@H]1CC(=O)N(C)CC(=O)N2CCNCC2	ZINC000662400817	O=C(CC1CS(=O)(=O)CCN1)NCC(=O)N2CCNCC2
COCC(=O)N2CCN(C(=O)C(=O)N1CCO[C@@H](CC(N)=O)C1)CC2	ZINC000625388630	O=C(N1CCNCC1)C(=O)N2CCOCC2
Cc2cc(C)nc(SCCN1CCCC1)n2	ZINC000000191582	C2CCN(CCSc1ncccn1)C2
CN(C)CCSc2nc1ccccc1c(=O)n2c3ccccc3	ZINC000000028373	O=c2n(c1ccccc1)cnc3ccccc23
COc3cccc([C@@]2(CC(=O)N(C)CCCN1CCCCC1)CC(=O)N(CCN(C)C)C2=O)c3	ZINC000014882755	O=C(CC2(c1ccccc1)CC(=O)NC2=O)NCCCN3CCCCC3
CN(C)OC(=O)c2cccc3n(C)c(c1ccccc1)c[n+]23	ZINC000000387447	c3ccc(c2c[n+]1ccccc1[nH]2)cc3
CCS(=O)(=O)C(=c2[nH]c1ccccc1[nH]2)S(=O)(=O)CC	ZINC000000050999	C=c2[nH]c1ccccc1[nH]2
CN2CCN(NC(=O)COc1ccccc1C)CC2	ZINC000000467699	O=C(COc1ccccc1)NN2CCNCC2
CCN(CC)CCC(=O)c1ccc(OC)c(OC)c1	ZINC000000141445	c1ccccc1
C[C@@H]2C[N@](C)C[C@](OC(C)=O)(c1ccccc1)C2	ZINC000000051466	C2CNCC(c1ccccc1)C2
C(Cc2ccc1OCOc1c2)NC4C3CC5CC(C3)CC4C5	ZINC000000172180	C(Cc2ccc1OCOc1c2)NC4C3CC5CC(C3)CC4C5
CC1(C)C[C@@H](C(N)=O)C(C)(C)N1	ZINC000000155932	C1CCNC1
C1C[C@@H]2C[C@H]1C[C@H]2N4CCN(c3ccccc3)CC4	ZINC000000181886	C1CC2CC1CC2N4CCN(c3ccccc3)CC4
Cn3c2OC(N)=C(C#N)[C@@H](c1ccccc1)c2c(=O)n(C)c3=O	ZINC000000062534	O=c3[nH]c2OC=CC(c1ccccc1)c2c(=O)[nH]3
C4CCN(CCn2c(N1CCOCC1)nc3ccccc23)CC4	ZINC000000339595	C4CCN(CCn2c(N1CCOCC1)nc3ccccc23)CC4
OC14CC3C[C@@H](C1)C2(NCCS2)[C@H](C3)C4	ZINC000000225126	C1CSC3(N1)C2CC4CC(C2)CC3C4
Cc1ccc(CSC(N)=N)cc1	ZINC000000096836	c1ccccc1
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
C[C@H]1CCC[C@@H](C)[N@]1CCNC(=O)C2CCN(S(C)(=O)=O)CC2	ZINC000000262178	O=C(NCCN1CCCCC1)C2CCNCC2
c4ccc(c3nn(c1ccccc1)[n+](c2ccccc2)n3)cc4	ZINC000000154828	c4ccc(c3nn(c1ccccc1)[n+](c2ccccc2)n3)cc4
CC(C)(C)c3ccc(C(=O)N2CCN(c1ccccn1)CC2)cc3	ZINC000000093939	O=C(N2CCN(c1ccccn1)CC2)c3ccccc3
COc2ccc(S(=O)(=O)Nc1cc(N(=O)=O)ccc1C)cc2	ZINC000000102485	O=S(=O)(Nc1ccccc1)c2ccccc2
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
C[C@@H]2[C@@H]1CC[C@]3(C)[C@@H]([C@@H]1OC2=O)[C@@](C)(O)C=CC3=O	ZINC000000002242	O=C3CC2CCC1C(CC=CC1=O)C2O3
OC2CCN(C[C@@H](O)COc1ccc(Cl)c(Cl)c1)CC2	ZINC000000066354	C2CCN(CCCOc1ccccc1)CC2
CCCn3c(=S)[nH]c2cc(C(=O)N1CCOCC1)ccc2c3=O	ZINC000000425369	O=C(N1CCOCC1)c3ccc2c(=O)[nH]c(=S)[nH]c2c3
CN(C)CCN4C(=O)C[C@@](CC(=O)N2CCN(Cc1ccccc1)CC2)(c3cccc(F)c3)C4=O	ZINC000012037197	O=C4CC(CC(=O)N2CCN(Cc1ccccc1)CC2)(c3ccccc3)C(=O)N4
Fc4ccc(N3CCN(CCCn1c(=O)[nH]c2ccccc12)CC3)cc4	ZINC000000605896	O=c2[nH]c1ccccc1n2CCCN4CCN(c3ccccc3)CC4
CN(C)CCC[C@]3(O)c1ccccc1CSc2sccc23	ZINC000000347400	C2Sc1sccc1Cc3ccccc23
O=C(Nc2ccc(C1=NCCN1)cc2)c5cc4ccc(C3=NCCN3)cc4[nH]5	ZINC000006535484	O=C(Nc2ccc(C1=NCCN1)cc2)c5cc4ccc(C3=NCCN3)cc4[nH]5
NS(=O)(=O)c3cc(C(=O)N2CC(S(=O)(=O)N1CCNCC1)C2)co3	ZINC000516651499	O=C(N2CC(S(=O)(=O)N1CCNCC1)C2)c3ccoc3
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
CC(C)N(CCN(C)C)C(=O)C(=O)NC1CCN(CC(=O)N(C)C)CC1	ZINC000561760387	C1CCNCC1
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
OC3(c1ccc(Br)cc1)CCN(CCCc2ccccc2)CC3	ZINC000000757539	C(CN2CCC(c1ccccc1)CC2)Cc3ccccc3
C[C@@H](N1CCN(C(N)=N)CC1)c2ccccc2	ZINC000002599561	C2CN(Cc1ccccc1)CCN2
FC(F)(F)c1ccccc1NC(=O)c2cccs2	ZINC000000029346	O=C(Nc1ccccc1)c2cccs2
CCN3CC[N@@](Cc2ccc(CN1CCCCC1)s2)CCC3=O	ZINC000012041357	O=C3CCN(Cc2ccc(CN1CCCCC1)s2)CCN3
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
CN2CCN(C(=O)NCc1ccc(C)cc1)CC2	ZINC000000386874	O=C(NCc1ccccc1)N2CCNCC2
COC(=O)c1ccccc1CS(=O)(=O)N=C(O)Nc2nc(OC)cc(OC)n2	ZINC000001532062	O=S(=O)(Cc1ccccc1)N=CNc2ncccn2
CCOC(=O)c2cnc1ccc(F)cc1c2NCCN(C)C	ZINC000000145926	c2ccc1ncccc1c2
Cc1cc(C(F)(F)F)c(C#N)c(SCC(O)=O)n1	ZINC000000039037	c1ccncc1
Cc2ccc(NC(=O)c1cccs1)cc2C	ZINC000000029349	O=C(Nc1ccccc1)c2cccs2
CN4CCN(c2nc1ccccc1n3c(C)nnc23)CC4	ZINC000000236466	C4CN(c2nc1ccccc1n3cnnc23)CCN4
C[N+](C)(C)C[C@H](O)CSc1nnnn1c2ccccc2	ZINC000000402524	c2ccc(n1cnnn1)cc2
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
CN(C)c2c(F)cc(C(=O)NC(=O)NCc1cccnc1)cc2F	ZINC000000107852	O=C(NCc1cccnc1)NC(=O)c2ccccc2
COCCN(CCN(C)C)C(=O)C(=O)N1CC[N@@](C[C@@H](C)O)[C@@H](C)C1	ZINC000410506279	C1CNCCN1
CC(C)(C)NC[C@@H](O)COc2cccc1NC(=O)CCc12	ZINC000000000128	O=C2CCc1ccccc1N2
CC(=O)N/C(=C/c1ccccc1)C(=O)NCc2ccco2	ZINC000000031331	O=C(NCc1ccco1)C=Cc2ccccc2
CCS(=O)(=O)NCCS(=O)(=O)N1CCCC[C@@H]1CNC(=O)CCN	ZINC000262794765	C1CCNCC1
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)Oc1cc(C(=O)NC(C)(C)C)cc(C(=O)NC(C)(C)C)c1	ZINC000000051862	c1ccccc1
CN(C)CCOC(=O)C2(c1ccccc1)CCCC2	ZINC000000168965	C2CCC(c1ccccc1)C2
O[C@@]3(c1ccccc1)CN2CCCSC2=[N+]3c4ccc(F)cc4	ZINC000000389450	C4CSC3=[N+](c1ccccc1)C(c2ccccc2)CN3C4
CCc2ccc(NS(=O)(=O)c1ccccc1)cc2	ZINC000000029182	O=S(=O)(Nc1ccccc1)c2ccccc2
Cn3cc2c(NC1=NCCN1)cccc2n3	ZINC000000001564	C3CN=C(Nc1cccc2n[nH]cc12)N3
OC(=O)C[C@@H]2NC(=S)N(Cc1ccccc1)C2=O	ZINC000000034236	O=C1CNC(=S)N1Cc2ccccc2
CCOC(=O)N2CCN([C@@H]1CC[C@@H](C)C1)CC2	ZINC000000215999	C2CCC(N1CCNCC1)C2
Nc2n[nH]c3c(c1ccccc1C(F)(F)F)[nH][nH]n23	ZINC000000038202	c3ccc(c1[nH][nH]n2cn[nH]c12)cc3
Nc2n[nH]c3c(c1ccc(F)cc1)[nH][nH]n23	ZINC000000038200	c3ccc(c1[nH][nH]n2cn[nH]c12)cc3
Clc2ccc(CNCc1cccnc1)cc2	ZINC000000076985	C(NCc1cccnc1)c2ccccc2
Cc2ccc(C[n+]1cccc(C(N)=O)c1)cc2	ZINC000000160601	C(c1ccccc1)[n+]2ccccc2
COc1ccc(Cl)cc1C(=O)Nc2ccc(C#N)cc2	ZINC000000030826	O=C(Nc1ccccc1)c2ccccc2
COc3ccc(CN2CCN(c1ccccn1)CC2)cc3	ZINC000000238607	C2CN(c1ccccn1)CCN2Cc3ccccc3
CCOC(=O)c1cc(CC)sc1NC(=O)CCNC(C)(C)C	ZINC000000247910	c1ccsc1
O=C(OCCn1ccnc1)c2ccccc2	ZINC000000002255	O=C(OCCn1ccnc1)c2ccccc2
OC[C@@H]1CCCC[N@]1[C@H]3CCc2ccccc2C3	ZINC000000220335	C3CCN(C2CCc1ccccc1C2)CC3
CC(=O)O[C@H]1C[C@H]2CCC[C@@H]1N2	ZINC000000012509	C1CC2CCC(C1)N2
CC2(C)C(c1ccco1)[N+](=O)C(C)(C)N2O	ZINC000000201480	O=[N+]1CNCC1c2ccco2
CN2CCC(NCC1CCCCC1)CC2	ZINC000000221160	C2CCC(CNC1CCNCC1)CC2
C[C@@H](N)[C@@H]2COc1ccccc1O2	ZINC000000197693	C2COc1ccccc1O2
CN3CCN(c2ccc(N1CCN(C)CC1)nn2)CC3	ZINC000000190765	C3CN(c2ccc(N1CCNCC1)nn2)CCN3
CN4CCN([C@@H]2[C@@H](O)[C@H](NCc1ccccc1)[C@H]3CO[C@@H]2O3)CC4	ZINC000022922130	C4CN(C2CC(NCc1ccccc1)C3COC2O3)CCN4
OC(=O)C3CCN([C@H]2CC(=O)N(c1ccccc1F)C2=O)CC3	ZINC000000049419	O=C2CC(N1CCCCC1)C(=O)N2c3ccccc3
C=CCn2cc(C=c1c(=O)[nH]c(=S)[nH]c1=O)c3ccccc23	ZINC000000868445	O=c1[nH]c(=S)[nH]c(=O)c1=Cc2c[nH]c3ccccc23
CC(=O)N3CCC(C(=O)Nc2ccc(N1CCOCC1)cc2)CC3	ZINC000000105554	O=C(Nc2ccc(N1CCOCC1)cc2)C3CCNCC3
CC(C)(C)OC(=O)[C@H](CCN)NC(=O)[C@@H](N)CCCNC(N)=NN(=O)=O	ZINC000013809549	nonring
NCc2ccc(N1CCOCC1)cc2	ZINC000000158855	C2CN(c1ccccc1)CCO2
CC2(C)Nc1cc(=C(C#N)C#N)ccc1=N2	ZINC000000500961	C=c2ccc1=NCNc1c2
COc2ccc([C@@H](C(=O)O[C@@H](C)CN(C)C)c1ccccc1)cc2	ZINC000000453966	C(c1ccccc1)c2ccccc2
COC(=O)c2cc(NS(=O)(=O)c1ccccc1)ccc2O	ZINC000000365514	O=S(=O)(Nc1ccccc1)c2ccccc2
CC[C@@H](O)CN2CCN(C(=O)C(=O)N1CCC[C@@](O)(CC(N)=O)C1)CC2	ZINC000644912405	O=C(N1CCCCC1)C(=O)N2CCNCC2
CCC(=O)Nc2nc1ccccc1n2CCN(C)C	ZINC000000186879	c2ccc1[nH]cnc1c2
Clc2cc(Cl)c(N1CCNCC1)n(=O)c2	ZINC000000140958	O=n1ccccc1N2CCNCC2
O=C(NC2CCN(Cc1ccccc1)CC2)c4cc3ccccc3oc4=O	ZINC000000778555	O=C(NC2CCN(Cc1ccccc1)CC2)c4cc3ccccc3oc4=O
OCCN(CCO)C[C@@H](O)C23CC1CC(CC(C1)C2)C3	ZINC000000135319	C1C2CC3CC1CC(C2)C3
C[N@]3CCC[C@@H](NC(=O)C2CCN(Cc1ccc(F)cc1)CC2)C3	ZINC000012195150	O=C(NC1CCCNC1)C3CCN(Cc2ccccc2)CC3
Fc1ccccc1N3CCN(CCc2ccccc2)CC3	ZINC000000218187	C2CN(c1ccccc1)CCN2CCc3ccccc3
C[N@@](CCNc1ncnc2[nH]cnc12)Cc3ccccc3	ZINC000000213922	C(CNc1ncnc2[nH]cnc12)NCc3ccccc3
CN(C)c2ccc(C[N@@](C)C[C@@H](O)c1ccccc1)cc2	ZINC000000212988	C(Cc1ccccc1)NCc2ccccc2
Fc3ccc(C(=O)N2CCN(C1CCCC1)CC2)cc3	ZINC000000239704	O=C(N2CCN(C1CCCC1)CC2)c3ccccc3
C[N+](C)(C)c1ccc(C=O)cc1	ZINC000000083942	c1ccccc1
O=C(C[C@H](C(=O)c1ccccc1)c2ccccc2)N3CCOCC3	ZINC000000035128	O=C(CC(C(=O)c1ccccc1)c2ccccc2)N3CCOCC3
NC[C@@H](c1ccccc1)c2c[nH]c3ccccc23	ZINC000000110239	C(c1ccccc1)c2c[nH]c3ccccc23
NCC(=O)NCC(=O)Nc1cc(Cl)c(S(N)(=O)=O)cc1S(N)(=O)=O	ZINC000013800645	c1ccccc1
COC(=O)C[C@@]2(C)OC[C@@H](CN1CCCCC1)O2	ZINC000000191960	C2CCN(CC1COCO1)CC2
CCOC(=O)c1sc(N)c(C(=O)OC)c1C	ZINC000000037375	c1ccsc1
Nc3ccc2nc(c1cc(O)ccc1N)[nH]c2c3	ZINC000000075591	c3ccc(c2nc1ccccc1[nH]2)cc3
C[C@H](O)C[N@]1CCn3c2[C@@H]1CCCc2c4cc(C)ccc34	ZINC000000201246	C2CC1NCCn3c1c(C2)c4ccccc34
CN([C@@H](CCCN)C(=O)Nc2ccc1ccccc1c2)C(=O)[C@@H](N)Cc3ccccc3	ZINC000001532447	O=C(CCc1ccccc1)NCC(=O)Nc3ccc2ccccc2c3
CSc1nc(N)cc(N(C)C)n1	ZINC000000330563	c1cncnc1
CC3(C)OC(=O)N2Cc1cccc[n+]1C[C@@]23O	ZINC000000053398	O=C3OCC2C[n+]1ccccc1CN23
CC(C)C#C[C@@]2(C(F)(F)F)OCC(=O)Nc1ccc(Cl)cc12	ZINC000000023590	O=C2COCc1ccccc1N2
OC(=O)c3ccc(NC(=O)c2ccc(F)c(S(=O)(=O)N1CCOCC1)c2)cc3	ZINC000000707352	O=C(Nc1ccccc1)c3cccc(S(=O)(=O)N2CCOCC2)c3
Cn2c(CN1CCCCC1)c(C#N)c3ccccc23	ZINC000000049567	C3CCN(Cc2cc1ccccc1[nH]2)CC3
COc1ccccc1NC(=O)c2ccc[n+](C)c2	ZINC000000364608	O=C(Nc1ccccc1)c2cccnc2
NC(=N)NN=Cc1ccccc1Cl	ZINC000000128265	c1ccccc1
COc4cccc(C(=O)Nc3c1CCCCc1nc2CCCc23)c4	ZINC000000198614	O=C(Nc3c1CCCCc1nc2CCCc23)c4ccccc4
CCOC(=O)c1c(N)sc2c1CC(C)(C)NC2(C)C	ZINC000000060293	C2Cc1ccsc1CN2
Oc3c(O)c(CN1CCCCC1)c2ccccc2c3CN4CCCCC4	ZINC000000756483	C4CCN(Cc2ccc(CN1CCCCC1)c3ccccc23)CC4
Cn2c[n+](Cc1ccccc1)c3c(=O)n(C)c(=O)n(C)c23	ZINC000000383222	O=c3[nH]c(=O)c2[n+](Cc1ccccc1)c[nH]c2[nH]3
COc3ccc(N2CCN(C(=O)NC(=O)c1ccccc1)CC2)cc3	ZINC000000081858	O=C(NC(=O)c1ccccc1)N3CCN(c2ccccc2)CC3
O=C(Nc3c1CCCCc1nc2CCCc23)C4CCCCC4	ZINC000000198613	O=C(Nc3c1CCCCc1nc2CCCc23)C4CCCCC4
O=C(CN1CC[n+]2c1scc2c3cccs3)c4ccccc4	ZINC000000446922	O=C(CN1CC[n+]2c1scc2c3cccs3)c4ccccc4
C[C@@H](C[C@@H](C#CCN(C)C)N(C)C)CC(C)(C)C	ZINC000001593745	nonring
C3CN=C(Cc1cccc2OCOc12)N3	ZINC000000003817	C3CN=C(Cc1cccc2OCOc12)N3
O=C(N1CCNCC1)c3ccc2cc[nH]c2c3	ZINC000000153979	O=C(N1CCNCC1)c3ccc2cc[nH]c2c3
O=C(CN1CCCC1)N2CCc3ccccc23	ZINC000000159547	O=C(CN1CCCC1)N2CCc3ccccc23
COC(=O)[C@@H](C#N)C1CC(C)(C)NC(C)(C)C1	ZINC000000104372	C1CCNCC1
CN(C)CCCn2cnc3c(=O)oc1ccccc1c23	ZINC000000302249	O=c2oc1ccccc1c3[nH]cnc23
Cn2c(=O)[nH]c(=O)c3n(CCN1CCCCC1)cnc23	ZINC000000067617	O=c3[nH]c(=O)c2n(CCN1CCCCC1)cnc2[nH]3
CCN(CC)CCC[C@@H](C)Nc1ccnc2ccc(N(C)C)cc12	ZINC000001706377	c2ccc1ncccc1c2
CCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c2ccccc2N(=O)=O	ZINC000000070370	O=C2NC=CC(c1ccccc1)N2
COc3ccc(c2nc(C(=O)Nc1nn[nH]n1)cs2)cc3	ZINC000000002384	O=C(Nc1nn[nH]n1)c3csc(c2ccccc2)n3
CC(C)n1nccc1n3c(C)cc(CNCCC[N@]2CCCC[C@@H]2C)c3C	ZINC000006651233	C3CCN(CCCNCc2ccn(c1ccn[nH]1)c2)CC3
COc2cc(CNCc1cccnc1)ccc2OCC(N)=O	ZINC000000360045	C(NCc1cccnc1)c2ccccc2
NS(=O)(=O)N2CCN(C(=O)CNS(=O)(=O)c1ccccc1)CC2	ZINC000558527706	O=C(CNS(=O)(=O)c1ccccc1)N2CCNCC2
NC(=O)[C@@H]1C(=S)NC(O)=C(C#N)C12CCCCC2	ZINC000000032867	S=C2CC1(CCCCC1)C=CN2
C[N+](=O)Cc1ccc(Br)cc1	ZINC000000084684	c1ccccc1
CCN(CC2CCN(C1CCN(C)CC1)CC2)C(=O)CCN4Cc3ccccc3C4=O	ZINC000012466190	O=C(CCN2Cc1ccccc1C2=O)NCC4CCN(C3CCNCC3)CC4
CN(C)CC[C@H]2CN(C)C(=O)c1cccnc1C2	ZINC000000002656	O=C1NCCCc2ncccc12
C[C@]24C[N@](C1CCNCC1)C[C@H]2C(=O)Nc3ccccc3C(=O)N4	ZINC000012337905	O=C4Nc1ccccc1C(=O)NC3CN(C2CCNCC2)CC34
COc2cc(c1ccc[nH]1)c4c(=O)[nH]c3ccc(F)c2c34	ZINC000000003491	O=c2[nH]c4cccc3ccc(c1ccc[nH]1)c2c34
CC[n+]1c(C)scc1c2ccccc2	ZINC000000150858	c2ccc(c1cscn1)cc2
CN(C)CCSc1nnnn1c2ccccc2	ZINC000000090514	c2ccc(n1cnnn1)cc2
CC(C)NS(=O)(=O)N2CCN(c1c(C#N)c(=O)n(C)c(=O)n1C)CC2	ZINC000285470667	O=c2cc(N1CCNCC1)[nH]c(=O)[nH]2
CC(C)CN2CCC(C(=O)NC[C@@H]1CCCO1)CC2	ZINC000000317523	O=C(NCC1CCCO1)C2CCNCC2
NC(=O)c2cc[n+](Cc1ccc(N(=O)=O)cc1)cc2	ZINC000000362611	C(c1ccccc1)[n+]2ccccc2
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
COc3ccc(CC/N=C(\C)c2ccc1ccccc1c2)cc3OC	ZINC000000099159	C(Cc1ccccc1)N=Cc3ccc2ccccc2c3
COc2c(c1ccccc1)sc3nc(C)cc(C)[n+]23	ZINC000000128007	c3ccc(c2c[n+]1cccnc1s2)cc3
CCC(O)(CC)C#CCN1CCCC1	ZINC000000068193	C1CCNC1
CCN(CCCN(C)C)C(=O)C(=O)NC[C@@H](C)CN1CCN(C)CC1	ZINC000560014836	C1CNCCN1
OCC[N+]14CCC(CC1)[C@@H](C(O)(c2ccccc2)c3ccccc3)C4	ZINC000000499346	C1CN4CCC1C(C(c2ccccc2)c3ccccc3)C4
COC(=O)[C@@H]4Cc1c([nH]c2ccccc12)C3(CCN(C)CC3)N4	ZINC000000083417	C4Cc1c([nH]c2ccccc12)C3(CCNCC3)N4
CNC[C@@H]2CCC[N@@](CCc1ccc(OC)cc1)C2	ZINC000011888814	C2CCN(CCc1ccccc1)CC2
CN(C)CCc2[nH]c1ccc(C)cc1c2CC#N	ZINC000000028969	c2ccc1[nH]ccc1c2
C1CN3CCC1C(c2ccoc2)=C3	ZINC000000017162	C1CN3CCC1C(c2ccoc2)=C3
C[C@@H]2CCC[N@](C1CCNCC1)C2	ZINC000000299465	C2CCN(C1CCNCC1)CC2
CCN(CC)c2ccc(Nc1cc(=O)[nH]c(=O)[nH]1)cc2	ZINC000000028965	O=c2cc(Nc1ccccc1)[nH]c(=O)[nH]2
NCCCOC[C@@H]1CCC[N@]2CCCC[C@@H]12	ZINC000004110582	C2CCN1CCCCC1C2
CC3(C)Cc2nc(c1ccccc1)nc(NN)c2CO3	ZINC000000521665	C3Cc2nc(c1ccccc1)ncc2CO3
CN(C)C[C@@]2(O)C1CN4CC[N@](C1)CC2(c3ccccc3)C4	ZINC000019773779	C1CN4CC3CN1CC(c2ccccc2)(C3)C4
NC(=O)c1ccccc1NC(=O)C(O)=C(N(=O)=O)c3cnc2ccc(N(=O)=O)cc2n3	ZINC000001631441	O=C(Nc1ccccc1)C=Cc3cnc2ccccc2n3
CC3=C(C(N)=O)[C@@H](c1ccc(Cl)cc1Cl)n2[nH]nnc2=N3	ZINC000000071516	C3=CC(c1ccccc1)n2[nH]nnc2=N3
Oc2c(C(=O)Nc1cnccn1)c(=O)c4cccc3CCn2c34	ZINC000001297844	O=C(Nc1cnccn1)c2cn4CCc3cccc(c2=O)c34
CN2CCN(C(=O)CCNC(=O)CNS(=O)(=O)c1cn(C)cn1)CC2	ZINC000531788049	O=C(CNS(=O)(=O)c1c[nH]cn1)NCCC(=O)N2CCNCC2
Cc4ccc([C@@H](Nc1cc(C)ccn1)c2c(C)[nH]c3ccccc23)cc4	ZINC000000072054	N(C(c1ccccc1)c2c[nH]c3ccccc23)c4ccccn4
Cc1cc(C(C)(C)C)cc(C)c1CC2=NCCN2	ZINC000000057534	C2CN=C(Cc1ccccc1)N2
CCOC(=O)Cn3cc(\C=c2/c(=O)[nH]c(=O)n(c1ccc(C)c(C)c1)c2=O)c4ccccc34	ZINC000001186412	O=c3[nH]c(=O)c(=Cc1c[nH]c2ccccc12)c(=O)n3c4ccccc4
COc3ccc(C[C@H]1NCCc2cc(OC)c(OC)cc12)cc3OC	ZINC000000057531	C3Cc1ccccc1C(Cc2ccccc2)N3
NC(=O)C2CCN(Cc1ccccc1Br)CC2	ZINC000000277785	C2CCN(Cc1ccccc1)CC2
CN(C)CCNc2oc(c1ccc(N(=O)=O)cc1)nc2C#N	ZINC000000528903	c2ccc(c1ncco1)cc2
CCCC[S+](CCCC)Cc2ccc3NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCCNC(=O)CNC(=O)CNC(=O)c2c3	ZINC000026252728	O=C2CNC(=O)CNC(=O)c3cccc(NC(=O)C1CCCN1C(=O)CCCCCN2)c3
CC(C)(C)NC(=O)[C@@H]2C[C@@H]1CCCC[C@H]1CN2	ZINC000000057086	C2CCC1CNCCC1C2
CCOC(=O)c2cnc1c(C)c(Cl)ccc1c2N4CCN(Cc3ccccc3)CC4	ZINC000000645729	C3CN(c1ccnc2ccccc12)CCN3Cc4ccccc4
O=C1C[C@@H]2CCC[C@H](C1)[N@]2Cc3ccccc3	ZINC000000170627	O=C1CC2CCCC(C1)N2Cc3ccccc3
OC2CCN(Cc1ccsc1)CC2	ZINC000000200753	C2CCN(Cc1ccsc1)CC2
Clc2ccc(Cl)c(S(=O)(=O)n1ccnc1)c2	ZINC000000049189	O=S(=O)(c1ccccc1)n2ccnc2
CCOC(=O)c1ncn3c1COc2cc(F)ccc23	ZINC000000016825	C2Oc1ccccc1n3cncc23
COc3ccc(CNCC2(c1ccccc1)CCCC2)cc3OC	ZINC000000186772	C3CCC(CNCc1ccccc1)(c2ccccc2)C3
CCN(CC)C[C@@H](O)Cn2c1ccc(Cl)cc1c3cc(Cl)ccc23	ZINC000000786498	c1ccc3c(c1)[nH]c2ccccc23
FC(F)(F)c2cccc(C[n+]1cccc(C#N)c1)c2	ZINC000000152621	C(c1ccccc1)[n+]2ccccc2
CN(C)CC(C)(C)CNC(=O)[C@@H]2C[C@@H]1CCCC[C@@H]1N2	ZINC000019515291	C2CCC1NCCC1C2
COC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)Cc2cn(Sc1ccccc1N(=O)=O)c3ccccc23	ZINC000026815790	S(c1ccccc1)n2ccc3ccccc23
CCOc1ccccc1[C@@H]2NC(=O)NC(C)=C2C(N)=O	ZINC000000071730	O=C2NC=CC(c1ccccc1)N2
Clc1ccc(N(=O)=O)cc1N2CCNCC2	ZINC000000036169	C2CN(c1ccccc1)CCN2
C[C@@H]4CCC[N@@](CC(=O)N3CCC(c2ncc1CNCCc1n2)CC3)C4	ZINC000019496500	O=C(CN1CCCCC1)N4CCC(c3ncc2CNCCc2n3)CC4
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
CCOc1c(NC(N)=N)c(NC(C)=O)c(NC(N)=N)cc1C(=O)OC	ZINC000040955093	c1ccccc1
O=C(CNS(=O)(=O)N1CCS(=O)(=O)CC1)NCCN2CCCCCC2	ZINC000431589903	O=C(CNS(=O)(=O)N1CCS(=O)(=O)CC1)NCCN2CCCCCC2
FC(F)(F)c2cccc(NC(=O)CNCc1ccco1)c2	ZINC000000118220	O=C(CNCc1ccco1)Nc2ccccc2
CC(C)(N)Cc1ccc(F)cc1	ZINC000000156299	c1ccccc1
CC(C)c1cc(OC(C)=O)c(C)cc1OCCN(C)C	ZINC000000057401	c1ccccc1
CCN2CCC(O)(C#Cc1ccccc1)CC2	ZINC000000088469	C2CC(C#Cc1ccccc1)CCN2
C[N@]3CCC[C@H](OC(=O)c2ccc1OCCOc1c2)C3	ZINC000000375759	O=C(OC1CCCNC1)c3ccc2OCCOc2c3
Clc3cccc(N2CCN(C(=O)[C@@H]1CCCN1)CC2)c3	ZINC000000390540	O=C(C1CCCN1)N3CCN(c2ccccc2)CC3
NC3C[C@H](c1ccccc1)N[C@H](c2ccccc2)C3	ZINC000001719794	C3CC(c1ccccc1)NC(c2ccccc2)C3
O=C(Nc4ccc3c(=O)n(CCC2CCN(Cc1ccccc1)CC2)c(=O)c3c4)c5ccccc5	ZINC000000598356	O=C(Nc4ccc3c(=O)n(CCC2CCN(Cc1ccccc1)CC2)c(=O)c3c4)c5ccccc5
CN3C(=O)C[C@@H](NC(=O)[C@H]2CN(CCN1CCOCC1)C(=O)C2)C3=O	ZINC000583961593	O=C3CC(NC(=O)C2CN(CCN1CCOCC1)C(=O)C2)C(=O)N3
COc4ccc([C@@H]2NC(=N)Nc3nc1ccccc1n23)c(OC)c4	ZINC000000543967	N=C2NC(c1ccccc1)n3c(N2)nc4ccccc34
C[C@@H](NCc1ccccc1)[C@@H]3COc2ccccc2O3	ZINC000000174660	C(NCc1ccccc1)C3COc2ccccc2O3
N=C2N[C@H](c1ccccc1)Nc3ccccc23	ZINC000000022225	N=C2NC(c1ccccc1)Nc3ccccc23
C=CC[N+]13COC[C@@H]1[C@H](c2ccc(N(=O)=O)cc2)OC3	ZINC000000497806	C2OCN3COC(c1ccccc1)C23
C\C(=C/C(N)=O)c1ccccc1Br	ZINC000000007182	c1ccccc1
CCC[C@@H](C)NS(=O)(=O)c1ccc(Cl)cc1	ZINC000000030355	c1ccccc1
Cc2[nH]c1ccc(OC(F)(F)F)cc1c2CCN4C(=O)OC3(CC(C)(C)NC(C)(C)C3)[C@]4(C)O	ZINC000000718619	O=C2OC1(CCNCC1)CN2CCc3c[nH]c4ccccc34
CN4CCN(c2cc1[nH]c(=O)[nH]c1cc2NC=c3c(=O)[nH]c(=O)n(C)c3=O)CC4	ZINC000408528277	O=c4[nH]c(=O)c(=CNc2cc1[nH]c(=O)[nH]c1cc2N3CCNCC3)c(=O)[nH]4
CC(=O)CSc1n(C)cc[n+]1C	ZINC000000013518	c1c[nH]cn1
CC(C)NC(=N)NC(=N)Nc1ccc(Cl)c(Cl)c1	ZINC000000001136	c1ccccc1
CC(=O)c2c(NN1CCOCC1)oc(C)cc2=O	ZINC000000033582	O=c2ccoc(NN1CCOCC1)c2
CS(=O)(=O)NCCNc2cc([C@@H]1CCOC1)nc(NCCO)n2	ZINC000426522897	C2CC(c1ccncn1)CO2
FC(F)(F)c2cnc(C[n+]1ccccc1)c(Cl)c2	ZINC000000160166	C(c1ccccn1)[n+]2ccccc2
O=C2N=C(N1CCOCC1)CN2Cc3ccccc3	ZINC000000022146	O=C2N=C(N1CCOCC1)CN2Cc3ccccc3
Cc2cccc(NC(=O)c1ccc(OCC(O)=O)cc1)c2C	ZINC000000065151	O=C(Nc1ccccc1)c2ccccc2
CCOC(=O)c1ccc(O)cc1	ZINC000000001392	c1ccccc1
CC[N@]1CCC[C@H]1CNC(=O)c2c(O)c(CC)cc(Cl)c2OC	ZINC000000001395	O=C(NCC1CCCN1)c2ccccc2
CC(C)N2CC[C@@H](NC(=O)C(=O)N(C)C[C@@H](O)CN1CCOCC1)C2=O	ZINC000558330534	O=C1NCCC1NC(=O)C(=O)NCCCN2CCOCC2
CN(C)c3cc[n+](Cn2c(=O)c1ccccc1c2=O)cc3	ZINC000000480195	O=c2n(C[n+]1ccccc1)c(=O)c3ccccc23
Clc2cccc3c(S(=O)(=O)N1CCCNCC1)cccc23	ZINC000000402771	O=S(=O)(N1CCCNCC1)c2cccc3ccccc23
COc1ccc(Cl)cc1NS(C)(=O)=O	ZINC000000029502	c1ccccc1
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
CN2CCC(N(C)Cc1ccc(N(=O)=O)s1)CC2	ZINC000000237437	C2CC(NCc1cccs1)CCN2
N=C2N[C@@H](Cc1cccs1)CS2	ZINC000000027432	N=C2NC(Cc1cccs1)CS2
Cc2ccc(C(=O)NCCc1ccc(S(N)(=O)=O)cc1)cc2C	ZINC000000182468	O=C(NCCc1ccccc1)c2ccccc2
COc3ccc(C(=O)Nc2ccc(N1CCN(C)CC1)cc2)cc3S(=O)(=O)NCCN(C)C	ZINC000009464740	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
CCOC(=O)[C@@H]2CN(Cc1ccccc1)C(=O)C2=O	ZINC000000004960	O=C2CCN(Cc1ccccc1)C2=O
C[C@H](SC(=O)c1cccs1)C(=O)N[C@H]2CCSC2=O	ZINC000000004382	O=C(CSC(=O)c1cccs1)NC2CCSC2=O
OCC2(C1=NO[C@](O)(C(F)(F)F)C1)CCCCC2	ZINC000000054178	C2CCC(C1=NOCC1)CC2
COc2ccc(OC)c(/C=C/C(=O)Nc1nccs1)c2	ZINC000000022066	O=C(Nc1nccs1)C=Cc2ccccc2
CC(C)(C)NC[C@H](O)COc2ccc(NC(=O)NC1CCCCC1)cc2	ZINC000000538582	O=C(NC1CCCCC1)Nc2ccccc2
NC(=O)c2ccc[n+](CCC[n+]1cccc(C(N)=O)c1)c2	ZINC000003023152	C(C[n+]1ccccc1)C[n+]2ccccc2
CCN2CCN(C(=O)c1ccc(Cl)cc1N(=O)=O)CC2	ZINC000000303072	O=C(N1CCNCC1)c2ccccc2
Cc1ccccc1CN3CCN(Cc2cccc(N(=O)=O)c2)CC3	ZINC000000351212	C2CN(Cc1ccccc1)CCN2Cc3ccccc3
OC(=O)c1cc(N(=O)=O)ccc1Br	ZINC000000056845	c1ccccc1
CS(=O)(=O)N2Cc1ccccc1C[C@@H]2C(=O)NN3CCOCC3	ZINC000000246868	O=C(NN1CCOCC1)C3Cc2ccccc2CN3
Nc2nnc(CCN1CCCCC1)s2	ZINC000000098442	C2CCN(CCc1nncs1)CC2
Fc2cccc(C(=O)OCCN1CCCCC1)c2	ZINC000000210753	O=C(OCCN1CCCCC1)c2ccccc2
COc2cccc(NC(=O)c1cc[n+](C)cc1)c2	ZINC000000364617	O=C(Nc1ccccc1)c2ccncc2
CCOC(=O)C2CCN(C/C=C/c1ccccc1N(=O)=O)CC2	ZINC000000278788	C2CCN(CC=Cc1ccccc1)CC2
CC2CCN(C[C@H](O)COc1cccc(C)c1)CC2	ZINC000000249926	C2CCN(CCCOc1ccccc1)CC2
Fc3cccc(COc2ccc(CN[C@@H]1CCNC1=O)cc2)c3	ZINC000000022080	O=C1NCCC1NCc3ccc(OCc2ccccc2)cc3
COc2cccc(CN(C)C1CCN(C)CC1)c2	ZINC000000237155	C2CC(NCc1ccccc1)CCN2
NCc2ccc(n1cccc1)cc2	ZINC000000159037	c2ccc(n1cccc1)cc2
O=c2[nH]c1ccccc1c(=O)n2CCN3CCSCC3	ZINC000000068770	O=c2[nH]c1ccccc1c(=O)n2CCN3CCSCC3
Nc4c(NC2CCN(Cc1ccccc1)CC2)c3ccccc3oc4=O	ZINC000000176878	O=c4cc(NC2CCN(Cc1ccccc1)CC2)c3ccccc3o4
CN3C(=O)C[C@H](NCc2ccc1OCOc1c2)C3=O	ZINC000000049269	O=C3CC(NCc2ccc1OCOc1c2)C(=O)N3
Cc3ccc2[nH]c(c1cc[n+](C)cc1)cc2c3	ZINC000000063339	c3ccc2[nH]c(c1ccncc1)cc2c3
Fc3ccc(Cn2cc1[nH]cccc1c2=O)cc3	ZINC000000003003	O=c2n(Cc1ccccc1)cc3[nH]cccc23
Nc2nccn3c(Cc1c(F)cccc1F)nnc23	ZINC000000013344	C(c1ccccc1)c2nnc3cnccn23
Oc3cc2[C@H](c1ccccc1)CNCCc2c(Cl)c3O	ZINC000000005579	C3Cc1ccccc1C(c2ccccc2)CN3
CCN[C@H](Cc1ccccn1)c2sccc2C	ZINC000000015857	C(Cc1cccs1)c2ccccn2
Fc3ccc(NC(=O)CSc2nnc1CCCCCn12)cc3	ZINC000000029005	O=C(CSc2nnc1CCCCCn12)Nc3ccccc3
NC2(c1cccc(Cl)c1)CCC2	ZINC000000054468	C2CC(c1ccccc1)C2
C[C@@H](Sc1ccccc1Cl)C(=O)NCC2CC2	ZINC000000007159	O=C(CSc1ccccc1)NCC2CC2
N#Cc1cccnc1N2CCNCC2	ZINC000000148271	C2CN(c1ccccn1)CCN2
COc2cc1nc(N(CCO)CCO)nc(N)c1cc2OC	ZINC000000389139	c2ccc1ncncc1c2
COCC[N@]2CC[C@@H](NC(=O)C(=O)NC[C@@H](C)CN1CCN(C)CC1)C2	ZINC000560012796	O=C(NCCCN1CCNCC1)C(=O)NC2CCNC2
CC3CCN(C2CCN(Cc1cccc(N(=O)=O)c1)CC2)CC3	ZINC000000315791	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
CC[C@H]2Cn1cc(N(=O)=O)nc1O2	ZINC000000005609	C2Cn1ccnc1O2
CN(c1ccc(O)cc1)c3nc(O)c([C@@H]2SC(=O)NC2=O)s3	ZINC000001170438	O=C3NC(=O)C(c2cnc(Nc1ccccc1)s2)S3
COc2ccc(NC1=NCCOC1)cc2	ZINC000000225233	C2CN=C(Nc1ccccc1)CO2
CCN3CCN(c2cc(SC(C)C)nc(c1ccc(OC)cc1)n2)CC3	ZINC000000631249	C3CN(c2ccnc(c1ccccc1)n2)CCN3
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
COCC(=O)N3C[C@H]1CNC[C@@]1(C(=O)NC(C)(C)CN2CCCC2)C3	ZINC000065381045	O=C(NCCN1CCCC1)C23CNCC2CNC3
CC(C)NC[C@@H](O)c1ccc(NS(C)(=O)=O)cc1	ZINC000000004166	c1ccccc1
NC(=O)C4CCN([C@@H]2[C@@H](O)[C@H](NCc1ccc(F)cc1)[C@H]3CO[C@@H]2O3)CC4	ZINC000012529672	C4CCN(C2CC(NCc1ccccc1)C3COC2O3)CC4
CN[C@H](Cc1ccccc1N)c2sccc2C	ZINC000000008413	C(Cc1cccs1)c2ccccc2
Cn2nc(c1cccnc1)nc2c3ccccc3CO	ZINC000000001445	c3ccc(c2nc(c1cccnc1)n[nH]2)cc3
Cc1ccccc1N4CCN(CCc3nnc2CCCCn23)CC4	ZINC000000001246	C1CCn2c(C1)nnc2CCN4CCN(c3ccccc3)CC4
COc2ccc(NC(=O)CC[N@]1CCC[C@@H](C)C1)c(OC)c2	ZINC000000176476	O=C(CCN1CCCCC1)Nc2ccccc2
C[N@]3CCC[C@H](OC(=O)[C@](O)(C1CCCCC1)c2ccccc2)C3	ZINC000000000667	O=C(OC1CCCNC1)C(C2CCCCC2)c3ccccc3
C4CN(c2nc1ccccc1n2Cc3ccccc3)CCN4	ZINC000000007943	C4CN(c2nc1ccccc1n2Cc3ccccc3)CCN4
NC3=N[C@@H](c1c(O)ccc2ccccc12)C=NN3	ZINC000000036303	N3C=NC(c1cccc2ccccc12)C=N3
COc4cc(CNC2C1CC3CC(C1)CC2C3)c(N(=O)=O)cc4OC	ZINC000000182869	C(NC2C1CC3CC(C1)CC2C3)c4ccccc4
C[C@@H]2O[C@@](O)(c1ccc(N(=O)=O)cc1)CC[N+]23CCCCC3	ZINC000000162705	C1CC[N+]3(CC1)CCC(c2ccccc2)OC3
CC[C@@]2(C)N(O)C(C)(C)C(c1ccc(OC)cc1)[N+]2=O	ZINC000000269119	O=[N+]1CNCC1c2ccccc2
C[C@@H]2O[C@@](O)(c1ccc(Cl)cc1)C[N+]23CCCCC3	ZINC000000162700	C1CC[N+]3(CC1)COC(c2ccccc2)C3
CC(=O)c3sc2nsc(SCCN1CCCCC1)c2c3N	ZINC000000160603	C3CCN(CCSc1snc2sccc12)CC3
Cc1ccc(NC[C@@H](O)CNC(N)=N)c(Br)c1	ZINC000000307839	c1ccccc1
CCCN4CCN(c3nnc(n1cccc1CNC2CCCC2)s3)CC4	ZINC000007002074	C4CCC(NCc1cccn1c3nnc(N2CCNCC2)s3)C4
Cc4cccc(N[C@H](c1ccccn1)c3ccc2ccc(C)nc2c3O)n4	ZINC000000684054	N(C(c2ccc1cccnc1c2)c3ccccn3)c4ccccn4
N[n+]2cc1ccccc1cc2C#N	ZINC000000162440	c2ccc1cnccc1c2
CS(=O)(=O)N2CCN(CCNC(=O)NCCN1C(=O)CCC1=O)CC2	ZINC000603729992	O=C1CCC(=O)N1CCNC(=O)NCCN2CCNCC2
Cc4ccc(C[N@]1C[C@@H]3C[C@H](C1)c2cccc(=O)n2C3)o4	ZINC000000228725	O=c4cccc3C2CC(CN(Cc1ccco1)C2)Cn34
COc3ccc(N2C(=O)C[C@@H](NCCc1ccc(OC)c(OC)c1)C2=O)cc3Cl	ZINC000000710581	O=C2CC(NCCc1ccccc1)C(=O)N2c3ccccc3
C[C@@H]2CSc3nnc(c1cccc(N(=O)=O)c1)n23	ZINC000000056282	C1Cn2c(S1)nnc2c3ccccc3
C[C@@H](CNC(=O)C(=O)NCCC1CCN(C)CC1)CN2CCN(C)CC2	ZINC000560015104	O=C(NCCCN1CCNCC1)C(=O)NCCC2CCNCC2
CC(=O)N[C@@H]1[C@@H](NC(N)=N)C=C(C(O)=O)O[C@H]1[C@@H]2C[C@@H](O)[C@@H](O)CO2	ZINC000013487813	C2CCC(C1CCC=CO1)OC2
COc2ccc(\C=N\C1=NNC(=O)[C@@H](CC(O)=O)S1)cc2	ZINC000000031921	O=C2CSC(N=Cc1ccccc1)=NN2
CC(C)N2CCC(NCc1cc(C#N)n(C)c1C)CC2	ZINC000014119745	C2CC(NCc1cc[nH]c1)CCN2
CS(=O)(=O)N(CC(=O)Nc1ccccc1F)c2ccccc2F	ZINC000000048615	O=C(CNc1ccccc1)Nc2ccccc2
C3CCN=C(NN=Cc2ccc(N1CCOCC1)cc2)CC3	ZINC000000265415	C3CCN=C(NN=Cc2ccc(N1CCOCC1)cc2)CC3
CC2(C)CC(NC(=O)c1cncc(Br)c1)CC(C)(C)N2	ZINC000000092326	O=C(NC1CCNCC1)c2cccnc2
CS(=O)(=O)N3N=C(c2cccc(NS(=O)(=O)c1ccccc1)c2)C[C@@H]3c4ccco4	ZINC000001077358	O=S(=O)(Nc3cccc(C2=NNC(c1ccco1)C2)c3)c4ccccc4
CCN(c1ccccc1C)S(=O)(=O)c2ccc(F)cc2	ZINC000000029484	O=S(=O)(Nc1ccccc1)c2ccccc2
NC(=N)NC(=N)Nc1ccc(F)c(Cl)c1	ZINC000000088731	c1ccccc1
Oc1ccccc1[C@H](CC(=O)N2CCCCC2)N3CCCCC3	ZINC000000191028	O=C(CC(N1CCCCC1)c2ccccc2)N3CCCCC3
COC(=O)[C@@H]2OC1(CCCC1)O[C@H]2C(=O)OC	ZINC000000033480	C1CCC2(C1)OCCO2
O=C(Nc2ccc(C1=NCCN1)cc2)Nc4ccc(C3=NCCN3)cc4	ZINC000001682417	O=C(Nc2ccc(C1=NCCN1)cc2)Nc4ccc(C3=NCCN3)cc4
COc1ccc([C@@H](C)N)cc1OC	ZINC000000296167	c1ccccc1
CC(=O)NCCC(=O)N2C[C@@H]1C[C@@H](O)C[N@@]1C3(C2)CN(C(=O)CCNC(C)=O)C3	ZINC000514289867	C3CC2CNCC1(CNC1)N2C3
CC[C@H]2CCNc3cc1[nH]c(=O)cc(C(F)(F)F)c1cc23	ZINC000000007496	O=c3ccc2cc1CCCNc1cc2[nH]3
CN(C)CCNC(=O)Cn2c(=S)[nH]c1ccccc1c2=O	ZINC000000425335	O=c1[nH]c(=S)[nH]c2ccccc12
CCN(CC)CCOc1ccccc1OC	ZINC000000050098	c1ccccc1
COc2cc(C(=O)NCC1(N(C)C)CCCC1)cc(OC)c2OCc3ccccc3	ZINC000000591392	O=C(NCC1CCCC1)c3ccc(OCc2ccccc2)cc3
COc1ccccc1[C@@H]2NC(=O)NC(C)=C2C(=O)OCC(C)C	ZINC000000044103	O=C2NC=CC(c1ccccc1)N2
Cc1cc(=O)oc(C)c1C(=O)NCCN2CCCCC2	ZINC000000521510	O=C(NCCN1CCCCC1)c2ccc(=O)oc2
CN(C)CCNc3c1CCCc1c(C#N)c4nc2ccccc2n34	ZINC000000126363	C4Cc3cc2nc1ccccc1n2cc3C4
CC2CCC(NC1CCC(O)CC1)CC2	ZINC000000221320	C2CCC(NC1CCCCC1)CC2
O=c2cc(N1CCNCC1)nc3ccccn23	ZINC000000006940	O=c2cc(N1CCNCC1)nc3ccccn23
Nn3c(SCC(=O)Nc1ccccc1F)nc2ccccc2c3=O	ZINC000000382014	O=C(CSc2nc1ccccc1c(=O)[nH]2)Nc3ccccc3
COc5cc4c(=O)n(CCCNCCCNCCN)c3c2cc1OCOc1cc2c(=O)c3c4cc5OC	ZINC000027650515	O=c4[nH]c3c2cc1OCOc1cc2c(=O)c3c5ccccc45
COc3ccc(CN2CCN(c1cccc(C(F)(F)F)c1)CC2)cc3	ZINC000000752390	C2CN(c1ccccc1)CCN2Cc3ccccc3
CCN(CC)c3ccc(n2cc1n(C)c(=O)n(C)c(=O)c1c2)cc3	ZINC000000530561	O=c3[nH]c(=O)c2cn(c1ccccc1)cc2[nH]3
COCc1c(N)c(C)nc(Cl)c1C#N	ZINC000000035808	c1ccncc1
COc3ccc([C@@H]1NCC[C@@]2(O)CCCC[C@@H]12)cc3OC	ZINC000000301375	C1CCC2C(C1)CCNC2c3ccccc3
C[C@@H](O)CNc2nc1ccccc1n2C	ZINC000000513008	c2ccc1[nH]cnc1c2
CN(c2ccc(C1=NCCN1)cc2)S(=O)(=O)c5cccc(S(=O)(=O)N(C)c4ccc(C3=NCCN3)cc4)c5	ZINC000001668432	O=S(=O)(Nc2ccc(C1=NCCN1)cc2)c5cccc(S(=O)(=O)Nc4ccc(C3=NCCN3)cc4)c5
Cc1c(Cl)c(Cl)nc(C(O)=O)c1Cl	ZINC000000035803	c1ccncc1
NC(=O)CN3CCC(NC(=O)[C@@H]1CCC[N@]1Cc2ccccc2)CC3	ZINC000057153072	O=C(NC1CCNCC1)C2CCCN2Cc3ccccc3
C[C@@H](CN(C)C)Sc1nc(C)cc(C)n1	ZINC000000141431	c1cncnc1
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
N=c2ccn(Cc1ccc(N(=O)=O)cc1)cc2	ZINC000000493732	N=c2ccn(Cc1ccccc1)cc2
C[C@@H](CCN1CCN(C=O)CC1)c2ccccc2	ZINC000000214581	C(CN1CCNCC1)Cc2ccccc2
CCCc1cc(=O)oc2cc(O)cc(O)c12	ZINC000000040645	O=c2ccc1ccccc1o2
Cc1cc(Br)ccc1NC(=O)CSc2nncn2C	ZINC000000040646	O=C(CSc1nnc[nH]1)Nc2ccccc2
O=C3NCC2(CCN(CCc1ccccc1)CC2)O3	ZINC000000001441	O=C3NCC2(CCN(CCc1ccccc1)CC2)O3
CC(=O)N2CCC(NC1CC1)CC2	ZINC000000153943	C2CC(NC1CC1)CCN2
COC(=O)c2ccc(C[N+](C)(C)CN1CCCC1=O)cc2	ZINC000000180381	O=C1CCCN1CNCc2ccccc2
CC[C@@H](C(=O)Nc1ccc(C(=O)OC)cc1)c2ccccc2	ZINC000000030786	O=C(Cc1ccccc1)Nc2ccccc2
COc1cccc(OC)c1C(=O)c2cc[n+](C)cc2	ZINC000000142983	O=C(c1ccccc1)c2ccncc2
C[n+]5cc2c1OCOc1ccc2c6ccc4cc3OCOc3cc4c56	ZINC000000000706	C6Oc5cc4ccc3c2ccc1OCOc1c2cnc3c4cc5O6
O=c1[nH]c(=S)[nH]c1=Cc3ccc2ccccc2c3	ZINC000000041158	O=c1[nH]c(=S)[nH]c1=Cc3ccc2ccccc2c3
CC(=O)O[C@@H]4[C@H](N1CCCCC1)c3c(O)c(/C=C/C(=O)N2CCCCC2)ccc3OC4(C)C	ZINC000000676886	O=C(C=Cc3ccc2OCCC(N1CCCCC1)c2c3)N4CCCCC4
CC(=O)OCC[N@@](Cc1ccccc1)Cc3ccc2OCOc2c3	ZINC000000537345	C3Oc2ccc(CNCc1ccccc1)cc2O3
COc2cccc(C(=O)NCc1ccc(C)cc1)c2	ZINC000000030032	O=C(NCc1ccccc1)c2ccccc2
C3CN=C([C@H]1OCCc2ccccc12)N3	ZINC000000197828	C3CN=C(C1OCCc2ccccc12)N3
CC[n+]2ccc(\C=C\c1ccc(OC)cc1OC)cc2	ZINC000000044032	C(=Cc1ccncc1)c2ccccc2
C[n+]2cc(C(=O)NCC[N+]1(C)CCCCC1)ccc2\C=N\O	ZINC000000306973	O=C(NCCN1CCCCC1)c2cccnc2
CC1(C)[C@H]2CC=C(CN(CCO)CCO)[C@@H]1C2	ZINC000000217766	C1C=CC2CC1C2
C2CN(c1ccccn1)CCN2Cc3ccsc3	ZINC000000237942	C2CN(c1ccccn1)CCN2Cc3ccsc3
CN(C)CCn2cnc1ncccc1c2=O	ZINC000000088423	O=c1[nH]cnc2ncccc12
CN2CCN(c1ccc(N)cc1F)CC2	ZINC000000169801	C2CN(c1ccccc1)CCN2
NC2=NC[C@@H]1CCCC[C@@H]1S2	ZINC000000006839	C2CCC1SC=NCC1C2
Cc1ccc(N(=O)=O)cc1S(=O)(=O)n2cnc3ccccc23	ZINC000000051907	O=S(=O)(c1ccccc1)n2cnc3ccccc23
CN(C)C(=O)Oc1cccc([N+](C)(C)C)c1	ZINC000000001792	c1ccccc1
COc3ccc(CCNC(=O)c2cccc(NS(=O)(=O)c1cccc(F)c1)c2)cc3OC	ZINC000000631439	O=C(NCCc1ccccc1)c3cccc(NS(=O)(=O)c2ccccc2)c3
COc3ccc(CN2CCC([N@]1CCC[C@@H](C)C1)CC2)cc3	ZINC000000317950	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
C[C@@H]3[C@H](N1CCCCC1)C(=O)N(c2ccc(C)cc2)C3=O	ZINC000000102241	O=C2CC(N1CCCCC1)C(=O)N2c3ccccc3
COc3cc2CC[N+](C)(C)[C@H](Cc1ccc(O)cc1)c2cc3OC	ZINC000000338168	C3Cc1ccccc1C(Cc2ccccc2)N3
CN2CCN(/N=C/c1ccc(Cl)cc1)CC2	ZINC000000435102	C2CN(N=Cc1ccccc1)CCN2
CN(C)CCOc5cccc(CN[C@H]1C[C@@H]4N(C1)C(=O)[C@H](Cc2c[nH]c3ccccc23)NC4=O)c5	ZINC000014744740	O=C5NC(Cc1c[nH]c2ccccc12)C(=O)N4CC(NCc3ccccc3)CC45
Cc3cc(C)c2oc(N1CCNCC1)nc2c3	ZINC000000007238	C3CN(c2nc1ccccc1o2)CCN3
Cc2nc1cc(S(=O)(=O)C(F)(F)F)ccc1s2	ZINC000000035415	c2ccc1scnc1c2
CNS(=O)(=O)c3ccc(NC(=O)[C@@H]1C[C@@H]2C[C@H]1C=C2)cc3	ZINC000000081957	O=C(Nc1ccccc1)C2CC3CC2C=C3
Cc2cc(NCc1cccnc1)nc(N)n2	ZINC000000073355	C(Nc1ccncn1)c2cccnc2
COc4ccc([C@@H]2NC(c1ccc(OC)cc1)=N[C@H]2c3ccc(OC)cc3)cc4	ZINC000000586999	N3C(c1ccccc1)C(c2ccccc2)N=C3c4ccccc4
COc3ccc(N2C(=O)C[C@@H]([N@@](C)CCc1ccc(OC)c(OC)c1)C2=O)cc3	ZINC000000708722	O=C2CC(NCCc1ccccc1)C(=O)N2c3ccccc3
CC(=O)Nc1ccc(C(O)=O)cc1NC(C)=O	ZINC000000071547	c1ccccc1
CCN(C(C)C)C(=O)c2cc(C)cc(OC[C@H](C)Nc1ccncc1)c2	ZINC000000602556	C(COc1ccccc1)Nc2ccncc2
COc2cc(NC(=S)N1CCC(C(N)=O)CC1)cc(OC)c2	ZINC000000306750	S=C(Nc1ccccc1)N2CCCCC2
COC(=O)[C@@H](C)On2c(=O)c1ccccc1c2=O	ZINC000000040609	O=c1[nH]c(=O)c2ccccc12
NC(=O)C1=C[C@]2(N(=O)=O)CN(CC(O)=O)C[C@](N(=O)=O)(C1)C2	ZINC000002751478	C1NCC2CC1CC=C2
C[N@@](CCCn2c(=S)[nH]c1ncccc1c2=O)Cc3ccccc3	ZINC000000424570	O=c2n(CCCNCc1ccccc1)c(=S)[nH]c3ncccc23
OC(=O)CNCc1ccccc1O	ZINC000000019040	c1ccccc1
C[C@H](NS(C)(=O)=O)C(=O)N[C@@]1(C)CCN(C(=O)[C@@H](C)NS(C)(=O)=O)C1	ZINC000647728417	C1CCNC1
C3CC(c1c[nH]c2ccccc12)CCN3	ZINC000000084072	C3CC(c1c[nH]c2ccccc12)CCN3
CCc2cc1c(=O)n(CC=C)c(SCC(N)=O)nc1s2	ZINC000000072422	O=c1[nH]cnc2sccc12
Cn2c(NCc1ccccc1)nc3n(C)c(=O)[nH]c(=O)c23	ZINC000000041471	O=c3[nH]c(=O)c2[nH]c(NCc1ccccc1)nc2[nH]3
CCOc4ccc(n3c(=S)[nH]c(=O)\c(=C/c2cc(C)n(c1cccnc1)c2C)c3=O)cc4	ZINC000001187116	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc4ccn(c3cccnc3)c4
Cc2cn([C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1F)c(=O)[nH]c2=O	ZINC000000006228	O=c2ccn(C1CCCO1)c(=O)[nH]2
COc2cc(C(=O)NC1CCN(C)CC1)nc3ccccc23	ZINC000000108644	O=C(NC1CCNCC1)c3ccc2ccccc2n3
CN3CCN(C(=S)c2ccc(OCc1cccc(C)c1)cc2)CC3	ZINC000000382344	S=C(N1CCNCC1)c3ccc(OCc2ccccc2)cc3
CC1=NCCc2c1[nH]c3cc(O)ccc23	ZINC000000058176	C1Cc2c(C=N1)[nH]c3ccccc23
CN3CCN(C(=O)NC[C@H]2CN(Cc1ccccc1)C(=O)C2)CC3	ZINC000000347888	O=C2CC(CNC(=O)N1CCNCC1)CN2Cc3ccccc3
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
COc2ccc(COC[C@@H](O)CN1CCCCC1)cc2OC	ZINC000000064504	C2CCN(CCCOCc1ccccc1)CC2
Cc1nc(N)nc(N)c1c2ccc(Cl)c(Cl)c2	ZINC000000001723	c2ccc(c1cncnc1)cc2
O=C(CCN2CCN(c1ccccn1)CC2)N4CCC(N3CCCC3)CC4	ZINC000019660951	O=C(CCN2CCN(c1ccccn1)CC2)N4CCC(N3CCCC3)CC4
COC(=O)c1ccccc1NC(=O)Cc2cccs2	ZINC000000030812	O=C(Cc1cccs1)Nc2ccccc2
CN(C)CC#C[C@@H]1CCCN1C(C)=O	ZINC000000012240	C1CCNC1
O[C@@H]([C@H](O)c2nc1ccc(C#N)cc1[nH]2)c4nc3cc(C#N)ccc3[nH]4	ZINC000000131302	C(Cc2nc1ccccc1[nH]2)c4nc3ccccc3[nH]4
Cc2ccc(NC(=O)CN1CCC(C(N)=O)CC1)cc2	ZINC000000299685	O=C(CN1CCCCC1)Nc2ccccc2
NC(=O)C3CCN(Cc2nc(c1ccccc1)no2)CC3	ZINC000000200215	C3CCN(Cc2nc(c1ccccc1)no2)CC3
COc1ccccc1N3[C@@H](c2ccccc2)NC(=N)NC3=N	ZINC000003075956	N=C3NC(c1ccccc1)N(c2ccccc2)C(=N)N3
COc3c1OCOc1cc2CC[N+](C)(C)[C@H](CC(C)=O)c23	ZINC000000526377	C3Cc2cc1OCOc1cc2CN3
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
COC(=O)[C@@H]1CN(C(=O)NCCNS(=O)(=O)NC(C)C)CC[N@@](C)C1	ZINC000413488029	C1CNCCNC1
CCN(C)C(=O)CNC(=O)C(=O)N2CCN(C(=O)Cn1cnnn1)CC2	ZINC000558241871	O=C(Cn1cnnn1)N2CCNCC2
Cc1nc[nH]c1CN4CCC([C@@H]3CC[N@@](CCc2ccccc2)C3)CC4	ZINC000011817968	C2CN(Cc1cnc[nH]1)CCC2C4CCN(CCc3ccccc3)C4
CCOC(=O)C1CCN(CC[C@@H](O)C(F)(F)F)CC1	ZINC000000152365	C1CCNCC1
O=C2[C@@H](N1CCCCC1)CCN2c3ccccc3	ZINC000000000287	O=C2C(N1CCCCC1)CCN2c3ccccc3
CN3CCN(Cc2ccc1[nH]cc(CCN)c1c2)S3(=O)=O	ZINC000000016311	O=S1(=O)NCCN1Cc3ccc2[nH]ccc2c3
OC4N(c3ccc(N2C(=O)C[C@@H](NCCN1CCOCC1)C2=O)cc3)C(=O)C=C4NCCN5CCOCC5	ZINC000103128926	O=C2CC(NCCN1CCOCC1)C(=O)N2c5ccc(N4CC(NCCN3CCOCC3)=CC4=O)cc5
Cc1n[n+](C(C)(C)C)nn1C=C	ZINC000000052203	c1nnn[nH]1
CCOC(=O)NC(=O)c1cn(CCN(C)C)c(=O)[nH]c1=O	ZINC000000481078	O=c1cc[nH]c(=O)[nH]1
Cc2ccc(NC(=O)CSc1nccn1C)cc2Cl	ZINC000000039186	O=C(CSc1ncc[nH]1)Nc2ccccc2
NCCCC[C@@H](NC(=O)[C@@H](Cc1cnc[nH]1)NC(=O)CN)C(O)=O	ZINC000097730338	c1c[nH]cn1
COc3ccc(N2CCN(Cc1cccc(C)c1)CC2)cc3	ZINC000000202023	C2CN(c1ccccc1)CCN2Cc3ccccc3
O=C(CNC(=O)N2CCN(C(=O)C(=O)N1CCOCC1)CC2)NCC#N	ZINC000511910704	O=C(N1CCNCC1)C(=O)N2CCOCC2
CNC(=O)NC[C@@H]1CN(C(=O)N[C@@H](C)C[N@@](C)CCCN(C)C)CCO1	ZINC000637263559	C1COCCN1
CN(C)CCNC(=O)C23CCC1C[C@@H](C[C@@H](C1)C2)C3	ZINC000000437951	C1CC2CC3CC1CC(C2)C3
CC(C)C[C@H](NC(=O)[C@@H](C)N)C(=O)N[C@H](CCCCN)C(=O)Nc2ccc1c(C)cc(=O)oc1c2	ZINC000004534039	O=c2ccc1ccccc1o2
CN(C)c1ccc(\C=N\NC(=S)NC(C)(C)C)cc1	ZINC000000072416	c1ccccc1
Nc1nonc1NC(=O)CO[C@@H]2CN3CCC2CC3	ZINC000000053410	O=C(COC1CN2CCC1CC2)Nc3cnon3
ClC1=CC[C@@H]3[C@H](C1)C(=O)N(CCNC2CCCCC2)C3=O	ZINC000000105276	O=C2C1CC=CCC1C(=O)N2CCNC3CCCCC3
CN(C)CCNc1ncnc2ccccc12	ZINC000000118541	c2ccc1ncncc1c2
COCCN1CCC[C@@H]1CNC(=O)C(=O)N2CCC([N@@](C)CCO)CC2	ZINC000561119537	O=C(NCC1CCCN1)C(=O)N2CCCCC2
C[C@@H](NC2CCN(CCc1ccccc1)CC2)c3ccc(F)cc3	ZINC000000213915	C2CN(CCc1ccccc1)CCC2NCc3ccccc3
CC(C)(\C=N\O)[N+](=O)Cc1ccccn1	ZINC000000337820	c1ccncc1
CCn2c(C)[n+](C[C@@H](O)COc1ccccc1)c3ccccc23	ZINC000000316206	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
CNC(=O)CN2CCC(NC(=O)NCCCn1ccnc1)CC2	ZINC000047597440	O=C(NCCCn1ccnc1)NC2CCNCC2
OC(C(=O)O[C@@H]1CN2CCC1CC2)(c3ccccc3)c4ccccc4	ZINC000000057479	O=C(OC1CN2CCC1CC2)C(c3ccccc3)c4ccccc4
COc2ccc(C(=O)OCC[N+]1(C)CCOCC1)cc2	ZINC000000215710	O=C(OCCN1CCOCC1)c2ccccc2
CN(C)CCNC(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000000149980	c1ccccc1
COC(=O)C1=CNN[C@@H]1C(=O)NC2CCCCC2	ZINC000000040822	O=C(NC1CCCCC1)C2NNC=C2
C[n+]2cnc3n(Cc1ccccc1)cnc(N)c23	ZINC000000330551	C(c1ccccc1)n2cncc3ncnc23
COc3cc2CC[N@](C)[C@H](Cc1ccc(O)cc1)c2cc3OC	ZINC000000044851	C3Cc1ccccc1C(Cc2ccccc2)N3
OC(=O)Cc2csc(NC(=O)c1ccccc1)n2	ZINC000000040563	O=C(Nc1nccs1)c2ccccc2
COc2nc(C)c(CC(=O)N(CCN(C)C)C1CCN(C)CC1)c(OC)n2	ZINC000012238262	O=C(Cc1cncnc1)NC2CCNCC2
CC(C)[C@@](O)(C#CCN1CCCCCC1)c2ccccc2	ZINC000000198373	C2CCCN(CC#CCc1ccccc1)CC2
CCOc2ccc(C(=O)NCc1ccccc1)cc2	ZINC000000029974	O=C(NCc1ccccc1)c2ccccc2
CCN(CC)CC(=O)Nc1ccc(Br)cc1	ZINC000000152107	c1ccccc1
CCN(CC)CC(=O)Nc1cc(Cl)ccc1Cl	ZINC000000152106	c1ccccc1
COc1ccccc1N4CCN(CCCN3C(=O)[C@@H]2CCCCN2C3=O)CC4	ZINC000000641749	O=C2C1CCCCN1C(=O)N2CCCN4CCN(c3ccccc3)CC4
CC(C)(O)[C@@]2(C)NCCc1ccccc12	ZINC000000090894	C2Cc1ccccc1CN2
CCc3nsc([C@H]1CN2CCC1CC2)n3	ZINC000000004100	C1CN3CCC1C(c2ncns2)C3
Cc1ccccc1c3coc2cc(OCC(O)=O)cc(Cl)c2c3=O	ZINC000000003800	O=c2c(c1ccccc1)coc3ccccc23
CC(=O)O[C@@H]2CCN[C@@H]1CCCC[C@H]12	ZINC000000127745	C2CCC1NCCCC1C2
C[N@]1[C@H]3CC[C@@H]1CC(OC(=O)CCN2CCCC2)C3	ZINC000000198755	O=C(CCN1CCCC1)OC2CC3CCC(C2)N3
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
Cc2ccc1[nH]c(CCN)cc1c2	ZINC000000119433	c2ccc1[nH]ccc1c2
CCc1[nH]c(=O)n(C(=O)C(C)C)c1C(=O)c3ccc(n2ccnc2C)cc3	ZINC000000575731	O=C(c2ccc(n1ccnc1)cc2)c3c[nH]c(=O)[nH]3
CC(=O)Nc1nonc1Nc2cc(C)nn2c3ccccc3	ZINC000000042416	N(c1cnon1)c2ccnn2c3ccccc3
OC(C(=O)OCCN1CCCCC1)(c2ccccc2)c3ccccc3	ZINC000000188746	O=C(OCCN1CCCCC1)C(c2ccccc2)c3ccccc3
OC3CCN(Cc2ccc1OCOc1c2)CC3	ZINC000000042082	C3CCN(Cc2ccc1OCOc1c2)CC3
COc2ccc(O)c(Cc1nccn1C)c2	ZINC000000003690	C(c1ccccc1)c2ncc[nH]2
C2CO[C@H](CNCc1ccccn1)C2	ZINC000000299729	C2COC(CNCc1ccccn1)C2
CN(C)CCc2[nH]c1ccc(C)cc1c2CN3CCOCC3	ZINC000000098712	C3CN(Cc1c[nH]c2ccccc12)CCO3
Brc1ccccc1C(=O)NCCc2ccccc2	ZINC000000036025	O=C(NCCc1ccccc1)c2ccccc2
OC[C@@H]4O[C@H](CNC1CCOCC1)[C@H](N3CCN(c2ncccn2)CC3)[C@@H]4O	ZINC000020465090	C4CC(NCC1OCCC1N3CCN(c2ncccn2)CC3)CCO4
N[C@H](CC[C@H](N)C(O)=O)C[C@H]2O[C@H](n1ccc(=O)[nH]c1=O)[C@H](O)[C@@H]2O	ZINC000049018409	O=c2ccn(C1CCCO1)c(=O)[nH]2
Cc3ccc(n2[nH]c(=O)\c(=C/c1ccccc1)c2=O)cc3	ZINC000000059958	O=c2[nH]n(c1ccccc1)c(=O)c2=Cc3ccccc3
FC(F)(F)c4cccc(N3CCN(CCn1c(=O)oc2ncccc12)CC3)c4	ZINC000000598231	O=c2oc1ncccc1n2CCN4CCN(c3ccccc3)CC4
CNS(=O)(=O)c2ccc(S(=O)(=O)NCC(=O)N1CCNCC1)cc2C	ZINC000573119900	O=C(CNS(=O)(=O)c1ccccc1)N2CCNCC2
CCOC(=O)C[C@@H](N)c1ccccc1Cl	ZINC000000043551	c1ccccc1
Cc2ccc(C)[n+](CNC(=O)c1ccc(Cl)cc1Cl)c2	ZINC000000035221	O=C(NC[n+]1ccccc1)c2ccccc2
CN(C)CCOC(=O)c1ccccc1	ZINC000000301115	c1ccccc1
OCn2nc(c1ccc(Cl)cc1Cl)oc2=S	ZINC000000032091	S=c2[nH]nc(c1ccccc1)o2
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
C2COCCN(Cc1ccccc1)CCOCCO2	ZINC000000242350	C2COCCN(Cc1ccccc1)CCOCCO2
CN(C)CCNC=c2c(=O)[nH]c(=O)n(CCc1ccccc1)c2=O	ZINC000002304147	C=c2c(=O)[nH]c(=O)n(CCc1ccccc1)c2=O
C[C@@H](N)C3CCC(C(=O)Nc1ccnc2[nH]ccc12)CC3	ZINC000000005718	O=C(Nc1ccnc2[nH]ccc12)C3CCCCC3
NNc2ncnc3c1ccccc1[nH]c23	ZINC000000506586	c1ccc3c(c1)[nH]c2cncnc23
Brc2ccc(CC(=O)NCc1ccccc1)cc2	ZINC000000030701	O=C(Cc1ccccc1)NCc2ccccc2
Cn2c(=O)oc3cc(S(=O)(=O)Nc1ccccc1F)ccc23	ZINC000000035202	O=c3[nH]c2ccc(S(=O)(=O)Nc1ccccc1)cc2o3
CC(C)[C@H](N)C(=O)OC[C@H](CO)OCN1C=N[C@H]2[C@H]1NC(=N)NC2=O	ZINC000252587237	N=C2NC1NC=NC1C(=O)N2
Cc1ccccc1NC(=O)C[N+]34CC[N+](CC(=O)Nc2ccccc2C)(CC3)CC4	ZINC000001768510	O=C(C[N+]23CC[N+](CC(=O)Nc1ccccc1)(CC2)CC3)Nc4ccccc4
C[C@@H]2CN(C1CCNCC1)C[C@@H](C)O2	ZINC000000299478	C2CC(N1CCOCC1)CCN2
CNc1nc(Br)cn2cc(C#N)nc12	ZINC000000005885	c2cn1ccnc1cn2
CN(C)c1cc(C)nc(N)c1C#N	ZINC000000192637	c1ccncc1
C[N+](C)(C)CCNC(=O)c2cc[n+](Cc1ccccc1)c(\C=N\O)c2	ZINC000000307025	C(c1ccccc1)[n+]2ccccc2
C1C[n+]2cccc3cccc(S1)c23	ZINC000000078731	C1C[n+]2cccc3cccc(S1)c23
CC[C@H]1C[N@]2CC[C@@H]1C[C@@H]2[C@H](O)c3ccnc4ccc(OC)cc34	ZINC000000156023	C1CN2CCC1CC2Cc3ccnc4ccccc34
CN(C)Cc1ccccc1c2cncnc2Nc3ccncc3	ZINC000004239215	N(c1ccncc1)c2ncncc2c3ccccc3
C[N@@](CCOC(=O)c1cccs1)Cc2ccccc2	ZINC000000174336	O=C(OCCNCc1ccccc1)c2cccs2
CCc1nn(CCN)c3c1ccc2occc23	ZINC000000017687	c3cc2c(ccc1cn[nH]c12)o3
COc2cc(NC(=N)NC(N)=N)c1ncccc1c2	ZINC000005639774	c2ccc1ncccc1c2
CC(C)(CN1CCOCC1)C(=O)N[C@@H]3CC[N@@](CCN2CCOCC2)C3	ZINC000635573677	O=C(CCN1CCOCC1)NC3CCN(CCN2CCOCC2)C3
C1CCc2c(C1)ncnc2NCCN4CCN(c3ccccc3)CC4	ZINC000000023124	C1CCc2c(C1)ncnc2NCCN4CCN(c3ccccc3)CC4
CC(=O)Nc2ccc(O[C@H]1O[C@@H](C(O)=O)[C@H](O)[C@@H](O)[C@@H]1O)cc2	ZINC000002243479	C2CCC(Oc1ccccc1)OC2
O=C(Cn2ccc(=NCc1ccccc1)cc2)c3cccc(N(=O)=O)c3	ZINC000000281356	O=C(Cn2ccc(=NCc1ccccc1)cc2)c3ccccc3
Brc3ccc(OC(=O)N1CCN2CCC1CC2)cc3	ZINC000000008849	O=C(Oc1ccccc1)N2CCN3CCC2CC3
O=c1ccc(=O)n1C3CCN(Cc2ccccc2)CC3	ZINC000000069744	O=c1ccc(=O)n1C3CCN(Cc2ccccc2)CC3
Nc2c([n+]1ccccc1)c(=O)[nH]c3ccccc23	ZINC000000408357	O=c2[nH]c1ccccc1cc2[n+]3ccccc3
O=C(N2CCN(C1CCCC1)CC2)c3cccnc3	ZINC000000239811	O=C(N2CCN(C1CCCC1)CC2)c3cccnc3
CCn3cc(C(=O)N[C@H]2[C@@H]1SCC(C)=C(C(O)=O)N1C2=O)c(C)n3	ZINC000002782908	O=C(NC2C1SCC=CN1C2=O)c3cn[nH]c3
Cc1ccccc1CN3CCN(C(=O)[C@@H]2CCCN2)CC3	ZINC000019687897	O=C(C1CCCN1)N3CCN(Cc2ccccc2)CC3
CN(C)Cc1cc(C(C)=O)n2ccccc12	ZINC000000179973	c2ccn1cccc1c2
Cc1cccc(C)c1OC[C@@H](O)CN3CCN(c2ccccn2)CC3	ZINC000000448306	C(COc1ccccc1)CN3CCN(c2ccccn2)CC3
COC(=O)NC(=S)N1CCN(C)CC1	ZINC000000388900	C1CNCCN1
COC(=O)C1=C(C)NC(=O)C[C@@H]1c2ccc(C)c(N(=O)=O)c2	ZINC000000082041	O=C2CC(c1ccccc1)C=CN2
CS(=O)(=O)N2CCN(S(=O)(=O)N[C@@H]1CCC[N@@](CCCO)C1)CC2	ZINC000516194676	O=S(=O)(NC1CCCNC1)N2CCNCC2
CC(C)N(C(C)C)C(=O)Cn1ccc(=N)c2ccccc12	ZINC000000226174	N=c1cc[nH]c2ccccc12
CN(C)CCNC(=O)c3ccc2nc1ccccc1c(N)c2c3	ZINC000005957827	c3ccc2nc1ccccc1cc2c3
CC2(C)C(c1ccccc1)[N+](=O)C(C)(C)N2O	ZINC000000120643	O=[N+]1CNCC1c2ccccc2
CCN2CCN(C[C@@H](C)CNC(=O)[C@H]1CN(CCN(C)C)C(=O)C1)CC2	ZINC000607049941	O=C2CC(C(=O)NCCCN1CCNCC1)CN2
COC(=O)CN(CCN1CCN(C)CC1)C(=O)C2=C[C@@H](O)[C@@H](O)[C@H](O)C2	ZINC000597613284	O=C(NCCN1CCNCC1)C2=CCCCC2
CSc3cccc(NC2CCN(CCc1ccccc1)CC2)c3	ZINC000000227684	C2CN(CCc1ccccc1)CCC2Nc3ccccc3
COc1cc(N)c(Cl)cc1C(=O)OCCN2CCCCC2	ZINC000000006097	O=C(OCCN1CCCCC1)c2ccccc2
CO[C@@H]([C@H](O)CO)[C@@H]1OC(C(O)=O)=C[C@H](NC(N)=N)[C@H]1NC(C)=O	ZINC000077301746	C1COC=CC1
CC[C@@H](NC(C)C)[C@@H](O)c1ccc(O)c(O)c1	ZINC000000402981	c1ccccc1
CNc3cc(OC)c(C(=O)N[C@@H]2CC[N@@](Cc1ccccc1)[C@@H]2C)cc3Cl	ZINC000000538069	O=C(NC2CCN(Cc1ccccc1)C2)c3ccccc3
COc2cc4CC[N+](C)(C)[C@H]3Cc1cccc(OC)c1c(c2O)c34	ZINC000000174794	C2Cc3cccc4c1ccccc1CC(N2)c34
COC(=O)c1c(C)[nH]c(C)c1C(=O)c2ccccc2Cc3ccccc3	ZINC000000005085	O=C(c1cc[nH]c1)c2ccccc2Cc3ccccc3
CCN(CC)CCn2c(=O)n(C)c1[nH]cnc1c2=O	ZINC000000485774	O=c2[nH]c(=O)c1nc[nH]c1[nH]2
COC(=O)/C=C/C(=O)NC[C@@H](NC(=O)[C@@H](N)CCCCN)C(O)=O	ZINC000006482124	nonring
COC(=O)CCC(=O)Nc1nccs1	ZINC000000027608	c1cscn1
COc3ccc(CCNC(=O)C(=C(O)c1ccccc1)n2cc(Cl)ccc2=O)cc3OC	ZINC000000819457	O=C(NCCc1ccccc1)C(=Cc2ccccc2)n3ccccc3=O
Cc3noc([C@H]1C[C@H]2CC[C@@H]1N2)n3	ZINC000000023545	C1CC2NC1CC2c3ncno3
C[C@H](N1CCN(S(C)(=O)=O)CC1)C(=O)N[C@@H]2CCS(=O)(=O)C2	ZINC000014121134	O=C(CN1CCNCC1)NC2CCS(=O)(=O)C2
COc4cc3C[C@H](CC2CCN(Cc1ccccc1)CC2)C(=O)c3cc4OC	ZINC000000597013	O=C3C(CC2CCN(Cc1ccccc1)CC2)Cc4ccccc34
Cc2cnc(NC(=O)c1ccccc1C(O)=O)c(Br)c2	ZINC000000146444	O=C(Nc1ccccn1)c2ccccc2
C[C@@H]1CC[C@H]2[C@]14CC[C@@]3(C)O[C@]2(C)[C@@H](NCCCC[N@@](C)CCCN(C)C)[C@H]3C4	ZINC000003806412	C2CC1C4CC3CC1(C2)CCC3O4
CN(C)CCOC(=O)c2c(C)nn3c1ccccc1n(C)c23	ZINC000000090524	c1ccc3c(c1)[nH]c2ccnn23
CC(=O)C(=O)N(CCN1CCCCC1)C[C@@H]3CCC[N@](C2CCCC2)C3	ZINC000012315510	C3CCN(CCNCC2CCCN(C1CCCC1)C2)CC3
O=C(NC2CCN(C1CC1)CC2)N4CCC(CN3CCOCC3)CC4	ZINC000045410049	O=C(NC2CCN(C1CC1)CC2)N4CCC(CN3CCOCC3)CC4
Cc3ccc(CN2CCN(c1ccccc1F)CC2)cc3	ZINC000000207506	C2CN(c1ccccc1)CCN2Cc3ccccc3
CN1CCC[C@@H]1CC(=O)C[C@@H]2CCC[N@]2C	ZINC000000968237	O=C(CC1CCCN1)CC2CCCN2
CCN(CC)CCOc2nnc(c1ccccc1)c3ccccc23	ZINC000000274093	c3ccc(c1nncc2ccccc12)cc3
Cc1cc(CN)c(C(F)(F)F)o1	ZINC000000158512	c1ccoc1
C[C@@H](CCN(C)C)NC(=O)C(=O)NCCC[N@]1CCC[C@@H](C(N)=O)C1	ZINC000557258009	C1CCNCC1
CC(C)NC[C@@H](O)COc1ccccc1C2CC2	ZINC000000000659	C1CC1c2ccccc2
CCN3CCC([N@]2CCCN(C(=O)[C@@H]1CC(=O)NC(=O)N1)CC2)CC3	ZINC000616381007	O=C3CC(C(=O)N2CCCN(C1CCNCC1)CC2)NC(=O)N3
Cc2[nH]c1nc(=O)sc1cc2c3ccncc3	ZINC000000018359	O=c3nc2[nH]cc(c1ccncc1)cc2s3
CCN2CCC(NCCCN1CCOCC1)CC2	ZINC000002498885	C(CNC1CCNCC1)CN2CCOCC2
O=C(CSC1=NCCN1)[C@H]3COc2ccccc2O3	ZINC000000226316	O=C(CSC1=NCCN1)C3COc2ccccc2O3
Cc2ccc(NC1=NC(C)(C)NC(=N)N1)cc2	ZINC000003886785	N=C2NCN=C(Nc1ccccc1)N2
COc1cc(CCN)c(N(=O)=O)cc1OC	ZINC000000138203	c1ccccc1
COC(=O)C2(c1ccccc1Cl)CCNCC2	ZINC000000022417	C2CC(c1ccccc1)CCN2
N=C3N1CCCCC[C@H]1Nc4sc2CCCCc2c34	ZINC000000280793	N=C3N1CCCCCC1Nc4sc2CCCCc2c34
N=C2N[C@@H](Cc1ccsc1)CS2	ZINC000000027426	N=C2NC(Cc1ccsc1)CS2
CS(=O)(=O)NC2CCN(Cc1ccccc1)CC2	ZINC000000029517	C2CCN(Cc1ccccc1)CC2
CCCn2oc1CCNCCc1c2=O	ZINC000000004370	O=c2[nH]oc1CCNCCc12
CN(C)CCCn3cnc2c(C#N)c(C)n(c1ccccc1)c2c3=O	ZINC000000535294	O=c2[nH]cnc3ccn(c1ccccc1)c23
C[C@@H]1SC(=N)N[C@H]1Cc2ccncc2	ZINC000000027428	N=C2NC(Cc1ccncc1)CS2
CCOC[C@@H](O)CN2CCN(C(=O)NCCCN1C(=O)CNC1=O)CC2	ZINC000605973475	O=C1CNC(=O)N1CCCNC(=O)N2CCNCC2
COc3cc(c2nc1ccccn1c2N)ccc3O	ZINC000000058459	c3ccc(c2cn1ccccc1n2)cc3
C[C@@H](CN)CNC(=O)C(=O)NC[C@H](N1CCN(C)CC1)c2cccs2	ZINC000569949356	C2CN(Cc1cccs1)CCN2
Cc3cc(C)n2nc(S(=O)(=O)Nc1ccccc1Cl)nc2n3	ZINC000000085801	O=S(=O)(Nc1ccccc1)c3nc2ncccn2n3
NS(=O)(=O)c2ccc(NC(=S)NC(=O)C1CC1)cc2	ZINC000000503084	O=C(NC(=S)Nc1ccccc1)C2CC2
NC(=O)C4CCN(C3(n1nnc2ccccc12)CCCCC3)CC4	ZINC000000053066	C4CCN(C3(n1nnc2ccccc12)CCCCC3)CC4
CN3CCN(c1c(N)c(=O)oc2ccccc12)CC3	ZINC000000190898	O=c3cc(N1CCNCC1)c2ccccc2o3
Cc3ccc(C2(O)CCN(CCNC(=O)CN1CCCCCC1)CC2)cc3	ZINC000012291106	O=C(CN1CCCCCC1)NCCN3CCC(c2ccccc2)CC3
Nc4cccc(n2c(=O)n(Cc1ccccc1)c(=O)c3nc[nH]c23)c4	ZINC000000170907	O=c3n(Cc1ccccc1)c(=O)c2nc[nH]c2n3c4ccccc4
CCN(CC)C[C@@H](O)CNC1=NS(=O)(=O)c2ccccc12	ZINC000000068169	O=S2(=O)N=Cc1ccccc12
CC1(C)CC(O)CC(C)(C)N1O	ZINC000000005575	C1CCNCC1
FC(F)C(F)(F)COC(=O)[C@@H]1CC=CC[C@H]1C(=O)NC2CC2	ZINC000000068765	O=C(NC1CC1)C2CCC=CC2
CNC(=O)C(=O)N2CCN(S(=O)(=O)c1ccc(S(N)(=O)=O)cc1)CC2	ZINC000559954132	O=S(=O)(N1CCNCC1)c2ccccc2
CCOC(=O)c1c(C)n(C)c2ccc(O)cc12	ZINC000000001652	c2ccc1[nH]ccc1c2
O[C@H](COc1ccccc1CC=C)CN2CCCCC2	ZINC000000075554	C2CCN(CCCOc1ccccc1)CC2
Cc1ccoc1C(=O)N2CCNCC2	ZINC000000105610	O=C(N1CCNCC1)c2ccco2
CN2CCN=C(c1ccccc1)c3cc(Cl)ccc23	ZINC000000001659	C3CN=C(c1ccccc1)c2ccccc2N3
C2CN(Cc1ccccc1)CCC2N=Nc4ccc3nncn3n4	ZINC000000550011	C2CN(Cc1ccccc1)CCC2N=Nc4ccc3nncn3n4
CN2CCN(c1ccc(C(F)(F)F)cc1NC(C)=O)CC2	ZINC000000075437	C2CN(c1ccccc1)CCN2
COc2ccc(C1C(C#N)(C#N)C1(C#N)C#N)cc2	ZINC000000137883	C1CC1c2ccccc2
C1C[N+]3(CCN1)CC[N+]2(CCNCC2)CC3	ZINC000000254821	C1C[N+]3(CCN1)CC[N+]2(CCNCC2)CC3
O=C(NC1CCCCC1)NS(=O)(=O)c3ncn(Cc2ccccc2)n3	ZINC000001065043	O=C(NC1CCCCC1)NS(=O)(=O)c3ncn(Cc2ccccc2)n3
CCN(CC)C[C@@H](O)c1cccn1c2ccc(CN)cc2	ZINC000004054753	c2ccc(n1cccc1)cc2
CS(=O)(=O)N2CCN(S(=O)(=O)NC[C@@H]1CC[C@@H](C(N)=O)O1)CC2	ZINC000470614954	O=S(=O)(NCC1CCCO1)N2CCNCC2
C[C@@H]1OCC[C@@H]1NC(=O)C(=O)N3CC(S(=O)(=O)N2CCNCC2)C3	ZINC000642698712	O=C(NC1CCOC1)C(=O)N3CC(S(=O)(=O)N2CCNCC2)C3
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
Cn2cc(S(=O)(=O)N1CC(NS(C)(=O)=O)C1)c(=O)n(C)c2=O	ZINC000625432742	O=c2[nH]cc(S(=O)(=O)N1CCC1)c(=O)[nH]2
Nc2sc1CCCCc1c2C(=O)NCCc3ccccc3	ZINC000000036793	O=C(NCCc1ccccc1)c3csc2CCCCc23
NC(=O)CSc1nnnn1C[C@@H](CC(O)=O)c2ccccc2	ZINC000000537202	C(Cn1cnnn1)c2ccccc2
NS(=O)(=O)c3ccc(NC(=S)N2CCN(c1ccccc1)CC2)cc3	ZINC000000651634	S=C(Nc1ccccc1)N3CCN(c2ccccc2)CC3
Cc2c(C#N)c1ccccc1n2CC(=O)NCc3ccco3	ZINC000000029031	O=C(Cn1ccc2ccccc12)NCc3ccco3
CC(C)[N+]1(C)CC[C@H](O)N1C=O	ZINC000000024324	C1CNNC1
CS(=O)(=O)N2CCN(C1CCCCCC1)CC2	ZINC000000300586	C2CCCC(N1CCNCC1)CC2
Cn3c1CCCc1c(=N)c2CCCc23	ZINC000000484731	N=c3c1CCCc1[nH]c2CCCc23
Nc3cc(N)nc(SCc2ccc(C(=O)N1CCOCC1)cc2)n3	ZINC000000115798	O=C(N1CCOCC1)c3ccc(CSc2ncccn2)cc3
O=C(CN1CCCC1=O)NCC23CCCN2CCC3	ZINC000000005883	O=C(CN1CCCC1=O)NCC23CCCN2CCC3
Brc2ccc(C(=O)CN1CCCC1=N)cc2	ZINC000000245493	N=C1CCCN1CC(=O)c2ccccc2
COc2ccc(CN1CCN(C(=O)CN)CC1)c(OC)c2OC	ZINC000000008460	C2CN(Cc1ccccc1)CCN2
O=C(NCc1nc[nH]n1)[C@@]24CNC[C@@H]2C[N@@](Cc3ccccc3)C4	ZINC000065454954	O=C(NCc1nc[nH]n1)C24CNCC2CN(Cc3ccccc3)C4
CCN(CC)CCOc2ccc1nc(N(C)C)sc1c2	ZINC000000001271	c2ccc1scnc1c2
CC(C)NC[C@@H](O)Cn2c1ccc(Cl)cc1c3cc(Cl)ccc23	ZINC000000759144	c1ccc3c(c1)[nH]c2ccccc23
OCCN(CCO)Cc1ccc(Br)cc1	ZINC000000280229	c1ccccc1
COc1ccc(N(=O)=O)cc1NC(=O)CCN2CCC(C)CC2	ZINC000000176384	O=C(CCN1CCCCC1)Nc2ccccc2
CCC[C@@H](C)NCc1ccc(Cl)cc1	ZINC000000013372	c1ccccc1
Brc1ccccc1\C=c3\sc2nc(=O)cnn2c3=O	ZINC000000055701	O=c3cnn2c(=O)c(=Cc1ccccc1)sc2n3
CCOC(=O)C1=C(O)CCNC1	ZINC000000156544	C1CC=CCN1
CCN3CCN(c1ncnc2ccc(Br)cc12)CC3	ZINC000000122268	C3CN(c1ncnc2ccccc12)CCN3
CCN(CC)C[C@H]2COc1ccccc1O2	ZINC000000000674	C2COc1ccccc1O2
C[C@@H](Cc2ccc1OCOc1c2)NC[C@H](O)c3ccc(O)c(O)c3	ZINC000000000677	C(Cc1ccccc1)NCCc3ccc2OCOc2c3
CN3CCCN(CC(=O)N2CC[N@@](CC1CC1)[C@H](CCO)C2)CC3	ZINC000065508346	O=C(CN1CCCNCC1)N3CCN(CC2CC2)CC3
CN(C)CCNC(=O)c1c(C)onc1c2ccccc2	ZINC000000155132	c2ccc(c1ccon1)cc2
CN([C@@H]2CC[C@](O)(Cn1ccc(=O)[nH]c1=O)[C@@H](O)C2)C(=O)CC[C@H](N)C(N)=O	ZINC000257278444	O=c2ccn(CC1CCCCC1)c(=O)[nH]2
CC2(C)CC(C[C@@]1(C)CC(C)(C)NC(=S)N1)=NC(=S)N2	ZINC000000051010	S=C2NCCC(CC1=NC(=S)NCC1)N2
C[C@@H](Cc1ccccc1)[n+]2[nH]oc(=N)c2CN3CCCCC3	ZINC000008239823	N=c2o[nH][n+](CCc1ccccc1)c2CN3CCCCC3
CCOc2ccc(Cn1ccnc1)cc2N(=O)=O	ZINC000000122006	C(c1ccccc1)n2ccnc2
CCN(CC)S(=O)(=O)c2cccc(C(=O)Nc1nccs1)c2	ZINC000000050605	O=C(Nc1nccs1)c2ccccc2
CN(C)CCNC(=S)Nc1ccccc1F	ZINC000000315968	c1ccccc1
Clc1ccccc1/C=C/C=c3\c(=O)[nH]n(c2ccccc2)c3=O	ZINC000000050606	O=c2[nH]n(c1ccccc1)c(=O)c2=CC=Cc3ccccc3
CCN2C(=O)C[C@H](NCc1ccc(S(N)(=O)=O)cc1)C2=O	ZINC000000534899	O=C2CC(NCc1ccccc1)C(=O)N2
C3CN=C(CN(Cc1ccccc1)c2ccccc2)N3	ZINC000000057204	C3CN=C(CN(Cc1ccccc1)c2ccccc2)N3
OC4(c1ccc(Cl)cc1)CCN(Cn2nnc3ccccc23)CC4	ZINC000000118451	C3CN(Cn1nnc2ccccc12)CCC3c4ccccc4
CN5CCN(CCC(=O)Nc4ccc3[nH]c2ccc(NC(=O)CCN1CCN(C)CC1)cc2c(=O)c3c4)CC5	ZINC000028375761	O=C(CCN1CCNCC1)Nc5ccc4[nH]c3ccc(NC(=O)CCN2CCNCC2)cc3c(=O)c4c5
Cc2noc(COc1ccccc1OC[C@@H](O)CNC(C)(C)C)n2	ZINC000000535920	C(Oc1ccccc1)c2ncno2
CC(=O)NCCNC(=O)N2CCN(S(=O)(=O)N1CCOCC1)CC2	ZINC000043140809	O=S(=O)(N1CCNCC1)N2CCOCC2
C[C@@H](COc1ccccc1)N[C@@H](CO)[C@H](O)c2ccccc2	ZINC000000004753	C(COc1ccccc1)NCCc2ccccc2
CO[C@@H](C)[C@@H](NC(=O)[C@@H]1CCC[N@@]1C)[C@H]2O[C@@H](SC)[C@@H](O)[C@@H](O)[C@H]2O	ZINC000006030217	O=C(NCC1CCCCO1)C2CCCN2
C[C@@H](O)c3cccc2Oc1ccccc1S(=O)(=O)c23	ZINC000000016262	O=S3(=O)c1ccccc1Oc2ccccc23
CN5CCN(C(=O)c4ccc3[nH]c(c2cc1ccccc1[nH]c2=O)cc3c4)CC5	ZINC000000591199	O=C(N1CCNCC1)c5ccc4[nH]c(c3cc2ccccc2[nH]c3=O)cc4c5
CS(=O)(=O)c3ccc(C2=C(c1cccnc1)C(=O)CC2)cc3	ZINC000000007002	O=C2CCC(c1ccccc1)=C2c3cccnc3
CC1CCN(C[C@@H](O)CNC(=O)C(=O)NC[C@@H](C)S(N)(=O)=O)CC1	ZINC000557905772	C1CCNCC1
O=S(=O)(Nc2ccc1OCCOc1c2)c3ccccc3C#N	ZINC000000074854	O=S(=O)(Nc2ccc1OCCOc1c2)c3ccccc3
C[N@]1[C@H]3CC[C@@H]1CC(OC(=O)[C@H](CO)c2ccccc2)C3	ZINC000000000056	O=C(Cc1ccccc1)OC2CC3CCC(C2)N3
COCCn2cc(S(=O)(=O)NC1CN(S(=O)(=O)N(C)C)C1)cn2	ZINC000625625523	O=S(=O)(NC1CNC1)c2cn[nH]c2
CSC1=NCCN1Cc2ccccc2	ZINC000000144683	C2CN(Cc1ccccc1)C=N2
C[N@]3CCc2[nH]c1cc(C)ccc1c2C3	ZINC000000055147	C3Cc2[nH]c1ccccc1c2CN3
CCn2cc(C(O)=O)c(=O)c3cnc(N1CCCC1)nc23	ZINC000000057461	O=c2cc[nH]c3nc(N1CCCC1)ncc23
CN(C)CCNC(=O)C2CCN(Cc1cccc(C)c1)CC2	ZINC000004499455	C2CCN(Cc1ccccc1)CC2
OC(C(=O)NCc1ccncc1)(c2ccccc2)c3ccccc3	ZINC000000052934	O=C(NCc1ccncc1)C(c2ccccc2)c3ccccc3
CC[N@]1CCC[C@@H]1CN(CC2CCN(CCOC)CC2)C(=O)\C=C\c3ccco3	ZINC000011816461	O=C(C=Cc1ccco1)N(CC2CCNCC2)CC3CCCN3
CC(C)c3c(C[N@@](C)[C@@H](C)Cc1ccccc1)n(C)n(c2ccccc2)c3=O	ZINC000000643070	O=c2cc(CNCCc1ccccc1)[nH]n2c3ccccc3
COc1ccccc1N3CCN(/N=C/c2sccc2C)CC3	ZINC000000046708	C2CN(c1ccccc1)CCN2N=Cc3cccs3
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
CC(C)[N+](C)(C)C[C@@H](O)COc1cccc2ccccc12	ZINC000000000653	c2ccc1ccccc1c2
O[C@H](CNC1CCCCC1)Cn3cnc2ccccc2c3=O	ZINC000000406602	O=c2n(CCCNC1CCCCC1)cnc3ccccc23
COCc2cc(C)nc3sc1c(=O)oc(C)nc1c23	ZINC000000058675	O=c2ocnc3c1cccnc1sc23
CN(C)S(=O)(=O)N2CC(NC(=O)[C@H]1CCCN1C(=O)CNC(C)=O)C2	ZINC000629542695	O=C(NC1CNC1)C2CCCN2
NC(=O)COc1ccc(Cl)cc1S(=O)(=O)NCC(=O)N2CCNCC2	ZINC000576635841	O=C(CNS(=O)(=O)c1ccccc1)N2CCNCC2
Cc2ccc(NCc1cc(Br)ccc1O)nc2	ZINC000000031566	C(Nc1ccccn1)c2ccccc2
CC3CCN(CC(=O)NCCCN2CCN(c1ncccn1)CC2)CC3	ZINC000051209562	O=C(CN1CCCCC1)NCCCN3CCN(c2ncccn2)CC3
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
CCN(C(C)=O)c2ccc(Oc1nc(OC)cc(OC)n1)cc2	ZINC000000042875	O(c1ccccc1)c2ncccn2
Cn3[nH]c2nn(c1ccc(Br)cc1)[nH]c2c3N	ZINC000000031868	c3ccc(n2nc1[nH][nH]cc1[nH]2)cc3
Nc2nc(c1ccc(Cl)cc1Cl)cn2N	ZINC000000255080	c2ccc(c1c[nH]cn1)cc2
CCN(CC)c1ccc(C=C(C#N)C#N)cc1	ZINC000000028397	c1ccccc1
C[C@H](N2CCN(S(=O)(=O)N1CCCC1)CC2)C(=O)NC(N)=O	ZINC000032777709	O=S(=O)(N1CCCC1)N2CCNCC2
Oc2nc(N1CCOCC1)sc2CC(=O)Nc3cccc(N(=O)=O)c3	ZINC000002646348	O=C(Cc2cnc(N1CCOCC1)s2)Nc3ccccc3
CC(=O)Nc3ccc2n(CCO)c1ccccc1[n+]2c3	ZINC000000387484	c1ccc3c(c1)[nH]c2cccc[n+]23
Fc1ccccc1CCNC[C@@H]2CCCNC2	ZINC000006222365	C2CNCC(CNCCc1ccccc1)C2
NNc2nc(N)nc(C1CC1)n2	ZINC000000163124	C1CC1c2ncncn2
Cc1cc(F)ccc1S(=O)(=O)Nc2ccc(O)c3ccccc23	ZINC000000081763	O=S(=O)(Nc1cccc2ccccc12)c3ccccc3
CCOc3ccc(N2C(=O)C[C@H](NCc1cccnc1)C2=O)cc3	ZINC000000062422	O=C2CC(NCc1cccnc1)C(=O)N2c3ccccc3
CC(C)c3ccc(O)c(CN2CCN(c1ccccc1)CC2)c3	ZINC000000333367	C2CN(c1ccccc1)CCN2Cc3ccccc3
COc2cc1nc(C)[nH]c1cc2OC	ZINC000000246411	c2ccc1[nH]cnc1c2
Clc1ccc(N(=O)=O)cc1C(=O)N2CCNC2=O	ZINC000000037041	O=C1NCCN1C(=O)c2ccccc2
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
Nc2ccc1cc(S(=O)(=O)CCOS(O)(=O)=O)ccc1c2	ZINC000002540001	c2ccc1ccccc1c2
CCOC(=O)N4CCC(NC2c1ccccc1c3ccccc23)CC4	ZINC000000217711	C4CC(NC2c1ccccc1c3ccccc23)CCN4
O=C(CSC2=N[C@@H]1CCCC[C@@H]1N2)N3CCOCC3	ZINC000000314043	O=C(CSC2=NC1CCCCC1N2)N3CCOCC3
COC(=O)C3=C(C)NC(C)=C(C(=O)OCc2ccc(CN1CCCCC1)o2)[C@H]3c4ccccc4F	ZINC000000587097	O=C(OCc2ccc(CN1CCCCC1)o2)C3=CNC=CC3c4ccccc4
CC[C@H](N1CCC(C(N)=O)CC1)c2nnnn2C3CCCC3	ZINC000000413524	C3CCN(Cc1nnnn1C2CCCC2)CC3
CCOC(=O)c3sc2ncnc(N1CCN(C)CC1)c2c3C	ZINC000000148041	C3CN(c1ncnc2sccc12)CCN3
CC(=O)Nc2ccc(OCC[n+]1cccc(C(N)=O)c1)cc2	ZINC000000297622	C(C[n+]1ccccc1)Oc2ccccc2
O=N(=O)c2cccc3c(=O)n(CCOc1ccccc1)c(=O)c23	ZINC000000033253	O=c2n(CCOc1ccccc1)c(=O)c3ccccc23
CCc1nc(N)nc(N)c1c2ccc(Cl)cc2	ZINC000000057464	c2ccc(c1cncnc1)cc2
Oc1ccc(Cl)cc1NC(=O)COc2ccccc2O	ZINC000000003014	O=C(COc1ccccc1)Nc2ccccc2
Cc1ccccc1OCC(=O)Nn2nnnc2Nc3ccccc3	ZINC000000027937	O=C(COc1ccccc1)Nn2nnnc2Nc3ccccc3
Cc2ccc(C(=O)C1CCNCC1)cc2	ZINC000000110326	O=C(C1CCNCC1)c2ccccc2
CCOC(=O)N2CCC(O)(C[N@]1CCN(S(C)(=O)=O)C[C@@H](C(=O)NC)C1)CC2	ZINC000585285117	C2CNCCN(CC1CCNCC1)C2
COCCNC(=O)CN2CCN(C(=O)C(=O)N1CCNC(=O)[C@@H]1C)CC2	ZINC000298740457	O=C2CN(C(=O)C(=O)N1CCNCC1)CCN2
CN2CCC(NCc1ccco1)CC2	ZINC000000268581	C2CC(NCc1ccco1)CCN2
CCN(CC)CCn2c1ccccc1n3ccnc23	ZINC000005625413	c1ccc2c(c1)[nH]c3nccn23
CN(C)CCNC(=O)c1cc(C)cc(C)c1	ZINC000000496685	c1ccccc1
NC2=C(C#N)[C@@H](c1ccco1)c3c(O2)n[nH]c3c4ccccn4	ZINC000000036297	O2C=CC(c1ccco1)c3c2n[nH]c3c4ccccn4
CCN(CC)C(=O)[C@@H]2CCC[N@@](Cc1cccnc1)C2	ZINC000000199348	C2CCN(Cc1cccnc1)CC2
C[N@]2CCC[C@@H](OC(=O)c1ccccc1F)C2	ZINC000000317985	O=C(OC1CCCNC1)c2ccccc2
Cc2cc(N1CCCC1)ccc2\C=N\NC(N)=S	ZINC000000563969	C2CCN(c1ccccc1)C2
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
O=CN2CCC[C@@H]1[C@@H]3CC[C@H]([C@@H]12)[C@@H]4[N@]3CCc5c4[nH]c6ccccc56	ZINC000000519341	C1CNC2C(C1)C3CCC2C4N3CCc5c4[nH]c6ccccc56
N[C@H]([C@@H](O)c1ccccc1)c2ccccc2	ZINC000000120668	C(Cc1ccccc1)c2ccccc2
O=C2NCN(c1ccccc1)C23CCNCC3	ZINC000000156951	O=C2NCN(c1ccccc1)C23CCNCC3
O=S(=O)(Cc1ccccc1)Nn2cnnc2	ZINC000000029867	O=S(=O)(Cc1ccccc1)Nn2cnnc2
Cc3nc(C1CCCCC1)c(c2ccc(S(N)(=O)=O)c(F)c2)o3	ZINC000000006662	C3CCC(c1ncoc1c2ccccc2)CC3
CN(C[C@@H](O)CN2CCN(C[C@@H](O)C[N@@](C)C1CC1)C[C@H](O)C2)C3CC3	ZINC000570367082	C(CNC1CC1)CN3CCCN(CCCNC2CC2)CC3
NS(=O)(=O)c2ccc(c1ccc(C=O)o1)cc2	ZINC000000031319	c2ccc(c1ccco1)cc2
COC(=O)c1ccccc1S(=O)(=O)C2CCNCC2	ZINC000000154174	O=S(=O)(C1CCNCC1)c2ccccc2
Cc2ccc(S(=O)(=O)C1CCNCC1)cc2	ZINC000000154176	O=S(=O)(C1CCNCC1)c2ccccc2
Cc3ccc(NC2=NC(=N)NC1(CCCCC1)N2)c(C)c3	ZINC000000203698	N=C3NC1(CCCCC1)NC(Nc2ccccc2)=N3
CCN(CC)c2nc1c(=O)[nH]c(=O)n(C)c1[nH]2	ZINC000000040186	O=c2[nH]c(=O)c1nc[nH]c1[nH]2
Cc2ccc(NN=c1c(=O)[nH]c(=O)[nH]c1=O)cc2Br	ZINC000004309431	O=c2[nH]c(=O)c(=NNc1ccccc1)c(=O)[nH]2
CN(c2c(C)n(C)n(c1ccccc1)c2=O)S(C)(=O)=O	ZINC000000050864	O=c1cc[nH]n1c2ccccc2
O=C(NCc1cccnc1)C3CCN(CC2CCCCC2)CC3	ZINC000000455490	O=C(NCc1cccnc1)C3CCN(CC2CCCCC2)CC3
C=CC[n+]2ccc(c1cc[n+](CC=C)cc1)cc2	ZINC000000242373	c2cc(c1ccncc1)ccn2
NC(=O)CCNC(=O)C2=C[C@@H](NC(=O)[C@@H]1C[C@@H](O)CN1)[C@@H](O)[C@H](O)C2	ZINC000003838843	O=C(NC1CCCC=C1)C2CCCN2
CN(C)CCN(Cc1cccs1)C(=S)Nc2ccc(C)c(C)c2	ZINC000000212619	S=C(NCc1cccs1)Nc2ccccc2
C[C@H]3Cc2ccc(C(=O)N[C@@H](Cc1ccccc1)C(O)=O)c(O)c2C(=O)O3	ZINC000000643203	O=C(NCCc1ccccc1)c3ccc2CCOC(=O)c2c3
C[N+](C)(C)/C=C/c1ccc(N(=O)=O)o1	ZINC000000162095	c1ccoc1
CC(C)[N@]2CCC[C@@H](C(=O)N1CCCCCC1)C2	ZINC000000212612	O=C(C1CCCNC1)N2CCCCCC2
Fc3ccc(Sc1ccccc1CNC2=NCCN2)cc3	ZINC000000346633	C3CN=C(NCc1ccccc1Sc2ccccc2)N3
CNc3cccc(CCOc2ccc1C[C@H](CC(O)=O)C(=O)N(CC(F)(F)F)Cc1c2)n3	ZINC000000581923	O=C3CCc2ccc(OCCc1ccccn1)cc2CN3
CC(C)C[C@@H](NC(=O)C1=C[C@@H](NC(=O)CCN)[C@@H](O)[C@H](O)C1)C(N)=O	ZINC000003838849	C1CCC=CC1
COc1ccc(Br)cc1CSc2ccccc2C3=NCCCN3	ZINC000000590622	C3CNC(c1ccccc1SCc2ccccc2)=NC3
Clc2cccc3CC[C@]1(COC(=N)N1)Cc23	ZINC000000006263	N=C3NC2(CCc1ccccc1C2)CO3
CN(C)CCNC(=O)c1cccc(Cl)c1	ZINC000000213479	c1ccccc1
CSC1=NC(C)(C)CCC(C)(C)N1	ZINC000000150182	C1CCN=CNC1
CC(C)(C)[N+](=O)Cc1cc(Cl)ccc1O	ZINC000000008621	c1ccccc1
NC(=O)OC[C@@H]2NC(=N)N1C[C@@H](OS(O)(=O)=O)C(O)(O)[C@@]13NC(=N)N[C@@H]23	ZINC000014508322	N=C3NC1CNC(=N)N2CCCC12N3
CN(C)c2ccc(C(=S)N1CCNCC1)cc2	ZINC000000302349	S=C(N1CCNCC1)c2ccccc2
OCCNC(=O)[C@@H]3C[C@H](CN1CCCC1)C[N@@](CCc2ccccc2)C3	ZINC000014540198	C3CCN(CC2CCCN(CCc1ccccc1)C2)C3
CN(C)[C@@H]2C[C@H](CNC(=O)C(=O)NCCS(=O)(=O)N1CCSCC1)C2	ZINC000656311048	O=C(NCCS(=O)(=O)N1CCSCC1)C(=O)NCC2CCC2
CC[N@]3CCC[C@@H](NC(=O)c2scc1CCCCc12)C3	ZINC000000104174	O=C(NC1CCCNC1)c3scc2CCCCc23
NC(=O)[C@@H]1CCC[N@]1CCCNC(=O)N3CCN(C[C@@H]2CCCO2)CC3	ZINC000637376577	O=C(NCCCN1CCCC1)N3CCN(CC2CCCO2)CC3
C[C@H](N(CCN(C)C)C(=S)Nc1cc(C)ccc1C)c2ccco2	ZINC000000263939	S=C(NCc1ccco1)Nc2ccccc2
COc2ccc(C[N@@](C)C1CCN(C)CC1)c(OC)c2	ZINC000003684325	C2CC(NCc1ccccc1)CCN2
CC[N@@](CCO)Cc2cc1cc(Br)ccc1s2	ZINC000000338844	c2ccc1sccc1c2
CN(C)CCNC(=S)Nc1ccc(F)cc1	ZINC000000316122	c1ccccc1
Brc3cncc(N1CCN2CCC1CC2)c3	ZINC000000025861	C1CN3CCC1N(c2cccnc2)CC3
Nc2nc1ccccc1n2CCN3CCOCC3	ZINC000000186858	C3CN(CCn1cnc2ccccc12)CCO3
COc3ccc(CN2CCN(c1ccccc1)CC2)c(OC)c3	ZINC000000293635	C2CN(c1ccccc1)CCN2Cc3ccccc3
CN(C)C(=O)COc3ccc2CC[C@H](NC[C@H](O)c1ccc(O)c(CCO)c1)Cc2c3	ZINC000000584203	C(Cc1ccccc1)NC3CCc2ccccc2C3
NC(=N)N=NC1CCC(N=NC(N)=N)CC1	ZINC000000492520	C1CCCCC1
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
CCOC(=O)c2[nH]c(C)c(CNCc1ccco1)c2C	ZINC000000034369	C(NCc1ccco1)c2cc[nH]c2
NN(CCO)C(=S)NCc1ccc(Cl)cc1	ZINC000000104981	c1ccccc1
O[C@H](CN1CCCCC1)CN(c2ccccc2)c3ccccc3	ZINC000000126997	C3CCN(CCCN(c1ccccc1)c2ccccc2)CC3
COc1ccccc1OCC(=O)N2CCNC2=O	ZINC000000037037	O=C(COc1ccccc1)N2CCNC2=O
C[N@]2CCC[C@@H](OC(=O)COc1ccc(F)cc1)C2	ZINC000000249839	O=C(COc1ccccc1)OC2CCCNC2
CO[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)NC[C@@H](N2CCNCC2)C(F)(F)F	ZINC000659540078	O=C(NCCN1CCNCC1)NC2CCS(=O)(=O)C2
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
CN4CCN(c2ncnc3sc(C)c(c1ccccc1)c23)CC4	ZINC000000038310	C4CN(c2ncnc3scc(c1ccccc1)c23)CCN4
CN(C)CCn2c1ccccc1n3cc(C(C)(C)C)nc23	ZINC000000208041	c1ccc2c(c1)[nH]c3nccn23
CCn2c(=S)[nH]c(=O)\c(=C/c1cccc(OC)c1OC)c2=O	ZINC000000440994	O=c1[nH]c(=S)[nH]c(=O)c1=Cc2ccccc2
N[C@H]2[C@@H](CO)COc3ccc1ccccc1c23	ZINC000000167384	C3COc2ccc1ccccc1c2C3
Cc2ccc(S(=O)(=O)NCCNC(=O)C(=O)NC[C@@H]1COCCN1)s2	ZINC000627328701	O=C(NCCNS(=O)(=O)c1cccs1)C(=O)NCC2COCCN2
CCCN2CCC([N@]1CCC[C@@H]1CO)CC2	ZINC000000757215	C2CCN(C1CCNCC1)C2
COC2(NS(=O)(=O)c1ccc(Cl)cc1)C(C)=CC(=O)C=C2C	ZINC000000052796	O=C2C=CC(NS(=O)(=O)c1ccccc1)C=C2
O=C(NC[C@@H]1CCCO1)C3CCN(C[C@H]2CCC=CC2)CC3	ZINC000000317506	O=C(NCC1CCCO1)C3CCN(CC2CCC=CC2)CC3
S=C(NC1CC1)N4CCC[N@@](Cc2cccc3ccccc23)CC4	ZINC000000066637	S=C(NC1CC1)N4CCCN(Cc2cccc3ccccc23)CC4
O=N(=O)c1ccccc1CN2CCNCC2	ZINC000000239623	C2CN(Cc1ccccc1)CCN2
COC(=O)c1ccccc1NC(=O)c2cc[n+](C)cc2	ZINC000000364621	O=C(Nc1ccccc1)c2ccncc2
CN(N)c3nc(N1CCCC1)nc(N2CCCC2)n3	ZINC000000040832	C3CCN(c2ncnc(N1CCCC1)n2)C3
CCOc2cc(Cc1cnc(N)nc1N)cc(OCC)c2n3cccc3	ZINC000000598590	C(c2ccc(n1cccc1)cc2)c3cncnc3
CCc2cn(Cc1ccccc1)c[n+]2Cc3ccccc3	ZINC000000161623	C(c1ccccc1)n3cc[n+](Cc2ccccc2)c3
CC(=O)N2CCC(NCCc1ccc(F)cc1)CC2	ZINC000000214057	C2CC(NCCc1ccccc1)CCN2
COc3ccc(C(=O)Cc2c(O)c1ccccc1oc2=O)cc3	ZINC000000070280	O=C(Cc2cc1ccccc1oc2=O)c3ccccc3
CS(=O)(=O)c1ccc(CN)cc1	ZINC000000086758	c1ccccc1
Nc3nc2CC[N@](Cc1ccccc1)Cc2s3	ZINC000000269005	C2Cc1ncsc1CN2Cc3ccccc3
Cc1nc[nH]c1CN3CCN(C(=O)CNC(N)=O)[C@H]2CS(=O)(=O)C[C@H]23	ZINC000077459927	O=S3(=O)CC2NCCN(Cc1cnc[nH]1)C2C3
O=N(=O)c3ccc2c(=O)n(CC1CCNCC1)c(=O)c2c3	ZINC000000362563	O=c2n(CC1CCNCC1)c(=O)c3ccccc23
Cc2cc(C)c(n1cccc1CN)c(C)c2	ZINC000000035367	c2ccc(n1cccc1)cc2
CN(CC(=O)N1CCNCC1)C(=O)Cn2cc(Br)c(=O)[nH]c2=O	ZINC000428198490	O=C(Cn1ccc(=O)[nH]c1=O)NCC(=O)N2CCNCC2
CCN2CCN(C(=O)CC1CCN(CCCS(N)(=O)=O)CC1)CC2	ZINC000066568258	O=C(CC1CCNCC1)N2CCNCC2
CCN(CC)CCn2c1ccccc1c3nnc(=NN)[nH]c23	ZINC000000530405	N=c3nnc2c1ccccc1[nH]c2[nH]3
CN(Cc1ccccc1)C(=O)C3CCN(Cc2ccc(C)o2)CC3	ZINC000000299661	O=C(NCc1ccccc1)C3CCN(Cc2ccco2)CC3
NC(=N)c2ccc(OCCCOc1ccc(C(N)=N)cc1Br)c(Br)c2	ZINC000001665651	C(COc1ccccc1)COc2ccccc2
CN(C)[C@@H]1CCCC[C@@H]1NS(=O)(=O)c2ccc(Cl)cc2	ZINC000000545961	O=S(=O)(NC1CCCCC1)c2ccccc2
CCN(Cc1ccccc1)S(=O)(=O)c2ccccc2	ZINC000000029384	O=S(=O)(NCc1ccccc1)c2ccccc2
NCc1ccc(F)c(Br)c1	ZINC000000157219	c1ccccc1
C3CN2C[C@@H](c1ccccc1)N=C2S3	ZINC000000119842	C3CN2CC(c1ccccc1)N=C2S3
CNC(=O)C[C@@]2(O)CCCN(S(=O)(=O)N1CCN(S(C)(=O)=O)CC1)C2	ZINC000643695289	O=S(=O)(N1CCCCC1)N2CCNCC2
OC(=O)COc2ccc(\C=c1/c(=O)[nH]c(=O)n(CC=C)c1=O)cc2	ZINC000002288388	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)[nH]2
C3CO[C@H](CNCc2ccc1OCOc1c2)C3	ZINC000000299714	C3COC(CNCc2ccc1OCOc1c2)C3
C[C@H](N)CN1CCc2ccc(Br)cc12	ZINC000000003233	C2Cc1ccccc1N2
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
CN2CCCc3c(N)c1CCCCc1nc23	ZINC000000227962	C3CCc2nc1NCCCc1cc2C3
Cc3ccc(O)c([C@@H](CC(=O)N1CCNCC1)c2ccccc2)c3	ZINC000000538720	O=C(CC(c1ccccc1)c2ccccc2)N3CCNCC3
CCCCC(=O)NC(=S)NNS(=O)(=O)c1ccccc1	ZINC000002690742	c1ccccc1
CCN(CC)CCn2c(C)nn3c1ccccc1nc23	ZINC000000085349	c1ccc2c(c1)nc3[nH]cnn23
NS(=O)(=O)N2CCN(C(=O)Cn1cc(Br)c(=O)[nH]c1=O)CC2	ZINC000264713393	O=C(Cn1ccc(=O)[nH]c1=O)N2CCNCC2
CCOC(=O)c3cc(c1ccccc1)cc(c2ccccc2)[o+]3	ZINC000000156572	c3ccc(c2cc[o+]c(c1ccccc1)c2)cc3
CCN4CCN(C(=O)C3CCN(C2CCN(C(=O)c1cc(OC)c(OC)c(OC)c1)CC2)CC3)CC4	ZINC000034912391	O=C(C3CCN(C2CCN(C(=O)c1ccccc1)CC2)CC3)N4CCNCC4
Cc3c(O)c(CN1CCCCC1)cc4c(c2ccccc2)cc(=O)oc34	ZINC000000046577	O=c4cc(c1ccccc1)c3cc(CN2CCCCC2)ccc3o4
Cn3c(=O)n(C)c2[nH]c(SCC(=O)NCCCN1CCOCC1)nc2c3=O	ZINC000016363702	O=C(CSc2nc1c(=O)[nH]c(=O)[nH]c1[nH]2)NCCCN3CCOCC3
CCOC(=O)c1ccccc1NC=c2c(=O)[nH]c(=S)n(C)c2=O	ZINC000002827653	O=c1[nH]c(=S)[nH]c(=O)c1=CNc2ccccc2
COC(=O)Nc2nn(c1ccc(OC)cc1)c(=O)c(C#N)c2C	ZINC000001425327	O=c1cccnn1c2ccccc2
CCOC(=O)C1=CCCC[C@H]1S(=O)(=O)Cc2ccc(F)cc2F	ZINC000000026752	O=S(=O)(Cc1ccccc1)C2CCCC=C2
Cc3cccc(N2C(=O)C[C@H](NCc1ccc(S(N)(=O)=O)cc1)C2=O)c3	ZINC000000714256	O=C2CC(NCc1ccccc1)C(=O)N2c3ccccc3
Cc2cccc(NCc1c[n+](C)c(C)cc1N)n2	ZINC000015780489	C(Nc1ccccn1)c2cccnc2
CCCCn2c(N)c(N(C)CC(=O)N1CCNC(=O)C1)c(=O)[nH]c2=O	ZINC000011237183	O=C2CN(C(=O)CNc1c[nH]c(=O)[nH]c1=O)CCN2
CCCC[N@@](C)CCNC(=O)C(=O)N1CCN(CCC(=O)N(C)C)CC1	ZINC000557252775	C1CNCCN1
COC(=O)[C@H]1C[C@H](O)CN1Cc2ccsc2	ZINC000000228978	C2CCN(Cc1ccsc1)C2
Cc1ccc(C)n1CC2CCNCC2	ZINC000000157735	C2CC(Cn1cccc1)CCN2
CN1CCC2(CC1)OC(=O)N(C(C)(C)C)C2=O	ZINC000000011052	O=C2NC(=O)C1(CCNCC1)O2
CCOc3ccc(C(=O)Nc2ccc1c(=O)n(C)c(=O)c1c2)cc3	ZINC000000086598	O=C(Nc2ccc1c(=O)[nH]c(=O)c1c2)c3ccccc3
CC(C)NC[C@H](O)COc1ccccc1CC=C	ZINC000000086599	c1ccccc1
CC(C)N[C@@H](C)Cc1ccc(I)cc1	ZINC000000003834	c1ccccc1
CN4CCC(N1CC[C@@H]3[C@H]1C(=O)NC[C@H](CCC(=O)Nc2ccccc2)[N@]3C)CC4	ZINC000022923142	O=C(CCC3CNC(=O)C1C(CCN1C2CCNCC2)N3)Nc4ccccc4
Cc2cc(=O)oc3cc(O[C@H]1OC[C@H](O)[C@@H](O)[C@@H]1O)ccc23	ZINC000000057398	O=c3ccc2ccc(OC1CCCCO1)cc2o3
COCCNC(=S)N[C@H]1C[C@@H]3[N@@](C1)[C@H](CCC(=O)N2CCOCC2)CNC3=O	ZINC000015708262	O=C(CCC1CNC(=O)C2CCCN12)N3CCOCC3
Fc3ccc(c2ccc(=O)n(CN1CCCCC1)n2)cc3	ZINC000000033934	O=c2ccc(c1ccccc1)nn2CN3CCCCC3
COCCNC(=O)CN2CCN(C(=O)NC1CCN(CCO)CC1)CC2	ZINC000608678264	O=C(NC1CCNCC1)N2CCNCC2
C[N@]1CCC[C@H]1c2cccnc2n4c(C)nc3ccccc3c4=O	ZINC000000519688	O=c3n(c1ncccc1C2CCCN2)cnc4ccccc34
NC(=O)C4(N1CCCCC1)CCN([C@@H]2OC(=O)c3ccccc23)CC4	ZINC000000106585	O=C3OC(N2CCC(N1CCCCC1)CC2)c4ccccc34
NCC2CCC(C(=O)Nc1ccccn1)CC2	ZINC000000012054	O=C(Nc1ccccn1)C2CCCCC2
OC(=O)CNS(=O)(=O)c1ccccc1I	ZINC000000161534	c1ccccc1
CC(C)(C)Nc2nc(NC(C)(C)C)nc(N1CCCCC1)n2	ZINC000000185371	C2CCN(c1ncncn1)CC2
CCOc1ccc(C(F)(F)F)cc1NS(=O)(=O)c3ccc2n(C)c(=O)n(C)c2c3	ZINC000001062804	O=c3[nH]c2ccc(S(=O)(=O)Nc1ccccc1)cc2[nH]3
CN([C@H]2[C@H](N1CCCC1)Cc3ccccc23)C(=O)Cc4cccc(N(=O)=O)c4	ZINC000000538092	O=C(Cc1ccccc1)NC3C(N2CCCC2)Cc4ccccc34
Cc2ccc(N(CC(N)=O)S(=O)(=O)c1ccccc1)c(C)c2	ZINC000000067910	O=S(=O)(Nc1ccccc1)c2ccccc2
CCOC(CN1CCCCC1)OCC	ZINC000000032338	C1CCNCC1
C3Cn1cccc1[C@H](Cc2ccccc2)N3	ZINC000000186715	C3Cn1cccc1C(Cc2ccccc2)N3
CCN(CC)[C@@H]2CC(=O)N(c1cccc(N(=O)=O)c1)C2=O	ZINC000000093274	O=C1CCC(=O)N1c2ccccc2
C[N@]2CC[C@@](O)(c1cccc(Cl)n1)C2	ZINC000000390297	C2CC(c1ccccn1)CN2
OC2CCN(Cc1ccccc1N(=O)=O)CC2	ZINC000000240144	C2CCN(Cc1ccccc1)CC2
Clc3cccc(C(=O)N[C@@H]1CN2CCC1CC2)c3	ZINC000000135705	O=C(NC1CN2CCC1CC2)c3ccccc3
OC3(Cc1cccc(Cl)n1)CCN(Cc2ccccc2)CC3	ZINC000000390292	C2CN(Cc1ccccc1)CCC2Cc3ccccn3
CCCC(=O)N3CCN(c2nc(N)c1cc(OC)c(OC)cc1n2)CC3	ZINC000000638562	C3CN(c2ncc1ccccc1n2)CCN3
CN(C)CCN2CCC(NC(=O)N1CCN(CCN(C)C)C(=O)C1)CC2	ZINC000650627072	O=C2CN(C(=O)NC1CCNCC1)CCN2
Cc3cc(NS(=O)(=O)c2ccc(NC(=S)Nc1ccc(F)cc1F)cc2)no3	ZINC000001044820	O=S(=O)(Nc1ccon1)c3ccc(NC(=S)Nc2ccccc2)cc3
CO[C@@]23C[C@H](COC(=O)c1cncc(Br)c1)C[N@@](C)[C@H]2Cc4cn(C)c5cccc3c45	ZINC000000538071	O=C(OCC2CNC1Cc3c[nH]c4cccc(C1C2)c34)c5cccnc5
C=CCn2c(=N)n(CCN1CCCCC1)c3ccccc23	ZINC000004550115	N=c2[nH]c1ccccc1n2CCN3CCCCC3
Clc3c(N1CCNCC1)cnn(c2ccccc2)c3=O	ZINC000000151447	O=c2cc(N1CCNCC1)cnn2c3ccccc3
Nc2cc(N)nc(SCC(=O)NC1CCCC1)n2	ZINC000000410873	O=C(CSc1ncccn1)NC2CCCC2
COc3ccc(NC(=O)[C@@H](N)Cc1c[nH]c2ccccc12)cc3	ZINC000000329105	O=C(CCc1c[nH]c2ccccc12)Nc3ccccc3
NC3CCC(C(=O)NC2CCN(C1CC1)CC2)CC3	ZINC000037629930	O=C(NC2CCN(C1CC1)CC2)C3CCCCC3
CC(C)[C@@H](CNC(=O)C(=O)N(C)CCCN(C)C)N1CCN(C)CC1	ZINC000559614559	C1CNCCN1
CCN(CC)C(=O)C2CCN(Cc1ccccc1)CC2	ZINC000000299282	C2CCN(Cc1ccccc1)CC2
Cc2ccc(OCC(=O)n1cnnc1N)c(Br)c2	ZINC000000092024	O=C(COc1ccccc1)n2cnnc2
C2CO[C@H](CNCc1ccco1)C2	ZINC000000265972	C2COC(CNCc1ccco1)C2
O=C(CNC(=O)[C@H]2N(C1CC1)C(=O)c3ccccc23)NC4=NCC(=O)N4	ZINC000520123720	O=C(CNC(=O)C2N(C1CC1)C(=O)c3ccccc23)NC4=NCC(=O)N4
CS(=O)(=O)N3CCC(NC[C@]2(O)CN(S(=O)(=O)c1ccccc1)C[C@H]2O)CC3	ZINC000585290841	O=S(=O)(N2CCC(CNC1CCNCC1)C2)c3ccccc3
C=Cc2cccc3cc(CC1=N[S@](=O)ON1)ccc23	ZINC000000012125	O=S3ONC(Cc2ccc1ccccc1c2)=N3
Fc5ccc(N4CCN(C2C1CC3CC(C1)CC2C3)CC4)cc5	ZINC000000182064	C2CN(c1ccccc1)CCN2C4C3CC5CC(C3)CC4C5
FC(F)(F)c3nc(c1nonc1Nc2ccccc2)no3	ZINC000000027639	N(c1ccccc1)c2nonc2c3ncon3
O=C(CNC1CCCCC1)Nc3sc2CCCCc2c3C#N	ZINC000000411672	O=C(CNC1CCCCC1)Nc3cc2CCCCc2s3
C[C@H]3CC(=C)C[C@H](c1ccccc1OC[C@@H](O)CN2CCCCC2)O3	ZINC000000348466	C=C3CCOC(c1ccccc1OCCCN2CCCCC2)C3
CC3(C)CC(NSc2nc1ccccc1s2)CC(C)(C)N3	ZINC000000027633	C3CC(NSc2nc1ccccc1s2)CCN3
CNS(=O)(=O)NCC(=O)Nc1cnn(CC(=O)NCCN(C)C)c1	ZINC000653020141	c1cn[nH]c1
S=C2N(CN1CCCCC1)CCN2CN3CCCCC3	ZINC000000027631	S=C2N(CN1CCCCC1)CCN2CN3CCCCC3
Cn2c(c1ccc[n+](C)c1)nc3ccccc23	ZINC000000050725	c3cncc(c2nc1ccccc1[nH]2)c3
C[C@@H]3CN(C(=O)C(=O)N2CCN(C[C@@H]1CCOC1)CC2)C[C@@H](C(N)=O)O3	ZINC000625566784	O=C(N1CCOCC1)C(=O)N3CCN(CC2CCOC2)CC3
Cc2csc3n(C)c1ccccc1[n+]23	ZINC000000005163	c1ccc2c(c1)[nH]c3scc[n+]23
COc1cc(N)cn[n+]1c2ccccc2	ZINC000000000908	c2ccc([n+]1ccccn1)cc2
O[C@@H](CSc1cccs1)CN2CCCC2	ZINC000000160142	C2CCN(CCCSc1cccs1)C2
NC(=N)c1ccc(C(F)(F)F)cc1	ZINC000000118910	c1ccccc1
Oc2ccc(C=c1[nH]c(=S)[nH]c1=O)cc2Br	ZINC000000016970	O=c1[nH]c(=S)[nH]c1=Cc2ccccc2
Cc2ccc(S(=O)(=O)NCC(=O)Nc1nnc(C)s1)cc2	ZINC000000033114	O=C(CNS(=O)(=O)c1ccccc1)Nc2nncs2
Cc2onc(c1ccccc1)c2C(=O)N3CCNCC3	ZINC000000158506	O=C(N1CCNCC1)c2conc2c3ccccc3
CC(C)(CNC(=O)c1cc(S(N)(=O)=O)ccc1O)[C@@]2(O)CCOC2	ZINC000616481194	O=C(NCCC1CCOC1)c2ccccc2
Cc2onc(c1ccccc1)c2CN	ZINC000000158500	c2ccc(c1ccon1)cc2
COc1cc(C=O)cc(OC)c1OCc2ccc(F)cc2	ZINC000000035114	C(Oc1ccccc1)c2ccccc2
NC2(CO)COC(c1ccncc1)OC2	ZINC000000227782	C2COC(c1ccncc1)OC2
Cc3c(C(=O)Nc2ccc(CN1CCCC1)cc2)cccc3N(=O)=O	ZINC000000514896	O=C(Nc2ccc(CN1CCCC1)cc2)c3ccccc3
CCOC(=O)C2C(c1cccc(OC)c1)C(C(=O)OCC)C(=C)NC2=C	ZINC000000628410	C=C2CC(c1ccccc1)CC(=C)N2
Clc3ccc(C1=C[C@H]2CC[C@@H](C1)N2)cc3Cl	ZINC000000022174	C1CC3NC1CC(c2ccccc2)=C3
Cc2cc[n+](c1c(C=O)sc(=O)n1C)cc2	ZINC000000077765	O=c2[nH]c([n+]1ccccc1)cs2
C[N@]1[C@H]3CC[C@@H]1C=C(c2ccc(Cl)cc2)C3	ZINC000000022173	C1CC3NC1CC(c2ccccc2)=C3
CS(=O)(=O)N2CCC[C@@H](NC(=O)CN1CCS(=O)(=O)CC1)C2	ZINC000139380813	O=C(CN1CCS(=O)(=O)CC1)NC2CCCNC2
CC(C)N2CCN(C(=O)c1ccco1)CC2	ZINC000000115761	O=C(N1CCNCC1)c2ccco2
CC[N@]1CCC[C@@H]1CNC(=O)c2cc(N)ccc2OC	ZINC000000347683	O=C(NCC1CCCN1)c2ccccc2
CCN3C(=O)C[C@H](N2CCC(Cc1ccccc1)CC2)C3=O	ZINC000000053073	O=C3CC(N2CCC(Cc1ccccc1)CC2)C(=O)N3
CCCN2CCC(Nc1cc(OC)cc(OC)c1)CC2	ZINC000000182396	C2CC(Nc1ccccc1)CCN2
C[C@@H](N)Cn1nc(C)c2ccc(O)cc12	ZINC000000009098	c2ccc1[nH]ncc1c2
CSc1nc(C)cc(SC(N)=N)n1	ZINC000000393729	c1cncnc1
Clc4cccc(NC(=O)CSc2nnc(c1cccnc1)n2CCN3CCCCC3)c4	ZINC000000704283	O=C(CSc2nnc(c1cccnc1)n2CCN3CCCCC3)Nc4ccccc4
Nc2nnc(SCC(=O)NCCc1ccccc1)s2	ZINC000000036095	O=C(CSc1nncs1)NCCc2ccccc2
Nc3c2Cc1ccccc1c2nc4ccccc34	ZINC000000022438	C3c1ccccc1c4nc2ccccc2cc34
CC(=O)Nc1ccccc1OC[C@@H](O)CN2CCC(C(N)=O)CC2	ZINC000000147011	C2CCN(CCCOc1ccccc1)CC2
CCN(CC)CCOc1ccc(Br)cc1	ZINC000000182398	c1ccccc1
Clc2cc(Cl)cc(NC(=O)C(=S)N1CCOCC1)c2	ZINC000000049033	O=C(Nc1ccccc1)C(=S)N2CCOCC2
N#Cc2nc(c1ccccc1)oc2N3CCOCC3	ZINC000000071393	C3CN(c2cnc(c1ccccc1)o2)CCO3
COc2cccc(O[C@H](C)CNC(=N)Cc1cccc(C)c1)c2	ZINC000000000846	N=C(Cc1ccccc1)NCCOc2ccccc2
CC(C)(C)C(=O)Nc1cc(NC(=O)C(C)(C)C)cc(C(O)=O)c1	ZINC000000192528	c1ccccc1
Cc1cccc(OC[C@H](O)CNC(C)(C)C)c1C	ZINC000000000844	c1ccccc1
COc6ccc([C@@H]2Oc1ccccc1C5=C2[C@@H](c3cccc(OC)c3)n4[nH]cnc4=N5)cc6	ZINC000000635924	O5C(c1ccccc1)C3=C(N=c2nc[nH]n2C3c4ccccc4)c6ccccc56
CN3CCN(C(=O)CCNC(=O)C(=O)N2CCN1C[C@H](O)C[C@H]1C2)CC3	ZINC000656292193	O=C(CCNC(=O)C(=O)N2CCN1CCCC1C2)N3CCNCC3
CN(C)CCCNC(=O)CO[C@H]1[C@H](O)[C@H](N)C[C@H](N)[C@@H]1OCSc2ccnc3cc(C(F)(F)F)ccc23	ZINC000044005745	C3CCC(OCSc1ccnc2ccccc12)CC3
O=C(NCc2cccc(CNC(=O)c1ccccn1)c2)c3ccccn3	ZINC000000022434	O=C(NCc2cccc(CNC(=O)c1ccccn1)c2)c3ccccn3
CC(C)Nc2nc(NC(C)C)nc(NS(=O)(=O)c1ccc(N)cc1)n2	ZINC000000849571	O=S(=O)(Nc1ncncn1)c2ccccc2
OC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)Cn3nnc2ccccc2c3=O	ZINC000002200816	O=C(Cn2nnc1ccccc1c2=O)NCCc3ccccc3
CN(C)[C@@H]2CCN(Cc1ccccc1)C[C@@H]2CCC(=O)NCCN3CCCCC3	ZINC000012455948	O=C(CCC2CCCN(Cc1ccccc1)C2)NCCN3CCCCC3
COc3cc([C@@H]1NC(=O)NC(C)=C1C(=O)OCc2ccccc2)cc(Br)c3O	ZINC000001189371	O=C3NC=C(C(=O)OCc1ccccc1)C(c2ccccc2)N3
CN4CCC(N(C)c2ncnc3sc1CCCCc1c23)CC4	ZINC000000098649	C1CCc3c(C1)sc4ncnc(NC2CCNCC2)c34
CCS(=O)(=O)c1ccc(F)cc1	ZINC000000001468	c1ccccc1
CN(C)CCN2C(=O)N[C@@](C)(c1ccc(N(=O)=O)cc1)C2=O	ZINC000000181425	O=C2NC(c1ccccc1)C(=O)N2
CCOC(=O)CCn1ccnc1C	ZINC000000170209	c1c[nH]cn1
C[N+]3(CC#Cc2ccc(C#CC[N+]1(C)CCOCC1)cc2)CCOCC3	ZINC000001302536	C3CN(CC#Cc2ccc(C#CCN1CCOCC1)cc2)CCO3
C[C@@H](Cc1c[nH]c2ccccc12)NC(=O)CN	ZINC000000141845	c2ccc1[nH]ccc1c2
CCSc1ccc(C[N+](C)(C)C)s1	ZINC000000048037	c1ccsc1
COc1ccccc1C(=O)N3CCN(C[C@H]2CCC=CC2)CC3	ZINC000000300593	O=C(N2CCN(CC1CCC=CC1)CC2)c3ccccc3
C(C(c1ccccc1)c2ccccc2)c3c[nH]cn3	ZINC000000005987	C(C(c1ccccc1)c2ccccc2)c3c[nH]cn3
CN4CCN(c3cc2n(C1CC1)cc(C(O)=O)c(=O)c2cc3N)CC4	ZINC000000008476	O=c3ccn(C1CC1)c4cc(N2CCNCC2)ccc34
CN([C@@H]2CC[C@]1(CCCO1)C[C@H]2N3CCCC3)C(=O)Cc4cccc5occc45	ZINC000000597356	O=C(Cc1cccc2occc12)NC4CCC3(CCCO3)CC4N5CCCC5
Brc3ccc(OCC(=O)Nc2ccc(CN1CCCCC1)cc2)cc3	ZINC000000724919	O=C(COc1ccccc1)Nc3ccc(CN2CCCCC2)cc3
NC(=O)C2CCN(C/C=C/c1ccccc1)CC2	ZINC000000219757	C2CCN(CC=Cc1ccccc1)CC2
OCCN2CCN(C(=O)COCC(=O)N1CCN(CCO)CC1)CC2	ZINC000530788520	O=C(COCC(=O)N1CCNCC1)N2CCNCC2
CN(C)CCCn2c1ccccc1ccc3ccccc23	ZINC000000001260	c3ccc2[nH]c1ccccc1ccc2c3
Fc4ccc(c2cn1CCSc1[n+]2c3ccccc3)cc4	ZINC000000245488	C4Cn3cc(c1ccccc1)[n+](c2ccccc2)c3S4
CN(C)CCNC(=O)C(=O)NC[C@@H]1OCCN1S(=O)(=O)c2cccs2	ZINC000009600504	O=S(=O)(N1CCOC1)c2cccs2
C[C@@H]2CN(C(C)=O)c1ccccc1[n+]3c(C)csc23	ZINC000000112689	C3Cc1scc[n+]1c2ccccc2N3
CN3C(=O)C[C@H](N2CCN(C(=O)CN1CCCC1)CC2)C3=O	ZINC000000036436	O=C3CC(N2CCN(C(=O)CN1CCCC1)CC2)C(=O)N3
CCC(=O)N([C@H](C)CN1CCCCC1)c2ccccc2	ZINC000000000604	C2CCN(CCNc1ccccc1)CC2
Clc1cccc(Cl)c1Cn2cnc(N(=O)=O)n2	ZINC000000037048	C(c1ccccc1)n2cncn2
CC[N@]1CCC[C@@H]1CNS(=O)(=O)c2cc(Cl)c(N)cc2OC	ZINC000000000430	O=S(=O)(NCC1CCCN1)c2ccccc2
CN(C)CC[C@@H](c1ccccc1)c2ccccn2	ZINC000000000607	C(c1ccccc1)c2ccccn2
CC[C@@](CO)(C(=O)O[C@@H]1C[N+]2(C)CCC1CC2)c3ccccc3	ZINC000000355496	O=C(Cc1ccccc1)OC2CN3CCC2CC3
Cn3c(=O)n(C)c2ncn([C@@H]1CN(C(=O)CCCN)C[C@@H](O)C[C@@]1(C)O)c2c3=O	ZINC000585287007	O=c3[nH]c(=O)c2n(C1CCCCNC1)cnc2[nH]3
CC(C)N[C@@H](C)C(=O)c1ccc(O)c(O)c1	ZINC000000000608	c1ccccc1
COCc4cc(CNC(=O)[C@@]13CNC[C@@H]1C[N@](C2CCCC2)C3)n[nH]4	ZINC000067723765	O=C(NCc1cc[nH]n1)C24CNCC2CN(C3CCCC3)C4
NNc1ncnc2ccc(Cl)cc12	ZINC000000397005	c2ccc1ncncc1c2
C[N@@](Cc2ccc1OCOc1c2)C3CCCCC3	ZINC000000044124	C3CCC(NCc2ccc1OCOc1c2)CC3
Cc1ccccc1NC2=NC(C)(C)NC(=N)N2	ZINC000000203665	N=C2NCN=C(Nc1ccccc1)N2
CN2C[C@H](NC(=O)CS(=O)(=O)CC(=O)N[C@@H]1CN(C)C(=O)C1)CC2=O	ZINC000654683378	O=C2CC(NC(=O)CS(=O)(=O)CC(=O)NC1CNC(=O)C1)CN2
NC(=O)N(O)C/C=C/c1ccoc1	ZINC000000010348	c1ccoc1
Cc2ccc(N1C(=N)NC(=N)NC1(C)C)c(C)c2	ZINC000000203660	N=C2NCN(c1ccccc1)C(=N)N2
NC(=N)Nc2ccc(C(=O)Nc1cnccn1)cc2	ZINC000000011213	O=C(Nc1cnccn1)c2ccccc2
CNCc3cn(C[C@H]2O[C@@H](CC(=O)N1CCC[C@@H]1COC)[C@H](O)[C@@H]2O)nn3	ZINC000008643715	O=C(CC2CCC(Cn1ccnn1)O2)N3CCCC3
O=C(NCCS(=O)(=O)N1CCSCC1)C(=O)N[C@@H]3CC[N@](C2CC2)C3	ZINC000570705684	O=C(NCCS(=O)(=O)N1CCSCC1)C(=O)NC3CCN(C2CC2)C3
O=N(=O)c2cccc(NS(=O)(=O)c1ccccc1C#N)c2	ZINC000000074848	O=S(=O)(Nc1ccccc1)c2ccccc2
FC(F)(F)c2cccc(NC(=O)CSC1=NCCN1)c2	ZINC000000141834	O=C(CSC1=NCCN1)Nc2ccccc2
C[n+]3cccc(\C=c2/nc(c1ccccc1)oc2=O)c3	ZINC000000509799	O=c2oc(c1ccccc1)nc2=Cc3cccnc3
CCC(=O)NS(=O)(=O)c2ccc(NC(=O)c1ccco1)cc2	ZINC000000301557	O=C(Nc1ccccc1)c2ccco2
CN(C)C[C@@H](O)COc3ccc(CN2CCN(c1cccc(Cl)c1)CC2)cc3	ZINC000012206532	C2CN(c1ccccc1)CCN2Cc3ccccc3
CN3CCN(c2ccc(NC(=O)CN1CCNCC1)cc2F)CC3	ZINC000020405849	O=C(CN1CCNCC1)Nc3ccc(N2CCNCC2)cc3
CCN[C@@H](C)Cc1cccc(C(F)(F)F)c1	ZINC000000000294	c1ccccc1
Nc4ccc(C(=O)N1C[C@@H]3C[C@H](C1)C[N@@](Cc2ccccc2)C3)cc4	ZINC000000004748	O=C(N3CC2CC(CN(Cc1ccccc1)C2)C3)c4ccccc4
NC(=N)NCCn1ccc2ccccc12	ZINC000000216148	c2ccc1[nH]ccc1c2
OCCNC(=O)CNC(=O)CCN2CCN(C(=O)[C@@H]1CCCO1)CC2	ZINC000448262524	O=C(C1CCCO1)N2CCNCC2
CS(=O)(=O)N2CCCN(S(=O)(=O)c1ccc(S(N)(=O)=O)cc1)CC2	ZINC000042655848	O=S(=O)(N1CCCNCC1)c2ccccc2
COc1ccc(Br)cc1C[N@]2CCC[C@@H](CO)C2	ZINC000000271777	C2CCN(Cc1ccccc1)CC2
Cc2nnc3[nH]c(c1cc(N(=O)=O)c(Cl)cc1Cl)nn23	ZINC000000036434	c3ccc(c2nn1cnnc1[nH]2)cc3
CN[C@H](c1cccc(O)c1)C(C)(C)C(=O)NCc2cccc3ccccc23	ZINC000000589926	O=C(CCc1ccccc1)NCc2cccc3ccccc23
Nc1nccc[n+]1Cc2ccccc2	ZINC000000392299	C(c1ccccc1)[n+]2cccnc2
N=c2ccn(Cc1ccccc1)cc2	ZINC000000059391	N=c2ccn(Cc1ccccc1)cc2
COc1ccc(Cl)cc1C(=O)N3CCN(c2ccccc2)CC3	ZINC000000030413	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
Brc3cn(CC(=O)Nc2nc(N1CCNCC1)n[nH]2)c(=O)[nH]c3=O	ZINC000566200751	O=C(Cn1ccc(=O)[nH]c1=O)Nc3nc(N2CCNCC2)n[nH]3
Cc3cc(C)[n+]2nc(N)c1ccccc1c2n3	ZINC000000392294	c1ccc2c(c1)cn[n+]3cccnc23
COc4ccc([C@@H]1NCCc2c1[nH]c3ccc(OC)cc23)cc4	ZINC000000526546	C4Cc1c([nH]c2ccccc12)C(c3ccccc3)N4
CN1CCC3(CC1)S[C@H]2C[N@@](C)CCC2=N3	ZINC000004963706	C3CC2=NC1(CCNCC1)SC2CN3
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
CN2CCC(N(C)C[C@@H](O)c1ccccc1)CC2	ZINC000002639104	C2CC(NCCc1ccccc1)CCN2
CC(C)C(=O)NCCNS(=O)(=O)N1CCN(S(C)(=O)=O)CC1	ZINC000408433312	C1CNCCN1
COc4ccc(c2nc1ccccn1c2NCCc3ccccc3)cc4	ZINC000000413887	C(Cc1ccccc1)Nc3c(c2ccccc2)nc4ccccn34
NC(=N)c1ccccc1OC(F)(F)F	ZINC000000122328	c1ccccc1
O[C@@]3(C[n+]1ccccc1)NCCc2ccccc23	ZINC000000051739	C3Cc1ccccc1C(C[n+]2ccccc2)N3
C[C@@H](C[N@@](C)Cc1ccccc1)OC(=O)c2ccc(Br)cc2	ZINC000000641652	O=C(OCCNCc1ccccc1)c2ccccc2
CCN3CCN(C2CCN(CCOC[C@@H]1CCCCO1)CC2)CC3	ZINC000020450779	C3CCC(COCCN2CCC(N1CCNCC1)CC2)OC3
O=C([C@@H]1CN2CCC1CC2)c3ccccc3	ZINC000000051654	O=C(C1CN2CCC1CC2)c3ccccc3
CC3CCN(CC2(NC(=O)[C@@H]1CCC[N@@](CC(N)=O)C1)CCCCC2)CC3	ZINC000019663709	O=C(NC2(CN1CCCCC1)CCCCC2)C3CCCNC3
CNC[C@@H](O)c1ccc(N(=O)=O)cc1	ZINC000000162397	c1ccccc1
O[C@@H]2[C@@H](O)[C@@H](Cc1ccccc1)NC(=O)N[C@@H]2Cc3ccccc3	ZINC000000008108	O=C3NC(Cc1ccccc1)CCC(Cc2ccccc2)N3
O=C(NCCN1CCCC1)NC2CCCCC2	ZINC000000401746	O=C(NCCN1CCCC1)NC2CCCCC2
COc3ccc2sc1C(=O)NCCNc1c2c3	ZINC000000002980	O=C1NCCNc2c1sc3ccccc23
COC(=O)c2ccc(N1CCN(C)CC1)nc2	ZINC000000004636	C2CN(c1ccccn1)CCN2
C[C@@H](N)C2CCC(C(=O)Nc1ccncc1)CC2	ZINC000000006989	O=C(Nc1ccncc1)C2CCCCC2
CCn2c(N1CCNCC1)nc3n(C)c(=O)[nH]c(=O)c23	ZINC000000180655	O=c3[nH]c(=O)c2[nH]c(N1CCNCC1)nc2[nH]3
C[N+](C)(CC=C)c1ccccc1O	ZINC000000027451	c1ccccc1
CC(=O)Nc2ccc(NS(=O)(=O)c1c(C)noc1C)cc2	ZINC000000155969	O=S(=O)(Nc1ccccc1)c2cnoc2
CC(C)(C)CC(=O)[n+]1ccccc1	ZINC000000040467	c1ccncc1
COc3ccc2[nH]cc(C(=O)C[N@]1CCCC[C@@H]1CCO)c2c3	ZINC000000485923	O=C(CN1CCCCC1)c2c[nH]c3ccccc23
CCCN(CCC)C2Cc1cc(OC)c(OC)cc1C2	ZINC000000007459	C2Cc1ccccc1C2
CN1CCOC[C@H]1CNC(=O)C(=O)N2CCN(CC(=O)NCC=C)CC2	ZINC000637106153	O=C(NCC1COCCN1)C(=O)N2CCNCC2
CC(C)[N@]1CCc2c(C1)sc(N)c2C(N)=O	ZINC000000216897	C2Cc1ccsc1CN2
COc2ccc1sc(C)[n+](C)c1c2	ZINC000000044008	c2ccc1scnc1c2
COc2cc(NS(=O)(=O)c1ccc(F)c(C)c1)cc(OC)c2	ZINC000000081775	O=S(=O)(Nc1ccccc1)c2ccccc2
Clc4cccc(NC(=O)C13CCN(CC1)Cc2ccccc23)c4	ZINC000000055580	O=C(Nc1ccccc1)C24CCN(CC2)Cc3ccccc34
COC(=O)c2cc(c1ccccc1OC)[nH]n2	ZINC000000037051	c2ccc(c1ccn[nH]1)cc2
Cc2cc(N(CCO)CCO)nc(NCc1ccccc1)n2	ZINC000000378400	C(Nc1ncccn1)c2ccccc2
CC(=O)Nc2ccc(S(=O)(=O)Nc1c(N)[nH]c(=S)[nH]c1=O)cc2	ZINC000008652531	O=c1[nH]c(=S)[nH]cc1NS(=O)(=O)c2ccccc2
C3CC(CNCc2ccc1OCOc1c2)CCN3	ZINC000010434626	C3CC(CNCc2ccc1OCOc1c2)CCN3
C[C@@H](C[N+]1(C)CCCCC1)OC(=O)CCCCC(=O)O[C@@H](C)C[N+]2(C)CCCCC2	ZINC000005527855	O=C(CCCCC(=O)OCCN1CCCCC1)OCCN2CCCCC2
COc1cc(Br)c(CCN)cc1OC	ZINC000000336690	c1ccccc1
COc3cccc(CN2CCC(C(=O)N(C)Cc1ccccc1)CC2)c3O	ZINC000000785861	O=C(NCc1ccccc1)C3CCN(Cc2ccccc2)CC3
CCc2ccc1scc(CCNC(C)=O)c1c2	ZINC000000006676	c2ccc1sccc1c2
CCOC(=O)[C@@H]2CCC[N@@](Cc1ccc(F)cc1F)C2	ZINC000000237968	C2CCN(Cc1ccccc1)CC2
CO[C@H]2C[C@@H](CN(C)CC(O)CN(C)C[C@@H]1C[C@H](OC)C[N@]1C)N(C)C2	ZINC000497513194	C(CNCC1CCCN1)CNCC2CCCN2
Nc3noc(C12CCN(CC1)C2)n3	ZINC000000011110	C2CC3(c1ncno1)CCN2C3
CN2CCN(C(=O)c1ccc(N(C)S(C)(=O)=O)cc1)CC2	ZINC000000479707	O=C(N1CCNCC1)c2ccccc2
Brc3cccc(CNC2CCN(CCc1ccccc1)CC2)c3	ZINC000000757079	C2CN(CCc1ccccc1)CCC2NCc3ccccc3
Cc2ccc(S(=O)(=O)CC(=O)NC1CC1)cc2	ZINC000000038223	O=C(CS(=O)(=O)c1ccccc1)NC2CC2
OC(=O)CNC(=O)CNC(=O)c1ccc(Br)cc1	ZINC000001840491	c1ccccc1
O[C@@H]2CC[N@@](Cc1ccc(F)cc1)C2	ZINC000000213015	C2CCN(Cc1ccccc1)C2
C[C@@H](CN(C)C)NS(=O)(=O)CCCS(=O)(=O)N[C@@H](C)CN(C)C	ZINC000561548699	nonring
O=C(NC1CC1)c4ccc(Cn3c(=O)[nH]c2ccccc2c3=O)cc4	ZINC000000424178	O=C(NC1CC1)c4ccc(Cn3c(=O)[nH]c2ccccc2c3=O)cc4
CC(=O)\C=C1/CN2CCC1CC2	ZINC000000006858	C=C1CN2CCC1CC2
N=C3N[C@H](c1ccccc1)N(c2ccccc2)C(=N)N3	ZINC000000063592	N=C3NC(c1ccccc1)N(c2ccccc2)C(=N)N3
N[C@@H](Cc1ccccc1)c3ccc2OCCOc2c3	ZINC000000042796	C3COc2cc(CCc1ccccc1)ccc2O3
COc3ccc(c2nnc(NC(=O)[C@H]1CCCN1)s2)cc3	ZINC000000324179	O=C(Nc2nnc(c1ccccc1)s2)C3CCCN3
COc2ccc(C/N=C/c1ccc(OC)cc1)cc2	ZINC000000110863	C(N=Cc1ccccc1)c2ccccc2
CN3CCN(NC(=O)CSc1nccc2ccccc12)CC3	ZINC000000532011	O=C(CSc1nccc2ccccc12)NN3CCNCC3
COc3ccc2Cc1ccn(C[C@H](C)N)c1c2c3	ZINC000000020046	C2c1ccccc1c3[nH]ccc23
COc2ccc(CCNC(=O)CN1CCC(C)CC1)cc2OC	ZINC000000038258	O=C(CN1CCCCC1)NCCc2ccccc2
Cc2cccc(NC1=NCCN1)c2C	ZINC000000007221	C2CN=C(Nc1ccccc1)N2
COC(=O)c1cc(OC)c(OC)cc1NC(=O)[C@@H]2CC[C@@H]2C(O)=O	ZINC000000118323	O=C(Nc1ccccc1)C2CCC2
CC[C@@H](NS(=O)(=O)c2ccc1ccccc1c2)C(O)=O	ZINC000000084451	c2ccc1ccccc1c2
C[C@H]1CC(=O)NN=C1c3ccc(NC2=C(C)C(=O)CC2)cc3	ZINC000000010961	O=C3CCC(c2ccc(NC1=CC(=O)CC1)cc2)=NN3
CN(C)CCCn2c(=O)n(C)c1ncn(C[C@@H](O)CO)c1c2=O	ZINC000000485559	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
CNS(=O)(=O)c1ccc3c(c1)c(=O)c2cc(S(=O)(=O)NC)ccc23	ZINC000000626189	O=c2c1ccccc1c3ccccc23
CN(C)c2cccc(/C=C/C(=O)C(C(O)=O)=C1SCCS1)c2	ZINC000000096794	O=C(C=Cc1ccccc1)C=C2SCCS2
Cc1ccc(C#N)c(SC(C)(C)C(O)=O)n1	ZINC000000039068	c1ccncc1
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
Cc2ccc(S(=O)(=O)N[C@@H](CC(O)=O)c1ccccc1)c(C)c2	ZINC000000096976	O=S(=O)(NCc1ccccc1)c2ccccc2
NC(=N)SCc1cccc(Cl)c1	ZINC000000096804	c1ccccc1
CN(C)c2ccc(NC(=O)c1ccc(Cl)cc1)cc2C(O)=O	ZINC000000139803	O=C(Nc1ccccc1)c2ccccc2
Nc3ccc(c2nc1ccccc1s2)cc3	ZINC000000006299	c3ccc(c2nc1ccccc1s2)cc3
C3CCN(Cc1c[nH]c2ccccc12)CC3	ZINC000000050819	C3CCN(Cc1c[nH]c2ccccc12)CC3
CN2C(C)(C)CC(NC(=O)c1ccccn1)CC2(C)C	ZINC000000269207	O=C(NC1CCNCC1)c2ccccn2
C[N+](C)(C)CCN[N+]2(C)CCCc1ccccc12	ZINC000001561530	C2CNc1ccccc1C2
OCCN2COc1ccccc1C2=O	ZINC000000006296	O=C1NCOc2ccccc12
Cn1ncc(Cl)c1C(=O)Nc3ccc(CN2CCCCC2)cc3	ZINC000000374888	O=C(Nc2ccc(CN1CCCCC1)cc2)c3ccn[nH]3
COC(=O)[C@@H]2C[C@@H](O)CN(c1nc(NCCO)nc(NC(C)C)n1)C2	ZINC000591997742	C2CCN(c1ncncn1)CC2
CN(C)CCN(CCN(C)C)C(=O)C(=O)N1CCN(CC(N)=O)C(=O)C1	ZINC000562692116	O=C1CNCCN1
O=c3n([C@@H]1CN2CCC1CC2)cc5CCCc4cccc3c45	ZINC000000014514	O=c3n(C1CN2CCC1CC2)cc5CCCc4cccc3c45
NCC(=O)N2CCN(CCCc1ccccc1)CC2	ZINC000001660232	C(CN1CCNCC1)Cc2ccccc2
CCN3CCN(c1c(Cl)cccc1NC(=O)c2ccc(C#N)cc2F)CC3	ZINC000000680128	O=C(Nc1ccccc1N2CCNCC2)c3ccccc3
CCOC(=O)[C@@H](C#N)[C@@]2(Cc1ccccc1)C[C@H](C)[N@@](C)C[C@@H]2C	ZINC000000341244	C2CC(Cc1ccccc1)CCN2
CCn2cc(Br)c(C(=O)NC(=S)Nc1cnn(C)c1C)n2	ZINC000000648381	O=C(NC(=S)Nc1cn[nH]c1)c2cc[nH]n2
CCN(CC)c2ccc(Nc1[nH]c(=O)nnc1C)cc2	ZINC000000114347	O=c2nncc(Nc1ccccc1)[nH]2
CN(C)c2cccc3c(S(=O)(=O)N1CCC[C@@H]1C(O)=O)cccc23	ZINC000000057283	O=S(=O)(N1CCCC1)c2cccc3ccccc23
CN(C)CCOC(=O)c1ccc(S(=O)(=O)N(C)C)o1	ZINC000000180494	c1ccoc1
Cc2ccc(CNS(=O)(=O)c1ccc(C(C)(C)C)cc1)n2C	ZINC000000033690	O=S(=O)(NCc1ccc[nH]1)c2ccccc2
NCCc2c[nH]c3c(OCc1ccccc1)cccc23	ZINC000000039096	C(Oc1cccc2cc[nH]c12)c3ccccc3
COc1ccccc1NC(=O)c3c(N)sc2C[N@](C)CCc23	ZINC000000235455	O=C(Nc1ccccc1)c3csc2CNCCc23
Nc2ccc[n+](c1ccc(F)cc1)c2	ZINC000000331559	c2ccc([n+]1ccccc1)cc2
NC3CCC(C(=O)N[C@@H]1CC[N@]2CCCC[C@@H]12)CC3	ZINC000037628381	O=C(NC1CCN2CCCCC12)C3CCCCC3
NC(=O)[C@H](CO)NC(=O)c2cc(S(=O)(=O)N1CCCC1)ccc2O	ZINC000557515243	O=S(=O)(N1CCCC1)c2ccccc2
C[C@@H](CN1CCCCC1)OC(=O)COc2ccc(Cl)cc2	ZINC000000249792	O=C(COc1ccccc1)OCCN2CCCCC2
CCCC(=O)NC(=S)Nc2ccc(N1CCN(C(C)=O)CC1)cc2	ZINC000000531720	C2CN(c1ccccc1)CCN2
O=C(Cn2cnc1ccc(N(=O)=O)cc1c2=O)N3CCOCC3	ZINC000000032659	O=C(Cn2cnc1ccccc1c2=O)N3CCOCC3
CCc2ncc3c(=O)[nH]c1cccnc1n23	ZINC000000013055	O=c2[nH]c1cccnc1n3cncc23
CN(C)c2ccc(\C=C\c1cc[n+](C)cc1)cc2	ZINC000000143705	C(=Cc1ccncc1)c2ccccc2
CN(C)Cc2ccc(CNCc1csc(C)n1)cc2	ZINC000007736229	C(NCc1cscn1)c2ccccc2
Nc3c(C(=O)N1CCOCC1)sc4nc2CCCCCc2cc34	ZINC000000032650	O=C(N1CCOCC1)c4cc3cc2CCCCCc2nc3s4
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
CN(C)C(=O)Cc2ccc(N1C(=N)NC(=N)NC1(C)C)cc2	ZINC000016954548	N=C2NCN(c1ccccc1)C(=N)N2
S=C2N=NC(c1ccccn1)N2N=Cc3cccnc3	ZINC000000032504	S=C2N=NC(c1ccccn1)N2N=Cc3cccnc3
O=c4cc6c(=O)n(CCNCCCCNCCn1c(=O)c3cccc2[nH]c(=O)cc(c1=O)c23)c(=O)c5cccc([nH]4)c56	ZINC000026376009	O=c4cc6c(=O)n(CCNCCCCNCCn1c(=O)c3cccc2[nH]c(=O)cc(c1=O)c23)c(=O)c5cccc([nH]4)c56
OCCN4CCN(CC(=O)N1CCNC(=O)[C@H]1CC(=O)Nc3ccc2OCOc2c3)CC4	ZINC000022933519	O=C(CC2N(C(=O)CN1CCNCC1)CCNC2=O)Nc4ccc3OCOc3c4
NC3CCN(Cc2ccc1cc(F)ccc1c2)CC3	ZINC000005514379	C3CCN(Cc2ccc1ccccc1c2)CC3
CN3CCC(OC(=O)c2cc1ccccc1oc2=O)CC3	ZINC000000108207	O=C(OC1CCNCC1)c3cc2ccccc2oc3=O
CN(C1CC(C)(C)N(C)C(C)(C)C1)C(=O)c2ccn[nH]2	ZINC000000034376	O=C(NC1CCNCC1)c2ccn[nH]2
O=C(CSc2nc1ccccc1[nH]2)NCCN3CCCCC3	ZINC000000203532	O=C(CSc2nc1ccccc1[nH]2)NCCN3CCCCC3
C[N+]2(CCOC(=O)c1ccc(O)cc1O)CCCCC2	ZINC000000492442	O=C(OCCN1CCCCC1)c2ccccc2
C[N+](C)(C)C[C@@H](O)COc1ccccc1	ZINC000000173783	c1ccccc1
Fc4ccc(C3=CC[N@](C2CCN(CCc1ccccc1)CC2)CC3)cc4	ZINC000000756655	C2CN(CCc1ccccc1)CCC2N4CCC(c3ccccc3)=CC4
CCN(CC)S(=O)(=O)c1ccc(C(O)=O)cc1	ZINC000000001380	c1ccccc1
COc2cc(O)c1ccccc1c2OC	ZINC000000024657	c2ccc1ccccc1c2
Nc1ccccc1Nc3nc2ccccc2[nH]3	ZINC000000033917	N(c1ccccc1)c3nc2ccccc2[nH]3
CCN(CC)C(=O)[C@@H]2CCC[N@@](C/C=C/c1ccccc1)C2	ZINC000000214548	C2CCN(CC=Cc1ccccc1)CC2
O=N(=O)c3ccc(\C=N\N=c1/c(=O)[nH]c2ccccc12)cc3	ZINC000000041686	O=c2[nH]c1ccccc1c2=NN=Cc3ccccc3
C3CC(OCc2ccc1ccccc1c2)CCN3	ZINC000000003647	C3CC(OCc2ccc1ccccc1c2)CCN3
CCn2c(C)[n+](c1ccccc1)c3ccc(N)cc23	ZINC000000176865	c3ccc([n+]1c[nH]c2ccccc12)cc3
FC(F)(F)c2cccc(CSC1=NCCCN1)c2	ZINC000000137983	C2CNC(SCc1ccccc1)=NC2
CN(c1cccc(C)c1)S(=O)(=O)c2c(C)[nH]c(=O)[nH]c2=O	ZINC000000423293	O=c2[nH]cc(S(=O)(=O)Nc1ccccc1)c(=O)[nH]2
CO[C@@H]2Nc1cc(O)c(OC)cc1C(=O)N3CC(=C\C)\C[C@H]23	ZINC000000002198	C=C3CC2CNc1ccccc1C(=O)N2C3
CNC(=O)[C@@H]1CCC[C@@H]1NC(=O)C(=O)NCCC(=O)N2CCN(C)CC2	ZINC000569337202	O=C(CCNC(=O)C(=O)NC1CCCC1)N2CCNCC2
C[C@@H]2CN=C(NC1CCCCC1)S2	ZINC000000135009	C2CCC(NC1=NCCS1)CC2
NC(=O)C2CCN(c1nccc(C(F)(F)F)n1)CC2	ZINC000000066643	C2CCN(c1ncccn1)CC2
CCOC(=O)c3ccc[n+](CCOn2c(=O)c1ccccc1c2=O)c3	ZINC000000388995	O=c2n(OCC[n+]1ccccc1)c(=O)c3ccccc23
Clc3ccc(c2nc1SCCn1c(=O)c2C#N)cc3	ZINC000000051770	O=c3cc(c1ccccc1)nc2SCCn23
Nc1ccccc1NC3CCN(Cc2ccccc2)CC3	ZINC000000161635	C2CN(Cc1ccccc1)CCC2Nc3ccccc3
CCOC(=O)c2csc(=NNS(=O)(=O)c1ccccc1)[nH]2	ZINC000001415077	O=S(=O)(NN=c1[nH]ccs1)c2ccccc2
Nc2cc(N)nc(SC[C@@H]1CCCO1)n2	ZINC000000415631	C2COC(CSc1ncccn1)C2
O=C4C[C@H](N3CCC(C2CCN([C@H]1CC(=O)NC1=O)CC2)CC3)C(=O)N4	ZINC000012343592	O=C4CC(N3CCC(C2CCN(C1CC(=O)NC1=O)CC2)CC3)C(=O)N4
NC(=O)C2CCN(C[C@H]1CCC=CC1)CC2	ZINC000000042134	C2CCN(CC1CCC=CC1)CC2
NC(=O)CCS(=O)(=O)CCN1CCCC1	ZINC000000188933	C1CCNC1
COc3cccc(C(=O)N2CCN(C1CCCCC1)CC2)c3	ZINC000000285181	O=C(N2CCN(C1CCCCC1)CC2)c3ccccc3
CCOc3ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)N1CCCCC1)cc2)cc3	ZINC000001111582	O=S(=O)(Nc2ccc(S(=O)(=O)N1CCCCC1)cc2)c3ccccc3
C2CN(c1ccccn1)CCN2Cc3c[nH]nc3c4ccccc4	ZINC000000151967	C2CN(c1ccccn1)CCN2Cc3c[nH]nc3c4ccccc4
CCOC(=O)N2CCC([N@@](CC)Cc1ccccc1)CC2	ZINC000000220004	C2CC(NCc1ccccc1)CCN2
CN(C)CCN4[C@@H](c1ccccc1)c3c(oc2ccccc2c3=O)C4=O	ZINC000000536842	O=C2NC(c1ccccc1)c4c2oc3ccccc3c4=O
O[C@H](CN1CCCC1)Cn2ccc(C(F)(F)F)n2	ZINC000000117335	C2CCN(CCCn1cccn1)C2
CCOC(=O)c2[nH]c1ccccc1c2NC(=O)CN(C)C	ZINC000000492531	c2ccc1[nH]ccc1c2
COc3ccc(N2C(=O)[C@@H](CC(N)=O)N(NC(=O)c1cccs1)C2=S)cc3	ZINC000002727931	O=C2CN(NC(=O)c1cccs1)C(=S)N2c3ccccc3
Cc2[nH]c1ccc(OC(F)(F)Cl)cc1c2CCN	ZINC000000034571	c2ccc1[nH]ccc1c2
Fc1ccccc1C(=O)NCc3ccc2OCOc2c3	ZINC000000037533	O=C(NCc2ccc1OCOc1c2)c3ccccc3
CN(CC#C)C[C@H]1C[N@]2CC[C@H]1C[C@@H]2CNC(=S)Nc3ccc(N(C)C)cc3	ZINC000020503945	S=C(NCC1CC2CCN1CC2)Nc3ccccc3
CCN3CCN(c2oc(COc1ccccc1)nc2C#N)CC3	ZINC000000108334	C3CN(c2cnc(COc1ccccc1)o2)CCN3
CN(C)CC(=O)Nc1cc(C)nc2ccccc12	ZINC000000104326	c2ccc1ncccc1c2
CC(C)(C)CN3CCC[C@](O)(CN2CCC(N1CCCC1)CC2)C3=O	ZINC000011934079	O=C1NCCCC1CN3CCC(N2CCCC2)CC3
Nc3c(NCCN1CCCC1)c2ccccc2oc3=O	ZINC000000198777	O=c3cc(NCCN1CCCC1)c2ccccc2o3
CC(C)NC[C@H](O)COc1cc(C)c(OC(C)=O)c(C)c1C	ZINC000000389149	c1ccccc1
CN(CCCCN1CCOCC1)c3nc2CCNCCc2c(=O)[nH]3	ZINC000065398547	O=c3[nH]c(NCCCCN1CCOCC1)nc2CCNCCc23
COc2[nH]c1ccc(F)cc1c2C(=O)OCC3CCN(CCNS(C)(=O)=O)CC3	ZINC000000598219	O=C(OCC1CCNCC1)c2c[nH]c3ccccc23
COc3cccc(N2CCN(C[C@@H](C)Nc1ccccn1)CC2)c3	ZINC000000163582	C(CN2CCN(c1ccccc1)CC2)Nc3ccccn3
Fc3cc2[C@H]1CNC[C@H](C1)c2cc3F	ZINC000000024032	C1NCC2CC1c3ccccc23
O=C1NCCN1CCNS(=O)(=O)c2cccs2	ZINC000000146511	O=C1NCCN1CCNS(=O)(=O)c2cccs2
CCCc2cc([C@H]1CCC[N@]1C)on2	ZINC000000008088	C2CNC(c1ccno1)C2
Cc2sc1ccccc1[n+]2C	ZINC000000101129	c2ccc1scnc1c2
C[N@]2CCCN(Cc1ccccc1N(=O)=O)CC2	ZINC000000238053	C2CNCCN(Cc1ccccc1)C2
N[C@H]3CN(C2CCN(Cc1ccccc1)CC2)C(=O)C3	ZINC000035679708	O=C1CCCN1C3CCN(Cc2ccccc2)CC3
N#Cc1ccccc1Cn3ccc(=NCc2ccccc2)cc3	ZINC000000281302	C(N=c2ccn(Cc1ccccc1)cc2)c3ccccc3
CC1(C)CC(O)(C#C)CC(C)(C)N1	ZINC000000062927	C1CCNCC1
O=C(NCc1ccncc1)[C@H]2CCCCN2	ZINC000000017735	O=C(NCc1ccncc1)C2CCCCN2
COc4ccc3[nH]c(=O)c(C[N@]2C[C@H](O)[C@@H](N1CCN(C)CC1)C2)cc3c4	ZINC000067840324	O=c2[nH]c1ccccc1cc2CN4CCC(N3CCNCC3)C4
COc2cccc(CN1CCSCC1)c2	ZINC000000238299	C2CN(Cc1ccccc1)CCS2
Cc1ccccc1C(=O)NC[C@@H]2CCC[N@]3CCCC[C@@H]23	ZINC000000055271	O=C(NCC1CCCN2CCCCC12)c3ccccc3
COc2ccc(CN1CCC(C(=O)NC(C)C)CC1)cc2	ZINC000000236080	C2CCN(Cc1ccccc1)CC2
CCN(C)C(=O)CNC(=O)C(=O)NCCC[N@]1CCC[C@@H](C(N)=O)C1	ZINC000557255386	C1CCNCC1
CC3(C)CC(Nc2ccc(Nc1ccccc1)cc2)CC(C)(C)N3	ZINC000000086102	C3CC(Nc2ccc(Nc1ccccc1)cc2)CCN3
Fc1ccccc1c2ncc3ccccn23	ZINC000000086105	c3ccc(c1ncc2ccccn12)cc3
CC(=O)c3cccc(NC1=NS(=O)(=O)c2ccccc12)c3	ZINC000000035220	O=S3(=O)N=C(Nc1ccccc1)c2ccccc23
CN(C)CCN(CCN(C)C)C(=O)C(=O)N1CCO[C@@H](CC(N)=O)C1	ZINC000625466288	C1COCCN1
CC(C)Cn1c(NCCN(C)C)nc2ccccc12	ZINC000005817390	c2ccc1[nH]cnc1c2
Cc2cc(Nc1ccc(F)cc1F)nc(N)n2	ZINC000000089189	N(c1ccccc1)c2ccncn2
O[C@@]2(c1ccc(Cl)cc1)C=C(C(F)(F)F)NN2C=O	ZINC000000033193	N2NC(c1ccccc1)C=C2
Nc3cccc(C2=N[C@@H]1C=CC=C[C@@H]1N=C2)c3	ZINC000000169288	C3=CC2N=CC(c1ccccc1)=NC2C=C3
N[C@H]1CC(=O)c2csc(Cl)c12	ZINC000000003357	O=C1CCc2cscc12
CC2[C@H](C(=O)N1CCO[C@@H](C(N)=O)C1)[C@H]2C(=O)N3CCO[C@@H](C(N)=O)C3	ZINC000667646605	O=C(C1CC1C(=O)N2CCOCC2)N3CCOCC3
OC(=O)c2c(CN1CCOCC1)c(O)c(O)c(O)c2CN3CCOCC3	ZINC000001603614	C3CN(Cc2cccc(CN1CCOCC1)c2)CCO3
C[C@@H](NC(=S)Nc1ccc(Br)cn1)c2ccccc2	ZINC000000008820	S=C(NCc1ccccc1)Nc2ccccn2
COC(CN[C@@H]1CCCc2c1[nH]c3ccc(C)cc23)OC	ZINC000000200163	C1CCc2c(C1)[nH]c3ccccc23
NNc2cc(Cl)nc(N1CCOCC1)n2	ZINC000000331112	C2CN(c1ncccn1)CCO2
C[C@H]1CCCC[N@]1Cc3c(C)n(C)n(c2ccccc2)c3=O	ZINC000000183148	O=c2c(CN1CCCCC1)c[nH]n2c3ccccc3
CCN(CC)C(=O)[C@@H]3CCC[N@@](Cc2ccc1OCOc1c2)C3	ZINC000000240454	C3CCN(Cc2ccc1OCOc1c2)CC3
C[C@@H]2C(=O)C=C(OC(=O)Cc1ccccc1N(=O)=O)C2=O	ZINC000000041223	O=C(Cc1ccccc1)OC2=CC(=O)CC2=O
CN(C)[C@H]3CCc2[nH]c1c(F)cc(F)cc1c2C3	ZINC000000000312	C1CCc2c(C1)[nH]c3ccccc23
Clc3c(N2CCN(Cc1ccccc1)CC2)cn[nH]c3=O	ZINC000000150065	O=c3cc(N2CCN(Cc1ccccc1)CC2)cn[nH]3
CN2CCC(N(C)Cc1ccccc1N(=O)=O)CC2	ZINC000000239833	C2CC(NCc1ccccc1)CCN2
COc2ccc(C[N@]1CCC[C@@H](CN)C1)cc2	ZINC000011888385	C2CCN(Cc1ccccc1)CC2
Fc2cccc3CN(N=C1NCCN1)Cc23	ZINC000000010612	C3CNC(=NN2Cc1ccccc1C2)N3
C[N@](c1cccc(F)c1C#N)n2c(C)ccc2C	ZINC000000140604	N(c1ccccc1)n2cccc2
CCCCNC(=O)NS(=O)(=O)c2ccc(NC(=O)c1ccc(Br)cc1)cc2	ZINC000001795200	O=C(Nc1ccccc1)c2ccccc2
COCCn2ccc(=NC(=O)C(=O)N1CCN(CCN(C)C)C(=O)C1)[nH]2	ZINC000651958811	O=C2CN(C(=O)C(=O)N=c1cc[nH][nH]1)CCN2
CN(C)CCCN(CCCN(C)C)C(=O)C1CCN(S(N)(=O)=O)CC1	ZINC000590319365	C1CCNCC1
CCOC(=O)c2ccc(NC(=O)[C@@H]1CC(=O)N=C(NC)S1)cc2	ZINC000000299054	O=C2CC(C(=O)Nc1ccccc1)SC=N2
O=C2C[C@H](N1CCSCC1)C(=O)N2CCc3ccccc3	ZINC000000033217	O=C2CC(N1CCSCC1)C(=O)N2CCc3ccccc3
COc2ccc(OC)c([C@@H]1NC(=O)NC(C)=C1C(N)=O)c2	ZINC000000071706	O=C2NC=CC(c1ccccc1)N2
CCOC(=O)c2cnc1cccc[n+]1c2Cl	ZINC000000114978	c2cc[n+]1cccnc1c2
C[N+]14CCCC[C@H]1[C@H](Cn3c(=O)c2ccccc2c3=O)CCC4	ZINC000000265582	O=c3n(CC1CCCN2CCCCC12)c(=O)c4ccccc34
CC(C)(C)[C@H](N)C(=O)N1CCC[C@@H]1C#N	ZINC000000009241	C1CCNC1
CCN(CC2CCN(C1CCN(C)CC1)CC2)C(=O)c3csc(C(C)C)n3	ZINC000011764869	O=C(NCC2CCN(C1CCNCC1)CC2)c3cscn3
CC(C)CCNC(=O)C2CCN(Cc1cccnc1)CC2	ZINC000000299295	C2CCN(Cc1cccnc1)CC2
O[C@@H]3CCC[N@](C2CCN(Cc1ccccc1)CC2)C3	ZINC000000279803	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
CC(C)(C)C(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000000073524	c1ccccc1
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
Cc3ccc([C@H]2COc1cc(O)c(O)cc1C2)cc3	ZINC000000002772	C2Oc1ccccc1CC2c3ccccc3
COC(=O)c2cccc(N1CCCC1=O)c2	ZINC000000027620	O=C1CCCN1c2ccccc2
CCCc2ncc(C[n+]1ccccc1C)c(N)n2	ZINC000000000934	C(c1cncnc1)[n+]2ccccc2
NC(=O)C3CCN(C[C@@H](O)Cc2ccc1OCOc1c2)CC3	ZINC000000119365	C3CCN(CCCc2ccc1OCOc1c2)CC3
CN(C)(=O)CCOC(c1ccccc1)c2ccccc2	ZINC000000000932	C(c1ccccc1)c2ccccc2
C[C@@H]2C[C@H](OC(=O)CN1CCCC1=O)CC(C)(C)C2	ZINC000000000636	O=C(CN1CCCC1=O)OC2CCCCC2
CC2(C)CC(N1CN=C(N)N(C#N)C1)CC(C)(C)N2	ZINC000000027629	C2CC(N1CNC=NC1)CCN2
COc1ccc(C)cc1NS(=O)(=O)c3ccc(NC(=O)CN(c2ccccc2F)S(C)(=O)=O)cc3	ZINC000000980318	O=C(CNc1ccccc1)Nc3ccc(S(=O)(=O)Nc2ccccc2)cc3
C[C@H]1CNCCN1c2cccc(C)c2	ZINC000000266406	C2CN(c1ccccc1)CCN2
Fc3ccc(OCC(=O)n1nnc2ccccc12)cc3	ZINC000000049333	O=C(COc1ccccc1)n2nnc3ccccc23
CCOC(=O)c1c(C)nc(C)cc1NCCN(C)C	ZINC000005033754	c1ccncc1
CC[C@@H]1CNCC[C@@H]1c2cccc3ccsc23	ZINC000000026714	C3CC(c1cccc2ccsc12)CCN3
CN2CCN(C(=S)Nc1ccccc1F)CC2	ZINC000000453762	S=C(Nc1ccccc1)N2CCNCC2
COc2cccc([C@@]1(O)CCCC[C@@H]1CN(C)C)c2	ZINC000000000853	C2CCC(c1ccccc1)CC2
CCC(=O)N1CC[C@@H](NC(=O)C(=O)N(CCN(C)C)CCN(C)C)C1	ZINC000561647156	C1CCNC1
Clc3ccc(C(=O)CN2Cc1ccccc1C2=N)cc3	ZINC000000193567	N=C2N(CC(=O)c1ccccc1)Cc3ccccc23
Oc3ccc(C[C@@H]1NCCc2cc(O)c(O)cc12)cc3	ZINC000000000857	C3Cc1ccccc1C(Cc2ccccc2)N3
COc3ccc(C(=O)c2c(N)sc1C[N@](C)CCc12)cc3	ZINC000000155021	O=C(c1ccccc1)c3csc2CNCCc23
NS(=O)(=O)N2CCC[C@@H](C(=O)NCCCN1C(=O)CNC1=O)C2	ZINC000668451526	O=C1CNC(=O)N1CCCNC(=O)C2CCCNC2
CC(=O)ON=C1CC(C)(C)NC(C)(C)C1	ZINC000000040493	N=C1CCNCC1
Cc3cc(=O)oc4cc(OCCN2CCN(c1ccc(Cl)c(Cl)c1)CC2)ccc34	ZINC000000628464	O=c4ccc3ccc(OCCN2CCN(c1ccccc1)CC2)cc3o4
CC(C)(C)NCc1ccc(F)cc1F	ZINC000000009953	c1ccccc1
C2C[C@H](COc1cccnc1)N2	ZINC000000018377	C2CC(COc1cccnc1)N2
COc3c1OCOc1cc2CC[N@](C)[C@@H](C[C@@H](C)O)c23	ZINC000000485912	C3Cc2cc1OCOc1cc2CN3
Cc1cccc[n+]1CC(O)C[n+]2ccccc2C	ZINC000001666257	C(C[n+]1ccccc1)C[n+]2ccccc2
COCc1cc(C)nc(NN)c1C#N	ZINC000000245071	c1ccncc1
OC(=O)c4cccc(N3C(=O)[C@H]2[C@H]1C[C@H](C=C1)[C@H]2C3=O)c4	ZINC000000064612	O=C3C2C1CC(C=C1)C2C(=O)N3c4ccccc4
CC1(C)NC(=N)NC(=N)N1OCc2ccc(Cl)c(Cl)c2	ZINC000000001180	N=C2NCN(OCc1ccccc1)C(=N)N2
CN(C)S(=O)(=O)N2CCC[C@@H](NC(=O)N1CCC[C@@](O)(C(N)=O)C1)C2	ZINC000562006174	O=C(NC1CCCNC1)N2CCCCC2
CN(C)CCCn2c(=O)n(c1ccccc1)c3cc(Cl)ccc23	ZINC000000001182	O=c2[nH]c1ccccc1n2c3ccccc3
C3CN(C2=NC(Cc1ccccc1)=NCS2)CCO3	ZINC000000146629	C3CN(C2=NC(Cc1ccccc1)=NCS2)CCO3
CNC2(C(N)=O)CCN(Cc1ccccc1)CC2	ZINC000000393553	C2CCN(Cc1ccccc1)CC2
CN(/N=C/c1cccn1C)C2=NCCN2	ZINC000000255691	C2CN=C(NN=Cc1ccc[nH]1)N2
C[C@@H]1[C@H](C)C(=O)CC[N@]1CCc2ccccc2	ZINC000000039082	O=C2CCN(CCc1ccccc1)CC2
NC(=O)C4(N1CCCCC1)CCN(c3nc(c2ccccc2)cs3)CC4	ZINC000000717883	C4CCN(C3CCN(c2nc(c1ccccc1)cs2)CC3)CC4
C[N+]2(C)CCN(c1ccc(Cl)nn1)CC2	ZINC000000009087	C2CN(c1cccnn1)CCN2
Cc1cccc(Cl)c1NC(=O)CN	ZINC000000394100	c1ccccc1
O=c2[nH]cnc3c(CC1CCCC1)c[nH]c23	ZINC000000019374	O=c2[nH]cnc3c(CC1CCCC1)c[nH]c23
COC(=O)[C@@H]2[C@@H](O)C=Cc3oc1cc(CO)cc(=O)c1c(O)c23	ZINC000000009082	O=c2cccc3oc1C=CCCc1cc23
COc2ccc(/C=C/C(=O)N1CCCC1=O)cc2OC	ZINC000000004828	O=C1CCCN1C(=O)C=Cc2ccccc2
Cc3cc[n+](CC2OCc1ccccc1CO2)cc3	ZINC000000185744	C2OC(C[n+]1ccccc1)OCc3ccccc23
COc2ccc(CNc1cc(C)ccn1)c(O)c2	ZINC000000049027	C(Nc1ccccn1)c2ccccc2
C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)NCC(N)=O	ZINC000002973686	c1ccccc1
Clc3ccc(OCC(=O)N[C@@H]1CN2CCC1CC2)cc3	ZINC000000537719	O=C(COc1ccccc1)NC2CN3CCC2CC3
Oc1ccccc1CNCc2ccccc2	ZINC000000164259	C(NCc1ccccc1)c2ccccc2
Cc2nc1ccccn1c(=O)c2CCN4CCC(C(=O)c3ccc(F)cc3)CC4	ZINC000000538194	O=C(C3CCN(CCc2cnc1ccccn1c2=O)CC3)c4ccccc4
CNC[C@@H](O)CN2CCN(c1ccccc1OC)CC2	ZINC000000227553	C2CN(c1ccccc1)CCN2
C[C@@H](CN1CCCC1)OC(=O)c2ccccc2Cl	ZINC000000210709	O=C(OCCN1CCCC1)c2ccccc2
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
Clc2ccc(NC(=O)CN1CCCC1=O)cc2	ZINC000000004826	O=C(CN1CCCC1=O)Nc2ccccc2
Cc1cc(I)ccc1NC(=O)/C=C/C(O)=O	ZINC000000096765	c1ccccc1
COC(=O)NCCc1ccc(OC[C@H](O)CNC(C)C)cc1	ZINC000000000586	c1ccccc1
O=C(NCCN1CCCCC1)c2ccc(=O)oc2	ZINC000000527156	O=C(NCCN1CCCCC1)c2ccc(=O)oc2
OC(=O)C3CCN(S(=O)(=O)c1cccc2cccnc12)CC3	ZINC000000067529	O=S(=O)(N1CCCCC1)c2cccc3cccnc23
COc1ccc2C[C@@H]5[C@H]3CCC(=O)[C@H]4Oc1c2[C@]34CC[N@]5C	ZINC000000000583	O=C1CCC2C3Cc4cccc5OC1C2(CCN3)c45
C[C@H](CN(C)C)CN2c1ccccc1S(=O)(=O)c3ccccc23	ZINC000000000582	O=S3(=O)c1ccccc1Nc2ccccc23
O=C2C[C@H](N1CCCCC1)C(=O)N2c4ccc3OCOc3c4	ZINC000000534708	O=C2CC(N1CCCCC1)C(=O)N2c4ccc3OCOc3c4
C[N@@](CCc1ccccn1)[C@@H]3CC(=O)N(c2ccccc2)C3=O	ZINC000000272674	O=C2CC(NCCc1ccccn1)C(=O)N2c3ccccc3
CC(C)(C)N1CC(O)CN(C(C)(C)C)CC(O)C1	ZINC000000171774	C1CNCCCNC1
CC1=C(N=NC(N)=N)CC[C@@]2(C)C1CC[C@@H]2CN=NC(N)=N	ZINC000043599258	C2CC1CCC=CC1C2
CC(=NNC1=NCCN1)c2ccc(C)cc2	ZINC000000150257	C2CN=C(NN=Cc1ccccc1)N2
Cc2csc(Cc1c[nH]cn1)c2C	ZINC000000022760	C(c1c[nH]cn1)c2cccs2
N[C@@H]1CCCc2c1[nH]c3ccc(Br)cc23	ZINC000000131414	C1CCc2c(C1)[nH]c3ccccc23
C3CC(COCc1ccccc1)(c2ccccc2)CCN3	ZINC000000018461	C3CC(COCc1ccccc1)(c2ccccc2)CCN3
CSc2nnc(c1cc[n+](C)cc1)n2CCO	ZINC000000353156	c2cc(c1nnc[nH]1)ccn2
Cn2c[n+](C[C@@H](O)COC[C@H]1CCC=CC1)c3ccccc23	ZINC000000098638	C(COCC1CCC=CC1)C[n+]2c[nH]c3ccccc23
Nc3ccc(c2cc(=O)c1c(N)c(F)c(CO)c(F)c1o2)cc3F	ZINC000000019626	O=c2cc(c1ccccc1)oc3ccccc23
Cn2c(=O)oc3ccc(C(=O)c1ccccc1)cc23	ZINC000000012860	O=C(c1ccccc1)c3ccc2oc(=O)[nH]c2c3
CCN(CC)CCNc1nc(C)cc(C)n1	ZINC000000150093	c1cncnc1
CN3CCN(c2nc(c1ccco1)cc(C(F)(F)F)n2)CC3	ZINC000000213243	C3CN(c2nccc(c1ccco1)n2)CCN3
CCOc4ccc([N+]3=C1CCCCCN1[C@](O)(c2ccc(F)cc2)C3)cc4	ZINC000000624138	C4CCN3C(c1ccccc1)C[N+](c2ccccc2)=C3CC4
CO[C@@H]1CS(=O)(=O)[C@H]2CN(C(=O)C(=O)NC[C@@H](C)S(N)(=O)=O)C[C@@H]12	ZINC000658743800	O=S2(=O)CCC1CNCC12
CCCc2n(C)c1ccccc1[n+]2C[C@@H](O)COCc3ccccc3	ZINC000000098631	C(COCc1ccccc1)C[n+]2c[nH]c3ccccc23
CCOc3ccc(CN2CCC(C(=O)NC[C@@H]1CCCO1)CC2)cc3	ZINC000000317172	O=C(NCC1CCCO1)C3CCN(Cc2ccccc2)CC3
COc1ccccc1NC(=O)N3CCN(CCc2ccccc2)CC3	ZINC000000146028	O=C(Nc1ccccc1)N3CCN(CCc2ccccc2)CC3
CN3CCN(C[C@@H](O)CN[C@@H]2CCN(Cc1ccc(C#N)cc1)C2=O)CC3	ZINC000570626325	O=C2C(NCCCN1CCNCC1)CCN2Cc3ccccc3
CN(C)CC(=O)Nc1ccccc1C	ZINC000000393023	c1ccccc1
Nc3nncc(C12CCN(CC1)C2)n3	ZINC000000005200	C2CC3(c1cnncn1)CCN2C3
CCc2oc1ccccc1c2CC3=NCCN3	ZINC000000001218	C3CN=C(Cc1coc2ccccc12)N3
COC(=O)CSc2ccc(C(=O)N1CCCCC1)cc2N(=O)=O	ZINC000000048130	O=C(N1CCCCC1)c2ccccc2
COc2cc(NC(=O)CCN1CCCCC1)cc(OC)c2	ZINC000000176426	O=C(CCN1CCCCC1)Nc2ccccc2
C[C@H](O)CN1CCN(CCN(C[C@H](C)O)C[C@H](C)O)CC1	ZINC000000393842	C1CNCCN1
CCN(CC)c1ccc(C=NNC(N)=NN(=O)=O)cc1	ZINC000000247755	c1ccccc1
C3CN=C(Nc2ccc1nccnc1c2)N3	ZINC000000014042	C3CN=C(Nc2ccc1nccnc1c2)N3
O=C(NCc1ccncc1)c2cccs2	ZINC000000029585	O=C(NCc1ccncc1)c2cccs2
FC(F)(F)c1ccccc1S(=O)(=O)NNC(=N)c2ccccn2	ZINC000000105923	N=C(NNS(=O)(=O)c1ccccc1)c2ccccn2
CCCc4cc(N1CCN(CC)CC1)n3c(nc2ccccc23)c4C#N	ZINC000000352599	C4CN(c2cccc3nc1ccccc1n23)CCN4
Fc2cccc(NC1=NCCS1)c2	ZINC000000129566	C2CN=C(Nc1ccccc1)S2
CCN(CC)CCSc2nnc(Nc1ccccc1)n2c3ccccc3	ZINC000000754448	N(c1ccccc1)c2nncn2c3ccccc3
COC(=O)CC1(CN(C)C)CCCCC1	ZINC000000158401	C1CCCCC1
CC(C)(C)NC[C@H](O)c1cc(Br)no1	ZINC000000000098	c1cnoc1
O=C3CN(C[C@@H]1CCCO1)C(=O)[C@@H]2Cc4c(CN23)[nH]c5ccccc45	ZINC000000488305	O=C3CN(CC1CCCO1)C(=O)C2Cc4c(CN23)[nH]c5ccccc45
Cc3ccc(N2CCN(Cc1ccoc1)CC2)cc3	ZINC000000213476	C2CN(c1ccccc1)CCN2Cc3ccoc3
Cc3noc(COc1ccccc1OCC[N+]2(C)CCOCC2)c3Cl	ZINC000000622053	C3CN(CCOc1ccccc1OCc2ccno2)CCO3
CN3CCN([C@@H]2COc1ccccc1[C@@H]2N)CC3	ZINC000019397299	C3CN(C2COc1ccccc1C2)CCN3
C[C@@H]3[C@@H]2CCc1ccccc1N2CCC3=O	ZINC000000022614	O=C3CCN1C(CCc2ccccc12)C3
NC(=N)N3CCC(N2CCCCN(c1cccc(C(N)=N)c1)C2=O)CC3	ZINC000026654023	O=C2N(C1CCNCC1)CCCCN2c3ccccc3
Cc3nc(S(=O)(=O)NCc2ccc1OCCc1c2)cn3C	ZINC000000131672	O=S(=O)(NCc2ccc1OCCc1c2)c3c[nH]cn3
NS(=O)(=O)N2CCCN(CCC[N@]1CCCN(S(N)(=O)=O)CC1)CC2	ZINC000365384501	C2CNCCN(CCCN1CCCNCC1)C2
CCOC(=O)c1c(C)oc2cc(CN(C)C)c(O)cc12	ZINC000000227097	c2ccc1occc1c2
O[C@H]1CSc3n(C1)c2ccccc2[n+]3CC=C	ZINC000000439780	C3CSc2nc1ccccc1n2C3
CC(C)(C)NC[C@@H](O)COc1ccccc1NC(=O)c2ccco2	ZINC000000000039	O=C(Nc1ccccc1)c2ccco2
Cn2nnc(C1=CCCNC1)n2	ZINC000000004001	C2CC=C(c1nn[nH]n1)CN2
CN(C)CC(C)(C)CN[C@@H]1C[C@H]2CC[C@@H]1C2	ZINC000004011192	C1CC2CCC1C2
CC[C@@H](C)NC[C@@H](O)c1ccc(N)cc1	ZINC000000000034	c1ccccc1
CN(C)C[C@H]1CC(=O)[C@H](CN(C)C)CC1=O	ZINC000001717766	O=C1CCC(=O)CC1
CN(C)C(=O)Oc1ccc[n+](C)c1	ZINC000000002009	c1ccncc1
CN1C(=O)COc2c1cc(Cl)cc2C(=O)N[C@H]3CN4CCC3CC4	ZINC000000004132	O=C1COc2c(N1)cccc2C(=O)NC3CN4CCC3CC4
CCN(CC)CCN3[C@@H](c1ccc(F)cc1)Nc2ccccc2C3=O	ZINC000000484245	O=C2NC(c1ccccc1)Nc3ccccc23
O=C([C@@H]1CCCNC1)N3CCN(Cc2ccccc2)CC3	ZINC000019410977	O=C(C1CCCNC1)N3CCN(Cc2ccccc2)CC3
CCSC(=O)c1cccc(C(=O)SCC)c1	ZINC000000001324	c1ccccc1
CCN(CC)c2ccc(\C=N\NC(=S)Nc1ccc(C)cc1)cc2	ZINC000000499170	S=C(NN=Cc1ccccc1)Nc2ccccc2
COc1cc(C)c(OC)c(C)c1CC2=NCCN2	ZINC000000001327	C2CN=C(Cc1ccccc1)N2
CN2CCN(NS(=O)(=O)c1ccc(Br)s1)CC2	ZINC000000352668	O=S(=O)(NN1CCNCC1)c2cccs2
Cc1ccc(OC[C@H](O)CNC(C)(C)C)c2oc(=O)ccc12	ZINC000000000100	O=c2ccc1ccccc1o2
Cc1ccc(Cl)c(OC[C@@H](O)CNC(C)(C)C)c1	ZINC000000000106	c1ccccc1
C[C@@H](CN(C)C)[C@@](O)(Cc1ccccc1)c2ccccc2	ZINC000000056564	C(Cc1ccccc1)c2ccccc2
CN3CCC([N@]2CCC[C@@H](C(=O)NCc1cnn(C)c1C)C2)CC3	ZINC000012582819	O=C(NCc1cn[nH]c1)C3CCCN(C2CCNCC2)C3
CCn3c(=C\C=C\c2oc1ccccc1[n+]2CC)/oc4ccccc34	ZINC000000106856	C(=Cc2nc1ccccc1o2)C=c4[nH]c3ccccc3o4
OC(=O)[C@H](NC(=O)c1ccc(Cl)cc1)c2ccccc2	ZINC000000085280	O=C(NCc1ccccc1)c2ccccc2
C[C@@H](O)CNCc1ccccc1F	ZINC000000268958	c1ccccc1
Cn1nccc1C(=O)OCC(=O)Nc2ccc(F)c(Cl)c2	ZINC000000037117	O=C(COC(=O)c1ccn[nH]1)Nc2ccccc2
Nc2cccc(C(=N)NCCNC(=N)c1cccc(N)c1)c2	ZINC000004014027	N=C(NCCNC(=N)c1ccccc1)c2ccccc2
COCc3cc(C)nc(N2CCN(Cc1ccccc1)CC2)c3C#N	ZINC000000350608	C2CN(c1ccccn1)CCN2Cc3ccccc3
Fc3ccc(N2CCN(CCN1CCNCC1)CC2)cc3	ZINC000020270233	C3CN(CCN2CCN(c1ccccc1)CC2)CCN3
CC[C@@H]1CCC[N@]1CNC(=O)c2cc(OC)c(OC)c(OC)c2	ZINC000000192219	O=C(NCN1CCCC1)c2ccccc2
CN(CC(=O)Nc1cc(Cl)c(S(N)(=O)=O)cc1S(N)(=O)=O)C(N)=N	ZINC000013800579	c1ccccc1
CC2(C)CC(c1ccc(O)c(O)c1)=CC(C)(C)N2	ZINC000000058452	C2CC(c1ccccc1)=CCN2
COc2cc(C[N@@](C)C1CCN(C)CC1)cc3OCOc23	ZINC000000216558	C3CC(NCc2ccc1OCOc1c2)CCN3
CN2CCC(=NOC(=O)c1ccc(C)cc1)CC2	ZINC000000262176	O=C(ON=C1CCNCC1)c2ccccc2
Cc2cn([C@H]1O[C@@H](CO)C[C@H]1O)c(=O)[nH]c2=O	ZINC000000011175	O=c2ccn(C1CCCO1)c(=O)[nH]2
NC(=O)c1ccccc1CN3Cc2ccccc2C3=N	ZINC000000392244	N=C2N(Cc1ccccc1)Cc3ccccc23
C[N@]1CCC3=C(C1)c2nsnc2SC3	ZINC000000021235	C1CC3=C(CN1)c2nsnc2SC3
CCCN2CCC(N(C)C1CCN(C)CC1)CC2	ZINC000000221721	C2CC(NC1CCNCC1)CCN2
Cc4ccc3nc(c1ccc(O)cc1)c(NC[C@@H]2CCCO2)n3c4	ZINC000000417324	C4COC(CNc2c(c1ccccc1)nc3ccccn23)C4
COc3ccc(S(=O)(=O)Nc1ccccc1C(=O)N2CCOCC2)c(Cl)c3Cl	ZINC000000810467	O=C(N1CCOCC1)c2ccccc2NS(=O)(=O)c3ccccc3
Nc2nc(F)cc(Oc1ccc(I)cc1)n2	ZINC000000033290	O(c1ccccc1)c2ccncn2
COc2ccc(S(=O)(=O)Nc1cccc(N(C)S(C)(=O)=O)c1)c(Cl)c2Cl	ZINC000000983135	O=S(=O)(Nc1ccccc1)c2ccccc2
CCN(CC)C[C@H](O)CNc3nccc4c(C)c2[nH]c1ccncc1c2cc34	ZINC000005139348	c4cc3cc2[nH]c1ccncc1c2cc3cn4
CN(C)CC[S@](=O)c1ccccc1	ZINC000000271016	c1ccccc1
C[N+](C)(C)Cc1c(O)cccc1N(=O)=O	ZINC000000294696	c1ccccc1
CCN2CCO[C@@H](CNC(=O)C(=O)N(C)CCN1CCCS1(=O)=O)C2	ZINC000647029476	O=C(NCCN1CCCS1(=O)=O)C(=O)NCC2CNCCO2
CN(C)[C@H]3CCN(C(=O)c1nn(C)c2ccccc12)C3	ZINC000000020610	O=C(N1CCCC1)c2n[nH]c3ccccc23
CCN(CC)C[C@H](O)CNc2ncc(C)c3n(C)c1ccc(O)cc1c23	ZINC000005139347	c1ccc3c(c1)[nH]c2ccncc23
O[C@H]1CS(=O)(=O)C[C@H]1N3CCN([C@@H]2CS(=O)(=O)C[C@@H]2O)CC3	ZINC000020812972	O=S3(=O)CCC(N2CCN(C1CCS(=O)(=O)C1)CC2)C3
Cc4nc3n(CCN1CCCCC1)c2ccccc2n3n4	ZINC000000266093	C4CCN(CCn2c1ccccc1n3ncnc23)CC4
Cc1n[nH]c(C)c1S(=O)(=O)Nc3ccc2OCCOc2c3	ZINC000000428625	O=S(=O)(Nc2ccc1OCCOc1c2)c3cn[nH]c3
COc1ccccc1NC[C@@H](O)CN	ZINC000000191148	c1ccccc1
CCN(CC)CCOc1c(Br)ccc4c1sc3nc2CCCn2c(=O)c34	ZINC000000754186	O=c3n1CCCc1nc4sc2ccccc2c34
FC(F)(F)c3ccc2n(C1CCNCC1)nnc2c3	ZINC000000161651	C3CC(n1nnc2ccccc12)CCN3
CCOC(=O)c4ccc(N3C(=O)C[C@@H](NCCCN2CCN(Cc1ccccc1)CC2)C3=O)cc4	ZINC000022782341	O=C3CC(NCCCN2CCN(Cc1ccccc1)CC2)C(=O)N3c4ccccc4
CC[C@@H](C)N4CCN(S(=O)(=O)CCCN3CCC(CNC(=O)c2cccc1OCCOc12)CC3)CC4	ZINC000028344313	O=C(NCC2CCN(CCCS(=O)(=O)N1CCNCC1)CC2)c4cccc3OCCOc34
Oc3ccc(c2cncc(c1ccc(O)cc1)c2)cc3	ZINC000000006514	c3ccc(c2cncc(c1ccccc1)c2)cc3
Clc2cccc3CN(C1=NCCN1)Cc23	ZINC000000006515	C3CN=C(N2Cc1ccccc1C2)N3
CC(C)(C)NC(=O)C3CCN(Cc2cccc(OCc1ccccc1)c2)CC3	ZINC000000785870	C3CCN(Cc2cccc(OCc1ccccc1)c2)CC3
CC(=O)N3C[C@H]1[N@@](CCc2ccccc12)[C@H]3c4ccccc4	ZINC000000029001	C3NC(c1ccccc1)N4CCc2ccccc2C34
CCCCN3C(=O)[C@@]2(NC(=N)NC(N1CCCCC1)=N2)c4ccccc34	ZINC000019330867	N=C2NC(N1CCCCC1)=NC4(N2)C(=O)Nc3ccccc34
COc3ccc2[nH]cc(C1CCN(C)CC1)c2n3	ZINC000000007594	C3CC(c1c[nH]c2cccnc12)CCN3
C[C@@H]1CCc3c(C1)sc(NC(=O)CSc2nncn2C)c3C#N	ZINC000000077446	O=C(CSc1nnc[nH]1)Nc3cc2CCCCc2s3
CN(C)CC(=O)N[C@@H]2CCC[N@@](CC1CCCCC1)C2	ZINC000011998730	C2CCC(CN1CCCCC1)CC2
CCN2CCC(NC(=O)C[N@@](C)CCOc1ccc(F)cc1)CC2	ZINC000016421443	O=C(CNCCOc1ccccc1)NC2CCNCC2
OCCN(CCO)C2CCC(c1ccccc1)CC2	ZINC000000221002	C2CCC(c1ccccc1)CC2
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
OC3(NC(=O)Cc1ccccc1)C(=O)c2ccccc2C3=O	ZINC000000103177	O=C(Cc1ccccc1)NC3C(=O)c2ccccc2C3=O
Cc1cc(C)[n+](C)n1C[C@@H](O)Cn3c2ccccc2c4ccccc34	ZINC000000301544	C(Cn1cccn1)Cn3c2ccccc2c4ccccc34
NCC(=O)Nc1ccc(C(F)(F)F)cc1	ZINC000000252346	c1ccccc1
O[C@@H]2CCC[N@@](Cc1cccc(F)c1)C2	ZINC000000239375	C2CCN(Cc1ccccc1)CC2
COc4ccc([C@@H]2C[C@@](C)(O)Oc3cc1OCOc1cc23)cc4	ZINC000000046811	C4CC(c1ccccc1)c3cc2OCOc2cc3O4
CC[N@]1CCC[C@H]1CN(CC(=O)N2CCNCC2)C(=O)c3ccc(F)cc3	ZINC000015864137	O=C(CN(CC1CCCN1)C(=O)c2ccccc2)N3CCNCC3
CCOC(=O)C1=C(COCCNCC(=O)NCCN)NC(C)=C(C(=O)OC)[C@@H]1c2ccccc2Cl	ZINC000027647466	N2C=CC(c1ccccc1)C=C2
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
CCOc3ccc(N2C(=O)C[C@H](N[C@@H]1CCCCNC1=O)C2=O)cc3	ZINC000000084425	O=C2CC(NC1CCCCNC1=O)C(=O)N2c3ccccc3
Cc1c(CCO)c(=O)[nH]n1S(=O)(=O)c2ccc(Cl)cc2Cl	ZINC000001395006	O=c2ccn(S(=O)(=O)c1ccccc1)[nH]2
O=C(N1CCOCC1)[n+]3ccc(N2CCOCC2)cc3	ZINC000000368081	O=C(N1CCOCC1)[n+]3ccc(N2CCOCC2)cc3
COc2ccc(CNCc1ccc(OC)cc1)cc2	ZINC000000110870	C(NCc1ccccc1)c2ccccc2
Cc4cc(NC(=O)CSc2ncnc3sc1CCCc1c23)no4	ZINC000000038301	O=C(CSc2ncnc3sc1CCCc1c23)Nc4ccon4
CC[N@]1CCC[C@@H]1CNC(=O)c2ccccc2Cl	ZINC000000244349	O=C(NCC1CCCN1)c2ccccc2
Cc2cn1c(C)nc(N(=O)=O)c1n2CCCC(O)=O	ZINC000000049513	c2cn1cncc1[nH]2
Fc4ccc(C(=O)NCCN3CCC(n1c(=O)[nH]c2cc(Cl)ccc12)CC3)cc4	ZINC000000537818	O=C(NCCN3CCC(n1c(=O)[nH]c2ccccc12)CC3)c4ccccc4
NCCOc2cc(N1CCC(N)CC1)cc3sc(C(N)=O)c(N)c23	ZINC000006745115	C3CCN(c2ccc1ccsc1c2)CC3
CS(=O)(=O)c2ccc(N1CCNCC1)cc2	ZINC000000154150	C2CN(c1ccccc1)CCN2
CC[C@H](N)[C@@H]1CCCCNC1=O	ZINC000000199212	O=C1CCCCCN1
COC(=O)C3=C(NNc1ccccc1)CN(c2ccc(Cl)cc2)C3	ZINC000000044375	C2C=C(NNc1ccccc1)CN2c3ccccc3
COC(=O)CCN1CCCCC1	ZINC000000050803	C1CCNCC1
CN(C)CCNC(=O)[C@@H]3C[C@H](CN1CCN(C)CC1)CN(Cc2nccn2C)C3	ZINC000023353780	C3CC(CN1CCNCC1)CN(Cc2ncc[nH]2)C3
Cc1ccccc1C[N@]2CCC[C@@H](O)C2	ZINC000000201565	C2CCN(Cc1ccccc1)CC2
CN(C)C[C@@H]2Oc1ccccc1O[C@@]2(O)c3ccccc3	ZINC000000283835	C2Oc1ccccc1OC2c3ccccc3
O=C(N1CCOCC1)N3CCC(Cc2ccccc2)CC3	ZINC000000030263	O=C(N1CCOCC1)N3CCC(Cc2ccccc2)CC3
COc1cc(N)c(Cl)cc1C(=O)NC3CCN(Cc2ccccc2)CC3	ZINC000000608261	O=C(NC2CCN(Cc1ccccc1)CC2)c3ccccc3
CN2CCN(CC(=O)Nc1ccc(Cl)c(N(=O)=O)c1)CC2	ZINC000000379454	O=C(CN1CCNCC1)Nc2ccccc2
NC(=O)C3CCN(CC(=O)Nc1ccccc1N2CCOCC2)CC3	ZINC000000154795	O=C(CN1CCCCC1)Nc2ccccc2N3CCOCC3
CN(CCNC(=O)C(=O)N(C)[C@H]1CNC[C@@H]1O)S(=O)(=O)c2cccs2	ZINC000419496099	O=C(NCCNS(=O)(=O)c1cccs1)C(=O)NC2CCNC2
CCS(=O)(=O)NCCNC(=O)N1CCN(CC(=O)N(C)C)CC1	ZINC000676290248	C1CNCCN1
C[N+]3(Cc2ccc(C[N+]1(C)CCOCC1)cc2)CCOCC3	ZINC000006068276	C3CN(Cc2ccc(CN1CCOCC1)cc2)CCO3
COc2ccc(Oc1ccccc1N(=O)=O)cc2	ZINC000000028149	O(c1ccccc1)c2ccccc2
OC[C@@H]1CCCC[N@]1Cc2ccsc2	ZINC000000246104	C2CCN(Cc1ccsc1)CC2
COc1cc(SC)ccc1C(=O)Nc2ccccc2C(N)=O	ZINC000000030866	O=C(Nc1ccccc1)c2ccccc2
OC(=O)C[C@@H](NCc1ccco1)C(=O)Nc2cccc(F)c2	ZINC000000543118	O=C(CNCc1ccco1)Nc2ccccc2
COc2ccc(CN1CCC(O)CC1)cc2Br	ZINC000000201209	C2CCN(Cc1ccccc1)CC2
Cc2[nH]c1ccc(CN)cc1c2C	ZINC000000142398	c2ccc1[nH]ccc1c2
NC(=O)C5(N1CCCCC1)CCN(CCCN3c2ccccc2CCc4ccc(Cl)cc34)CC5	ZINC000000608266	C5CCN(C4CCN(CCCN2c1ccccc1CCc3ccccc23)CC4)CC5
CN2CCC(NCCc1cccc(F)c1)CC2	ZINC000000757805	C2CC(NCCc1ccccc1)CCN2
Fc2ccc(OCC(=O)NCCN1CCCC1)cc2	ZINC000000383104	O=C(COc1ccccc1)NCCN2CCCC2
CN(C)Cc3cc2oc(=O)c1NCCCc1c2cc3O	ZINC000000198167	O=c3oc1ccccc1c2CCCNc23
CN2CCC(OC(=O)COc1ccc(Cl)cc1Cl)CC2	ZINC000000523633	O=C(COc1ccccc1)OC2CCNCC2
C[N@]1CCc3c(C1)sc(NC(=O)Cc2ccccc2)c3C#N	ZINC000000563231	O=C(Cc1ccccc1)Nc3cc2CCNCc2s3
Cc2c(C)c1ccccc1n2C[C@@H](O)CNCc3ccco3	ZINC000000086827	C(CNCc1ccco1)Cn2ccc3ccccc23
C[C@H]([N@]4CC[C@@H](CNC(=O)CCc2nnc3ccc(N1CCN(C)CC1)nn23)C4)c5ccccc5	ZINC000020530524	O=C(CCc2nnc3ccc(N1CCNCC1)nn23)NCC5CCN(Cc4ccccc4)C5
O=C3C[C@@H](C(=O)N2CCN(C(=O)CN1C(=O)CCC1=O)CC2)NC(=O)N3	ZINC000666817138	O=C3CC(C(=O)N2CCN(C(=O)CN1C(=O)CCC1=O)CC2)NC(=O)N3
CC(C)N3CCC(N2CC[N@@](CCCn1cccn1)C[C@@H]2CCO)CC3	ZINC000019836836	C(CN2CCN(C1CCNCC1)CC2)Cn3cccn3
C[C@@H]2C[C@H](OC(=O)c1ccccc1O)CC(C)(C)C2	ZINC000000000370	O=C(OC1CCCCC1)c2ccccc2
NC(=O)c2ccn3[C@H](c1cccnc1)SCc23	ZINC000000004355	C2SC(c1cccnc1)n3cccc23
N[C@@H](CO)[C@@H](O)c1ccc(N(=O)=O)cc1	ZINC000000035766	c1ccccc1
CCCn2c(=O)n(C[C@H](C)CC)c1nn(CCN(C)C)nc1c2=O	ZINC000000024624	O=c2[nH]c(=O)c1n[nH]nc1[nH]2
CC[C@H]2N(C(=O)\C=C\c1ccccc1)CCNC2=O	ZINC000000082315	O=C2CN(C(=O)C=Cc1ccccc1)CCN2
COc1ccccc1C(=O)OC2CCN(C)CC2	ZINC000000383082	O=C(OC1CCNCC1)c2ccccc2
OCCC2(O)CCN(Cc1ccccc1)CC2	ZINC000000136661	C2CCN(Cc1ccccc1)CC2
COC(=O)c2cc1ccccc1c(N)c2O	ZINC000000035166	c2ccc1ccccc1c2
COc4cccc(N3CCN(C2CCC(c1ccccc1)CC2)CC3)c4	ZINC000000756629	C2CC(c1ccccc1)CCC2N4CCN(c3ccccc3)CC4
COc3ccc(N2C[C@@H](C(=O)NCc1ccco1)CC2=O)cc3	ZINC000000035163	O=C2CC(C(=O)NCc1ccco1)CN2c3ccccc3
COc2ccc(CNC1CCCC1)cc2O	ZINC000000035162	C2CCC(NCc1ccccc1)C2
CC[C@@](O)(CCN1CCCCC1)c2ccccc2	ZINC000000139720	C2CCN(CCCc1ccccc1)CC2
CN(C)c3ccc(\C=N\c2c(C)n(C)n(c1ccccc1)c2=O)cc3	ZINC000000061141	O=c2c(N=Cc1ccccc1)c[nH]n2c3ccccc3
O=C(N4CCN(C2C1CC3CC(C1)CC2C3)CC4)c5ccncc5	ZINC000000317072	O=C(N4CCN(C2C1CC3CC(C1)CC2C3)CC4)c5ccncc5
C[C@@H]3CN(c2oc(c1ccc(F)cc1)nc2C#N)C[C@@H](C)O3	ZINC000000038098	C3CN(c2cnc(c1ccccc1)o2)CCO3
OC(=O)[C@@H]1SCCN1S(=O)(=O)c3ccc(/N=N/N2CCOCC2)cc3	ZINC000000866383	O=S(=O)(N1CCSC1)c3ccc(N=NN2CCOCC2)cc3
CN(C)CCn3c1c(CCCn2cnnc12)c4ccccc34	ZINC000000052653	C4Cc1c([nH]c2ccccc12)c3nncn3C4
Nc2nc1ccccc1n2CCN3CCCCC3	ZINC000000186855	C3CCN(CCn1cnc2ccccc12)CC3
CC(C)(C)S(=O)(=O)c1ccsc1S(C)(=O)=O	ZINC000000110110	c1ccsc1
C5CN=C(c4cccc(c3ccc(c2cccc(C1=NCCN1)c2)o3)c4)N5	ZINC000006525382	C5CN=C(c4cccc(c3ccc(c2cccc(C1=NCCN1)c2)o3)c4)N5
CCOC(=O)C1=C(C)NC(=O)C[C@@H]1c2ccc(Cl)cc2Cl	ZINC000000031420	O=C2CC(c1ccccc1)C=CN2
CC(=O)N3CCC(NC(c1ccccc1)c2ccccc2)CC3	ZINC000000215472	C3CC(NC(c1ccccc1)c2ccccc2)CCN3
CN2CCN(c1cccc(Cl)n1)CC2	ZINC000000017836	C2CN(c1ccccn1)CCN2
Cc2cc(C)cc(NC(=O)CN1CCCCC1)c2	ZINC000000042122	O=C(CN1CCCCC1)Nc2ccccc2
FC(F)(F)c2nc1ccccc1n2CC(=O)NCCN3CCCC3	ZINC000000612423	O=C(Cn1cnc2ccccc12)NCCN3CCCC3
O=C(N[C@@H]2CCc1ccccc1C2)c3ccc(C#N)nc3	ZINC000000003558	O=C(NC2CCc1ccccc1C2)c3cccnc3
Fc2ccc(NC1=NCCN1)cc2	ZINC000000098076	C2CN=C(Nc1ccccc1)N2
Cc2ccc(CCP(O)(=O)CCc1ccc(C)nc1)cn2	ZINC000000049521	O=P(CCc1cccnc1)CCc2cccnc2
COc3ccc([C@@H]2Nc1ccccc1C(=O)N2NC(C)=O)cc3	ZINC000000052668	O=C2NC(c1ccccc1)Nc3ccccc23
Cc2cc(C)c(C#N)c(OCC(=O)N/N=C/c1ccccc1Cl)n2	ZINC000000032999	O=C(COc1ccccn1)NN=Cc2ccccc2
C1CCc3c(C1)nc4[nH]c2ccccc2n34	ZINC000000127798	C1CCc3c(C1)nc4[nH]c2ccccc2n34
CCCc2nc1ccc(Br)cn1c2NC(C)(C)C	ZINC000000320197	c2ccn1ccnc1c2
COc1cc(Br)cc2cc(C(O)=O)c(=O)oc12	ZINC000000083851	O=c2ccc1ccccc1o2
C[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](C)NC(C)=O)C(N)=O	ZINC000049049253	nonring
OC(=O)CCCc2ccc(NS(=O)(=O)c1ccccc1)cc2	ZINC000000011959	O=S(=O)(Nc1ccccc1)c2ccccc2
CN(C)CC(=O)Nc4ccc3[C@@H]2C[C@@H](C[N@@](Cc1ccccn1)C2)Cn3c4=O	ZINC000003841945	O=c4cccc3C2CC(CN(Cc1ccccn1)C2)Cn34
CC[C@]2(C)C[C@]1(CCC[N@@](CCO)C1)CCO2	ZINC000000198762	C1CNCC2(C1)CCOCC2
C4Cc1c([nH]c2ccccc12)C3(CCNCC3)N4	ZINC000000156252	C4Cc1c([nH]c2ccccc12)C3(CCNCC3)N4
CN(C)CCN(Cc1ccccc1)c3nc2ccccc2o3	ZINC000000001857	C(Nc2nc1ccccc1o2)c3ccccc3
O=S(=O)(c1ccccc1)n3ccc4c(N2CCNCC2)cccc34	ZINC000000003210	O=S(=O)(c1ccccc1)n3ccc4c(N2CCNCC2)cccc34
O=C(NCCN1CCCCC1)c2ccccc2N(=O)=O	ZINC000000027770	O=C(NCCN1CCCCC1)c2ccccc2
NC(=O)[C@]2(O)CCCN(C(=O)CNS(=O)(=O)c1cccc(C#N)c1)C2	ZINC000577993018	O=C(CNS(=O)(=O)c1ccccc1)N2CCCCC2
NS(=O)(=O)N3CCc4ccc(NC(=O)[C@]12CNC[C@H]1COC2)cc34	ZINC000653074617	O=C(Nc2ccc1CCNc1c2)C34CNCC3COC4
C\C(=N\NC(N)=S)c1ccc(N)cc1	ZINC000000047573	c1ccccc1
Cc4c(c1ccccc1)oc3c(C(=O)OCCN2CCCCC2)cccc3c4=O	ZINC000000608382	O=C(OCCN1CCCCC1)c3cccc4c(=O)cc(c2ccccc2)oc34
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
Cc1nccn1Cc2ccccc2	ZINC000000156633	C(c1ccccc1)n2ccnc2
Fc2ccc(C1=CC[N@@](CC=C)CC1)cc2	ZINC000000010230	C2CC(c1ccccc1)=CCN2
Cc2cc(c1ccccc1)o[n+]2C	ZINC000000198784	c2ccc(c1ccno1)cc2
COc2ccc(C[C@@H](C)NC[C@@H]1CCCO1)cc2	ZINC000000220848	C2COC(CNCCc1ccccc1)C2
CC[C@@]3(C1=NCCN1)Cc2ccccc2O3	ZINC000000002748	C3CN=C(C2Cc1ccccc1O2)N3
C[N@]1[C@H]4CC[C@@H]1CC(NC(=O)c2nn(C)c3ccccc23)C4	ZINC000000005747	O=C(NC1CC2CCC(C1)N2)c3n[nH]c4ccccc34
FC(F)(F)c2nnc3ccc(N1CCCCC1)nn23	ZINC000000049230	C3CCN(c2ccc1nncn1n2)CC3
CN(C)CCN(Cc1ccccc1)c2ccnc(N(C)C)c2C#N	ZINC000000210132	C(Nc1ccncc1)c2ccccc2
CN(C)CCNC(=O)C[C@@H]2O[C@H](CNCc1ccccn1)[C@@H](O)[C@H]2O	ZINC000008627195	C2COC(CNCc1ccccn1)C2
COc1ccc(C(C)=O)cc1CN2CCCCC2	ZINC000000198231	C2CCN(Cc1ccccc1)CC2
O=C2C[C@@H](Cc1ccccc1)C(=O)N2c3ncccn3	ZINC000000033591	O=C2CC(Cc1ccccc1)C(=O)N2c3ncccn3
CN3CCN(C(=O)N(c1ccccc1)c2ccccc2)CC3	ZINC000000152068	O=C(N1CCNCC1)N(c2ccccc2)c3ccccc3
CC(=O)N3CCc4cc(NC2CCN(Cc1ccccc1)CC2)ccc34	ZINC000000007074	C4Cc3cc(NC2CCN(Cc1ccccc1)CC2)ccc3N4
COc1ccc(CN)cc1Cl	ZINC000000170050	c1ccccc1
COc5ccc4nccc(N3CC[C@@H](NCCNS(=O)(=O)c2ccc1SCC(=O)Nc1c2)C3)c4n5	ZINC000045167379	O=C5CSc4ccc(S(=O)(=O)NCCNC3CCN(c1ccnc2cccnc12)C3)cc4N5
Cc3cc(C)[n+]2nc(SCc1ccccc1)sc2n3	ZINC000000124266	C(Sc2n[n+]1cccnc1s2)c3ccccc3
C[C@@H]2CN(C1=NCCN1)C[C@@H](C)O2	ZINC000000152795	C2CN=C(N1CCOCC1)N2
COc1cc(N)c(Cl)cc1C(=O)N[C@@H]2CN3CCC2CC3	ZINC000000003961	O=C(NC1CN2CCC1CC2)c3ccccc3
NC(=O)c3ccc(N2CCN(C(=O)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1)CC2)nc3	ZINC000616485896	O=C(N2CCN(c1ccccn1)CC2)C3=CCCCC3
Nc3nnc(Cc1c[nH]c2ccccc12)s3	ZINC000000032424	C(c1c[nH]c2ccccc12)c3nncs3
CC(C)N2CCC(NCc1ccc(S(N)(=O)=O)cc1)CC2	ZINC000021504314	C2CC(NCc1ccccc1)CCN2
OC(=O)Cn3c(=O)s\c(=C/c2ccc1OCOc1c2)c3=O	ZINC000000974434	O=c3[nH]c(=O)c(=Cc2ccc1OCOc1c2)s3
CC2CCN(Cc1cnc(NC(C)=O)s1)CC2	ZINC000000032420	C2CCN(Cc1cncs1)CC2
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
OC(=O)c1nccnc1C(=O)NC(c2ccccc2)c3ccccc3	ZINC000000069576	O=C(NC(c1ccccc1)c2ccccc2)c3cnccn3
Fc3ccc(NC(=O)N2CCN(c1ccncc1)CC2)cc3	ZINC000000152484	O=C(Nc1ccccc1)N3CCN(c2ccncc2)CC3
CC(C)OC[C@H](O)C[N@]2CCc1ccccc1C2	ZINC000000465828	C2Cc1ccccc1CN2
OC(=O)CNC(=O)CNS(=O)(=O)c1ccc(Br)cc1	ZINC000002865672	c1ccccc1
Cn4c(=O)n(C)c3nc2ccc(c1ccccc1)cc2cc3c4=O	ZINC000000088263	O=c4[nH]c(=O)c3cc2cc(c1ccccc1)ccc2nc3[nH]4
CCOC(=O)C([C@@H](c1ccccc1)S(O)(=O)=O)C(=O)OCC	ZINC000001621955	c1ccccc1
COc3ccc(N2N=C(C(=O)c1ccc(C)cc1)C(O)(O)C2=O)cc3	ZINC000000084956	O=C2CC(C(=O)c1ccccc1)=NN2c3ccccc3
Nc2cc(S(=O)(=O)c1ccc(O)c(N)c1)ccc2O	ZINC000000036432	O=S(=O)(c1ccccc1)c2ccccc2
CCn1ccnc1C[C@H]3COc2ccccc2O3	ZINC000000000385	C2Oc1ccccc1OC2Cc3ncc[nH]3
CN(C)c2ccc(\C=C\C[N@@](CCO)Cc1ccccc1)cc2	ZINC000000214388	C(NCc1ccccc1)C=Cc2ccccc2
CCN2CCN(CC(=O)NC[C@@H]1CCN(S(C)(=O)=O)C1)C(=O)C2=O	ZINC000533577995	O=C(CN1CCNC(=O)C1=O)NCC2CCNC2
CC(C)N3CCC(N2CCN(c1ccccc1)CC2)CC3	ZINC000000207683	C3CC(N2CCN(c1ccccc1)CC2)CCN3
OC(=O)Cc3sc(c2cccc(n1cccc1)c2)nc3O	ZINC000000121352	c3ccn(c2cccc(c1nccs1)c2)c3
CN1CCOC[C@@H]1CNC(=O)N3CCN(C(=O)C(=O)NC2CC2)CC3	ZINC000624737716	O=C(NCC1COCCN1)N3CCN(C(=O)C(=O)NC2CC2)CC3
Cn2c[n+](C[C@@H](O)COc1ccccc1)c3ccccc23	ZINC000000273019	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
CC(C)(C)NC[C@H](O)c1ccc(O)cc1Cl	ZINC000000004904	c1ccccc1
CCc2ccc(C(=O)[C@H](C)CN1CCCC1)cc2	ZINC000000000387	O=C(CCN1CCCC1)c2ccccc2
Cc4cc3c(c1ccccc1F)nc(N2CCNCC2)nc3s4	ZINC000000004901	C4CN(c3nc(c1ccccc1)c2ccsc2n3)CCN4
CC2CCN(C[C@H](O)COC1CCC(C(C)(C)C)CC1)CC2	ZINC000000448352	C2CCC(OCCCN1CCCCC1)CC2
COc2ccc(CN1CCC(C(=O)NC(C)(C)C)CC1)c(OC)c2	ZINC000000299587	C2CCN(Cc1ccccc1)CC2
Clc4ccc(C=NNc3cn2c(nc1ccccc12)[nH][nH]3)cc4	ZINC000000366875	N(N=Cc1ccccc1)c4cn3c2ccccc2nc3[nH][nH]4
COc2ccc(CSC1=NCCN1)cc2N(=O)=O	ZINC000000179282	C2CN=C(SCc1ccccc1)N2
C[N@]1[C@H]4CCC[C@@H]1CC(NC(=O)c2cccc3nc[nH]c23)C4	ZINC000000385631	O=C(NC1CC2CCCC(C1)N2)c3cccc4nc[nH]c34
CCCCN3[C@H]2CC[N@](C1CCN(C)CC1)C[C@H]2CCC3=O	ZINC000014966135	O=C3CCC2CN(C1CCNCC1)CCC2N3
Cc1cccc(C)c1N2C(=N)NC(=N)NC2(C)C	ZINC000001680767	N=C2NCN(c1ccccc1)C(=N)N2
CCCc2nc(S(=O)(=O)c1ccc(C)cc1)c(NC)o2	ZINC000000035955	O=S(=O)(c1ccccc1)c2cocn2
Cc1cc(Cl)nc(Cl)c1C(=O)NC(=O)Nn2cnnc2	ZINC000000162962	O=C(NC(=O)c1cccnc1)Nn2cnnc2
Cc3cc(C)c2cc(C(=O)NCCN1CCCCC1)[nH]c2c3	ZINC000000171571	O=C(NCCN1CCCCC1)c3cc2ccccc2[nH]3
Cc2cc(C)[n+]1ccsc1n2	ZINC000000124319	c2cnc1scc[n+]1c2
NC(=N)COc1ccccc1Cl	ZINC000000124318	c1ccccc1
CN(C)[C@@H](CNC(=O)NC[C@H](N(C)C)c1ccccc1)c2ccccc2	ZINC000003300911	O=C(NCCc1ccccc1)NCCc2ccccc2
C4CN([C@H]1CC[C@H]2S[C@@H]1CC[C@@H]2N3CCOCC3)CCO4	ZINC000015319995	C4CN(C1CCC2SC1CCC2N3CCOCC3)CCO4
O=C(SCc1ccccc1)c2ccccc2	ZINC000000002162	O=C(SCc1ccccc1)c2ccccc2
COCCN2CCCN(C(=O)C(=O)N1CCO[C@@H](CC(N)=O)C1)CC2=O	ZINC000625596466	O=C2CN(C(=O)C(=O)N1CCOCC1)CCCN2
N[C@@H]3CSc2[nH]c1ccccc1c2C3	ZINC000000012148	C3CSc2[nH]c1ccccc1c2C3
CN3CCN(c2ncc(c1cc(Cl)cc(Cl)c1Cl)c(N)n2)CC3	ZINC000000538354	C3CN(c2ncc(c1ccccc1)cn2)CCN3
O=C(N[C@@H]1CC[N@]2CCCC[C@H]12)N4CCN(CCc3ccccc3)CC4	ZINC000047105561	O=C(NC1CCN2CCCCC12)N4CCN(CCc3ccccc3)CC4
CN2CCc1nc(N(C)C)cc(N)c1C2	ZINC000000171378	C2Cc1ncccc1CN2
Cc2ccc1[nH]c(=O)c(=NNC(N)=N)c1c2	ZINC000000189060	N=c1c(=O)[nH]c2ccccc12
CN(C)CC(C)(C)CNC1C[C@@H]2CC[C@H](C1)[N@]2C	ZINC000003683608	C1CC2CCC(C1)N2
C/C=C(\C)C(=O)OC1C[C@@H]2CC[C@H](C1)[N@]2C	ZINC000000002169	C1CC2CCC(C1)N2
C[n+]2ccc(/C=C/c1ccc(O)cc1)cc2	ZINC000000242385	C(=Cc1ccncc1)c2ccccc2
Cn2c(=O)n(C)c1ncn(C[C@@H](O)CN(CC=C)CC=C)c1c2=O	ZINC000000164104	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
C[C@H]1C[N@@](C)CC[C@]1(O)c2ccccc2	ZINC000000236345	C2CC(c1ccccc1)CCN2
Cn1c(NC(=O)CNC(N)=N)ccc1C(=O)NCCC(N)=N	ZINC000040466486	c1cc[nH]c1
NC(=O)CCOC2CCN(Cc1ccccc1)CC2	ZINC000000161461	C2CCN(Cc1ccccc1)CC2
C[C@@H]2CN(C[C@@H]1CN(C)CCO1)CCN2C(=O)CNS(=O)(=O)N(C)C	ZINC000668350086	C2COC(CN1CCNCC1)CN2
C3N(c1ccnc2ccccc12)Cc4ccccc34	ZINC000000026872	C3N(c1ccnc2ccccc12)Cc4ccccc34
O=C(NCCCCN2CCN(c1ncccn1)CC2)[C@]34CNC[C@H]3COC4	ZINC000653124692	O=C(NCCCCN2CCN(c1ncccn1)CC2)C34CNCC3COC4
COc3ccc(CN[C@@H](C)[C@@H]2COc1ccccc1O2)c(OC)c3	ZINC000000189266	C(NCc1ccccc1)C3COc2ccccc2O3
COc2cc1nccc(N)c1cc2OC	ZINC000000000924	c2ccc1ncccc1c2
O=C(Cn2ccc1ccccc1c2=O)NCC(=O)N3CCOCC3	ZINC000000200566	O=C(Cn2ccc1ccccc1c2=O)NCC(=O)N3CCOCC3
Cn2ccc3cc(NC(=O)Nc1cncnc1)ccc23	ZINC000000016914	O=C(Nc2ccc1[nH]ccc1c2)Nc3cncnc3
COC[C@H](O)C[N@]1C[C@@H]3C[C@H](C1)c2cccc(=O)n2C3	ZINC000000525451	O=c3cccc2C1CNCC(C1)Cn23
CCn2cc(NS(=O)(=O)c1c(C)n[nH]c1C)c(C(=O)NCC(C)C)n2	ZINC000002804540	O=S(=O)(Nc1cn[nH]c1)c2cn[nH]c2
O=C2CCN(CCc1ccccc1)CC2	ZINC000000119408	O=C2CCN(CCc1ccccc1)CC2
Clc4ccc3[n+](Cc1cccc2ccccc12)csc3c4	ZINC000000272793	C(c1cccc2ccccc12)[n+]3csc4ccccc34
O=C(NC(=S)NN1CCCCC1)c2csc(N(=O)=O)c2	ZINC000000143316	O=C(NC(=S)NN1CCCCC1)c2ccsc2
CSc2ccc1ncn(/C=C/C(O)=O)c(=O)c1c2	ZINC000000002160	O=c1[nH]cnc2ccccc12
CC(CN1CCN(S(N)(=O)=O)CC1)CN2CCN(S(N)(=O)=O)CC2	ZINC000510239838	C(CN1CCNCC1)CN2CCNCC2
CCOc1c(Cl)cc(Cl)cc1CNCC2CCNCC2	ZINC000010434723	C2CC(CNCc1ccccc1)CCN2
CN(C)CCCn1cnc2n(C)c(=O)n(C)c(=O)c12	ZINC000000089656	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
O=N(=O)c2cc1OCOc1cc2CNC3CCCCC3	ZINC000000263214	C3CCC(NCc2ccc1OCOc1c2)CC3
CC2(C)CC[C@]1(C)CCC(C)(C)N=C1N2	ZINC000000057627	C2CNC1=NCCCC1C2
O=C(CN1CCCCC1)N4CCc3[nH]c2ccccc2c3C4	ZINC000000491143	O=C(CN1CCCCC1)N4CCc3[nH]c2ccccc2c3C4
C3CCN(CC2OCc1ccccc1CO2)C3	ZINC000000174698	C3CCN(CC2OCc1ccccc1CO2)C3
CCOC(=O)Cn2[nH][nH]c3c(=O)n(c1ccccc1)c(=O)c23	ZINC000000114817	O=c2n(c1ccccc1)c(=O)c3[nH][nH][nH]c23
C3CCN(CCSc2nc1ccccc1[nH]2)C3	ZINC000000182699	C3CCN(CCSc2nc1ccccc1[nH]2)C3
CC(C)(C)NC(NCC1CC1)N=N	ZINC000000089933	C1CC1
Cc2ccc(OC[C@H]1CCCN1)cn2	ZINC000000018380	C2CNC(COc1cccnc1)C2
NC(=N)c3ccc(c2cc(c1ccc(C(N)=N)cc1)on2)cc3	ZINC000006536322	c3ccc(c2cc(c1ccccc1)on2)cc3
Clc2ccc(NC(=O)c1cccnc1)cc2	ZINC000000029540	O=C(Nc1ccccc1)c2cccnc2
CNC[C@@H](O)c1ccc(O)c(OC)c1	ZINC000000056626	c1ccccc1
C(NCc1ccco1)C3OCc2ccccc2CO3	ZINC000000174697	C(NCc1ccco1)C3OCc2ccccc2CO3
Brc3ccc(C(=O)ONC(=N)c2ccc(CN1CCCCC1)cc2)o3	ZINC000004785055	N=C(NOC(=O)c1ccco1)c3ccc(CN2CCCCC2)cc3
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
COc2ccc(C[C@@H](O)CN1CCCCC1)cc2	ZINC000000053058	C2CCN(CCCc1ccccc1)CC2
CN2CCC(OC(=O)c1cccc(F)c1)CC2	ZINC000000110644	O=C(OC1CCNCC1)c2ccccc2
CSc2ccc(Oc1ccc(S(N)(=O)=O)cc1CN(C)C)cc2	ZINC000000593140	O(c1ccccc1)c2ccccc2
O=c2[nH]c(=O)c(=CNCc1ccco1)c(=O)n2Cc3ccco3	ZINC000002315486	O=c2[nH]c(=O)c(=CNCc1ccco1)c(=O)n2Cc3ccco3
CN(C)Cc1cc(C(N)=O)ccc1Oc2ccc(OC(F)(F)F)cc2	ZINC000000593143	O(c1ccccc1)c2ccccc2
CS(=O)(=O)N2CCN(C(=O)N1CCOCC1)C[C@H]2C(=O)N[C@H]3CCCNC3=O	ZINC000015709558	O=C1NCCCC1NC(=O)C3CN(C(=O)N2CCOCC2)CCN3
Cc3c[nH]c(=O)n(CCCN2CCN(c1ccccc1OCC(F)(F)F)CC2)c3=O	ZINC000000601958	O=c1cc[nH]c(=O)n1CCCN3CCN(c2ccccc2)CC3
C[C@H](C(N)=O)[S@@](=O)C(c1ccccc1)c2ccccc2	ZINC000000019367	C(c1ccccc1)c2ccccc2
Cc2[nH]c1ccccc1c2Sc3ccccc3	ZINC000000028375	S(c1ccccc1)c2c[nH]c3ccccc23
C[C@@H](O)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)N[C@@H]([C@@H](C)O)C(N)=O	ZINC000071773625	O=C(C1CCCN1)N2CCCC2
CN(C)CCCN2C(=O)C[C@@H]([N@]1CCC[C@@H](CNS(C)(=O)=O)C1)C2=O	ZINC000525688332	O=C2CC(N1CCCCC1)C(=O)N2
CC3CCN(CC(=O)Nc2sc(c1ccccc1)cc2C(N)=O)CC3	ZINC000000780386	O=C(CN1CCCCC1)Nc3ccc(c2ccccc2)s3
O=S(=O)(N=C2NC[C@H]1CCC[C@H]1N2)c3ccccc3	ZINC000000137945	O=S(=O)(N=C2NCC1CCCC1N2)c3ccccc3
COC(=O)C1=CN(C)C=C(C(=O)OC)C1c2cccs2	ZINC000000036520	N2C=CC(c1cccs1)C=C2
COc1ccc(Cl)cc1C(=O)NCCc2ccc(C(O)=O)cc2	ZINC000000001668	O=C(NCCc1ccccc1)c2ccccc2
CCOC(=O)N3CCN(C[C@H]1C[C@H]2C[C@@H]1C=C2)CC3	ZINC000000219416	C3CN(CC1CC2CC1C=C2)CCN3
C[C@@H]2CCC[N@@](CCC(=O)Nc1ccccc1)C2	ZINC000000176341	O=C(CCN1CCCCC1)Nc2ccccc2
CN4CCN(c3cc2n(C)c1ccccc1oc2nn3)CC4	ZINC000000050247	C4CN(c3cc2[nH]c1ccccc1oc2nn3)CCN4
O=c2ccc(=O)n(c1ccccc1)n2CCCN3CCC4(CC3)OCCO4	ZINC000000704301	O=c2ccc(=O)n(c1ccccc1)n2CCCN3CCC4(CC3)OCCO4
COc1ccccc1N5CCN(C[C@@H]2CN=c3n2c(=O)[nH]c4ccccc34)CC5	ZINC000000601766	O=c4[nH]c1ccccc1c5=NCC(CN3CCN(c2ccccc2)CC3)n45
CCOC[C@@H](O)CN2CCN(C(=O)NC[C@@H]1CCC[N@]1CCOC)CC2	ZINC000605976561	O=C(NCC1CCCN1)N2CCNCC2
CC(CCN1CCN(C(=O)CO)CC1)CCN2CCN(C(=O)CO)CC2	ZINC000411420666	C(CCN1CCNCC1)CCN2CCNCC2
Cc2cc(n1nc(C)cc1C)nc(N)n2	ZINC000000182356	c2cnn(c1ccncn1)c2
COC(=O)N3CCN(C(=O)Cc1ccc(Cl)c(Cl)c1)[C@@H](CN2CCCC2)C3	ZINC000000597739	O=C(Cc1ccccc1)N2CCNCC2CN3CCCC3
CC[C@@H](C)[C@@H](N)C(=O)N2CCN(C(=O)C1CCCCC1)CC2	ZINC000000252615	O=C(C1CCCCC1)N2CCNCC2
Fc1cccc(F)c1CN2CCCCC2	ZINC000000138525	C2CCN(Cc1ccccc1)CC2
CCN(CC)CCNc1[nH]c(=O)nnc1C	ZINC000000138524	O=c1nncc[nH]1
CN(C)CCN(CC(=O)N(C)C)C(=O)NCCCCN1CCOCC1	ZINC000663653886	C1COCCN1
O=C(CN1C(=O)COc2ccccc12)NCCN3CCCC3	ZINC000000219679	O=C(CN1C(=O)COc2ccccc12)NCCN3CCCC3
CC2(C)[C@H]3CC=C(C[N@]1CCC[C@@H]1CO)[C@@H]2C3	ZINC000000212385	C3CCN(CC1=CCC2CC1C2)C3
CCOC(=O)C2(c1ccccc1)CCN(C)CC2	ZINC000000001681	C2CC(c1ccccc1)CCN2
CC(=O)N2CCN(C[C@@]1(O)CCCN(C(=O)CNS(C)(=O)=O)CC1)CC2	ZINC000257259335	C2CNCCC(CN1CCNCC1)C2
CN3CCN(c2nc1ccccc1o2)CC3	ZINC000000019141	C3CN(c2nc1ccccc1o2)CCN3
OCC[N@]3CCCN(c2nc1ccccc1o2)CC3	ZINC000000019143	C3CNCCN(c2nc1ccccc1o2)C3
C[C@H](CN)c1cc(F)cc2ccoc12	ZINC000000026050	c2ccc1occc1c2
CN(C)[C@@H](CNS(=O)(=O)c1ccc(C)cc1)c2ccccc2	ZINC000000616984	O=S(=O)(NCCc1ccccc1)c2ccccc2
CC(C)(CO)CNc1nc(N)nc(Cl)c1N	ZINC000000021006	c1cncnc1
CC(C)(CO)CNc1cc(Cl)nc(N)n1	ZINC000000021005	c1cncnc1
CC(C)N2CCC(NC1CCN(C(N)=O)CC1)CC2	ZINC000037236789	C2CC(NC1CCNCC1)CCN2
OC2CCN(Cc1ccc(N(=O)=O)cc1)CC2	ZINC000000240189	C2CCN(Cc1ccccc1)CC2
O[C@H](CN[C@H]1CCCCNC1=O)c2ccccc2	ZINC000000130400	O=C1NCCCCC1NCCc2ccccc2
N[C@@H](c1ccccc1)P(O)(=O)[C@@H](N)c2ccccc2	ZINC000000186743	O=P(Cc1ccccc1)Cc2ccccc2
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
CCC(=O)Nc3ccc2[nH]cc(C1CCN(C)CC1)c2n3	ZINC000000023433	C3CC(c1c[nH]c2cccnc12)CCN3
CCN(CC)C(=O)[n+]1ccc(N)cc1	ZINC000000389055	c1ccncc1
CCc2c(C)sc(NC(=O)c1ccncc1)c2C(=O)OC	ZINC000000027960	O=C(Nc1cccs1)c2ccncc2
Cc2[nH]c1c(Cl)cc(Cl)cc1c2CCN	ZINC000000140713	c2ccc1[nH]ccc1c2
C[C@@H]3S[C@@]1(CN2CCC1CC2)NC3=O	ZINC000000244192	O=C3CSC1(CN2CCC1CC2)N3
OCCN(C1CCCCC1)S(=O)(=O)c2ccccc2	ZINC000000029388	O=S(=O)(NC1CCCCC1)c2ccccc2
CN[C@@H](C)c1ccc(OC)c(OC)c1	ZINC000000051282	c1ccccc1
Nc3nc2c1CCCCc1ccc2s3	ZINC000000026450	C1CCc2c(C1)ccc3scnc23
O=C(Nc1ccccc1)c3ccc[n+](Cc2ccc(N(=O)=O)cc2)c3	ZINC000000307878	O=C(Nc1ccccc1)c3ccc[n+](Cc2ccccc2)c3
Cc2oc1CCCCc1c2C(=O)Nc3ccc(C(O)=O)cc3	ZINC000000034904	O=C(Nc1ccccc1)c3coc2CCCCc23
Cc1cccc(C)c1NC3=NC(=N)NC2(CCCC2)N3	ZINC000002482864	N=C3NC1(CCCC1)NC(Nc2ccccc2)=N3
C[N+]3(CCC[N+]2(C)CCC1(CCCCC1)CC2)CCOCC3	ZINC000001603883	C1CCC3(CC1)CCN(CCCN2CCOCC2)CC3
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
Fc4ccc([C@H]1CCNC[C@@H]1COc3ccc2OCOc2c3)cc4	ZINC000000007525	C4CC(c1ccccc1)C(COc3ccc2OCOc2c3)CN4
CC3(C)CC(NC(=O)C1C[C@@H]2CCC[C@H](C1)C2=O)CC(C)(C)N3	ZINC000000351768	O=C(NC1CCNCC1)C2CC3CCCC(C2)C3=O
CN2CCN(c1ccccc1C=O)CC2	ZINC000000165756	C2CN(c1ccccc1)CCN2
Brc3cnc2cc(C(=O)N1CCOCC1)nn2c3	ZINC000000058646	O=C(N1CCOCC1)c3cc2ncccn2n3
C(CN1CCOCC1)Nc3ccnc4cc2ccccc2cc34	ZINC000000196200	C(CN1CCOCC1)Nc3ccnc4cc2ccccc2cc34
CN3[C@@H]2N=C(NCCN1CCOCC1)N(C)[C@H]2C(=O)N(C)C3=O	ZINC000000195433	O=C3NC2N=C(NCCN1CCOCC1)NC2C(=O)N3
NC(=O)N(O)Cc2ccc(c1ccccc1)o2	ZINC000000010360	c2ccc(c1ccco1)cc2
Cc2cnc1ccc(Br)c[n+]1c2C	ZINC000000078045	c2cc[n+]1cccnc1c2
Cc3ccc(\C=N\N2CCN(c1ccccc1)CC2)s3	ZINC000000028635	C2CN(c1ccccc1)CCN2N=Cc3cccs3
CS(=O)(=O)N2CCN(S(=O)(=O)NCC1CCN(CCO)CC1)CC2	ZINC000443313256	O=S(=O)(NCC1CCNCC1)N2CCNCC2
C4CN=C(c3ccc2cc(C1=NCCN1)[nH]c2c3)N4	ZINC000001583607	C4CN=C(c3ccc2cc(C1=NCCN1)[nH]c2c3)N4
CNC(=O)Oc3ccc(c2c[n+]1cc(Cl)ccc1n2C)cc3	ZINC000000387370	c3ccc(c2c[n+]1ccccc1[nH]2)cc3
COC(=O)[C@@H]1C[C@@H](O)CN1S(=O)(=O)c2ccc(OC)c(OC)c2	ZINC000000166248	O=S(=O)(N1CCCC1)c2ccccc2
CC(=O)N3CCN(c2[nH]c(=S)c(C#N)c1CC(C)(C)OCc12)CC3	ZINC000000496250	S=c3cc1CCOCc1c(N2CCNCC2)[nH]3
CNC(=O)NC[C@@H]1CN(C(=O)C(=O)N(C)CCOCCO)CCO1	ZINC000625565822	C1COCCN1
C[C@@H]3CC(=O)c2n(Cc1ccccc1)nc[n+]2N3	ZINC000000409681	O=C2CCN[n+]3cnn(Cc1ccccc1)c23
CC(C)(CNC(=O)N2CC(S(=O)(=O)N1CCNCC1)C2)NS(C)(=O)=O	ZINC000669472625	O=S(=O)(C1CNC1)N2CCNCC2
COc4ccc3SCCN(C(=O)CCN2CCC(Cc1ccccc1)CC2)Cc3c4	ZINC000000600324	O=C(CCN2CCC(Cc1ccccc1)CC2)N4CCSc3ccccc3C4
CC(C)N[C@H]1CCn2c(=O)[nH]c3cccc([C@@H]1O)c23	ZINC000000004010	O=c1[nH]c3cccc2CCCCn1c23
CC(=O)NC2(C(Cl)(Cl)Cl)Oc1ccccc1O2	ZINC000000045398	C2Oc1ccccc1O2
Cc3ccnc(NS(=O)(=O)c2ccc1ccccc1c2)c3	ZINC000000037582	O=S(=O)(Nc1ccccn1)c3ccc2ccccc2c3
Oc1ccc(Cl)cc1NC=c2c(=O)[nH]c(=S)[nH]c2=O	ZINC000000059283	O=c1[nH]c(=S)[nH]c(=O)c1=CNc2ccccc2
C(c2ccc1ccccc1n2)[n+]3ccccc3	ZINC000000041806	C(c2ccc1ccccc1n2)[n+]3ccccc3
C[N@]1CCC[C@@H]1CCNS(=O)(=O)c2ccc(Br)cc2	ZINC000000352673	O=S(=O)(NCCC1CCCN1)c2ccccc2
Oc2cc(Cc1ccccc1)cnc2CN3CCCCC3	ZINC000000186208	C3CCN(Cc2ccc(Cc1ccccc1)cn2)CC3
Nc2sc1CCCCc1c2C(=O)c3cccc(Cl)c3	ZINC000000004121	O=C(c1ccccc1)c3csc2CCCCc23
Brc1ccccc1C(=O)Nc3ccc(S(=O)(=O)Nc2ncccn2)cc3	ZINC000000800951	O=C(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c3ccccc3
Cc3ccc2[n+](Cc1ccc(Br)cc1)csc2c3	ZINC000000271714	C(c1ccccc1)[n+]2csc3ccccc23
CN(C)CCO[C@](C)(c1ccccc1)c2ccc(Cl)cc2	ZINC000000000137	C(c1ccccc1)c2ccccc2
CSc1nc(C)cc(C)c1CN	ZINC000000036450	c1ccncc1
CSc2ccc(OCc1ncc(N(=O)=O)n1C)cc2	ZINC000000001448	C(Oc1ccccc1)c2ncc[nH]2
CN(C)[C@@](C)(CO)Cc1ccc(Cl)c(Cl)c1	ZINC000000000130	c1ccccc1
CN(C)CCOC(=O)c2sc1ccccc1c2Cl	ZINC000000195505	c2ccc1sccc1c2
COc3ccc2sc1ccccc1n(CCCN(C)C)c2c3	ZINC000000000488	c3ccc2sc1ccccc1[nH]c2c3
CN[C@@H](C)C(=O)c1ccc(OC)cc1	ZINC000000000486	c1ccccc1
N=C2CC(C=O)=Cc1ccccc1N2	ZINC000000023320	N=C2CC=Cc1ccccc1N2
C[C@@H]1O[C@@]2(CS1)CN3CCC2CC3	ZINC000000010163	C1CN3CCC1C2(CSCO2)C3
CCOC(=O)N(c1ccccc1)S(=O)(=O)c2ccccc2	ZINC000000041918	O=S(=O)(Nc1ccccc1)c2ccccc2
O[C@H]2C[N+]3(Cc1ccccc1N(=O)=O)CCC2CC3	ZINC000000178979	C2C[N+]3(Cc1ccccc1)CCC2CC3
Clc2ccc(Cl)c(NC(=O)C[C@@H]1NCCCNC1=O)c2	ZINC000000118114	O=C(CC1NCCCNC1=O)Nc2ccccc2
CC(C)N[C@@H](C)Cc1ccc(O)cn1	ZINC000000004659	c1ccncc1
CC[C@@H](CO)NC[C@@H](O)Cn2c1ccccc1c3ccccc23	ZINC000000572317	c1ccc3c(c1)[nH]c2ccccc23
COc3ccc(\C=c2/sc(N1CCN(C(C)=O)CC1)nc2=O)cc3	ZINC000000048273	O=c2nc(N1CCNCC1)sc2=Cc3ccccc3
CC2(C)C[C@](Cc1ccccc1)([C@@H](CN)CO)CCO2	ZINC000000191084	C2CC(Cc1ccccc1)CCO2
CC(C)(C)OC(=O)[C@H]1CCCN1	ZINC000000156852	C1CCNC1
CC(C)O[C@@]23Oc1ccccc1C=C2N4CCC3CC4	ZINC000000178975	C1CN4CCC1C3Oc2ccccc2C=C34
CC[C@@H](C)NS(=O)(=O)c2ccc(NS(=O)(=O)c1ccc(Br)cc1)cc2	ZINC000001127369	O=S(=O)(Nc1ccccc1)c2ccccc2
CN(C)CCOC(=O)c2ccc1[nH]c(C)c(C)c1c2	ZINC000000247661	c2ccc1[nH]ccc1c2
CNC[C@@H](OC)c1cccc(C(F)(F)F)c1	ZINC000000000313	c1ccccc1
CC(C)(C)NC[C@@H](O)c1ccccc1F	ZINC000000000311	c1ccccc1
CN(C)c2ccc(\C=N\NC(=S)Nc1cccc(C)c1)cc2	ZINC000000027893	S=C(NN=Cc1ccccc1)Nc2ccccc2
C2CN(Cc1ccccc1)CCC2NCc3ccco3	ZINC000002382998	C2CN(Cc1ccccc1)CCC2NCc3ccco3
FC(F)(F)c2ccc([C@@H]1CNC(=N)O1)cc2	ZINC000000000318	N=C2NCC(c1ccccc1)O2
CN(C)Cc2cccc(NC(=O)NCCC(=O)N1CCN(C)CC1)c2	ZINC000046227561	O=C(NCCC(=O)N1CCNCC1)Nc2ccccc2
COc2cccc3[C@@H]1CC[N@@](CC=C)[C@H]1CCc23	ZINC000000013943	C3CC1C(CCc2ccccc12)N3
O[C@H](CNC1CCC1)c2ccc(O)c(O)c2	ZINC000000000551	C2CC(NCCc1ccccc1)C2
Cc4ccc(c3nc(CN1CCCCC1)cc(CN2CCCCC2)c3O)cc4	ZINC000000754191	C4CCN(Cc3cc(CN1CCCCC1)nc(c2ccccc2)c3)CC4
C[N+]2(C)CCc1cc(Br)ccc12	ZINC000000021672	C2Cc1ccccc1N2
CN4CCC(N(C)c2nc(c1ccccc1)nc3ccccc23)CC4	ZINC000000132601	C4CC(Nc2nc(c1ccccc1)nc3ccccc23)CCN4
COc2ccc(Nc1ncc[nH]1)c(C)c2	ZINC000000020287	N(c1ccccc1)c2ncc[nH]2
C[C@@H]2CC[C@@H](NC(=O)N1CCN(CC(N)=O)C(=O)C1)CS2(=O)=O	ZINC000666374085	O=C2CN(C(=O)NC1CCCS(=O)(=O)C1)CCN2
NC[C@@H](O)COc1c(Cl)cccc1Cl	ZINC000000139845	c1ccccc1
CCN(CC)CC(=O)Nc1c(C#N)cnn1c2ccccc2	ZINC000000159845	c2ccc(n1cccn1)cc2
COc2cc(NS(=O)(=O)c1ccc(NC(C)=O)cc1)nc(OC)n2	ZINC000000826341	O=S(=O)(Nc1ccncn1)c2ccccc2
CN3CCC(CC(=O)N[C@@H]2CCC[N@@](Cc1ccccc1F)C2)CC3	ZINC000012431920	O=C(CC1CCNCC1)NC3CCCN(Cc2ccccc2)C3
Nc2cc(N)nc(SCC(=O)c1ccccc1)n2	ZINC000000351585	O=C(CSc1ncccn1)c2ccccc2
CC(=O)NC1CC(C)(C)NC(C)(C)C1	ZINC000000154561	C1CCNCC1
Nc2ncnc3n([C@@H]1C[C@@H](O)[C@H](CO)O1)c(Br)nc23	ZINC000000158249	C3COC(n1cnc2cncnc12)C3
O=C(C[N@]2CCc1ccccc1C2)Nc3ccccc3	ZINC000000420165	O=C(CN2CCc1ccccc1C2)Nc3ccccc3
CC(C)NCC(=O)Nc2c1CCN(C)c1nc3ccccc23	ZINC000000355059	C3Cc2cc1ccccc1nc2N3
COC(=O)[C@@H]2C[C@@H](O)CN(C[C@H](O)C[N@]1C[C@@H](O)C[C@@H](C(=O)OC)C1)C2	ZINC000592203815	C2CCN(CCCN1CCCCC1)CC2
CCN(CC)c2ccc(C[N@]1CCC[C@@H](C(N)=O)C1)cc2	ZINC000000214412	C2CCN(Cc1ccccc1)CC2
COc3cc(OC)c(\C=c2/c(=O)[nH]c(=O)n(c1ccc(Br)cc1)c2=O)cc3OC	ZINC000001153816	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)n2c3ccccc3
Fc3ccc(N2C(=O)C[C@H](N1CCSCC1)C2=O)cc3	ZINC000000063621	O=C2CC(N1CCSCC1)C(=O)N2c3ccccc3
O[C@H]4[C@H](N2CCN(c1cnccn1)CC2)c3ccccc3C45CCNCC5	ZINC000020636782	C1CC5(CCN1)CC(N3CCN(c2cnccn2)CC3)c4ccccc45
Cc3nnc2sc(C(=O)Nc1ccccc1)c(C(O)=O)n2c3=O	ZINC000000173627	O=C(Nc1ccccc1)c3cn2c(=O)cnnc2s3
CCOc3cc(\C=c2\c(=O)[nH]n(c1ccc(Cl)cc1)c2=O)cc(I)c3OC	ZINC000000993898	O=c2[nH]n(c1ccccc1)c(=O)c2=Cc3ccccc3
Cc2nn(Cc1ccccc1F)c(C)[n+]2N	ZINC000000405175	C(c1ccccc1)n2cncn2
COc1cccc(O)c1[C@@H]3NCc2ccccc2n4cccc34	ZINC000000104524	C3NC(c1ccccc1)c2cccn2c4ccccc34
CCS(=O)(=O)C(C)(C)S(=O)(=O)CC	ZINC000000002116	nonring
CS(=O)(=O)NC3CN(S(=O)(=O)c2ccc1[nH]c(=O)c(=O)[nH]c1c2)C3	ZINC000625433791	O=c3[nH]c2ccc(S(=O)(=O)N1CCC1)cc2[nH]c3=O
C[C@@H](Nc2nc(N1CCNCC1)nc3ccccc23)c4ccccc4	ZINC000000568534	C4CN(c3nc(NCc1ccccc1)c2ccccc2n3)CCN4
NS(=O)(=O)c1ccc(NC(=O)[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)cc1	ZINC000004417047	c1ccccc1
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
NC(=N)NC(=N)Nc1ccccc1S	ZINC000000164150	c1ccccc1
FC(F)(F)c3c1CCCCc1nc(SCCN2CCCC2)c3C#N	ZINC000000663898	C3CCN(CCSc2ccc1CCCCc1n2)C3
CC(C)N(CCCNC(=O)C(=O)NCC(=O)N1CCNCC1)C(C)C	ZINC000642787363	C1CNCCN1
C[C@H](OC[C@H](O)CNC1CC(C)(C)NC(C)(C)C1)c2ccc(Cl)cc2	ZINC000002652686	C(CNC1CCNCC1)COCc2ccccc2
NNc3cc(N1CCOCC1)nc(OCCc2ccccn2)n3	ZINC000000033983	C3CN(c2ccnc(OCCc1ccccn1)n2)CCO3
Cc2cc[n+](Cc1ccc(Br)cc1)cc2	ZINC000000084099	C(c1ccccc1)[n+]2ccccc2
Cc3ccc(N2C[C@@H](C(=O)Nc1cccc(N(=O)=O)c1)CC2=O)cc3	ZINC000000044365	O=C2CC(C(=O)Nc1ccccc1)CN2c3ccccc3
NCc1ccc(C(F)(F)F)nc1	ZINC000000154410	c1ccncc1
O=C(N1CCOCC1)c2ccccc2c4nc3ccccc3[nH]4	ZINC000000031983	O=C(N1CCOCC1)c2ccccc2c4nc3ccccc3[nH]4
NC(=N)c1ccc(C(F)(F)F)nc1	ZINC000000154415	c1ccncc1
Cc2sc1ccccc1c2CC3=NCCN3	ZINC000000001721	C3CN=C(Cc1csc2ccccc12)N3
C[N@@](Cn1c(=O)oc2ccccc12)C3CCCCC3	ZINC000000034170	O=c2oc1ccccc1n2CNC3CCCCC3
CCS(=O)(=O)N2CCC(C(=O)NCC[N@]1CCCC[C@@H]1C)CC2	ZINC000000262546	O=C(NCCN1CCCCC1)C2CCNCC2
O[C@@H]([C@H](N1CCCCC1)c2ccccc2)c3ccc(Cl)cc3	ZINC000000346081	C3CCN(C(Cc1ccccc1)c2ccccc2)CC3
CC(C)c2ccc(C[N@]1CCC[C@@H](O)C1)cc2	ZINC000000200891	C2CCN(Cc1ccccc1)CC2
COc2ccc(CNCc1ccc(F)cc1)cc2OC	ZINC000000172208	C(NCc1ccccc1)c2ccccc2
C[C@@H](OC(=O)c1cccc(Cl)c1)c2ccc[n+](C)c2	ZINC000000136719	O=C(OCc1cccnc1)c2ccccc2
CC3(C)Cc1ccccc1C(N2CCOCC2)=N3	ZINC000000051827	C3CN(C1=NCCc2ccccc12)CCO3
COc2ccc(S(=O)(=O)Nc1ccc(C#N)cc1)cc2	ZINC000000030295	O=S(=O)(Nc1ccccc1)c2ccccc2
FC(F)(F)c2ccnc(N1CCCNCC1)n2	ZINC000000066276	C2CNCCN(c1ncccn1)C2
CC(C)(CO)NC[C@H](O)Cn2c1ccccc1c3ccccc23	ZINC000000339502	c1ccc3c(c1)[nH]c2ccccc23
COc2ccc(OC)c1C[C@@]3(CCc12)CN=CN3	ZINC000000006258	C2CC1(CN=CN1)Cc3ccccc23
C[C@@]14CCCN1c3cc2[nH]c(=O)cc(C(F)(F)F)c2cc3CC4	ZINC000000007303	O=c4ccc3cc2CCC1CCCN1c2cc3[nH]4
C2CN(Cc1ccccc1)CCC2N4CCN(c3ncccn3)CC4	ZINC000000757696	C2CN(Cc1ccccc1)CCC2N4CCN(c3ncccn3)CC4
O[C@@]3(c1ccc(F)cc1)C[n+]2ccccc2N3c4ccccc4	ZINC000000239777	C3C(c1ccccc1)N(c2ccccc2)c4cccc[n+]34
CNC(=O)[C@@H]1CCCN1C(=O)C(=O)N3CCN(c2nccnn2)CC3	ZINC000625441386	O=C(N1CCCC1)C(=O)N3CCN(c2nccnn2)CC3
C[C@@H](N1CCC(=C)CC1)[C@](O)(Cn2cncn2)c3ccc(F)cc3F	ZINC000000006251	C=C3CCN(CC(Cn1cncn1)c2ccccc2)CC3
S=C2N[C@H]1CCCC[C@@H]1N2CN3CCCC3	ZINC000000353187	S=C2NC1CCCCC1N2CN3CCCC3
CC3(C)CC(N2CN(C1CCCCC1)CC2=O)CC(C)(C)N3	ZINC000000141619	O=C2CN(C1CCCCC1)CN2C3CCNCC3
Cc2nc(NC(=O)CNCC1CC1)sc2C	ZINC000000256458	O=C(CNCC1CC1)Nc2nccs2
CN(C)C[C@@H](NC(=O)NCCC(=O)N1CCN(C)CC1)c2ccccc2	ZINC000045185961	O=C(NCCC(=O)N1CCNCC1)NCc2ccccc2
C[N@]2CCCN(C(=S)Nc1ccccc1)CC2	ZINC000000097838	S=C(Nc1ccccc1)N2CCCNCC2
CN(C)CCC=c2c1ccccc1sc3ccccc23	ZINC000000001997	C=c2c1ccccc1sc3ccccc23
Clc4ccc(Nc2nc1[nH]onc1n3c(=S)nnc23)cc4	ZINC000000048914	S=c3nnc4c(Nc1ccccc1)nc2[nH]onc2n34
NS(=O)(=O)N2CCC(C(=O)NC[C@@H](N1CCNCC1)C(F)(F)F)CC2	ZINC000261759909	O=C(NCCN1CCNCC1)C2CCNCC2
CCC(=O)OC2(CC#C)CCN(CCc1ccccc1)CC2	ZINC000000001992	C2CCN(CCc1ccccc1)CC2
C[N@]2[C@H](c1ccccc1)CC(=O)[C@]3(O)CCCC[C@H]23	ZINC000000085683	O=C3CC(c1ccccc1)NC2CCCCC23
O=c2nc(N1CCOCC1)s/c2=c3/c(=O)[nH]c4ccccc34	ZINC000000036982	O=c2nc(N1CCOCC1)sc2=c3c(=O)[nH]c4ccccc34
COc2ccc(OC)c(S(=O)(=O)N1CCCC[C@@H]1C(O)=O)c2	ZINC000000248460	O=S(=O)(N1CCCCC1)c2ccccc2
CC(C)n3cc4C[C@H]2[C@@H](C[C@H](C(=O)N[C@@H]1CCC[C@@H]1O)C[N@@]2C)c5cccc3c45	ZINC000000598189	O=C(NC1CCCC1)C3CNC2Cc4c[nH]c5cccc(C2C3)c45
NC(=O)CN4CCC(N[C@H]2[C@H](O)C1(CCNCC1)c3ccccc23)CC4	ZINC000072440146	C4CC(NC2CC1(CCNCC1)c3ccccc23)CCN4
COc3ccc2n(C)c(C)c(C(=O)CNC1=NCCS1)c2c3	ZINC000000117589	O=C(CNC1=NCCS1)c2c[nH]c3ccccc23
CN(C)S(=O)(=O)N2CCC[C@@H](NS(=O)(=O)N1CCO[C@@H](C#N)C1)C2	ZINC000557861873	O=S(=O)(NC1CCCNC1)N2CCOCC2
Brc2ccc(NC(=O)Cc1ccc(N(=O)=O)cc1)nc2	ZINC000000043535	O=C(Cc1ccccc1)Nc2ccccn2
COC(=O)[C@@]2(C)CC[C@@H](C(=O)Nc1ccccc1C(O)=O)C2(C)C	ZINC000000036755	O=C(Nc1ccccc1)C2CCCC2
CC[C@@H](NC(=O)C(=O)N1CCO[C@@H](C(=O)NC)C1)C(=O)N2CCOCC2	ZINC000288390862	O=C(CNC(=O)C(=O)N1CCOCC1)N2CCOCC2
Cc1[nH]cnc1Cc3nc(c2ccccc2)cs3	ZINC000000004346	C(c1c[nH]cn1)c3nc(c2ccccc2)cs3
CCCNC(=N)NC(=N)Nc1ccc(Cl)cc1	ZINC000005781444	c1ccccc1
CC2=C(C#N)[C@@H](c1ccc[n+](C)c1)C(C#N)=C(N)S2	ZINC000000496102	S2C=CC(c1cccnc1)C=C2
O=S(=O)(NC[C@@H]1CCCO1)c2ccccc2	ZINC000000029399	O=S(=O)(NCC1CCCO1)c2ccccc2
C[C@@H]4C[N+]1(CCCCC1)C[C@@](O)(c3ccc2ccccc2c3)O4	ZINC000000162693	C1CC[N+]4(CC1)CCOC(c3ccc2ccccc2c3)C4
CCOC(=O)[C@@H](C)Sc2nc1n(C)c(=O)[nH]c(=O)c1n2C	ZINC000000180695	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
COCC(=O)N3CCN(C(=O)C1CCNCC1)[C@H](C(=O)N[C@H]2CCCNC2=O)C3	ZINC000008299530	O=C1NCCCC1NC(=O)C2CNCCN2C(=O)C3CCNCC3
CC[N+](C)(C)c1cccc(O)c1	ZINC000000001341	c1ccccc1
OCCN(CCO)Cc1ccccc1CC#N	ZINC000000139597	c1ccccc1
COc1ccccc1CNC(N)=N	ZINC000000235180	c1ccccc1
Cc2cc(C)nc(SCC(=O)Nc1ccc(F)cc1F)n2	ZINC000000031563	O=C(CSc1ncccn1)Nc2ccccc2
CCOC(=O)C2CCN(Cc1ccc(F)c(F)c1)CC2	ZINC000000239176	C2CCN(Cc1ccccc1)CC2
O=C([C@@H]1CNCCO1)N3CCN(S(=O)(=O)N2CCOCC2)CC3	ZINC000262653417	O=C(C1CNCCO1)N3CCN(S(=O)(=O)N2CCOCC2)CC3
Cc2ccc(F)c(C1=NCCN1)c2	ZINC000000026886	C2CN=C(c1ccccc1)N2
O=C1SCCN1Cc2ccccc2	ZINC000000004221	O=C1SCCN1Cc2ccccc2
C[C@H](Oc1ccccc1)C(=O)NCc2ccncc2	ZINC000000030923	O=C(COc1ccccc1)NCc2ccncc2
CCOC(=O)C2CCN(Cc1ccccc1OC)CC2	ZINC000000240503	C2CCN(Cc1ccccc1)CC2
NC(=O)C[C@@H]3CN(C(=O)C(=O)N2CCN(c1cccnn1)CC2)CCO3	ZINC000625457644	O=C(N1CCOCC1)C(=O)N3CCN(c2cccnn2)CC3
OC(=O)c1nccnc1C(=O)Nc3cccc2CCCCc23	ZINC000000069476	O=C(Nc2cccc1CCCCc12)c3cnccn3
CCNC(=O)N2C(=O)C1(OCCO1)c3cc(Br)ccc23	ZINC000000298186	O=C2Nc1ccccc1C23OCCO3
CC(=O)Oc2c(C)c(C)c1O[C@@](C)(CC[N+](C)(C)C)CCc1c2C	ZINC000000012154	C2COc1ccccc1C2
Cc3ccc([C@@H]1C(C#N)=C(N)OC2=C1C(=O)CCC2)c(C)c3	ZINC000000028049	O=C1CCCC3=C1C(c2ccccc2)C=CO3
CCN2CCN(C(=S)Nc1cccc(F)c1)CC2	ZINC000000316006	S=C(Nc1ccccc1)N2CCNCC2
O=C1CCCN1[C@@H]2CCCc3ccccc23	ZINC000000016136	O=C1CCCN1C2CCCc3ccccc23
CNS(=O)(=O)c1cccnc1N2CCN(C(C)C)CC2	ZINC000000481382	C2CN(c1ccccn1)CCN2
O=C3C[C@@H](C(=O)N[C@@H]2CC[N@@](CCN1CCOCC1)C2)NC(=O)N3	ZINC000668821455	O=C3CC(C(=O)NC2CCN(CCN1CCOCC1)C2)NC(=O)N3
CN(C)C[C@@H]1CCC[C@@H](CN(C)C)C1=NO	ZINC000004791865	N=C1CCCCC1
CN(C)CC(C)(C)CNC(=O)C2CCN(Cc1ccccc1O)CC2	ZINC000004388637	C2CCN(Cc1ccccc1)CC2
Nc3cc(N)nc(SCC(=O)N1CCc2ccccc12)n3	ZINC000000420137	O=C(CSc1ncccn1)N2CCc3ccccc23
O[C@@H]2CCC[N@@](Cc1cccnc1)C2	ZINC000000199796	C2CCN(Cc1cccnc1)CC2
C[N@]1CCCC[C@@H]1Cc2c[nH]cn2	ZINC000000016606	C2CCC(Cc1c[nH]cn1)NC2
C[C@@H](O)CN(C[C@@H](C)O)Cc1cccc(Cl)c1	ZINC000000042119	c1ccccc1
COc1cscc1C(=O)NC3(O)C(=O)c2ccccc2C3=O	ZINC000000143725	O=C(NC2C(=O)c1ccccc1C2=O)c3ccsc3
CCC[n+]3ccc(c1c[nH]c2ccccc12)cc3	ZINC000000042755	c3ccc2c(c1ccncc1)c[nH]c2c3
CCO[C@@H]2CN(C(=O)C(=O)NC1CCN(CCN(C)C)CC1)C[C@H]2CN	ZINC000652679090	O=C(NC1CCNCC1)C(=O)N2CCCC2
O=c4[nH]c(=O)c(=Cc3ccc(c2ccc1c(=O)[nH]c(=O)c1c2)o3)c(=O)[nH]4	ZINC000001187263	O=c4[nH]c(=O)c(=Cc3ccc(c2ccc1c(=O)[nH]c(=O)c1c2)o3)c(=O)[nH]4
CN4CCN(c2ccnc3ccc(NC(=O)Cc1cccc(Cl)c1Cl)cc23)CC4	ZINC000000586016	O=C(Cc1ccccc1)Nc4ccc3nccc(N2CCNCC2)c3c4
N(c1ccncc1)n3c(c2ccncc2)nnc3c4ccncc4	ZINC000000392387	N(c1ccncc1)n3c(c2ccncc2)nnc3c4ccncc4
CCc3nn2c(=O)cc(N1CCNCC1)nc2s3	ZINC000000213538	O=c2cc(N1CCNCC1)nc3scnn23
Cc1c(Cl)cccc1NS(C)(=O)=O	ZINC000000029498	c1ccccc1
S=C(NCc1ccco1)Nc2nccs2	ZINC000000008935	S=C(NCc1ccco1)Nc2nccs2
CCS(=O)(=O)N3C[C@@H]2C[N@@](Cc1cc(=O)[nH]c(=O)[nH]1)C[C@]2(C(O)=O)C3	ZINC000096151859	O=c3cc(CN2CC1CNCC1C2)[nH]c(=O)[nH]3
CCOC(=O)c3ccc(NC(=S)N2CCC(N1CCCCC1)(C(N)=O)CC2)cc3	ZINC000000787383	S=C(Nc1ccccc1)N3CCC(N2CCCCC2)CC3
O=C([C@@H]1CCCN1)N3CCN(C2CCCC2)CC3	ZINC000019687875	O=C(C1CCCN1)N3CCN(C2CCCC2)CC3
NC[C@@H](O)C[C@@H]3NC(=O)[C@@H](N)Cc1cc(ccc1O)c2ccc(O)c(c2)[C@@H](O)[C@@H](C(O)=O)NC3=O	ZINC000014859745	O=C2CCc1cccc(c1)c3cccc(CCNC(=O)CN2)c3
C2CN(Cc1ccccn1)CCS2	ZINC000000277731	C2CN(Cc1ccccn1)CCS2
O=c3cc(Nc2ccc(N1CCCCCC1)cc2)[nH]c(=O)[nH]3	ZINC000000277732	O=c3cc(Nc2ccc(N1CCCCCC1)cc2)[nH]c(=O)[nH]3
CCOc2cc([C@@H]1NC(=S)NC(C)=C1C(=O)NC)ccc2O	ZINC000000083282	S=C2NC=CC(c1ccccc1)N2
CN(C)C(=O)N(C)[C@@H]2CCN(C(=O)C(=O)NCC(=O)N1CCNCC1)C2	ZINC000659716093	O=C(CNC(=O)C(=O)N1CCCC1)N2CCNCC2
C[C@@H](CNC(=O)C(=O)NCCS(=O)(=O)NC(C)(C)C)S(N)(=O)=O	ZINC000541028775	nonring
CCN(CC)C(N)=C(N=Nc1ccc(C)cc1)C#N	ZINC000000067827	c1ccccc1
NCC(=O)N[C@H](CCCNC(N)=N)C(=O)Nc1ccc(N(=O)=O)cc1	ZINC000004545953	c1ccccc1
OC[C@@H]2CCC[N@@](Cc1ccc(Br)o1)C2	ZINC000000209142	C2CCN(Cc1ccco1)CC2
Nc3nc(Br)c2ncn([C@@H]1CC[C@H](CO)O1)c2n3	ZINC000000014849	C3COC(n1cnc2cncnc12)C3
COc2ccc(S(=O)(=O)Nc1ccccc1C(=O)NC(C)C)cc2Br	ZINC000001138184	O=S(=O)(Nc1ccccc1)c2ccccc2
CC(C)(C)NC[C@@H](O)COc2cccc1CCCSc12	ZINC000000000748	C2CSc1ccccc1C2
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
NS(=O)(=O)c2ccc(NS(=O)(=O)/C=C/c1ccccc1)cc2	ZINC000000405550	O=S(=O)(Nc1ccccc1)C=Cc2ccccc2
C[C@@H](NS(=O)(=O)c1cnn(C)c1)C(=O)N(CCN(C)C)CCN(C)C	ZINC000531776432	c1cn[nH]c1
CCOC(=O)c1c(N)nn(C(=O)C(C)C)c1c2ccc(OC)cc2	ZINC000000105064	c2ccc(c1ccn[nH]1)cc2
C=CC[N+]2(CC#Cc1ccccc1)CCOCC2	ZINC000000196849	C2CN(CC#Cc1ccccc1)CCO2
COCCN(C)S(=O)(=O)N1CCOC[C@@H]1CNS(C)(=O)=O	ZINC000625625741	C1COCCN1
Fc1ccccc1[C@@H]2SCC(=O)N2CCN3CCCCC3	ZINC000000072749	O=C2CSC(c1ccccc1)N2CCN3CCCCC3
C[C@H]2C=C(C)C[C@@H](C(=O)N1CCN(C)CC1)[C@@H]2C(O)=O	ZINC000000118018	O=C(C1CCC=CC1)N2CCNCC2
C[C@@H]1CCCC[C@@H]1[N@]2CNc3c(C2)c(=O)n(C)c(=O)n3C	ZINC000000477793	O=c3[nH]c2NCN(C1CCCCC1)Cc2c(=O)[nH]3
CC3CCN(Cn2cnn(CN1CCC(C)CC1)c2=S)CC3	ZINC000000102969	S=c2n(CN1CCCCC1)cnn2CN3CCCCC3
CN2CCC(=NOC(=O)Nc1ccccc1)CC2	ZINC000000171161	O=C(Nc1ccccc1)ON=C2CCNCC2
CN(C)C[C@@H](O)COc1ccccc1CCc2ccccc2	ZINC000000013099	C(Cc1ccccc1)c2ccccc2
NCc3ccc(c2cc(c1ccccc1)[nH]n2)cc3	ZINC000000008800	c3ccc(c2cc(c1ccccc1)[nH]n2)cc3
CNC(=O)N[C@@H]2CCN(C(=O)C(=O)NCCC(=O)N1CCN(C)CC1)C2	ZINC000559773104	O=C(CCNC(=O)C(=O)N1CCCC1)N2CCNCC2
ClC1=CC[C@@H]3[C@@H](C1)C(=O)N(CC[n+]2ccccc2)C3=O	ZINC000000105262	O=C2C1CC=CCC1C(=O)N2CC[n+]3ccccc3
CC(=O)NC2CN(S(=O)(=O)CCCS(=O)(=O)N=c1nc[nH]n1C)C2	ZINC000348354723	O=S(=O)(CCCS(=O)(=O)N1CCC1)N=c2nc[nH][nH]2
CCOC(=O)[C@@](Cl)(NC(=O)N[C@](Cl)(C(=O)OCC)C(F)(F)F)C(F)(F)F	ZINC000001856236	nonring
NC(=N)NCc2nc(c1ccccc1F)cs2	ZINC000000013096	c2ccc(c1cscn1)cc2
CN(C)Cc2ncc(Cc1ccc(C)cc1)cc2O	ZINC000000186994	C(c1ccccc1)c2cccnc2
CN(C)Cc2nc(c1c(Cl)cccc1Cl)no2	ZINC000000165973	c2ccc(c1ncon1)cc2
CN(CCN1CCCS1(=O)=O)C(=O)C(=O)N2CC[C@@](O)(C(F)(F)F)C2	ZINC000647561409	O=C(NCCN1CCCS1(=O)=O)C(=O)N2CCCC2
CNc3nc(NC[C@@]1(O)CCSC1)nc(NC[C@@]2(O)CCSC2)n3	ZINC000428180827	C3CC(CNc2ncnc(NCC1CCSC1)n2)CS3
CN3CCN(C[C@@]2(O)CCCN(C(=O)CN1CCN(CCO)CC1)CC2)CC3	ZINC000257242465	O=C(CN1CCNCC1)N3CCCC(CN2CCNCC2)CC3
COc2ccc(S(=O)(=O)n1[nH]c(=O)c(CCO)c1C)cc2	ZINC000001393749	O=c2ccn(S(=O)(=O)c1ccccc1)[nH]2
O[C@]13CCCC[C@H]1[C@H](c2ccc(N(=O)=O)cc2)NCC3	ZINC000000284790	C1CCC2C(C1)CCNC2c3ccccc3
Cc1nnsc1C(=O)NC3CCN(Cc2ccccc2)CC3	ZINC000000119758	O=C(NC2CCN(Cc1ccccc1)CC2)c3cnns3
CC3=CC(=O)C[C@@H]2CCc1cc(Cl)ccc1N23	ZINC000000022624	O=C3CC2CCc1ccccc1N2C=C3
CCn1c(C)nc2cc(CO)ccc12	ZINC000000226133	c2ccc1[nH]cnc1c2
CN2CCC(N(C)C(=S)NCCc1ccccc1)CC2	ZINC000000109209	S=C(NCCc1ccccc1)NC2CCNCC2
Cc3ccc(c2nnc(SCCN1CCCCC1)n2C)cc3	ZINC000000410805	C3CCN(CCSc2nnc(c1ccccc1)[nH]2)CC3
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
CC[N@]1CCC[C@@H]1CNC(=S)N2CCN(C)CC2	ZINC000035185067	S=C(NCC1CCCN1)N2CCNCC2
CSC2=NC(C)(C)C[C@@](C)(c1ccc(O)cc1O)N2	ZINC000000033343	C2CC(c1ccccc1)NC=N2
NC(=O)c2ccc(NC(=O)Cc1ccc(Br)cc1)cc2	ZINC000000030771	O=C(Cc1ccccc1)Nc2ccccc2
CC(=O)Nc4ccc3c(CCC2CCN(Cc1ccccc1)CC2)noc3c4	ZINC000000606711	C2CN(Cc1ccccc1)CCC2CCc3noc4ccccc34
C[S@@](=O)C[S@](=O)C[C@H](CO)NC(=O)C=Cc1c(C)[nH]c(=O)[nH]c1=O	ZINC000013910162	O=c1cc[nH]c(=O)[nH]1
CN2C(=O)OC1(CC(C)(C)NC(C)(C)C1)[C@@]2(C)O	ZINC000000036887	O=C2NCC1(CCNCC1)O2
CN(C)CCSc3nc(N)c2c1CC(C)(C)OCc1sc2n3	ZINC000000534356	C1Cc2c(CO1)sc3ncncc23
C[N+]3(CCO)CCN(c2nc1ccccc1o2)CC3	ZINC000000019138	C3CN(c2nc1ccccc1o2)CCN3
CN(C)Cc1ccc(OC(=O)N(C)C)c(Cl)c1	ZINC000000187884	c1ccccc1
Oc2ccc(C(=O)OCCN1CCCCC1)cc2	ZINC000000209540	O=C(OCCN1CCCCC1)c2ccccc2
COc2cccc(C(=O)Nc1ccc(C(C)=O)cc1)c2	ZINC000000029082	O=C(Nc1ccccc1)c2ccccc2
CN1C[C@H](NC(=O)[C@@H](N)CCCNC(N)=NN(=O)=O)C[C@H]1C(N)=O	ZINC000035064496	C1CCNC1
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
C[C@@H](Cc1c[nH]c2ccc(Cl)cc12)/N=C/c3ccc(N(C)C)cc3	ZINC000000053115	C(Cc1c[nH]c2ccccc12)N=Cc3ccccc3
OCC(CO)NCC(=O)Nc2cccc(S(=O)(=O)N1CCOCC1)c2	ZINC000519833951	O=S(=O)(N1CCOCC1)c2ccccc2
CS(=O)(=O)NCCNC(=O)N1CCCN(S(C)(=O)=O)CC1	ZINC000045586556	C1CNCCNC1
Cc2cc(C)c1[nH]c(C)c(CCN)c1c2	ZINC000000140715	c2ccc1[nH]ccc1c2
O=c2[nH]c(C[n+]1ccccc1)nc3ccccc23	ZINC000000103507	O=c2[nH]c(C[n+]1ccccc1)nc3ccccc23
Cc1ccc(C)c2c(CCN)c(C)[nH]c12	ZINC000000140717	c2ccc1[nH]ccc1c2
COc3cc2CCN(CCc1ccc(N)cc1)CCc2cc3OC	ZINC000000000830	C(Cc1ccccc1)N3CCc2ccccc2CC3
CC(C)C[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)CCCNC(=O)C[C@@H](C(N)=O)NC2=O	ZINC000029470976	O=C2CCNC(=O)CNC(=O)C(NC(=O)CCc1ccccc1)CCCN2
O=C(CSc2nc(c1ccncc1)ccc2C#N)NC3CC3	ZINC000000033166	O=C(CSc2cccc(c1ccncc1)n2)NC3CC3
CC[N@]5C[C@]3(COC)[C@H](O)C[C@H](OC)[C@@]46[C@@H]1C[C@@]2(O)[C@H](O)[C@@H]1[C@](O)([C@@H](O)[C@@H]2OC)[C@@H]([C@H](OC)[C@H]34)[C@@H]56	ZINC000070691794	C3CC1CNC2C4CC1C2(C3)C5CC6CCC4C5C6
CN(C)Cc1c(O)ccc2ccccc12	ZINC000000129301	c2ccc1ccccc1c2
CN(C)S(=O)(=O)N2CC(NC(=O)C(=O)Nc1c(C)cnn1C)C2	ZINC000628032212	O=C(NC1CNC1)C(=O)Nc2ccn[nH]2
Nc2cc(SCc1cccnc1)nc(N)n2	ZINC000000125124	C(Sc1ccncn1)c2cccnc2
COc2ccc1[nH]c(C(O)=O)c(CCNC(C)=O)c1c2	ZINC000000112920	c2ccc1[nH]ccc1c2
Oc2ccc3C[C@H]5[N@@](CC1CC1)CC[C@@]46[C@@H](Oc2c34)C(=C)CC[C@@]56O	ZINC000000403529	C=C1CCC2C3Cc5cccc6OC1C2(CCN3CC4CC4)c56
O[C@@H]3CCC[N@]([C@@H]2CCc1ccccc1C2)C3	ZINC000000221679	C3CCN(C2CCc1ccccc1C2)CC3
CC3(C)SC[C@@H](C(=O)Nc2nnc(C1CC1)s2)N3C=O	ZINC000000115420	O=C(Nc2nnc(C1CC1)s2)C3CSCN3
CC(C)(C)NS(=O)(=O)c1ccc(F)cc1	ZINC000000029553	c1ccccc1
Cc3ccc(NC2=NC1(CCCC1)NC(=N)N2)cc3	ZINC000000203776	N=C3NC(Nc1ccccc1)=NC2(CCCC2)N3
COc1ccccc1N2CCNCC2	ZINC000000012687	C2CN(c1ccccc1)CCN2
O=C1OCC[C@@H]3[C@@H]1[C@H]2CCC[N@@]2C35CCN(Cc4ccccc4)CC5	ZINC000004722431	O=C1OCCC3C1C2CCCN2C35CCN(Cc4ccccc4)CC5
CNS(=O)(=O)c1ccc(C)c(I)c1	ZINC000000161537	c1ccccc1
Cc1nnc(=O)[nH]c1N2CCNCC2	ZINC000000111708	O=c2nncc(N1CCNCC1)[nH]2
CCN(C)C(=O)CNC(=O)C(=O)NCCN1CCN(S(C)(=O)=O)CC1	ZINC000671358113	C1CNCCN1
CS(=O)(=O)N2CCN(S(=O)(=O)NCCN1CCNC(=O)C1)CC2	ZINC000512460973	O=C2CN(CCNS(=O)(=O)N1CCNCC1)CCN2
CN(C)CCOc1ccc(C#N)cc1	ZINC000000346289	c1ccccc1
CCNC(=O)[C@H]3O[C@@H](n1cnc2c(N)nc(C#CCN(C)C)nc12)[C@H](O)[C@@H]3O	ZINC000012405631	C3COC(n1cnc2cncnc12)C3
CC(C)NS(=O)(=O)[C@@H]1CCN(C(=O)C(=O)NC[C@@H](C)S(N)(=O)=O)C1	ZINC000541945892	C1CCNC1
CN(C)CCNC(=S)Nc1cccc(C(F)(F)F)c1	ZINC000000460013	c1ccccc1
CC[C@@H]3C[N+]2(C)CCc1cc(OC)c(OC)cc1[C@@H]2CC3=O	ZINC000000044568	O=C3CCN2CCc1ccccc1C2C3
Clc2cccc(NC(=O)CN1CCCC1)c2	ZINC000000050238	O=C(CN1CCCC1)Nc2ccccc2
O=C(CCn1c(=O)oc2ccccc12)NCCN3CCCCC3	ZINC000000128540	O=C(CCn1c(=O)oc2ccccc12)NCCN3CCCCC3
CCN(CC)CC(=O)Nc2sc1CCCCc1c2C#N	ZINC000000208789	C2CCc1sccc1C2
CN(C)CCCn2c(=N)n(C[C@@H](O)c1ccccc1)c3ccccc23	ZINC000000092849	N=c2[nH]c1ccccc1n2CCc3ccccc3
C[N@]1CCC[C@@H]1CCNC3C2CC4CC(C2)CC3C4	ZINC000000277390	C4CNC(CCNC2C1CC3CC(C1)CC2C3)C4
O=C1NCCCC[C@H]1NS(=O)(=O)c3ccc2OCCCOc2c3	ZINC000000131022	O=C1NCCCCC1NS(=O)(=O)c3ccc2OCCCOc2c3
N#CC2(c1ccccc1)CCNCC2	ZINC000000155176	C2CC(c1ccccc1)CCN2
Cn2cc(S(=O)(=O)NCCN1CCC[C@@H](CNS(N)(=O)=O)C1)cn2	ZINC000409448242	O=S(=O)(NCCN1CCCCC1)c2cn[nH]c2
O=C(Cc1ccccc1)N3CCN(C(=O)Cc2ccccc2)CC3	ZINC000000064866	O=C(Cc1ccccc1)N3CCN(C(=O)Cc2ccccc2)CC3
NC(=O)C(NC(=O)NC[C@@H]([C@@H]1CCOC1)N2CCOCC2)C(N)=O	ZINC000045440615	C2CC(CN1CCOCC1)CO2
CC3(C)CC(NC(=O)c2ccc(n1cnnn1)cc2)CC(C)(C)N3	ZINC000000036884	O=C(NC1CCNCC1)c3ccc(n2cnnn2)cc3
O=c3n(c1ccccc1)c2nnnn2c4ccccc34	ZINC000000045797	O=c3n(c1ccccc1)c2nnnn2c4ccccc34
CC(=C)c3cccc(C(C)(C)NC(=O)N[C@@H]1CN2CCC1CC2)c3	ZINC000000094195	O=C(NCc1ccccc1)NC2CN3CCC2CC3
CC(C)c2ccc(CNC(=O)CSc1nnc(N)s1)cc2	ZINC000000036148	O=C(CSc1nncs1)NCc2ccccc2
CN4CCN(c3ccc2nc1sc(C)c(C)c1c(=O)n2n3)CC4	ZINC000000102203	O=c3c1ccsc1nc4ccc(N2CCNCC2)nn34
CCOc2cc1CCN[C@H](C(CC)CC)c1cc2OCC	ZINC000000034606	C2Cc1ccccc1CN2
CCNC(=S)N1CCN(CC)CC1	ZINC000000300304	C1CNCCN1
CC24CN3CC(c1ccccc1)(CN(C2)C3[C@@H](O)[C@@H](O)[C@@H](O)[C@@H](O)CO)C4=O	ZINC000019339017	O=C2C1CN4CN(C1)CC2(c3ccccc3)C4
Cn2c(N)[n+](CC(=O)c1ccccc1)c3ccccc23	ZINC000000085627	O=C(C[n+]1c[nH]c2ccccc12)c3ccccc3
CC(C)NS(=O)(=O)NCCNC(=O)N2CC([N@]1CC[C@@H](O)C1)C2	ZINC000651061062	C2CCN(C1CNC1)C2
NCc1ccccc1Sc2ccccc2CO	ZINC000000056761	S(c1ccccc1)c2ccccc2
CCc2n(CC)c1ccccc1[n+]2C[C@@H](O)COc3c(C)cccc3C	ZINC000000781047	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
CN(C)Cc2ccc([C@@H](N)c1ccncc1)cc2	ZINC000011832609	C(c1ccccc1)c2ccncc2
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
Cc2cccc(OCCN1CCC(N)CC1)c2	ZINC000011729494	C2CCN(CCOc1ccccc1)CC2
COC(=O)Cc1c(I)c(C)[nH]c1C(=O)OC	ZINC000000393042	c1cc[nH]c1
CN3CCN(c2ccc(CN1CCS(=O)(=O)CC1)cc2)CC3	ZINC000000130144	O=S3(=O)CCN(Cc2ccc(N1CCNCC1)cc2)CC3
Cc4cc(n1ccnc1C)n3c2ccccc2nc3c4C#N	ZINC000000183184	c1ccc4c(c1)nc3cccc(n2ccnc2)n34
CNC(=O)NC[C@@H]2CN(C(=O)C(=O)N1CCOC[C@@H]1C[C@@H](C)O)CCO2	ZINC000625615315	O=C(N1CCOCC1)C(=O)N2CCOCC2
CN3[C@@H]2N=C(NCCN)N(Cc1ccccc1)[C@@H]2C(=O)N(C)C3=O	ZINC000036350327	O=C3NC2N=CN(Cc1ccccc1)C2C(=O)N3
Nc2nc(SCC(=O)NC[C@@H]1CCCO1)[nH]c(=O)c2c3ccccc3	ZINC000000817633	O=C(CSc2ncc(c1ccccc1)c(=O)[nH]2)NCC3CCCO3
Cc4c(C[N@]2CCc1ccccc1C2)c(=O)n(c3ccccc3)n4C	ZINC000000217874	O=c3c(CN2CCc1ccccc1C2)c[nH]n3c4ccccc4
CN2[C@H](c1ccccc1)CC(C)(O)C[C@H]2c3ccccc3	ZINC000000208438	C3CC(c1ccccc1)NC(c2ccccc2)C3
CN(C)CCSc2nc1ccccc1[nH]2	ZINC000000182695	c2ccc1[nH]cnc1c2
NC(=O)C2c1ccccc1CCc3ccccc23	ZINC000000001236	C2Cc1ccccc1Cc3ccccc23
NCCn2c(N)c(C#N)c3nc1ccccc1nc23	ZINC000000107333	c3ccc2nc1[nH]ccc1nc2c3
COC(=O)c2ccc(NC(=S)N1CCN(C)CC1)cc2	ZINC000000134398	S=C(Nc1ccccc1)N2CCNCC2
CN2C[C@@H](NC(=O)CNS(=O)(=O)c1ccc(C#N)cc1)C(=O)N2	ZINC000577637008	O=C(CNS(=O)(=O)c1ccccc1)NC2CNNC2=O
CN(C)CC[C@@]1(C)OCCC2=C1Cc3ccccc23	ZINC000000000635	C1CC2=C(CO1)Cc3ccccc23
CC(=C)[C@H]3CCC(CN2CCN(c1ccccn1)CC2)=CC3	ZINC000000278283	C3CCC(CN2CCN(c1ccccn1)CC2)=CC3
Nc2nc(N)nc(NC1CC1)n2	ZINC000000001239	C1CC1Nc2ncncn2
C3CCN(C[C@H]2COc1ccccc1O2)CC3	ZINC000000000631	C3CCN(CC2COc1ccccc1O2)CC3
O[C@H](CN1CCCCC1)Cn2ccnc2N(=O)=O	ZINC000000000630	C2CCN(CCCn1ccnc1)CC2
COC(=O)c2ccc(NC(=O)Cn1ccnc1)cc2	ZINC000000051297	O=C(Cn1ccnc1)Nc2ccccc2
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
CC2(C)CC(NCc1ccccc1)CC(C)(C)N2	ZINC000000140566	C2CC(NCc1ccccc1)CCN2
CC(C)[N@]3C[C@@H](C)[C@](OC(=O)c1ccccc1)(c2ccccc2)C[C@@H]3C	ZINC000000705292	O=C(OC2(c1ccccc1)CCNCC2)c3ccccc3
CCOC(=O)C1CCN(S(=O)(=O)N(C)C)CC1	ZINC000000030665	C1CCNCC1
C[C@@H](N)c1ccc(S(C)(=O)=O)cc1	ZINC000000154311	c1ccccc1
CN2C(=O)C[C@H](NCCc1ccc(S(N)(=O)=O)cc1)C2=O	ZINC000000077515	O=C2CC(NCCc1ccccc1)C(=O)N2
C[N@]1[C@H]4CC[C@@H]1CC(NC(=O)c2cnn3ccc(C)cc23)C4	ZINC000000008332	O=C(NC1CC2CCC(C1)N2)c3cnn4ccccc34
COc3ccc(/N=C/c1ccccc1N2CCN(C)CC2)cc3	ZINC000000112658	C3CN(c1ccccc1C=Nc2ccccc2)CCN3
C3CC[C@H](C2CCN(Cc1ccccc1)CC2)NC3	ZINC000003734775	C3CCC(C2CCN(Cc1ccccc1)CC2)NC3
O=C(COc1ccccc1)NC(=S)N2CCCc3ccccc23	ZINC000000048466	O=C(COc1ccccc1)NC(=S)N2CCCc3ccccc23
C1CN3CCC1C(c2ccccn2)=C3	ZINC000000004847	C1CN3CCC1C(c2ccccn2)=C3
OC(=O)c2cccc(NC(=S)N/N=C/c1ccc(N(=O)=O)cc1)c2	ZINC000000234136	S=C(NN=Cc1ccccc1)Nc2ccccc2
Cc4ccc([C@@H](O)Cn2c1=NCCCn1c3ccccc23)cc4	ZINC000000315384	C1CN=c3n(C1)c2ccccc2n3CCc4ccccc4
Cc2nc(S(=O)(=O)NCCC(=O)N1CCN(S(N)(=O)=O)CC1)cn2C	ZINC000600089615	O=C(CCNS(=O)(=O)c1c[nH]cn1)N2CCNCC2
O[C@@H](COc2cccc(CNCc1cccnc1)c2)C[N@]4CCc3ccccc3C4	ZINC000011937825	C(COc2cccc(CNCc1cccnc1)c2)CN4CCc3ccccc3C4
Nc1ccncc1Oc2ccccc2	ZINC000000004796	O(c1ccccc1)c2cccnc2
CCc3nc(N1CCNCC1)c2ncn(C)c2n3	ZINC000000004065	C3CN(c1ncnc2[nH]cnc12)CCN3
O=C(CN1CCCC1)Nc4c2CCCc2cc3CCCc34	ZINC000000347598	O=C(CN1CCCC1)Nc4c2CCCc2cc3CCCc34
CCN4CCN(Cc3nc(c2c(C)ncc1CNCCc12)no3)CC4	ZINC000019790118	C4CN(Cc3nc(c2cncc1CNCCc12)no3)CCN4
OCCN(CCO)Cc1ccccc1Sc2cccc3ccccc23	ZINC000000690112	S(c1ccccc1)c2cccc3ccccc23
CN[C@@H](C(C)C)C(=O)N[C@@H]1C=C(C(=O)N[C@H](C)C(N)=O)C[C@@H](O)[C@@H]1O	ZINC000003839688	C1CCC=CC1
C[C@@H]1CC(CN)(CC(O)=O)C[C@H]1C	ZINC000000007621	C1CCCC1
CCOC2CC(CNC(=O)NC[C@@](C)(O)CN(C)C)(N1CCOCC1)C2	ZINC000365836276	C2CC(N1CCOCC1)C2
O=C(N2CCN(C1CCCC1)CC2)c3ccco3	ZINC000000115855	O=C(N2CCN(C1CCCC1)CC2)c3ccco3
NC3=NC[C@@]1(CN2CCC1CC2)O3	ZINC000000014867	C1CN3CCC1C2(CN=CO2)C3
O=C2C[C@@H](C(=O)NCCc1ccccc1)SC3=NCCN23	ZINC000000105874	O=C2CC(C(=O)NCCc1ccccc1)SC3=NCCN23
Cc1c(Cl)cccc1NC(=O)C(O)=c2c(=O)[nH]c(=O)[nH]c2=O	ZINC000001630095	O=C(Nc1ccccc1)C=c2c(=O)[nH]c(=O)[nH]c2=O
CCN(C)C(=O)Oc1nsnc1c2c(Cl)cccc2Cl	ZINC000000006647	c2ccc(c1cnsn1)cc2
COc2ccc([C@@]1(CCN)C[C@@H](C)[N@@](C)C[C@H]1C)cc2	ZINC000004340231	C2CC(c1ccccc1)CCN2
CCN2CCC(NCc1ccccc1F)CC2	ZINC000000217535	C2CC(NCc1ccccc1)CCN2
CC(C)(C)NC[C@@H](O)c1ccc(O)c(NC(N)=O)c1	ZINC000000000124	c1ccccc1
CC(C)OC(=O)c2cc1c(OC[C@H](O)CNC(C)(C)C)cccc1[nH]2	ZINC000000000127	c2ccc1[nH]ccc1c2
CNCc2ccc(S(=O)(=O)NC[C@@H]1CCCC[N@]1C)cc2	ZINC000044565304	O=S(=O)(NCC1CCCCN1)c2ccccc2
CN([C@@H]1CCCC[C@@H]1N2CCCC2)C(=O)Cc3ccc(Cl)c(Cl)c3	ZINC000000643035	O=C(Cc1ccccc1)NC2CCCCC2N3CCCC3
C/C=C(\C)C[N@@]3CCc2nnc([C@@H](C)NC(=O)C1CCN(C)CC1)n2CC3	ZINC000011971482	O=C(NCc2nnc1CCNCCn12)C3CCNCC3
O=c3ccc2cccc(N1CCNCC1)c2o3	ZINC000000004465	O=c3ccc2cccc(N1CCNCC1)c2o3
COc2ccc(C[N@@](CCOC(C)=O)C1CCCCC1)cc2OC	ZINC000000614905	C2CCC(NCc1ccccc1)CC2
CC1(C)Cc2c(CO1)[nH]c3ncnc(N)c23	ZINC000000509451	C1Cc2c(CO1)[nH]c3ncncc23
Fc4ccc(C(=O)C[C@H]3CC[N@@](CCOc2cccc1OCCOc12)C3)cc4	ZINC000000600676	O=C(CC3CCN(CCOc2cccc1OCCOc12)C3)c4ccccc4
COc1ccccc1CN3CCC(N2CCCCC2)CC3	ZINC000000243796	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
C3CN(c2nc1ccccc1s2)CCN3	ZINC000000242024	C3CN(c2nc1ccccc1s2)CCN3
COc3cc2CC[C@H](N)c1cc(=O)c(N)ccc1c2c(OC)c3OC	ZINC000000265532	O=c3cccc2c(CCCc1ccccc12)c3
COC(=O)[C@@H](NC(=O)NC2CCN(Cc1ccccc1)CC2)C(C)C	ZINC000000544938	C2CCN(Cc1ccccc1)CC2
C[C@H]1C[C@@H](C)CN(C(=O)[C@@H](C)NCCCN(C)C)C1	ZINC000004969414	C1CCNCC1
CC[C@]2(C)C[C@@H]([C@@H](O)CNCc1ccc(OC)c(OC)c1)CCO2	ZINC000000434064	C(CC1CCOCC1)NCc2ccccc2
Ic3cccc(C(=O)Nc2ccc(S(=O)(=O)Nc1nccs1)cc2)c3	ZINC000000682381	O=C(Nc2ccc(S(=O)(=O)Nc1nccs1)cc2)c3ccccc3
Cn3cc(S(=O)(=O)N2CCN(C(=O)C[C@@H]1NC(=O)NC1=O)CC2)cc3C(N)=O	ZINC000024842530	O=C3NC(CC(=O)N2CCN(S(=O)(=O)c1cc[nH]c1)CC2)C(=O)N3
CCOC(=O)c1ccc(S(C)(=O)=O)c(C)c1O	ZINC000000040457	c1ccccc1
NC(=N)CSc1ccccc1	ZINC000000124482	c1ccccc1
CN(C)Cc2ccc(O)c(CCc1ccccc1)n2	ZINC000000186301	C(Cc1ccccn1)c2ccccc2
CCC[S@](=O)c2ccc1nc(NC(=O)OC)[nH]c1c2	ZINC000000000017	c2ccc1[nH]cnc1c2
Cc2ccc(CSC1=NCCCN1)cc2C	ZINC000000144275	C2CNC(SCc1ccccc1)=NC2
CCC[N@]1[C@H]3CC[C@@H]1CC(OC(=O)c2ccc(OC)c(OC)c2)C3	ZINC000000488024	O=C(OC1CC2CCC(C1)N2)c3ccccc3
CCOc1ccc2c(c1)C(C)=CC(C)(C)[N+]2(C)C	ZINC000000055070	C2Nc1ccccc1C=C2
CCOC(=O)c2cnc1c(C)c(Cl)ccc1c2NCCN(C)C	ZINC000000132709	c2ccc1ncccc1c2
C[C@H](CNC1CCCCC1)c2ccncc2	ZINC000000009592	C2CCC(NCCc1ccncc1)CC2
C[C@@H]2O[C@H](NNC(=O)c1ccc(Cl)cc1)[C@H](O)[C@H](O)[C@@H]2O	ZINC000000291903	O=C(NNC1CCCCO1)c2ccccc2
COc2cc(\C=N\n1cnnc1)cc(Cl)c2O	ZINC000000034093	C(=Nn1cnnc1)c2ccccc2
CN(C)C(=O)[C@@H]1CCC[N@]1CCCNC(=O)NCC2(O)CCN(C)CC2	ZINC000525446887	O=C(NCCCN1CCCC1)NCC2CCNCC2
C[N@]1CCc4c(C1)sc3N[C@@H](\C=C\c2ccccc2)NC(=O)c34	ZINC000000551825	O=C3NC(C=Cc1ccccc1)Nc4sc2CNCCc2c34
CC(C)(C)[C@H](N)Cn1ccnc1	ZINC000000111472	c1c[nH]cn1
C4CCN(CCN1CCn2c1nc3ccccc23)C4	ZINC000000499925	C4CCN(CCN1CCn2c1nc3ccccc23)C4
CN4CCN(C(=O)c3ccc(C[N@]2CCc1ccccc1C2)cc3)CC4	ZINC000000532340	O=C(N1CCNCC1)c4ccc(CN3CCc2ccccc2C3)cc4
NC(=O)CN1CCCNCCN(CC(N)=O)CCN(CC(N)=O)CC1	ZINC000022583295	C1CNCCNCCNCCNC1
CN(C)CCn1cnc2n(C)c(=O)[nH]c(=O)c12	ZINC000000094845	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
CC4=C(C(N)=O)[C@@H](c1ccccc1)n3[nH]c(c2ccccc2)nc3=N4	ZINC000000071627	C4=CC(c1ccccc1)n3[nH]c(c2ccccc2)nc3=N4
CCN(CC)CCc1ccccn1	ZINC000000157959	c1ccncc1
C[N@]3CCCN(C[C@@H]2C[C@@H]1CCCC[C@@H]1N2)CC3	ZINC000020217797	C3CCC2NC(CN1CCCNCC1)CC2C3
N[C@@H](C(=O)N[C@H]2[C@H]1COC(C=C)=C(C(O)=O)N1C2=O)c3ccc(O)cc3	ZINC000003775420	O=C(Cc1ccccc1)NC3C2COC=CN2C3=O
OCNc4nc3c1ccccc1nc(CCN2CCCCC2)n3n4	ZINC000000357612	C4CCN(CCc2nc1ccccc1c3ncnn23)CC4
COc2cc(\C=c1/c(=O)[nH]c(=O)n(C)c1=O)ccc2OCC(O)=O	ZINC000002284172	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)[nH]2
Oc3c([C@H](N1CCCC1)c2ccc(Cl)cc2)ccc4cccnc34	ZINC000000038269	C4CCN(C(c1ccccc1)c3ccc2cccnc2c3)C4
C[N@@](Cc1ccccc1)Cc3c(O)ccc4c2CCCc2c(=O)oc34	ZINC000000122782	O=c4oc2c(CNCc1ccccc1)cccc2c3CCCc34
C[C@@H]2CN(C(=O)c1ccc(N(=O)=O)cc1)C[C@@H](C)O2	ZINC000000038987	O=C(N1CCOCC1)c2ccccc2
CN2C[C@H](NC(=O)C(=O)N1CCN(CC(=O)NCC=C)CC1)CCC2=O	ZINC000558280485	O=C2CCC(NC(=O)C(=O)N1CCNCC1)CN2
OC(=O)c3ccc(COc2c(Cl)cc(C=c1c(=O)[nH]c(=S)[nH]c1=O)cc2Cl)cc3	ZINC000001201877	O=c1[nH]c(=S)[nH]c(=O)c1=Cc3ccc(OCc2ccccc2)cc3
CN4CCN(c1ncnc3c1sc2nc(C)cc(C)c23)CC4	ZINC000000159160	C4CN(c2ncnc3c1cccnc1sc23)CCN4
CCOC(=O)[C@@H]1SCCN1c2ccc(C)cc2	ZINC000000053596	C2CN(c1ccccc1)CS2
O=C(CNC(=O)c2c[nH]c1ccccc1c2=O)NCC(=O)N3CCNCC3	ZINC000569629464	O=C(CNC(=O)c2c[nH]c1ccccc1c2=O)NCC(=O)N3CCNCC3
C[N@]2CC[C@@](O)(CNS(=O)(=O)c1ccc(S(=O)(=O)NCC#N)cc1)C2	ZINC000579495274	O=S(=O)(NCC1CCNC1)c2ccccc2
CC(C)C[N@]2CCO[C@@H](CNC(=O)N1CCN(CCN(C)C)C(=O)C1)C2	ZINC000650583118	O=C2CN(C(=O)NCC1CNCCO1)CCN2
OC2=CS(=O)(=O)N(Cc1ccccc1)c3cc(Cl)ccc23	ZINC000000092283	O=S2(=O)C=Cc1ccccc1N2Cc3ccccc3
Nc5nc4cc3N(Cc2ccc(S(=O)(=O)c1ccccc1)cc2)CCCc3cc4[nH]5	ZINC000000605223	O=S(=O)(c1ccccc1)c5ccc(CN3CCCc4cc2[nH]cnc2cc34)cc5
Brc3cccc(N2C(=O)C[C@H](N1CCOCC1)C2=O)c3	ZINC000000100443	O=C2CC(N1CCOCC1)C(=O)N2c3ccccc3
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
Oc5ccc(CCNc4nc(N1CCNCC1)nc(N3CCN(c2ccc(Cl)cc2)CC3)n4)cc5O	ZINC000028011993	C5CN(c4nc(NCCc1ccccc1)nc(N3CCN(c2ccccc2)CC3)n4)CCN5
O=c2[nH]c(c1ccccc1)cn3ccnc23	ZINC000000006400	O=c2[nH]c(c1ccccc1)cn3ccnc23
CN4CCN(c3nccc(CN[C@@H]1CCC(=O)N[C@H]1c2cccc(F)c2)n3)CC4	ZINC000012182280	O=C4CCC(NCc2ccnc(N1CCNCC1)n2)C(c3ccccc3)N4
CCOc3ccc(n2c(=O)[nH]c(=O)c(=Cc1ccc(N(C)C)c(Br)c1)c2=O)cc3	ZINC000001203744	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)n2c3ccccc3
COc2ccc(C[C@@H](C)NC[C@@H](O)c1cc(N)cc(CO)c1)cc2	ZINC000000000529	C(Cc1ccccc1)NCCc2ccccc2
C[N@@](C[C@@H](O)C(F)(F)F)C1CCCCC1	ZINC000000167457	C1CCCCC1
CCOC(=O)c1c(CN(CC)CC)n(C)c2cc(Br)c(O)cc12	ZINC000000755639	c2ccc1[nH]ccc1c2
CC(C)NCCn2c(c1ccc(Cl)cc1)cn4c2nc3ccccc34	ZINC000000708907	c4ccc(c3cn2c(nc1ccccc12)[nH]3)cc4
CC(=O)Nc2ccc(S(=O)(=O)Nc1ccc(Cl)cn1)cc2	ZINC000000030289	O=S(=O)(Nc1ccccn1)c2ccccc2
C[N+](C)(C)CCOC(=O)[C@@H]2CCC[N+](C)(Cc1ccccc1Cl)C2	ZINC000004692651	C2CCN(Cc1ccccc1)CC2
O=C3C[C@@H](c2ccc(S(=O)(=O)NC1CC1)cc2)CN3	ZINC000000111072	O=C3CC(c2ccc(S(=O)(=O)NC1CC1)cc2)CN3
O=CNN2CN[N+](Cc1ccccc1)=C2	ZINC000000401330	C2NC=[N+](Cc1ccccc1)N2
CN2CCC(NCCc1ccccc1F)CC2	ZINC000000756981	C2CC(NCCc1ccccc1)CCN2
Nc4nn3[C@@H](c1ccccc1)C=C(c2ccccc2)N=c3[nH]4	ZINC000000051515	C3=C(c1ccccc1)N=c2[nH]cnn2C3c4ccccc4
NC[C@@H]3CC[N@](Cc2ccc(C(=O)NCc1ccc(S(N)(=O)=O)cc1)c(=O)[nH]2)C3	ZINC000077357350	O=C(NCc1ccccc1)c3ccc(CN2CCCC2)[nH]c3=O
Clc4ccc3NC(NCC1CC1)=C[N+](=O)C(c2ccccc2)c3c4	ZINC000000001238	O=[N+]3C=C(NCC1CC1)Nc2ccccc2C3c4ccccc4
CCn2c[n+](C[C@@H](O)COCc1ccccc1)c3ccccc23	ZINC000000089041	C(COCc1ccccc1)C[n+]2c[nH]c3ccccc23
C[N+](C)(C)NC(=O)c1ccccc1	ZINC000000282363	c1ccccc1
CC(C)NS(=O)(=O)C[C@@H](C)c1ccccc1	ZINC000000008641	c1ccccc1
CC(C)[C@@H](CNC(=O)C(=O)NC1CCN(CCO)CC1)N2CCOCC2	ZINC000670814049	O=C(NCCN1CCOCC1)C(=O)NC2CCNCC2
CCCN(CCC)[C@H]3CCc2cc1CCOc1cc2C3	ZINC000000006227	C3CCc2cc1OCCc1cc2C3
O=C(NCCS(=O)(=O)N1CCSCC1)C(=O)N[C@@H]2CCNC23CCC3	ZINC000627386872	O=C(NCCS(=O)(=O)N1CCSCC1)C(=O)NC2CCNC23CCC3
CC[C@@H](CO)NC(=O)[C@@H]2C[N@@](C)[C@H]1Cc3cn(C)c4cccc(C1=C2)c34	ZINC000000601286	C4CC=C1C(Cc2c[nH]c3cccc1c23)N4
NC(=N)NC[C@@H](O)CN(c1ccccc1)c2ccccc2	ZINC000000492769	N(c1ccccc1)c2ccccc2
CCCc3nc(c1cc(N)ccn1)c(c2ccccc2C)s3	ZINC000000016726	c3ccc(c1scnc1c2ccccn2)cc3
O=C(NCCN1CCCCC1)Nc2cccc3ccccc23	ZINC000000124866	O=C(NCCN1CCCCC1)Nc2cccc3ccccc23
Cn3c2C(=O)C(c1ccc(Cl)cc1)Nc2c(=O)n(C)c3=O	ZINC000000033680	O=C2C(c1ccccc1)Nc3c2[nH]c(=O)[nH]c3=O
CCOC(=O)C2CCN(Cc1ccco1)CC2	ZINC000000207624	C2CCN(Cc1ccco1)CC2
O[C@@H]2CN(S(=O)(=O)c1ccccc1)C[C@@]2(O)CN4CC(C(=O)N3CCOCC3)C4	ZINC000585291226	O=C(C3CN(CC2CCN(S(=O)(=O)c1ccccc1)C2)C3)N4CCOCC4
Cn4c2c1ccccc1C[n+]2c3ccccc3c4=O	ZINC000000225105	O=c3[nH]c2c1ccccc1C[n+]2c4ccccc34
CN(C)CCn3c(Cn1nnc2ccccc12)nc4ccccc34	ZINC000000025531	C(c2nc1ccccc1[nH]2)n3nnc4ccccc34
NC(=N)NC(=N)S[C@@H]2CC(=O)N(c1ccccc1)C2=O	ZINC000000051993	O=C1CCC(=O)N1c2ccccc2
CSC(=[N+]1CCOCC1)c2ccc(O)cc2	ZINC000000339192	C2C[N+](=Cc1ccccc1)CCO2
OC(=O)CC3(CC(=O)NCCc1c[nH]c2ccccc12)OCCO3	ZINC000001716917	O=C(CC1OCCO1)NCCc2c[nH]c3ccccc23
CCOC(=O)c3cccc(NC2=NC1(CCCCC1)NC(=N)N2)c3	ZINC000000203765	N=C3NC(Nc1ccccc1)=NC2(CCCCC2)N3
CN2CCC([N@@](C)Cc1cc(Br)cs1)CC2	ZINC000000199303	C2CC(NCc1cccs1)CCN2
CS(=O)(=O)Cc2cc[n+](Cc1ccc(F)cc1)cc2	ZINC000000398866	C(c1ccccc1)[n+]2ccccc2
Cc4cc(=O)n3[C@@H](c1ccccc1)NC(=NCCN2CCCCC2)Nc3n4	ZINC000009289396	O=c4ccnc3NC(=NCCN1CCCCC1)NC(c2ccccc2)n34
CN2CCN(S(=O)(=O)N1CCN(CCCC(=O)NC(N)=O)CC1)CC2	ZINC000609203447	O=S(=O)(N1CCNCC1)N2CCNCC2
C[n+]3cccc(c2n[nH]c(c1ccccc1)n2)c3	ZINC000000173452	c3ccc(c2nc(c1cccnc1)n[nH]2)cc3
COc3ccc([C@@H]2Sc1cc(Cl)ccc1N(CCN(C)C)C(=O)[C@@H]2OC(C)=O)cc3	ZINC000000607779	O=C3CC(c1ccccc1)Sc2ccccc2N3
NCCc2c[nH]c3ccc(C1CCCCC1)cc23	ZINC000000077296	C3CCC(c2ccc1[nH]ccc1c2)CC3
NC(=O)c1cnc3n1CCc2ccccc2C34CCNCC4	ZINC000000008768	C1CC4(CCN1)c2ccccc2CCn3ccnc34
C[C@@H](c1ccccc1)n2cnc3cc(N)ccc23	ZINC000000056372	C(c1ccccc1)n2cnc3ccccc23
CC(C)(C)c3cc(c2cnc1CCCCCn12)cc(C(C)(C)C)c3O	ZINC000000099965	C3CCc2ncc(c1ccccc1)n2CC3
Fc3cccc(C(=O)O[C@@H]1CN2CCC1CC2)c3	ZINC000000187968	O=C(OC1CN2CCC1CC2)c3ccccc3
CN(CCCNC(=O)C[N@]1CCC[C@@H](C(=O)NCCN)C1)S(C)(=O)=O	ZINC000430627159	C1CCNCC1
CN(C)CCN(CCN(C)C)C(=O)NC1CCC2(CC1)NC(=O)NC2=O	ZINC000557851583	O=C2NC(=O)C1(CCCCC1)N2
CN3CCC(NC[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1N2CCCC2)CC3	ZINC000020465045	C3CCN(C1CCOC1CNC2CCNCC2)C3
Cc1ccccc1[N+](=O)Cc2ccncc2	ZINC000000084375	O=[N+](Cc1ccncc1)c2ccccc2
OC(=O)[C@@]3(Cn2c(=O)c1ccccc1c2=O)NCCS3(=O)=O	ZINC000001710391	O=c2n(CC1NCCS1(=O)=O)c(=O)c3ccccc23
CC[C@@]1(O)C(=O)OCc5c1cc4c3nc2ccccc2cc3Cn4c5=O	ZINC000000105309	O=C5Cc4cc3c2nc1ccccc1cc2Cn3c(=O)c4CO5
CCOc2cc(C=c1c(=O)[nH]c(=O)[nH]c1=O)cc(Cl)c2OC	ZINC000000998357	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)[nH]2
NCCCNS(=O)(=O)c2ccc(C(=O)NC[C@@]1(O)CCCNC1)cc2	ZINC000091254451	O=C(NCC1CCCNC1)c2ccccc2
CC(=O)Nc2nc1ccccc1n2CCN3CCCC3	ZINC000000186870	C3CCN(CCn1cnc2ccccc12)C3
Cc4cc(C[N@]3CC[C@@H](C2CCN(Cc1cccnc1)CC2)C3)[nH]n4	ZINC000011664145	C2CN(Cc1cccnc1)CCC2C4CCN(Cc3ccn[nH]3)C4
N(c1ccncc1)n2ccc3ccccc23	ZINC000000024994	N(c1ccncc1)n2ccc3ccccc23
O[C@]3(c1ccccc1)CN(c2ccc(Cl)cc2)C4=[N+]3CCCCC4	ZINC000000079094	C1CCC3=[N+](CC1)C(c2ccccc2)CN3c4ccccc4
CCOC(=O)N3CCC(N[C@@H](Cc1ccccc1)c2ccccc2)CC3	ZINC000000757913	C3CC(NC(Cc1ccccc1)c2ccccc2)CCN3
COC(=O)C=Cc2cn([C@@H]1OC[C@H](CO)[C@@H]1O)c(=O)[nH]c2=O	ZINC000000136666	O=c2ccn(C1CCCO1)c(=O)[nH]2
CC[N+](C)(CC)CC[N+]1(C)CCCCCC1	ZINC000001646433	C1CCCNCC1
COc3ccc(OC)c(N2C(=O)C[C@H](Cc1ccc(C)cc1)C2=O)c3	ZINC000000032299	O=C2CC(Cc1ccccc1)C(=O)N2c3ccccc3
OC[C@@H]3O[C@@H](n1c(Br)nc2c(=O)[nH]c(=O)[nH]c12)[C@@H](O)[C@@H]3O	ZINC000004786926	O=c3[nH]c(=O)c2ncn(C1CCCO1)c2[nH]3
CC2(C)NC(=N)NC(Nc1ccc(Cl)cc1)=N2	ZINC000000230586	N=C2NCN=C(Nc1ccccc1)N2
O=C(N[C@@H]2CCc1ccccc1C2)c3ccncc3	ZINC000000003560	O=C(NC2CCc1ccccc1C2)c3ccncc3
CCN(CC)CCNc2ncnc3sc1CCCCc1c23	ZINC000000084797	C1CCc2c(C1)sc3ncncc23
COC(=O)N=c2[nH]cc(CN1CCCC1)s2	ZINC000000116971	N=c2[nH]cc(CN1CCCC1)s2
COc3ccc2ccc1OC[C@H](NC(C)=O)Cc1c2c3	ZINC000000017521	C3COc2ccc1ccccc1c2C3
CCN4CCN(c3ccc(NC(=O)C[N@@](C)Cc2ccc(N1CCCCC1)cc2)cc3)CC4	ZINC000009604532	O=C(CNCc2ccc(N1CCCCC1)cc2)Nc4ccc(N3CCNCC3)cc4
NC(=O)C(CCN2CC[N@]1CCC[C@H]1C2)(c3ccccc3)c4ccccc4	ZINC000000608031	C4CC3CN(CCC(c1ccccc1)c2ccccc2)CCN3C4
Fc3ccc(C[N@]1CCC[C@H]1C(=O)N2CCNCC2)cc3	ZINC000040508043	O=C(C1CCCN1Cc2ccccc2)N3CCNCC3
CN3CCN(C(=S)c1c[nH]c2ccccc12)CC3	ZINC000000299827	S=C(N1CCNCC1)c2c[nH]c3ccccc23
CN1[C@H]4CC[C@@H]1CC(NC2C[C@@H]3CC[C@H](C2)[N@]3C)C4	ZINC000000874130	C3CC4CC(NC1CC2CCC(C1)N2)CC3N4
O=c2n(C[C@@H]1CNCCO1)c(=O)c3ccccc23	ZINC000000160590	O=c2n(CC1CNCCO1)c(=O)c3ccccc23
C[C@@H](CN1CCC(C(N)=O)CC1)c2ccccc2	ZINC000000277466	C2CCN(CCc1ccccc1)CC2
CCOc1cc(C(=O)NCCN(C)C)cc(OCC)c1OCC	ZINC000000213525	c1ccccc1
Nc3noc([C@H]1CN2CCC1CC2)n3	ZINC000000003765	C1CN3CCC1C(c2ncno2)C3
CC2(C)OC(=O)N(CCN1C(=O)OC(C)(C)[C@@]1(C)O)[C@]2(C)O	ZINC000000049492	O=C1OCCN1CCN2CCOC2=O
CNC(=O)NC[C@@H]2CN(C(=O)C(=O)NC[C@@H](OC)[C@@H]1CCOC1)CCO2	ZINC000625715018	O=C(NCCC1CCOC1)C(=O)N2CCOCC2
CC(C)=CC(=O)NS(=O)(=O)c1ccc(N)cc1	ZINC000000002093	c1ccccc1
COc3ccc(S(=O)(=O)Nc2cc(OC)c(NC(=O)c1ccccc1)cc2OC)cc3	ZINC000001147259	O=C(Nc2ccc(NS(=O)(=O)c1ccccc1)cc2)c3ccccc3
OC(=O)CNS(=O)(=O)c1ccc2[nH]c(=O)c3cccc1c23	ZINC000000828930	O=c1[nH]c3cccc2cccc1c23
Oc2cccc(\C=N\c1cccc(N(=O)=O)c1)c2O	ZINC000000065250	C(=Nc1ccccc1)c2ccccc2
C[N@]1CC=C3[C@H](C1)[C@@H](c2ccc(C)cc2)C(C#N)(C#N)C(N)=C3C#N	ZINC000000408309	C3NCC2C(c1ccccc1)CC=CC2=C3
Cc3ccc(C(=O)c2sc1[nH]c(=O)c(C(O)=O)cc1c2N)cc3	ZINC000000214167	O=C(c1ccccc1)c3cc2ccc(=O)[nH]c2s3
CCOC(=O)c2cccc(NC(=O)CCc1ccccc1)c2	ZINC000000031718	O=C(CCc1ccccc1)Nc2ccccc2
COc4ccc([C@@H]2Sc1ccccc1NC(=O)[C@H]2OC(=O)CN3CCN(C)CC3)cc4	ZINC000000638704	O=C(CN1CCNCC1)OC4C(c2ccccc2)Sc3ccccc3NC4=O
CNC(=O)Nc2sc(c1ccc(F)cc1)cc2C(N)=O	ZINC000000003241	c2ccc(c1cccs1)cc2
CN(C)c3cc(NC(=O)C[N@@](C)Cc1ccccc1)c2ccccc2n3	ZINC000000298832	O=C(CNCc1ccccc1)Nc2ccnc3ccccc23
CN(C)CCNc2c(C#N)c1CCN(C)Cc1c3nncn23	ZINC000013721884	C3Cc2ccn1cnnc1c2CN3
COc1ccccc1N4CCN([C@@H]3CCCN(C(=O)C2CCN(C)CC2)C3)CC4	ZINC000011668101	O=C(C1CCNCC1)N4CCCC(N3CCN(c2ccccc2)CC3)C4
Cc4cnc5c(NCCN1CCCCC1)nc3cc2ccccc2cc3n45	ZINC000000594520	C5CCN(CCNc3nc2cc1ccccc1cc2n4ccnc34)CC5
CN(C)CCn2c(C(=O)Nc1ccccc1)cc3ccccc23	ZINC000000403667	O=C(Nc1ccccc1)c3cc2ccccc2[nH]3
COCCN2CCN(C(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1)CC2	ZINC000266814804	O=C(CNS(=O)(=O)c1cc[nH]c1)N2CCNCC2
Cc3ccc(NC(=O)CNC1=NC(C)(C)Cc2ccccc12)cc3	ZINC000000343642	O=C(CNC1=NCCc2ccccc12)Nc3ccccc3
CCC(CC)Sc3nc2cc(N1CCNCC1)c(Cl)cc2[nH]3	ZINC000000003308	C3CN(c2ccc1[nH]cnc1c2)CCN3
C[C@@H](Oc2cncc(N1CCNCC1)n2)c3cccc(F)c3	ZINC000000003309	C3CN(c2cncc(OCc1ccccc1)n2)CCN3
CN(C)CC#CC1(O)CCCCC1	ZINC000000123369	C1CCCCC1
CCc3c(C)c(C#N)c2nc1ccccc1n2c3N4CCNCC4	ZINC000000048846	C4CN(c2cccc3nc1ccccc1n23)CCN4
CCN4CCN(c2nnc(c1ccc(C)cc1)c3ccccc23)CC4	ZINC000000038135	C4CN(c2nnc(c1ccccc1)c3ccccc23)CCN4
CC(C)(CNC(=O)[C@@H]1CCCN1)N2CCCCC2	ZINC000011954497	O=C(NCCN1CCCCC1)C2CCCN2
CN(C)CCNC(=O)Cn2cnc1sc(C)c(C)c1c2=O	ZINC000000109567	O=c1[nH]cnc2sccc12
Cc2cc(C)[n+]1cc(Br)ccc1n2	ZINC000000035416	c2cc[n+]1cccnc1c2
CCC[C@@]2(c1cccc(O)c1)CC[N@@](C)C[C@H]2C	ZINC000000001941	C2CC(c1ccccc1)CCN2
NNc2nnc(Cc1ccncc1)c3ccccc23	ZINC000000001943	C(c1ccncc1)c2nncc3ccccc23
CC(C)[C@@H]2NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CCCCN)NC2=O	ZINC000044069862	O=C2CNC(=O)CNC(=O)C(Cc1ccccc1)NC(=O)CNC(=O)CN2
CC[C@@]23CCC[N@]1CC[C@@]5([C@@H]12)C(=C(C(=O)OC)C3)Nc4ccccc45	ZINC000000525687	C3CC4CC=C2Nc1ccccc1C25CCN(C3)C45
CC2(C)C=CN(C(=O)Nc1ccccc1)C=C2	ZINC000000002561	O=C(Nc1ccccc1)N2C=CCC=C2
COc2ccc(C1(CN)CCOCC1)cc2OC	ZINC000000295384	C2CC(c1ccccc1)CCO2
Cn2c([C@@H](O)c1ccccc1)[n+](C)c3ccccc23	ZINC000000231567	C(c1ccccc1)c3nc2ccccc2[nH]3
Cn3cc(S(=O)(=O)NCC(=O)Nc2nc(N1CCNCC1)n[nH]2)cn3	ZINC000584290131	O=C(CNS(=O)(=O)c1cn[nH]c1)Nc3nc(N2CCNCC2)n[nH]3
C[N@]1CCCC[C@H]1C(=O)Nc2c(C)cccc2C	ZINC000000154964	O=C(Nc1ccccc1)C2CCCCN2
COc2ccc1[nH]cc(CCN)c1c2N(=O)=O	ZINC000000518941	c2ccc1[nH]ccc1c2
Cc2ccc(c1cn(N)c(N)n1)cc2	ZINC000000336889	c2ccc(c1c[nH]cn1)cc2
CC(C)(C)OC(=O)N1CCNCC1	ZINC000000152447	C1CNCCN1
CCN(CC)C(=O)[C@@]2(c1ccccc1)C[C@H]2CN	ZINC000000000506	C1CC1c2ccccc2
COCC(COC)N2CCN(C(=O)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1)CC2	ZINC000616255226	O=C(N1CCNCC1)C2=CCCCC2
CN(C)CCC(=O)c1ccccc1	ZINC000000079582	c1ccccc1
CN(C)S(=O)(=O)N2CCN(c1ccc(C)c(Cl)c1)CC2	ZINC000000079580	C2CN(c1ccccc1)CCN2
O=C1CCC(=O)N1OC[C@@H]2CCC[N@]3CCCC[C@H]23	ZINC000000035446	O=C1CCC(=O)N1OCC2CCCN3CCCCC23
O=C(N2CCN(Cc1ccccc1)CC2)c3ccc(=O)[nH]n3	ZINC000000543243	O=C(N2CCN(Cc1ccccc1)CC2)c3ccc(=O)[nH]n3
Cc3cc(C)[n+]2c(c1ccccc1)csc2n3	ZINC000000041311	c3ccc(c1csc2nccc[n+]12)cc3
O=C(NCc1ccccn1)C4CCN(C3CCN(C[C@H]2CCC=CC2)CC3)CC4	ZINC000011754135	O=C(NCc1ccccn1)C4CCN(C3CCN(CC2CCC=CC2)CC3)CC4
CCN(CC)CCNc3ncc2Cc1ccccc1Nc2c3C#N	ZINC000000537068	C2c1ccccc1Nc3ccncc23
Cc1cccc(C)c1NC(=O)[C@@H]2CCCNC2	ZINC000000243694	O=C(Nc1ccccc1)C2CCCNC2
CC(=O)n2ccc(C(=O)Nc1nccs1)n2	ZINC000000032374	O=C(Nc1nccs1)c2cc[nH]n2
CCN(CC)c3ccc(NCn2c(=O)c1ccccc1c2=O)c(C)c3	ZINC000000128679	O=c2n(CNc1ccccc1)c(=O)c3ccccc23
CN(C)c3ccc(\C=N\C2=NN(c1ccccc1)CC2)cc3	ZINC000000193971	C2CC(N=Cc1ccccc1)=NN2c3ccccc3
C3CN=C(COc1ccccc1C2CC2)N3	ZINC000000001160	C3CN=C(COc1ccccc1C2CC2)N3
NC(=N)S[C@@H](CN1CCCCC1)C(F)(F)F	ZINC000004834803	C1CCNCC1
C[n+]2cccc(NC(=O)NC(=O)c1ccc[n+](C)c1)c2	ZINC000000283765	O=C(NC(=O)c1cccnc1)Nc2cccnc2
CN(C)CCN(Cc1ccsc1)c2ccccn2	ZINC000000002149	C(Nc1ccccn1)c2ccsc2
COc1cc(CC=C)ccc1OCCn3cc(C=c2c(=O)[nH]c(=S)[nH]c2=O)c4ccccc34	ZINC000001168848	O=c1[nH]c(=S)[nH]c(=O)c1=Cc3cn(CCOc2ccccc2)c4ccccc34
CN2CCN(C(=O)N1CCOCC1)CC2	ZINC000000152045	O=C(N1CCNCC1)N2CCOCC2
Cc3cc(C)cc(N2[C@@H](c1cccc(Cl)c1)NC(=N)NC2=N)c3	ZINC000006785883	N=C3NC(c1ccccc1)N(c2ccccc2)C(=N)N3
COc4cc([C@@H]1NCCc2c1[nH]c3ccccc23)ccc4O	ZINC000000189597	C4Cc1c([nH]c2ccccc12)C(c3ccccc3)N4
Cc3ccc(C(=O)C[C@@]2(O)C(=O)N(CC(N)=O)c1ccccc12)cc3	ZINC000000299950	O=C(CC1C(=O)Nc2ccccc12)c3ccccc3
CN(C)[C@H]2CN(C(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1)C[C@@H]2O	ZINC000567625163	O=C(CNS(=O)(=O)c1cc[nH]c1)N2CCCC2
CN(C)CC(=O)N3c1ccccc1CCc4ccc(NC(=O)c2ccccc2)cc34	ZINC000000755077	O=C(Nc3ccc2CCc1ccccc1Nc2c3)c4ccccc4
Oc4ccc3[nH]cc([C@H]1CN2CCC1CC2)c3c4	ZINC000000005324	C1CN4CCC1C(c2c[nH]c3ccccc23)C4
Cc2[nH]c1ccc(F)cc1c2SC3CCNCC3	ZINC000000018495	C3CC(Sc1c[nH]c2ccccc12)CCN3
CC[n+]2cc(N)nc(c1ccc(Br)cc1)n2	ZINC000000506409	c2ccc(c1nccnn1)cc2
O=C(NCCS(=O)(=O)NC[C@@H]1CCCCO1)C(=O)N[C@H]2CCNC2	ZINC000569380767	O=C(NCCS(=O)(=O)NCC1CCCCO1)C(=O)NC2CCNC2
COC(=O)Cn2c([C@@H](O)c1ccccc1)nc3ccccc23	ZINC000000028984	C(c1ccccc1)c3nc2ccccc2[nH]3
CN3CCC(NC[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1N2CCOCC2)CC3	ZINC000020464794	C3CC(NCC1OCCC1N2CCOCC2)CCN3
COC(=O)c1sccc1NC(=O)/C=C/C(O)=O	ZINC000000068209	c1ccsc1
COc2ccc(CCNC1=NCCN1)cc2OC	ZINC000000017381	C2CN=C(NCCc1ccccc1)N2
O[C@H](Cn2c1ccccc1c3ccccc23)C[n+]4ccccc4	ZINC000000303657	C(Cn2c1ccccc1c3ccccc23)C[n+]4ccccc4
C3CN=C(NCCc2ccc1OCOc1c2)N3	ZINC000000017382	C3CN=C(NCCc2ccc1OCOc1c2)N3
COC(=O)c1ccc(\C=N\NC(N)=S)n1c2ccc(F)cc2	ZINC000000110714	c2ccc(n1cccc1)cc2
CCCC(=O)NOCc1cccc2ccc(OC)cc12	ZINC000000021040	c2ccc1ccccc1c2
O=C(CN1CCCC1)NCC3(c2ccccc2)CCCC3	ZINC000000209556	O=C(CN1CCCC1)NCC3(c2ccccc2)CCCC3
Cc2[nH]c1ccccc1c2CCN	ZINC000000140764	c2ccc1[nH]ccc1c2
CC1(C)[C@@H]2CC[C@@]1(C)C[N@@](CCC[N+](C)(C)C)C2	ZINC000001694698	C1CC2CNCC1C2
CN4CCN(c3cc(n1nc(C)cc1c2ccccc2)ncn3)CC4	ZINC000000102157	C4CN(c3cc(n1nccc1c2ccccc2)ncn3)CCN4
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
C[N+](C)(C)Cn2c(=O)c1ccccc1c2=O	ZINC000000164221	O=c1[nH]c(=O)c2ccccc12
CN(C)C(=O)N2CCC(C(=O)NCCN1CCCC1)CC2	ZINC000000262335	O=C(NCCN1CCCC1)C2CCNCC2
CCc2n(C)c1ccccc1[n+]2C[C@H](O)COc3cccc(C)c3	ZINC000000307215	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
CCn2c(=O)n(CC)c1[nH]cnc1c2=O	ZINC000000014106	O=c2[nH]c(=O)c1nc[nH]c1[nH]2
C[N@]3CC[C@@H](COC(=O)C(O)(c1ccccc1)c2ccccc2)C3	ZINC000000000806	O=C(OCC1CCNC1)C(c2ccccc2)c3ccccc3
CCC(=O)O[C@]2(c1ccccc1)C[C@@H](C)[N@@](C)C[C@@H]2C	ZINC000000000807	C2CC(c1ccccc1)CCN2
COc2ccc(C[N@@](C)CCc1ccccn1)cc2	ZINC000000200543	C(Cc1ccccn1)NCc2ccccc2
COc4ccc3c(C)c2c1cc(OC)c(OC)cc1CC[n+]2cc3c4OC	ZINC000000597214	C3C[n+]2cc1ccccc1cc2c4ccccc34
C4Cc3nc1ccccc1c(Nc2ccccc2)c3C4	ZINC000000122810	C4Cc3nc1ccccc1c(Nc2ccccc2)c3C4
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
CC2(C)CC(NC(=O)c1cccc(F)c1)CC(C)(C)N2	ZINC000000217330	O=C(NC1CCNCC1)c2ccccc2
COc2c1CNCCn1c3ccc(F)cc23	ZINC000000017967	C1Cn2c(CN1)cc3ccccc23
COc3ccc(NC2CCN(CCc1ccccc1)CC2)c(OC)c3	ZINC000000279607	C2CN(CCc1ccccc1)CCC2Nc3ccccc3
CCOC(=O)C2CCN(C1CCN(C)CC1)CC2	ZINC000000300887	C2CCN(C1CCNCC1)CC2
COC(=O)[C@H](C)CNCc1ccccc1	ZINC000000163433	c1ccccc1
C3CCC(NCCc1c[nH]c2ccccc12)CC3	ZINC000000068845	C3CCC(NCCc1c[nH]c2ccccc12)CC3
O=c4[nH]c3ccc(C#CCN2CCC(Cc1ccccc1)CC2)cc3[nH]4	ZINC000000023994	O=c4[nH]c3ccc(C#CCN2CCC(Cc1ccccc1)CC2)cc3[nH]4
CCN(CC)Cc3cc(NC1=NS(=O)(=O)c2ccccc12)ccc3OC(=O)c4ccccc4	ZINC000000716260	O=C(Oc3ccc(NC1=NS(=O)(=O)c2ccccc12)cc3)c4ccccc4
COc3ccc(c2cc(C#N)nc(N1CCN(C)CC1)n2)cc3	ZINC000000073403	C3CN(c2nccc(c1ccccc1)n2)CCN3
C3CN(Cc1c[nH]c2ncccc12)CCC3CCc4ccccc4	ZINC000000022901	C3CN(Cc1c[nH]c2ncccc12)CCC3CCc4ccccc4
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N2CCOCC2	ZINC000000052520	O=C(C1CCCN1)N2CCOCC2
Cc1cc(Br)ccc1NC(=N)NC(N)=N	ZINC000000073409	c1ccccc1
NC(=N)N[C@@H]2C[C@H](NC(N)=N)[C@@H](Oc1ccccn1)C[C@H]2Oc3ccccn3	ZINC000052565371	C3CC(Oc1ccccn1)CC(Oc2ccccn2)C3
O=N(=O)c2ccc(C[n+]1ccc(C#N)cc1)cc2	ZINC000000157942	C(c1ccccc1)[n+]2ccccc2
CC[N+](C)(C)Cc1ccccc1Br	ZINC000000001041	c1ccccc1
Fc3ccc(C[N@]2CCCN(C(=S)NC1CCCCC1)CC2)cc3	ZINC000000066332	S=C(NC1CCCCC1)N3CCCN(Cc2ccccc2)CC3
Cc2csc3c(=O)n(CCN1CCSCC1)c(=O)[nH]c23	ZINC000000103095	O=c2[nH]c1ccsc1c(=O)n2CCN3CCSCC3
CCn1c(C)[n+](CC)c2cc(S(N)(=O)=O)ccc12	ZINC000000236035	c2ccc1[nH]cnc1c2
C[C@@H](CS(=O)(=O)c1ccccc1)N2CCCCC2	ZINC000000074264	O=S(=O)(CCN1CCCCC1)c2ccccc2
CC[C@@]2(C)Cc1ccccc1C3=[N+]2CCS3	ZINC000000088547	C1C[N+]3=C(S1)c2ccccc2CC3
CC(C)CNC(=O)[C@@H]2CCC[N@](C1CCN(C)CC1)C2	ZINC000012473964	C2CCN(C1CCNCC1)CC2
CC(C)(C)NC(=S)NC2CCN(Cc1ccccc1)CC2	ZINC000000128555	C2CCN(Cc1ccccc1)CC2
O=C(NCc2ccc1OCOc1c2)c4cc3ccccc3o4	ZINC000000036056	O=C(NCc2ccc1OCOc1c2)c4cc3ccccc3o4
CO[C@H]1CCCC[C@H]1NCc2cc(OC)c(OC)c(OC)c2	ZINC000000267281	C2CCC(NCc1ccccc1)CC2
Br[C@@]12CCCC[C@@H]1CNCC2	ZINC000000158431	C2CCC1CNCCC1C2
CC(=O)Nc3ccc(C(=O)N1CCc2ccccc12)cc3	ZINC000000030072	O=C(N1CCc2ccccc12)c3ccccc3
CN(/N=C/c1ccncc1)C2=NCCN2	ZINC000000255661	C2CN=C(NN=Cc1ccncc1)N2
O=C(OCc1ccccc1)N2CCCNCC2	ZINC000000403331	O=C(OCc1ccccc1)N2CCCNCC2
COC(=O)[C@H]1C[N@@](C)CC[C@]1(C)OC(=O)Oc2ccccc2	ZINC000000345614	O=C(OC1CCNCC1)Oc2ccccc2
CC3CCN(C2CCN(CCc1ccccc1)CC2)CC3	ZINC000000182373	C3CCN(C2CCN(CCc1ccccc1)CC2)CC3
COc2ccc(C[N@]1CCC[C@@H](O)C1)c(OC)c2	ZINC000000207301	C2CCN(Cc1ccccc1)CC2
C4CN(c3ccc2C[N@](Cc1ccccc1)Cc2c3)CCN4	ZINC000009873791	C4CN(c3ccc2CN(Cc1ccccc1)Cc2c3)CCN4
C[C@@H]3C[C@H](Nc1ccccc1)c2ccccc2N3C(C)=O	ZINC000000027700	C3CC(Nc1ccccc1)c2ccccc2N3
CN(C)c2ccc(C(=N)c1ccc(N(C)C)cc1)cc2	ZINC000000155144	N=C(c1ccccc1)c2ccccc2
COCC[N@@](C)CCNC(=O)N2CCC(C(=O)N1CCN(C)CC1)CC2	ZINC000588982557	O=C(C1CCNCC1)N2CCNCC2
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
CN(C)CCNc2c1CCCc1nc3ccccc23	ZINC000001780063	C3Cc2cc1ccccc1nc2C3
CN(CC(=O)NC[C@@H]1CCCO1)S(=O)(=O)c2ccc(C)cc2	ZINC000000048592	O=C(CNS(=O)(=O)c1ccccc1)NCC2CCCO2
NC(=N)NC(=N)Nc2nc(c1ccccc1)cs2	ZINC000000089397	c2ccc(c1cscn1)cc2
COc2ccc(Cc1c(Cl)nc(SC)nc1NN)cc2	ZINC000000380806	C(c1ccccc1)c2cncnc2
COc2cc1CC(C)(C)NC(=NN)c1cc2OC	ZINC000000170246	N=C1NCCc2ccccc12
CO[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)N3CC(S(=O)(=O)N2CCNCC2)C3	ZINC000659565754	O=C(NC1CCS(=O)(=O)C1)N3CC(S(=O)(=O)N2CCNCC2)C3
CCN(CC)C[C@@H](O)CN1C(=O)NC(C)(C)C1=O	ZINC000000112249	O=C1CNC(=O)N1
CN2CCC([N@@](C)Cc1ccc(C)o1)CC2	ZINC000000278935	C2CC(NCc1ccco1)CCN2
C[C@@H]3CCC[C@@H](N2CCN(C(=O)c1ccncc1)CC2)C3	ZINC000000300552	O=C(N2CCN(C1CCCCC1)CC2)c3ccncc3
CN(C)[C@H](Cn2c(=O)c1ccccc1c2=O)c3cn(C)c4ccccc34	ZINC000000494136	O=c3n(CCc1c[nH]c2ccccc12)c(=O)c4ccccc34
Clc3ccc(N2C[C@@H]1CCNC[C@@H]12)cn3	ZINC000000027328	C3CC2CN(c1cccnc1)C2CN3
CN2c1ccccc1CNc3cncnc23	ZINC000000005251	C2Nc1cncnc1Nc3ccccc23
O=C(CCn2c(=O)c1cccc(N(=O)=O)c1c2=O)NC[C@@H]3CCCO3	ZINC000000117401	O=C(CCn2c(=O)c1ccccc1c2=O)NCC3CCCO3
CNS(=O)(=O)Cc2ccc1[nH]cc(CCN(C)C)c1c2	ZINC000000014360	c2ccc1[nH]ccc1c2
CCOC(=O)c3nc(Nc1ccc(C(O)=O)cc1)c2ccccc2n3	ZINC000000145904	N(c1ccccc1)c2ncnc3ccccc23
CCn2c(=Cc1cccc[n+]1C)ccc3ccccc23	ZINC000000044429	C(c1ccccn1)=c3ccc2ccccc2[nH]3
Nc2nc(=O)n([C@H]1CC[C@@H](CO)O1)cc2Br	ZINC000000039885	O=c1ncccn1C2CCCO2
COc3cc(CNc2nc1ccccc1n2C)cc(OC)c3OC	ZINC000000068015	C(Nc2nc1ccccc1[nH]2)c3ccccc3
Fc1ccccc1N2CCNCC2	ZINC000000155125	C2CN(c1ccccc1)CCN2
COc2ccc1ccccc1c2CN3CCSCC3	ZINC000000183157	C3CN(Cc1cccc2ccccc12)CCS3
CN(C)CCNC(=O)C(=O)NC[C@@H](N(C)C)c1ccc(N(C)C)cc1	ZINC000005340228	c1ccccc1
NC(=O)CN3CCN(c2cncc(N1CCN(CC(N)=O)CC1)n2)CC3	ZINC000557472665	C3CN(c2cncc(N1CCNCC1)n2)CCN3
O[C@H]3[C@@H](N2CCC(O)(c1ccc(F)cc1)CC2)COc4cc(O)ccc34	ZINC000000601447	C3CN(C2COc1ccccc1C2)CCC3c4ccccc4
CN(CC(=O)N(CC(N)=O)CC(N)=O)S(=O)(=O)c1ccc(C#N)cc1	ZINC000499977101	c1ccccc1
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
CCOC(=O)[C@@H]1CCC[N@@](C)C1	ZINC000000155206	C1CCNCC1
COc4ccc([C@@H](N1CCC(C)CC1)c2c(C)[nH]c3ccccc23)cc4	ZINC000000072029	C4CCN(C(c1ccccc1)c2c[nH]c3ccccc23)CC4
CN[C@H]3CCc2[nH]c1ccc(C(N)=O)cc1c2C3	ZINC000000008496	C1CCc2c(C1)[nH]c3ccccc23
CN[C@@]13CC=CC[C@H]1COc2ccccc23	ZINC000000012944	C2Oc1ccccc1C3CC=CCC23
Cc1ccccc1N2CCNCC2	ZINC000000066076	C2CN(c1ccccc1)CCN2
OC(=O)[C@H]1CCCN1C(=O)[C@H](Cc2cnc[nH]2)NC(=O)[C@H]3CCC(=O)N3	ZINC000002391087	O=C3CCC(C(=O)NC(Cc1cnc[nH]1)C(=O)N2CCCC2)N3
Cc2cc1nsnc1c(S(=O)(=O)NCC(O)=O)c2C	ZINC000000063553	c2ccc1nsnc1c2
Cc2ccc(N1CCNCC1)cc2C	ZINC000000066072	C2CN(c1ccccc1)CCN2
O=c2c(\C=N\NC(=S)NCc1ccco1)coc3ccccc23	ZINC000000075054	O=c2c(C=NNC(=S)NCc1ccco1)coc3ccccc23
OC(=O)CNC(=O)c2nc(Cl)c1ccccc1c2O	ZINC000000007670	c2ccc1cnccc1c2
CNS(=O)(=O)CCc3ccc2[nH]cc(C1CCN(C)CC1)c2c3	ZINC000000004076	C3CC(c1c[nH]c2ccccc12)CCN3
O=S(=O)(Nc1ncccn1)c3ccc(n2cnnn2)cc3	ZINC000000411407	O=S(=O)(Nc1ncccn1)c3ccc(n2cnnn2)cc3
C[C@@H]2CN(S(=O)(=O)N1CCN(C(=O)CNC(=O)CN)CC1)C[C@@H](C)O2	ZINC000262117944	O=S(=O)(N1CCNCC1)N2CCOCC2
C[N@]3CCC[C@@H](NC(=O)[C@@H]2Cc1ccccc1CN2)C3	ZINC000040673706	O=C(NC1CCCNC1)C3Cc2ccccc2CN3
CNc1nc(NC(C)(C)C)nc(NC(C)(C)C)n1	ZINC000000245572	c1ncncn1
CN3CCC(N2CCC(Cc1ccccc1)CC2)CC3	ZINC000000280476	C3CC(N2CCC(Cc1ccccc1)CC2)CCN3
COc4ccc([N+]3=C1CCCCN1[C@@](O)(c2ccccc2)C3)cc4	ZINC000000425737	C4CCC3=[N+](c1ccccc1)CC(c2ccccc2)N3C4
Cc1ccccc1OC[C@H](O)C[N@]2CCC=CC2	ZINC000000000794	C(COc1ccccc1)CN2CCC=CC2
CC[C@@]3(O)CC[N@]2CCc1ccc(C)cc1[C@@H]2C3	ZINC000000000795	C3CCN2CCc1ccccc1C2C3
C[N@]1C[C@H]2CC[C@@H]1C[C@@]23CC(C)=CC(=O)O3	ZINC000000001311	O=C1OC2(CC=C1)CC3CCC2CN3
CS(=O)(=O)N2CCN(S(=O)(=O)NCCCN1CCC(O)CC1)CC2	ZINC000443165576	O=S(=O)(NCCCN1CCCCC1)N2CCNCC2
CN(CC(=O)NCCC(=O)Nc1nnc(S(N)(=O)=O)s1)C(N)=N	ZINC000013800588	c1nncs1
CNC(=O)[C@H](Cc2ccc1ccccc1c2)N4CCN(C(=O)[C@H](N)Cc3ccc(F)cc3)[C@@H](CCN)C4=O	ZINC000036285903	O=C(CCc1ccccc1)N4CCN(CCc3ccc2ccccc2c3)C(=O)C4
CN(C)CCNC(=O)c2ccc(CN1CCCC1)cc2	ZINC000013646325	C2CCN(Cc1ccccc1)C2
Oc4c(C[C@@H]1CCCO1)c(=O)n5c2ccccc2c3ccccc3n45	ZINC000000000152	O=c4c(CC1CCCO1)cn5c2ccccc2c3ccccc3n45
CC2CCN(CC[C@@H](C)N(C)S(=O)(=O)c1cccc(C)c1)CC2	ZINC000000007275	O=S(=O)(NCCCN1CCCCC1)c2ccccc2
COCC[N@@](C)CCNC(=O)C(=O)NC2CCN([C@@H]1CCOC1)CC2	ZINC000668750510	C2CCN(C1CCOC1)CC2
NC(=O)C[N@]2CC[C@@]1(O)CCCC[C@H]1[C@@H]2c3ccc(F)cc3	ZINC000000534624	C1CCC2C(C1)CCNC2c3ccccc3
NS(=O)(=O)c3ccc2c(Cc1cc(S(N)(=O)=O)ccc12)c3	ZINC000000134278	C2c1ccccc1c3ccccc23
CCN2CCN(C(=O)NC1CCCCC1)CC2	ZINC000000413840	O=C(NC1CCCCC1)N2CCNCC2
FC(F)(F)c2cccc(\C=C(/C#N)C(=O)NC[C@@H]1CCCO1)c2	ZINC000000037472	O=C(NCC1CCCO1)C=Cc2ccccc2
N=C(NCCN2CCN(Cc1ccccc1)CC2)NC[C@@H]3CCCO3	ZINC000058159540	N=C(NCCN2CCN(Cc1ccccc1)CC2)NCC3CCCO3
O[C@@]23Oc1ccccc1C=C2N4CCC3CC4	ZINC000000052855	C1CN4CCC1C3Oc2ccccc2C=C34
CN(N)C(=N)NCc1ccccc1	ZINC000000011148	c1ccccc1
NC2=N[C@@H]1CCCC[C@@H]1CS2	ZINC000000021201	C2CCC1N=CSCC1C2
O=C(CN2CCN(S(=O)(=O)N1CCOCC1)CC2)N3CCNC3=O	ZINC000032770131	O=C(CN2CCN(S(=O)(=O)N1CCOCC1)CC2)N3CCNC3=O
COc3ccc(\C=c2/c(=O)[nH]c(=O)n(c1ccc(C)cc1)c2=O)cc3	ZINC000000063172	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)n2c3ccccc3
Nc2cc(N)nc(SCC(=O)Nc1ccccn1)n2	ZINC000000468973	O=C(CSc1ncccn1)Nc2ccccn2
O=C(N(C2CCN(CCc1ccccc1)CC2)c3cccnc3)c4ccco4	ZINC000000596859	O=C(N(C2CCN(CCc1ccccc1)CC2)c3cccnc3)c4ccco4
C[N+]4(Cc1cc(=O)[nH]c(=O)[nH]1)CCc3[nH]c2ccccc2c3C4	ZINC000000488961	O=c4cc(CN3CCc2[nH]c1ccccc1c2C3)[nH]c(=O)[nH]4
C[C@@]12NCCN1C(=O)OC23CCCCC3	ZINC000000139605	O=C3OC1(CCCCC1)C2NCCN23
COc2ccc(C(=O)Nc1ccccc1C(C)C)cc2OC	ZINC000000029911	O=C(Nc1ccccc1)c2ccccc2
CNC(=O)[C@@H]2CN(C(=O)C(=O)NC[C@H]1CCCN1S(C)(=O)=O)CCO2	ZINC000566705240	O=C(NCC1CCCN1)C(=O)N2CCOCC2
CN(C)C[C@@H]1CC2(C[C@@H](CN(C)C)C1=O)OCCO2	ZINC000001717644	O=C1CCC2(CC1)OCCO2
C[C@H](C(O)=O)c2ccc([C@H]1CCC\C(=N\O)C1)cc2	ZINC000000000845	N=C2CCCC(c1ccccc1)C2
C[C@@H]2CCC[N@@](CCS(=O)(=O)c1ccccc1)C2	ZINC000000165089	O=S(=O)(CCN1CCCCC1)c2ccccc2
CC[N@]1CCC[C@@H]1CNC(=O)c3ccc(N2CCCC2=O)cc3	ZINC000000429214	O=C1CCCN1c3ccc(C(=O)NCC2CCCN2)cc3
CCC[N@@](CCO)Cc1ccc(Br)s1	ZINC000000217981	c1ccsc1
COc2ccc(CCC(=O)Nc1cc(C)c(O)c(C)c1)cc2	ZINC000000007070	O=C(CCc1ccccc1)Nc2ccccc2
COc1ccccc1[C@@H](CCN)c2ccco2	ZINC000000141560	C(c1ccccc1)c2ccco2
C[C@@H](C[N@@](C)CCCN(C)C)NC(=O)N1CCN(C(C)(C)C(N)=O)CC1	ZINC000665760024	C1CNCCN1
CS(=O)(=O)N2CCN(S(=O)(=O)NC[C@@H](O)CN1CCCCC1)CC2	ZINC000443154762	O=S(=O)(NCCCN1CCCCC1)N2CCNCC2
CC[C@@H](C)[C@@H](C(=O)OC1CCN(C)CC1)c2ccccc2	ZINC000000155896	O=C(Cc1ccccc1)OC2CCNCC2
C[N+](C)(C)/C=C/C(=O)c1ccccc1	ZINC000000157963	c1ccccc1
CCN2CCN(c1ccc(NC(=O)C(C)C)cc1Cl)CC2	ZINC000000342348	C2CN(c1ccccc1)CCN2
CCN2CCC(NCc1cccc(F)c1)CC2	ZINC000000212347	C2CC(NCc1ccccc1)CCN2
CC(=O)Oc2ccc(C(=O)NC1CCCC1)cc2	ZINC000000030052	O=C(NC1CCCC1)c2ccccc2
CN3CCNC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C3	ZINC000004392966	O=C(CCc1ccccc1)NC3CNCCNC(=O)C(Cc2ccccc2)NC(=O)CNC3=O
COc1c(C)cccc1C(=O)Nc3ccc(N2CCN(C)CC2)cc3	ZINC000000528741	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
CN(C)CCOC(c1ccccc1)c2ccccc2	ZINC000000020244	C(c1ccccc1)c2ccccc2
CNC(=O)c3cc(S(=O)(=O)N1CCN2[C@@H](C1)C(=O)NC2=O)cn3C	ZINC000518014051	O=C3NC(=O)N2CCN(S(=O)(=O)c1cc[nH]c1)CC23
Cc2ccnc(NS(=O)(=O)c1ccc(NC(=O)CCC(O)=O)cc1)n2	ZINC000000860055	O=S(=O)(Nc1ncccn1)c2ccccc2
CN3CCN(c2cc(C)c1ccccc1n2)CC3	ZINC000000191191	C3CN(c2ccc1ccccc1n2)CCN3
COC(=O)c2cc(Br)c(=O)n(CCN1CCCCC1)c2	ZINC000000536063	O=c1ccccn1CCN2CCCCC2
CN4CCC(N3CCC(CN(Cc1ccncc1)C(=O)c2ccccc2)CC3)CC4	ZINC000011662215	O=C(N(CC2CCN(C1CCNCC1)CC2)Cc3ccncc3)c4ccccc4
CNC(=O)C[C@@]1(O)CCCN(C(=O)C(=O)NCCC[N@@](C)CCOC)C1	ZINC000645062043	C1CCNCC1
CN(/N=C/c1cccc(O)c1)C2=NS(=O)(=O)c3ccccc23	ZINC000000092121	O=S3(=O)N=C(NN=Cc1ccccc1)c2ccccc23
C[N@]3CCN(C(=O)C1CCNCC1)[C@@H](c2ccccc2)C3	ZINC000019411627	O=C(C1CCNCC1)N2CCNCC2c3ccccc3
O[C@@](C1=NCCN1)(c2ccc(Cl)cc2)c3ccccn3	ZINC000000000201	C3CN=C(C(c1ccccc1)c2ccccn2)N3
C(CN2CCN(c1ncccn1)CC2)Nc4ccc3ccccc3n4	ZINC000000007523	C(CN2CCN(c1ncccn1)CC2)Nc4ccc3ccccc3n4
COc2ccc(S(=O)(=O)NCCC(=O)N1CCOCC1)cc2	ZINC000000215965	O=C(CCNS(=O)(=O)c1ccccc1)N2CCOCC2
CC(C)(C)NC(=O)CSc1nc(N)cc(N)n1	ZINC000000417740	c1cncnc1
COCC[N@](C)CCCNC(=O)N2CCO[C@@H](CN1CCN(C)CC1)C2	ZINC000601253999	C2COC(CN1CCNCC1)CN2
CCn2nnc(C1=CCC[N@@](C)C1)n2	ZINC000000006302	C2CC=C(c1nn[nH]n1)CN2
Nc4nccc(c2c(c1ccc(F)cc1)ncn2C3CCNCC3)n4	ZINC000000007258	C4CC(n2cnc(c1ccccc1)c2c3ccncn3)CCN4
CN3CCN(C[C@@H]2CNC[C@H](C(=O)NCCc1ccccc1)C2)CC3	ZINC000023353424	O=C(NCCc1ccccc1)C3CNCC(CN2CCNCC2)C3
CC(C)N3CCC(N(C(=O)Cc1ccccc1)c2ccc(Cl)cc2)CC3	ZINC000000537935	O=C(Cc1ccccc1)N(C2CCNCC2)c3ccccc3
CC[C@H](C)Nc1ccc(N[C@@H](C)CC)cc1	ZINC000000057576	c1ccccc1
COc2ccc(c1nnc(SC)n1CC=C)cc2OC	ZINC000000039252	c2ccc(c1nnc[nH]1)cc2
COc5cccc(c3cn(c2ccc(CCN1CCC(O)CC1)cc2)c4ncnc(N)c34)c5	ZINC000001488120	C5CCN(CCc4ccc(n2cc(c1ccccc1)c3cncnc23)cc4)CC5
CN3CCC([N@@](C)C[C@@]2(O)CCCN(CC1CCCCC1)C2=O)CC3	ZINC000012387043	O=C2C(CNC1CCNCC1)CCCN2CC3CCCCC3
Cc3c(C(=O)Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)oc4ccc(F)cc34	ZINC000000634063	O=C(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c4cc3ccccc3o4
O=C(NCC1CCNCC1)Nc3nc2ccccc2s3	ZINC000000252732	O=C(NCC1CCNCC1)Nc3nc2ccccc2s3
CN2CCN(c1nc(N)c(C#N)c(CC#N)c1C#N)CC2	ZINC000000142726	C2CN(c1ccccn1)CCN2
O=C(COc2ccc(NC(=O)c1cccs1)cc2)N3CCOCC3	ZINC000000038356	O=C(COc2ccc(NC(=O)c1cccs1)cc2)N3CCOCC3
CC2(C)CC(NS(=O)(=O)c1ccccc1)CC(C)(C)N2	ZINC000000139843	O=S(=O)(NC1CCNCC1)c2ccccc2
COc2cccc(NC(=O)N(CCN(C)C)[C@@H](C)c1cccnc1)c2	ZINC000000262112	O=C(NCc1cccnc1)Nc2ccccc2
O=C(CN2CCN(Cc1ccccc1)CC2)N3CCNCC3	ZINC000019685385	O=C(CN2CCN(Cc1ccccc1)CC2)N3CCNCC3
CC(C)NC(=O)[C@@H]3C[C@@H](NC2CCN(Cc1ccccc1)CC2)CN3C(C)C	ZINC000020449775	C3CC(NC2CCN(Cc1ccccc1)CC2)CN3
O=c3n(n1cnnc1)c(=O)c5ccc(N2CCNCC2)c4cccc3c45	ZINC000000524821	O=c3n(n1cnnc1)c(=O)c5ccc(N2CCNCC2)c4cccc3c45
CCN(CC)CCn2c1ccccc1n3nc(C)c(C(C)=O)c23	ZINC000000266077	c1ccc3c(c1)[nH]c2ccnn23
Cn4c[n+](NC(=O)c3ccc(c2ccc(C(=O)N[n+]1cnn(C)c1)cc2)cc3)cn4	ZINC000006816941	O=C(N[n+]1cn[nH]c1)c4ccc(c3ccc(C(=O)N[n+]2cn[nH]c2)cc3)cc4
CN2CCN(c1ccc(N)cn1)CC2	ZINC000000167487	C2CN(c1ccccn1)CCN2
CCOc2cc(C(=O)N1CCN(C)CC1)cc(OCC)c2OCC	ZINC000000263712	O=C(N1CCNCC1)c2ccccc2
COCCN4CCC(C[N@](Cc1ccncc1)Cc2c[nH]nc2c3cccc(F)c3)CC4	ZINC000011661327	C4CC(CN(Cc1ccncc1)Cc2c[nH]nc2c3ccccc3)CCN4
CN(C)CCOC2CCN(C(=O)C(=O)NCCCN1CCOCC1)CC2	ZINC000559333250	O=C(NCCCN1CCOCC1)C(=O)N2CCCCC2
CNC(=O)Cn3[nH]c(=NC(=O)N2CC(N1CC[C@@H](O)C1)C2)cc3C	ZINC000650108299	O=C(N=c1cc[nH][nH]1)N3CC(N2CCCC2)C3
COc1ccc(C)cc1NC(=O)CNC(=O)[C@@]23CNC[C@@H]2C[N@@](C)C3	ZINC000065387682	O=C(CNC(=O)C12CNCC1CNC2)Nc3ccccc3
COc3cc2CC[N@](Cc1ccsc1)Cc2cc3OC	ZINC000000200307	C2Cc1ccccc1CN2Cc3ccsc3
CC(=O)Oc1cc(C(F)(F)F)ccc1C(O)=O	ZINC000000002220	c1ccccc1
O[C@@H](C[n+]1ccccc1)c2ccc(N(=O)=O)cc2	ZINC000000386971	C(C[n+]1ccccc1)c2ccccc2
Cc3ccc2n(C)c1CC[N+](C)(C)Cc1c2c3	ZINC000000142455	C3Cc2[nH]c1ccccc1c2CN3
CCN(CC)CCNc1ncnc2ccc(Br)cc12	ZINC000000084960	c2ccc1ncncc1c2
CN(C)[C@@]2(CNC(=O)C(=O)N1CCC[C@@](O)(CC(N)=O)C1)CCSC2	ZINC000645061260	O=C(NCC1CCSC1)C(=O)N2CCCCC2
Clc3ccc(CCNC2CCN(Cc1ccccc1)CC2)cc3	ZINC000000181945	C(Cc1ccccc1)NC3CCN(Cc2ccccc2)CC3
NCCC(=O)OC[C@@H]1CCC[N@]2CCCC[C@@H]12	ZINC000005382573	C2CCN1CCCCC1C2
Clc1cccc(Cl)c1NC(=O)N2CCNC2=O	ZINC000000043519	O=C1NCCN1C(=O)Nc2ccccc2
Clc2ccc(NC(=O)N1CCNC1=O)c(Cl)c2	ZINC000000043518	O=C1NCCN1C(=O)Nc2ccccc2
CCC[C@H]1CCc3c(C1)sc(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c3C(N)=O	ZINC000002103264	O=S(=O)(Nc2cc1CCCCc1s2)c3ccccc3
C[N+]12CCCC[C@@H]1[C@H](CO)CCC2	ZINC000000174830	C2CCN1CCCCC1C2
C[N+]3(CCNc2cc(=O)c(NCC[N+]1(C)CCOCC1)cc2=O)CCOCC3	ZINC000001703469	O=c2cc(NCCN1CCOCC1)c(=O)cc2NCCN3CCOCC3
FC(F)Oc2ccc(C[N+](=O)c1ccccc1)cc2	ZINC000000084388	O=[N+](Cc1ccccc1)c2ccccc2
OC[C@@H]2CCC[N@](C1CCCCCC1)C2	ZINC000000220055	C2CCCC(N1CCCCC1)CC2
COc3ccc(N2C(=O)C[C@H](NC[C@@H]1CCCO1)C2=O)cc3	ZINC000000084384	O=C2CC(NCC1CCCO1)C(=O)N2c3ccccc3
NC(=O)C2(N1CCCCC1)CCN(C(=O)CSCC(O)=O)CC2	ZINC000000154059	C2CCN(C1CCNCC1)CC2
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
Oc4ccc(N3CCN(C(=O)c2scc1CCCCc12)CC3)cc4	ZINC000000034604	O=C(N2CCN(c1ccccc1)CC2)c4scc3CCCCc34
CCOC(=O)c3ccc(n2[nH]c(=O)\c(=C/c1ccc(OC)c(Br)c1)c2=O)cc3	ZINC000001192182	O=c2[nH]n(c1ccccc1)c(=O)c2=Cc3ccccc3
CN(C)CCNc2ncnc3scc(c1ccccc1)c23	ZINC000000066501	c3ccc(c1csc2ncncc12)cc3
CCOc2ccc(NC(=O)C[C@@H]1SCCNC1=O)cc2	ZINC000000052324	O=C(CC1SCCNC1=O)Nc2ccccc2
CC(C)CN3CCO[C@@H](CNC(=O)c2ccc(C(=O)NC[C@@H]1C[N@@](CC(C)C)CCO1)cc2)C3	ZINC000022694275	O=C(NCC1CNCCO1)c3ccc(C(=O)NCC2CNCCO2)cc3
O=C1CNC(=S)N1CCc2cnc[nH]2	ZINC000000076829	O=C1CNC(=S)N1CCc2cnc[nH]2
CCOc2cc(CN)c(n1cccc1)cc2OCC	ZINC000000056345	c2ccc(n1cccc1)cc2
COc4ccc(S(=O)(=O)Nc2cc(C(=O)N1CCC[N@@](C)CC1)ccc2N3CCNCC3)cc4OC	ZINC000033033248	O=C(N1CCCNCC1)c4ccc(N2CCNCC2)c(NS(=O)(=O)c3ccccc3)c4
CC(C)[C@H](NC(=O)CS)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O	ZINC000048999213	nonring
NNc2ncnc3n(Cc1ccccc1)ncc23	ZINC000000045342	C(c1ccccc1)n2ncc3cncnc23
COc1ccc(OC[C@@H](O)CNC(C)C)cc1	ZINC000000073743	c1ccccc1
O[C@H](CO/N=C(\Cl)c1cccnc1)CN2CCCCC2	ZINC000000006126	C2CCN(CCCON=Cc1cccnc1)CC2
CN(C)c2ccc(CN1CCSCC1)cc2	ZINC000000201550	C2CN(Cc1ccccc1)CCS2
Cc3cc(N2CCN(C(=O)c1ccccc1)CC2)ncn3	ZINC000000013143	O=C(N2CCN(c1ccncn1)CC2)c3ccccc3
CS(=O)(=O)c1cc(F)ccc1N2CCNCC2	ZINC000000154145	C2CN(c1ccccc1)CCN2
N=C1SCCN1CC(=O)c2ccccc2	ZINC000000190006	N=C1SCCN1CC(=O)c2ccccc2
NC(=O)CCS(=O)(=O)c1ccc(Cl)cc1	ZINC000000078147	c1ccccc1
Cc3ccc(c2cn1cc(C)ccc1n2)cc3	ZINC000000023747	c3ccc(c2cn1ccccc1n2)cc3
COC(=O)c2oc1ccccc1c2NC(=O)c3ccccc3O	ZINC000000087140	O=C(Nc1coc2ccccc12)c3ccccc3
COc3ccc(C1=[N+](C)CCn2cccc12)c(OC)c3	ZINC000000387020	C3Cn1cccc1C(c2ccccc2)=N3
COc3ccc(CCN(C)C(=O)C2CCN(Cc1ccccc1Cl)CC2)cc3OC	ZINC000000778816	O=C(NCCc1ccccc1)C3CCN(Cc2ccccc2)CC3
Brc3ccc(C(=O)N2CCN(c1ccccc1)CC2)o3	ZINC000000031411	O=C(N2CCN(c1ccccc1)CC2)c3ccco3
CO[C@@H]2CC[N@]([C@@H]1CCC[C@@H]1NC(=O)C(=O)NC[C@@H](C)S(N)(=O)=O)C2	ZINC000628006389	C2CCC(N1CCCC1)C2
C3CN(c1ncnc2ccccc12)CCN3Cc4ccccc4	ZINC000000132613	C3CN(c1ncnc2ccccc12)CCN3Cc4ccccc4
OCCN1CCOCCOCCN(CCO)CCN(CCO)CC1	ZINC000019228135	C1CNCCOCCOCCNCCN1
CC[N@@](CCO)CCNS(=O)(=O)c2cnc1n(C)c(=O)[nH]c(=O)c1c2	ZINC000274362232	O=c2[nH]c(=O)c1cccnc1[nH]2
COc3ccc2CN(c1cccc(NC(C)=O)c1)C(=O)c2c3OC	ZINC000000047256	O=C2N(c1ccccc1)Cc3ccccc23
CC(=O)N[C@@H](CCCNC(N)=NN(=O)=O)C(=O)N[C@@H](CCN)C(N)=O	ZINC000013809536	nonring
CCOc2ccc(S(=O)(=O)NCc1ccccc1)cc2C(O)=O	ZINC000000042772	O=S(=O)(NCc1ccccc1)c2ccccc2
C[C@@H](CCN1CCN(C)CC1)NC(=O)N2CCN(CCN(C)C)C(=O)C2	ZINC000653340154	O=C2CN(C(=O)NCCCN1CCNCC1)CCN2
CN2CCN(Cc1ccc(N(=O)=O)o1)CC2	ZINC000000237666	C2CN(Cc1ccco1)CCN2
CCC[C@@H](N)C(=O)N1CCN(CC)CC1	ZINC000000252398	C1CNCCN1
CC(C)NC(=O)NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN4CCN(c3ccccn3)CC4	ZINC000020503901	C1CN4CCC1C(CN3CCN(c2ccccn2)CC3)C4
C[N+]2(CC(=O)OCCCOC(=O)C[N+]1(C)CCCC1)CCCC2	ZINC000004185123	O=C(CN1CCCC1)OCCCOC(=O)CN2CCCC2
CN(C)c2ccc(C(=O)N1NC(C(F)F)=C[C@@]1(O)C(F)F)cc2	ZINC000000204439	O=C(N1CC=CN1)c2ccccc2
Clc2ccc(CC(=O)Nc1ccccc1C#N)cc2	ZINC000000030755	O=C(Cc1ccccc1)Nc2ccccc2
CC[C@@H](C)NCc1ccc(C(=O)NC)o1	ZINC000000186796	c1ccoc1
CCOC(=O)c1c(N)scc1C2CC2	ZINC000000035083	C1CC1c2ccsc2
COc3cncc(N1[C@H]2CCNC[C@@H]1CC2)c3	ZINC000000026373	C1CC2CCC(CN1)N2c3cccnc3
COC(=O)[C@@H](C)c2ccc(c1ccsc1)cc2	ZINC000000003771	c2ccc(c1ccsc1)cc2
CC[C@@H](C)NC(=O)C2CCN(Cc1cccc(OC)c1O)CC2	ZINC000000299327	C2CCN(Cc1ccccc1)CC2
CN([C@H]3CC[C@@](O)(Cn1cnc2c(N)nc(N)nc12)[C@H](O)C3)C(=O)CCCN	ZINC000257270365	C3CCC(Cn1cnc2cncnc12)CC3
Clc4ccc(N3CCN(C2CCN(Cc1ccccc1)CC2)CC3)cc4	ZINC000000757771	C2CN(Cc1ccccc1)CCC2N4CCN(c3ccccc3)CC4
C[C@H](NC[C@@H](O)COc1ccccc1)[C@@H]3COc2ccccc2O3	ZINC000000249310	C(CNCC2COc1ccccc1O2)COc3ccccc3
Fc4ccc(OC[C@H]3CC[C@@H]2CN(c1ncc(F)cn1)CC[N@]2C3)cc4	ZINC000000601673	C3CC2CN(c1ncccn1)CCN2CC3COc4ccccc4
NNc1ncnc2ccsc12	ZINC000000160074	c2ncc1sccc1n2
CC(=O)OCCn1c(C)[n+](CCOC(C)=O)c2cc(Cl)c(Cl)cc12	ZINC000000777851	c2ccc1[nH]cnc1c2
C[N@]3CCC[C@@H](OC(=O)C(c1ccccc1)c2ccccc2)C3	ZINC000000250438	O=C(OC1CCCNC1)C(c2ccccc2)c3ccccc3
FC(F)(F)C(=O)Nc2ccc(C(=O)Nc1nccs1)cc2	ZINC000000036719	O=C(Nc1nccs1)c2ccccc2
CN2CCC([N@](C)Cc1ccc(N(C)C)cc1)CC2	ZINC000000201102	C2CC(NCc1ccccc1)CCN2
CC(=O)N3CCC(N[C@@H]1CCCc2ccccc12)CC3	ZINC000000214172	C3CC(NC1CCNCC1)c2ccccc2C3
Fc2ccc(C[N+](=O)c1ccccc1)cc2	ZINC000000078412	O=[N+](Cc1ccccc1)c2ccccc2
O=C2C[C@@H](C(=O)Nc1cccc(N(=O)=O)c1)CN2Cc3ccccc3	ZINC000000101164	O=C2CC(C(=O)Nc1ccccc1)CN2Cc3ccccc3
COC(=O)c1cc(C[N+](C)(C)C[C@@H](O)CO)c(Cl)cc1Cl	ZINC000000305674	c1ccccc1
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
CCC[N@@](CC1CC1)Cc2ccc(N(=O)=O)cc2	ZINC000000042931	C1CC1CNCc2ccccc2
NNc2nc(c1ccncc1)nc3ccccc23	ZINC000000078197	c3ccc2nc(c1ccncc1)ncc2c3
CC4CCN(C[C@@H](O)Cn2c1ccccc1sc3ccccc23)CC4	ZINC000000706985	C4CCN(CCCn2c1ccccc1sc3ccccc23)CC4
CC(C)C[C@H](NC(=O)N2CCN(c1ccccc1)CC2)C(O)=O	ZINC000000539688	C2CN(c1ccccc1)CCN2
Cc2n(C)c1ccccc1[n+]2C[C@@H](O)COc3ccc(F)cc3	ZINC000000316280	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
CCN(CC)Cc1c(O)c(CC)cc2c(C)cc(=O)oc12	ZINC000000137921	O=c2ccc1ccccc1o2
COc2ccc(CCN1C(=O)OC(C)(C)[C@@]1(C)O)cc2OC	ZINC000000049540	O=C1OCCN1CCc2ccccc2
CN(C)c2nc(NS(=O)(=O)c1ccc(Cl)cc1)nc(N(C)C)n2	ZINC000000862672	O=S(=O)(Nc1ncncn1)c2ccccc2
Nc4ccc(C2N=NC(=S)Cc3cc1OCOc1cc23)cc4	ZINC000000024167	S=C4Cc2cc1OCOc1cc2C(c3ccccc3)N=N4
CC[N@@](CCNC(=O)C(=O)N1CCN(C)C[C@@H]1CN)CCC(F)(F)F	ZINC000557262426	C1CNCCN1
Fc4ccc(c3cn2c1CCCCc1sc2n3)cc4	ZINC000000023696	C1CCc3c(C1)sc4nc(c2ccccc2)cn34
C3CN(c2nccc(OCc1ccccc1)n2)CCN3	ZINC000000003314	C3CN(c2nccc(OCc1ccccc1)n2)CCN3
CCN(C(=O)c1ccc(OC)c(OC)c1)c2ccccc2C	ZINC000000029918	O=C(Nc1ccccc1)c2ccccc2
Cc3ccc([C@@H]1SCC(=O)N1CCN2CCCCC2)cc3	ZINC000000072762	O=C2CSC(c1ccccc1)N2CCN3CCCCC3
C[C@H]4CCC=C5C[C@H]3OC(=O)[C@H](CN2CCC(N1CCCCC1)CC2)[C@H]3[C@@H](O)[C@]45C	ZINC000004062994	O=C3OC2CC1=CCCCC1CC2C3CN5CCC(N4CCCCC4)CC5
O[C@H](Cn1c(=O)sc2ccccc12)C[n+]3ccccc3	ZINC000000405483	O=c2sc1ccccc1n2CCC[n+]3ccccc3
O=C(NN1CCCCC1)C2CCNCC2	ZINC000000251559	O=C(NN1CCCCC1)C2CCNCC2
CN2CCC(CNC(=O)NC1CCN(CC(=O)N(C)C)CC1)CC2	ZINC000069441165	O=C(NCC1CCNCC1)NC2CCNCC2
Oc1ccccc1CN3CCC(C(=O)NC[C@@H]2CCCO2)CC3	ZINC000000317485	O=C(NCC1CCCO1)C3CCN(Cc2ccccc2)CC3
CN(C)c2cc(C)nc(N1CCCCC1)c2C#N	ZINC000000204329	C2CCN(c1ccccn1)CC2
Cc2n(CCO)c1cc(Cl)c(Cl)cc1[n+]2CCO	ZINC000000370117	c2ccc1[nH]cnc1c2
COc3cc(CNC2Cc1ccccc1C2)ccc3OC[C@@H](O)CN4CCCC4	ZINC000011838702	C4CCN(CCCOc3ccc(CNC2Cc1ccccc1C2)cc3)C4
COc3c1OCOc1cc2CC[N+](C)=Cc23	ZINC000000001216	C3Oc2cc1CCN=Cc1cc2O3
COc1ccc(C(C)=O)cc1CN(C)C	ZINC000000330642	c1ccccc1
COc2cc(C(=O)NCc1ccc(C)nc1N)cc(OC)c2OC	ZINC000000002225	O=C(NCc1cccnc1)c2ccccc2
Nc3cc(N)nc(SCc2noc(c1ccc(Cl)cc1)n2)n3	ZINC000000460145	C(Sc1ncccn1)c3noc(c2ccccc2)n3
C[C@@H]3C[C@@H](C[C@@H]1CCCCN1)[C@H]2CCCN[C@@H]2C3	ZINC000004098402	C3CCC(CC1CCCC2NCCCC12)NC3
CNC(=O)CCOC2CCN([C@@H]1CC(=O)N(CCCN(C)C)C1=O)CC2	ZINC000531205001	O=C2CC(N1CCCCC1)C(=O)N2
CN(C)CCCc3cc(C(=O)Nc2ccc(c1ccncc1)cc2)ccc3O	ZINC000000599925	O=C(Nc2ccc(c1ccncc1)cc2)c3ccccc3
Cc3cc1COC(=O)c1c(Sc2ccc(C(C)(C)C)cc2)n3	ZINC000000028968	O=C2OCc3ccnc(Sc1ccccc1)c23
COc1ccccc1[C@@H]3Oc2ccccc2C6=C3[C@@H](c4ccc(N(C)C)cc4)n5[nH]cnc5=N6	ZINC000000638004	O5C(c1ccccc1)C3=C(N=c2nc[nH]n2C3c4ccccc4)c6ccccc56
CCc2ccc(C)[n+](CC#CC[n+]1cc(CC)ccc1C)c2	ZINC000006489866	C(C#CC[n+]1ccccc1)[n+]2ccccc2
CC2(C)C[C@@](CCN)(c1ccc(F)cc1)CCO2	ZINC000000206875	C2CC(c1ccccc1)CCO2
C[C@@H](C[N@@](C)CCCN(C)C)NC(=O)N1CCN(CC(=O)N(C)C)CC1	ZINC000665760533	C1CNCCN1
CN2CCN(c1ncc(C#N)c(N)n1)CC2	ZINC000000159647	C2CN(c1ncccn1)CCN2
COc2cccc(NC(=S)N(C)C1CCN(C)CC1)c2	ZINC000000109220	S=C(NC1CCNCC1)Nc2ccccc2
CCOC(=O)c1ccccc1OC(N)=O	ZINC000000003929	c1ccccc1
CCCN3CCC(N2C[C@@H](NCc1cccc(C)c1)C[C@H]2C(=O)NCC)CC3	ZINC000023338360	C3CC(N2CCC(NCc1ccccc1)C2)CCN3
CCN(CC)CCn3c1ccccc1n4c(C(=O)CC)c(c2ccccc2)nc34	ZINC000000759019	c4ccc(c1cn3c(n1)[nH]c2ccccc23)cc4
CCOC(=O)c2ccc(NC(=O)COc1ccccc1C)cc2	ZINC000000038380	O=C(COc1ccccc1)Nc2ccccc2
C[n+]1ccccc1\C=c3/sc2ccccc2n3CCO	ZINC000000188599	C(c1ccccn1)=c3[nH]c2ccccc2s3
Nc2ncnc3n(CCN1CCCCC1)cnc23	ZINC000000490333	C3CCN(CCn1cnc2cncnc12)CC3
CCc1ccccc1N3CCN(CCc2cc(OC)c(OC)c(OC)c2)CC3	ZINC000000625024	C2CN(c1ccccc1)CCN2CCc3ccccc3
OC3CN(C(c1ccccc1)c2ccccc2)C3	ZINC000000133425	C3CN(C(c1ccccc1)c2ccccc2)C3
COC(=O)c1c[nH]nc1S(=O)(=O)N(CCN(C)C)C2CCN(C)CC2	ZINC000603309074	O=S(=O)(NC1CCNCC1)c2cc[nH]n2
N=C2NC[C@@H](Cc1ccc(N(=O)=O)cc1)C(=N)N2	ZINC000013757826	N=C2NCC(Cc1ccccc1)C(=N)N2
Cn2c(=O)[nH]c3cc1nn[nH]c1cc23	ZINC000000002428	O=c3[nH]c2cc1nn[nH]c1cc2[nH]3
CC1(C)CC3(CC(C)(C)N1)OC(=O)N(Cc2ccccn2)[C@@]3(C)O	ZINC000000036895	O=C2OC1(CCNCC1)CN2Cc3ccccn3
CN(C)CCNC(=O)CN1C(=O)CSc2ccccc12	ZINC000000218715	O=C2CSc1ccccc1N2
COC(=O)c2cc(N1CCNCC1)nc3ccccc23	ZINC000000033812	C3CN(c2ccc1ccccc1n2)CCN3
O=c/2[nH]c1ccccc1c\2=c4\sc3=NCCCn3c4=O	ZINC000000032549	O=c2[nH]c1ccccc1c2=c4sc3=NCCCn3c4=O
COc4ccc(CCn3c(=O)[nH]c(=O)\c(=C/c1c(C)[nH]c2ccccc12)c3=O)cc4OC	ZINC000001138367	O=c3[nH]c(=O)c(=Cc1c[nH]c2ccccc12)c(=O)n3CCc4ccccc4
Cn2cc(S(=O)(=O)N1CCOCC1)cc2C(=O)NCCNS(C)(=O)=O	ZINC000029682908	O=S(=O)(N1CCOCC1)c2cc[nH]c2
O[C@@H](CNCc1ccccc1C(F)(F)F)C(F)(F)F	ZINC000000170280	c1ccccc1
COc4cc3CC[C@@H]([N@@](C)Cc1ccccc1O)c2cc(=O)c(OC)ccc2c3c(OC)c4OC	ZINC000000689682	O=c1cccc4c(c1)C(NCc2ccccc2)CCc3ccccc34
CC2(C)CC(NC[C@@H](O)COCc1ccco1)CC(C)(C)N2	ZINC000007982416	C(CNC1CCNCC1)COCc2ccco2
CC3(C)Cc2nc1ccccc1c(N)c2C=C3	ZINC000000012173	C3Cc2nc1ccccc1cc2C=C3
COc2ccc(NC(=S)N1CCC[N@](C(C)C)C1)cc2Cl	ZINC000000260322	S=C(Nc1ccccc1)N2CCCNC2
NC(=N)SCCC(=O)NCNC(=O)CCSC(N)=N	ZINC000016991091	nonring
Clc4cccc(N3CCN(CCCn2nc1ccccn1c2=O)CC3)c4	ZINC000000538483	O=c3n(CCCN2CCN(c1ccccc1)CC2)nc4ccccn34
Cc2nc(N1CCNCC1)nc3CCCCc23	ZINC000000010493	C3CCc2nc(N1CCNCC1)ncc2C3
CCOC(=O)C1=C(CN(CC)CC)N(C)C(=O)N[C@@H]1c2ccccc2	ZINC000000033404	O=C2NC=CC(c1ccccc1)N2
COc2cccc(NC(=O)N1CCC([N@@](C)C(C)C)CC1)c2	ZINC000000260979	O=C(Nc1ccccc1)N2CCCCC2
COc1cc([S@@](C)=O)sc1c3nc2cc[nH]cc2n3	ZINC000000004861	c3csc(c2nc1cc[nH]cc1n2)c3
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)CCn2nc4c1ccccc1sc3c(CN)ccc2c34	ZINC000000838518	c1ccc2c(c1)sc4cccc3[nH]nc2c34
Cc4cc(C)c3c(N)c(C1=NC(C)(C)Cc2ccccc12)sc3n4	ZINC000000100030	C4Cc1ccccc1C(c3cc2cccnc2s3)=N4
CC(C)[N@@](C)C2CCN(S(=O)(=O)c1ccc(N(=O)=O)cc1)CC2	ZINC000000260971	O=S(=O)(N1CCCCC1)c2ccccc2
CN3CCC(NC(=O)c1cn(C)nc1C(=O)NC2CCN(C)CC2)CC3	ZINC000036617958	O=C(NC1CCNCC1)c2c[nH]nc2C(=O)NC3CCNCC3
CN[C@H](CC=C)Cc1cc(OC)c(OC)c(OC)c1	ZINC000000000813	c1ccccc1
O=C(CCn3c(=S)[nH]c2cc1OCOc1cc2c3=O)NC4CC4	ZINC000000425102	O=C(CCn3c(=S)[nH]c2cc1OCOc1cc2c3=O)NC4CC4
Cc2nc1CCCCn1c(=O)c2CCN5CCC(c3noc4cc(F)ccc34)CC5	ZINC000000538312	O=c5c(CCN3CCC(c1noc2ccccc12)CC3)cnc4CCCCn45
OC(=O)CC3(CC(=O)Nc1ccccc1n2cccn2)CCCCC3	ZINC000000129855	O=C(CC1CCCCC1)Nc2ccccc2n3cccn3
O=C(CN2N=C(c1ccccc1)CCC2=O)NCCN3CCCC3	ZINC000000219594	O=C(CN2N=C(c1ccccc1)CCC2=O)NCCN3CCCC3
COc1ccccc1NC(=O)Cc3c(O)[nH]c2ccccc2c3=O	ZINC000000223431	O=C(Cc2c[nH]c1ccccc1c2=O)Nc3ccccc3
CN(C)c3nc2ccc(OCCN1CCCCC1)cc2s3	ZINC000000275257	C3CCN(CCOc2ccc1ncsc1c2)CC3
N=C2Cc1ccccc1CN2c3cccc(N(=O)=O)c3	ZINC000000139600	N=C2Cc1ccccc1CN2c3ccccc3
CN(/N=C/c1ccc(C)o1)C2=NCCN2	ZINC000000255709	C2CN=C(NN=Cc1ccco1)N2
CN(C)S(=O)(=O)N3CC(NC(=O)C(=O)Nc1cn(C)nc1C2CC2)C3	ZINC000628032271	O=C(NC1CNC1)C(=O)Nc2c[nH]nc2C3CC3
Clc2cc1NC(=O)Cc1cc2CCN5CCN(c3nsc4ccccc34)CC5	ZINC000000538550	O=C5Cc4cc(CCN3CCN(c1nsc2ccccc12)CC3)ccc4N5
CCOc3ccc(N2C(=O)C[C@H](NCCc1ccccn1)C2=O)cc3	ZINC000000084312	O=C2CC(NCCc1ccccn1)C(=O)N2c3ccccc3
CCN(CC)CCOc1ccccc1O/C(=C/c2ccccc2)C(C)=O	ZINC000000538552	O(C=Cc1ccccc1)c2ccccc2
Fc1ccccc1C(=O)N3CCN(C(=O)COc2ccccc2)CC3	ZINC000000068691	O=C(COc1ccccc1)N3CCN(C(=O)c2ccccc2)CC3
CN3C(=O)CC2(CCN(CCCC(=O)c1ccc(F)cc1)CC2)C3=O	ZINC000000002045	O=C3CC2(CCN(CCCC(=O)c1ccccc1)CC2)C(=O)N3
CO[C@@H]1CS(=O)(=O)C[C@@H]1NC(=O)CNS(=O)(=O)c2cccnc2	ZINC000617869274	O=C(CNS(=O)(=O)c1cccnc1)NC2CCS(=O)(=O)C2
C[N+](C)(C)CCC[n+]1ccccc1CCc2cccc3ccccc23	ZINC000003620892	C(Cc1cccc2ccccc12)c3ccccn3
CN3CCN(NC(=O)c2sc1ccccc1c2Cl)CC3	ZINC000000334738	O=C(NN1CCNCC1)c3cc2ccccc2s3
Cc3cc(C)nc(NC(=N)N1CCCc2ccccc12)n3	ZINC000000069457	N=C(Nc1ncccn1)N2CCCc3ccccc23
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
COc2ccc1[nH]c(C)c(C(=O)CN(C)C)c1c2	ZINC000000117548	c2ccc1[nH]ccc1c2
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
CN[C@@]1(C)[C@H](C(C)C)CC[C@]1(C)O	ZINC000000099709	C1CCCC1
CN2CCN(c1ccc(NC(C)=O)cc1)CC2	ZINC000000515009	C2CN(c1ccccc1)CCN2
N#Cc4c1CCCCc1c(n2ccnc2)n5c3ccccc3nc45	ZINC000000083769	C1CCc4c(C1)cc3nc2ccccc2n3c4n5ccnc5
Cn3c(=O)n(C)c2ncn(C[C@@H](O)CNC1=NCCCC1)c2c3=O	ZINC000000091707	O=c3[nH]c(=O)c2n(CCCNC1=NCCCC1)cnc2[nH]3
NC(=O)C[S@@](=O)C(c1ccccc1)c2ccccc2	ZINC000000006156	C(c1ccccc1)c2ccccc2
CN(C)CCSC(=O)N2c1ccccc1C(C)(C)c3ccccc23	ZINC000000001038	C2c1ccccc1Nc3ccccc23
CN(C)CCNC(=O)[C@H]1CCCN(S(C)(=O)=O)C1	ZINC000000219447	C1CCNCC1
CC[C@@H](C)Oc1c(OC)cccc1\C=c3/c(=O)[nH]c(=S)n(c2ccc(F)cc2)c3=O	ZINC000001106534	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc3ccccc3
CCOC(=O)Cc2cn1CCN=c1s2	ZINC000000039893	C2Cn1ccsc1=N2
O=C(NCc1ccccc1)c3cccn(Cc2ccccc2)c3=O	ZINC000000058344	O=C(NCc1ccccc1)c3cccn(Cc2ccccc2)c3=O
C[N@]1[C@H]3CC[C@@H]1CC(NC(=O)c2ccc(Cl)cc2)C3	ZINC000000132942	O=C(NC1CC2CCC(C1)N2)c3ccccc3
Nc1ccc3c(=O)[nH]c(=O)c2cccc1c23	ZINC000000008558	O=c1[nH]c(=O)c3cccc2cccc1c23
CCCN(CCC)Cc1c(C(=O)OCC)nnn1c2nonc2N	ZINC000000112256	c2cn(c1cnon1)nn2
COc2ccc1c(CC[N+]1(C)C)c2	ZINC000000021691	C2Cc1ccccc1N2
Cn3c(=O)n(C)c2ncn(CCCC(=N)N1CCOCC1)c2c3=O	ZINC000000054274	N=C(CCCn1cnc2[nH]c(=O)[nH]c(=O)c12)N3CCOCC3
COc3ccc(CC1=NCCc2cc(OC)c(OC)cc12)cc3	ZINC000000006201	C3Cc1ccccc1C(Cc2ccccc2)=N3
C[N@]4CCC[C@H](C(=O)n2c1ccccc1[nH]c(=O)c3cccnc23)C4	ZINC000000004265	O=C(C1CCCNC1)n3c2ccccc2[nH]c(=O)c4cccnc34
CCc1nccn1CCC(=O)N(C)CC3CCN(CCc2ccccc2F)CC3	ZINC000011819222	O=C(CCn1ccnc1)NCC3CCN(CCc2ccccc2)CC3
Cn3c(=O)n(C)c2ncn(CC(=N)N1CCCCC1)c2c3=O	ZINC000000054272	N=C(Cn1cnc2[nH]c(=O)[nH]c(=O)c12)N3CCCCC3
COc2cc(C(=O)/C=C/N1CC=CC1)cc(OC)c2OC	ZINC000000002035	O=C(C=CN1CC=CC1)c2ccccc2
C[N@@](CCO)CCn2c(=O)n(C)c1ncn(C)c1c2=O	ZINC000000346993	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
CC2(C)CC(NC(=O)c1ccn[nH]1)CC(C)(C)N2	ZINC000000092959	O=C(NC1CCNCC1)c2ccn[nH]2
C4CCN(C(On1nnc2ccccc12)=[N+]3CCCC3)C4	ZINC000000395620	C4CCN(C(On1nnc2ccccc12)=[N+]3CCCC3)C4
CN(C)CCCN2c1ccccc1CCc3ccc(C#N)cc23	ZINC000000001141	C2Cc1ccccc1Nc3ccccc23
Cc2cc(\C=C\c1cccs1)cc(C)c2O	ZINC000000004311	C(=Cc1cccs1)c2ccccc2
CC(=O)N[C@@H]1C=C(C(=O)N[C@@H](CCS(C)(=O)=O)C(N)=O)C[C@@H](O)[C@@H]1O	ZINC000004200817	C1CCC=CC1
COc2ccc(C(=O)CCN1CCCCC1)cc2	ZINC000000128630	O=C(CCN1CCCCC1)c2ccccc2
CCN(CC)CCCN(CC)C(=O)C(=O)NCC(=O)N1CCNCC1	ZINC000584163228	C1CNCCN1
CC4=C(C(=O)Nc1ccccc1)[C@@H](c2ccccc2)n3nnnc3N4	ZINC000000065650	O=C(Nc1ccccc1)C3=CNc2nnnn2C3c4ccccc4
C[N@]1CCc3c(C1)c2ccccc2n3C	ZINC000000036609	C3Cc2[nH]c1ccccc1c2CN3
NC(=N)NCc3cc2c(=O)c1ccccc1c(=O)c2c(O)c3O[C@H]4O[C@@H](CO)[C@H](O)[C@@H](O)[C@@H]4O	ZINC000085593171	O=c3c1ccccc1c(=O)c4cc(OC2CCCCO2)ccc34
CC[N+](CC)(CCO)CCCN2C(=O)[C@@H]1CC=C(Cl)C[C@H]1C2=O	ZINC000000107352	O=C2NC(=O)C1CC=CCC12
COC(=O)C(C)(C)NC(=O)[C@@]13CNC[C@@H]1C[N@](C2CCCC2)C3	ZINC000065372435	C3CCC(N2CC1CNCC1C2)C3
CN(C)CCOC(=O)c2oc1ccccc1c2C	ZINC000000177171	c2ccc1occc1c2
O=C2C[C@H](NCc1ccco1)C(=O)N2CCc3ccccc3	ZINC000000132832	O=C2CC(NCc1ccco1)C(=O)N2CCc3ccccc3
COc2cccc(NC(=O)CC[N@]1C[C@@H](C)C[C@@H](C)C1)c2	ZINC000000176488	O=C(CCN1CCCCC1)Nc2ccccc2
CCOC(=O)c2c(C)nc3c([C@@H]1CCC[N@]1C)cccn23	ZINC000000134536	C3CNC(c1cccn2ccnc12)C3
CN(C)Cc2c(O)ccc3occ([C@@H](O)c1ccccc1)c23	ZINC000000196731	C(c1ccccc1)c2coc3ccccc23
O=C(C[C@@H]1CCNC[C@@H]1Cc3cc(CN2CCNCC2)on3)NC4CC4	ZINC000022936347	O=C(CC1CCNCC1Cc3cc(CN2CCNCC2)on3)NC4CC4
COc2cc(CN(C)C1CCN(C)CC1)cc(OC)c2O	ZINC000000207008	C2CC(NCc1ccccc1)CCN2
CN4CCC(c3cc(c1ccncc1)c(c2ccc(F)cc2)[nH]3)CC4	ZINC000000009158	C4CC(c3cc(c1ccncc1)c(c2ccccc2)[nH]3)CCN4
O[C@H](CN1CCN(C=O)CC1)CN3CCN([C@@H]2CCS(=O)(=O)C2)CC3	ZINC000072406229	O=S3(=O)CCC(N2CCN(CCCN1CCNCC1)CC2)C3
CCN2CCN(C(=S)c1ccc(OC)cc1)CC2	ZINC000000093761	S=C(N1CCNCC1)c2ccccc2
CC(C)(C)OC(=O)NCC2CCN(Cc1ccccc1)CC2	ZINC000000130612	C2CCN(Cc1ccccc1)CC2
Cn3nc(C(=O)NCCCN2CCN(CCCNC(=O)c1ccc(=O)n(C)n1)CC2)ccc3=O	ZINC000022809445	O=C(NCCCN2CCN(CCCNC(=O)c1ccc(=O)[nH]n1)CC2)c3ccc(=O)[nH]n3
O=C2CN(S(=O)(=O)CCCS(=O)(=O)Nc1cnc[nH]1)CCN2	ZINC000584123626	O=C2CN(S(=O)(=O)CCCS(=O)(=O)Nc1cnc[nH]1)CCN2
CC(C)(C)c2ccc(c1nnnn1CC(O)=O)cc2	ZINC000000012950	c2ccc(c1nnn[nH]1)cc2
C3NC[C@]4(c2ccc1ccccc1c2)OC[C@H]3O4	ZINC000000001768	C3NCC4(c2ccc1ccccc1c2)OCC3O4
COc1cc(C)ccc1S(=O)(=O)NC2CC(C)(C)NC(C)(C)C2	ZINC000000384609	O=S(=O)(NC1CCNCC1)c2ccccc2
COc3ccc([C@@H]2N(O)C(C)(C)C(c1ccccc1)[N+]2=O)cc3	ZINC000000300185	O=[N+]2C(c1ccccc1)CNC2c3ccccc3
OC[C@H](Cc1ccccc1)Nc3ncnc4n(c2ccccc2)ncc34	ZINC000000012959	C(Cc1ccccc1)Nc3ncnc4n(c2ccccc2)ncc34
Cn2nc(c1ccccc1)c(C=C)c(N)c2=O	ZINC000000021055	O=c2ccc(c1ccccc1)n[nH]2
C[N+](C)(C)[C@@H]2[C@@H](O)O[C@H]1[C@@H](O)CO[C@H]12	ZINC000000039940	C2CC1OCCC1O2
CSc1ccccc1OC[C@H](O)CNC(C)C	ZINC000000000781	c1ccccc1
CNC(=O)Oc3ccc2N(C)[C@@H]1ON(C)CC[C@]1(C)c2c3	ZINC000000001369	C3CC1C(Nc2ccccc12)ON3
CC(=O)N[C@H]1[C@H](O)[C@@H](O)[C@H](CO)O[C@H]1OCc2ccccc2	ZINC000000134040	C2CCC(OCc1ccccc1)OC2
C[N+](C)(C)Cc2ccc(C(=O)c1ccccc1)cc2	ZINC000000155088	O=C(c1ccccc1)c2ccccc2
OCC2=CC[N+]3(Cc1ccccc1)CC[C@H](O)[C@H]23	ZINC000000526751	C3CC1C=CC[N+]1(Cc2ccccc2)C3
Nc3cc(Cl)cc4nc(Cc2nc1ccccc1[nH]2)[nH]c34	ZINC000000026559	C(c2nc1ccccc1[nH]2)c4nc3ccccc3[nH]4
CCN2CCC(N1CCOCC1)CC2	ZINC000000280483	C2CC(N1CCOCC1)CCN2
CCc3ccc(NC2=NC(=O)C[C@@H](C(=O)c1ccccc1)N2)cc3	ZINC000000528409	O=C3CC(C(=O)c1ccccc1)NC(Nc2ccccc2)=N3
NCCc2c[nH]c3ccc(OCc1ccccc1)cc23	ZINC000000057128	C(Oc2ccc1[nH]ccc1c2)c3ccccc3
Cc3cc(NS(=O)(=O)c2cc(C(=O)Nc1ccccc1)ccc2Br)no3	ZINC000000990413	O=C(Nc1ccccc1)c3cccc(S(=O)(=O)Nc2ccon2)c3
C[C@@H](CNC(=O)C(=O)N2CCN(C(=O)[C@@H]1CCCO1)CC2)S(N)(=O)=O	ZINC000541959518	O=C(C1CCCO1)N2CCNCC2
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
Clc3ccc(CSc1nnc2[nH]cnn12)c(Cl)c3	ZINC000000036460	C(Sc1nnc2[nH]cnn12)c3ccccc3
CN3CCN(c2ccc(NC(=O)c1cccnc1Cl)cc2)CC3	ZINC000000533536	O=C(Nc2ccc(N1CCNCC1)cc2)c3cccnc3
CO/N=C2\COC1(CCN(C)CC1)C2	ZINC000000013601	N=C2COC1(CCNCC1)C2
Cc1nccn1CCCN2C(=O)OC(C)(C)[C@@]2(C)O	ZINC000000108973	O=C1OCCN1CCCn2ccnc2
OC(=O)Cn2c1CCCCc1c(=S)nc2c3cccc(N(=O)=O)c3	ZINC000000079483	S=c3nc(c1ccccc1)[nH]c2CCCCc23
Cc1cccnc1NC[C@@H](O)COc2ccccc2	ZINC000000141824	C(CNc1ccccn1)COc2ccccc2
Cn2ncc(C1=CCCNC1)n2	ZINC000000025029	C2CC=C(c1cn[nH]n1)CN2
COc2ccc([C@@H]1NC[C@@H](C(O)=O)S1)cc2	ZINC000000053078	C2CSC(c1ccccc1)N2
O=C(C[C@H]2[N@](C1CCCC1)CCNC2=O)NCC4CCN(Cc3ccccc3)CC4	ZINC000011775717	O=C(CC2N(C1CCCC1)CCNC2=O)NCC4CCN(Cc3ccccc3)CC4
CCOc3ccc2n(CCN(CC)CC)c1ccccc1sc2c3	ZINC000000114623	c3ccc2sc1ccccc1[nH]c2c3
COc1ccccc1N([C@H]2CN3CCC2CC3)C(=O)c4ccccc4	ZINC000000173295	O=C(N(C1CN2CCC1CC2)c3ccccc3)c4ccccc4
O[C@@H]3C=C5CC[N@]4Cc2cc1OCOc1cc2[C@H]([C@H]3O)[C@@H]45	ZINC000000000024	C5Oc4cc3CN1CCC2=CCCC(C12)c3cc4O5
CCOC(=O)COc2ccc1c(C)c(CCN(CC)CC)c(=O)oc1c2Cl	ZINC000000576842	O=c2ccc1ccccc1o2
Clc4ccc(C(=O)Cn2c1=NCCn1c3ccccc23)cc4	ZINC000000017113	O=C(Cn2c1=NCCn1c3ccccc23)c4ccccc4
COc1ccccc1N5CCN(CCn4cnc3sc2C[N@@](C)CCc2c3c4=O)CC5	ZINC000000591024	O=c4n(CCN2CCN(c1ccccc1)CC2)cnc5sc3CNCCc3c45
C[N+]1(C)[C@H]3CC[C@@H]1CC(OC(=O)[C@H](O)c2ccccc2)C3	ZINC000000000368	O=C(Cc1ccccc1)OC2CC3CCC(C2)N3
C[C@H](CNC1CCCCC1)OC(=O)c2ccccc2	ZINC000000000365	O=C(OCCNC1CCCCC1)c2ccccc2
C[N+](C)(C)CC[N+](C)(C)Cc1cccc2ccccc12	ZINC000001569175	c2ccc1ccccc1c2
Cn2c(c1ccccc1)cn4c2nc3n(C)c(=O)[nH]c(=O)c34	ZINC000000041829	O=c4[nH]c(=O)c3c(nc2[nH]c(c1ccccc1)cn23)[nH]4
NC(=O)Cc1ccc(OC[C@@H](O)CCl)cc1	ZINC000000040431	c1ccccc1
O[C@@H]2C[N@@](C1CCOCC1)CC[C@H]2N4CCN(CCc3ccccc3)CC4	ZINC000019835616	C4CC(N3CCC(N2CCN(CCc1ccccc1)CC2)CC3)CCO4
CCN(CC)CCn2c(c1ccccc1)noc2=N	ZINC000000001560	N=c2[nH]c(c1ccccc1)no2
COCCNC(=O)Cn2cc(C=c1c(=O)[nH]c(=O)[nH]c1=O)c3ccccc23	ZINC000002314524	O=c3[nH]c(=O)c(=Cc1c[nH]c2ccccc12)c(=O)[nH]3
Cc2ccc(n1cc(CN)cn1)cc2	ZINC000000333412	c2ccc(n1cccn1)cc2
Cc2cc1sc(C)[n+](CCO)c1cc2C	ZINC000000302586	c2ccc1scnc1c2
C[N+](C)(C)C[C@@H](O)c1cccc(N(=O)=O)c1	ZINC000000207088	c1ccccc1
CN3CCN(c2nc1ccccc1nc2C)CC3	ZINC000000244784	C3CN(c2cnc1ccccc1n2)CCN3
CCOC(=O)N2CCN(C(=O)c1ccc(N(=O)=O)c(C)c1)CC2	ZINC000000087935	O=C(N1CCNCC1)c2ccccc2
COc2cc(C)c(Cc1cnc(N)nc1N)cc2OC	ZINC000000000562	C(c1ccccc1)c2cncnc2
NC(=N)Cc1c(Cl)cccc1Cl	ZINC000000115197	c1ccccc1
CN1CCCCC/C1=N\CCn2cnc3n(C)c(=O)n(C)c(=O)c23	ZINC000000090157	O=c3[nH]c(=O)c2n(CCN=C1CCCCCN1)cnc2[nH]3
CCC(=O)O[C@@]2(c1ccccc1)CC[N@@](C)C[C@@H]2CC=C	ZINC000000000021	C2CC(c1ccccc1)CCN2
N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N3CCNCC3	ZINC000040459999	O=C(CCc1c[nH]c2ccccc12)N3CCNCC3
CCOC(=O)CN1CCCCC1	ZINC000000155331	C1CCNCC1
CC(C)(C)[C@@]1(O)C=C(C(F)(F)F)NN1C(=O)c2ccccc2F	ZINC000000033225	O=C(N1CC=CN1)c2ccccc2
CN2C(=O)C[C@](C)(c1ccccc1)C2=O	ZINC000000014257	O=C2CC(c1ccccc1)C(=O)N2
CC(=O)Nc4ccc(c3c[n+]2cc(Sc1ccccc1)ccc2n3C)cc4	ZINC000000631626	S(c1ccccc1)c4ccc3[nH]c(c2ccccc2)c[n+]3c4
CN2CCC(OC(=O)COc1ccccc1)CC2	ZINC000000383098	O=C(COc1ccccc1)OC2CCNCC2
CN[C@@H](C)[C@@H](O)c1ccccc1	ZINC000000020259	c1ccccc1
Cc2cc(C)c([n+]1cccc(C(N)=O)c1)c(C)c2	ZINC000000331464	c2ccc([n+]1ccccc1)cc2
C(Oc1ccccc1c3nc2ccccc2[nH]3)c4cccnc4	ZINC000000011046	C(Oc1ccccc1c3nc2ccccc2[nH]3)c4cccnc4
OC(=O)\C=C\C(=O)N2CCN(c1nccc(C(F)(F)F)n1)CC2	ZINC000000066221	C2CN(c1ncccn1)CCN2
C[C@@H]3CC[C@@H](N2CCN(c1ncccn1)CC2)C3	ZINC000000213776	C3CCC(N2CCN(c1ncccn1)CC2)C3
OCCN4CCN([C@@H]1CC[C@@H]2CC[C@H]1c3ccccc23)CC4	ZINC000000015038	C4CN(C1CCC2CCC1c3ccccc23)CCN4
Cc2cc(C)[n+](Cc1ccccc1)cc2C(N)=O	ZINC000000331463	C(c1ccccc1)[n+]2ccccc2
OC(=O)C3(CNS(=O)(=O)c2ccc1[nH]c(=O)c(=O)[nH]c1c2)CCC3	ZINC000556773891	O=c3[nH]c2ccc(S(=O)(=O)NCC1CCC1)cc2[nH]c3=O
Cc3ccc(N(CC1=NCCN1)c2cccc(O)c2)cc3	ZINC000000020251	C3CN=C(CN(c1ccccc1)c2ccccc2)N3
CC[C@@H]3CSC4=[N+](c1ccccc1)[C@@](O)(c2ccc(OC)cc2)CN34	ZINC000000623116	C4CN3CC(c1ccccc1)[N+](c2ccccc2)=C3S4
C[C@@H](N)COc1c(C)cccc1C	ZINC000000020257	c1ccccc1
NS(=O)(=O)c2ccc(NC(=O)CN1C(=O)CCC1=O)cc2	ZINC000000062214	O=C(CN1C(=O)CCC1=O)Nc2ccccc2
CC(C)NC[C@@H](O)COc1ccc(NC(C)=O)cc1C(C)=O	ZINC000000000211	c1ccccc1
C[C@H](N(C)C)C(=O)Nc2cc(c1ccccc1)nn2c3ccccc3	ZINC000000000217	c3ccc(c2ccn(c1ccccc1)n2)cc3
COc1cccc(OC)c1CN	ZINC000000167032	c1ccccc1
C[N@]4CCC[C@@H](CNC2C1CC3CC(C1)CC2C3)C4	ZINC000001633810	C4CNCC(CNC2C1CC3CC(C1)CC2C3)C4
CCc4ccc([C@@H]2NCCc3cc1OCCOc1cc23)cc4	ZINC000000140544	C4Cc2cc1OCCOc1cc2C(c3ccccc3)N4
CC(=O)Nc2ccc1n(C)cc[n+]1c2	ZINC000000387367	c2cc[n+]1cc[nH]c1c2
COc1cc(OC)c(C[N+](=O)C(C)(C)C)c(OC)c1	ZINC000000006331	c1ccccc1
C[C@]34CO[C@]5(C(=O)N2CCN(c1ccccn1)CC2)C[C@H]3CC[C@]45C	ZINC000000067549	O=C(N2CCN(c1ccccn1)CC2)C35CC4CCC3C4CO5
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
NC(=O)C2CCN(Cc1c(F)cccc1Cl)CC2	ZINC000000217884	C2CCN(Cc1ccccc1)CC2
Cc2cc(C)c(NC(=O)[C@@H]1CCC[N@]1CCO)c(C)c2	ZINC000000185814	O=C(Nc1ccccc1)C2CCCN2
NCCC(=O)n2c1ccccc1sc3ccc(C(F)(F)F)cc23	ZINC000000069851	c3ccc2sc1ccccc1[nH]c2c3
CC(C)C[C@@H](NS(=O)(=O)c2ccc1[nH]c(=O)c(=O)[nH]c1c2)C(O)=O	ZINC000002853243	O=c2[nH]c1ccccc1[nH]c2=O
O=C(Nc1ccccc1)O[C@@H]2CN3CCC2CC3	ZINC000000050683	O=C(Nc1ccccc1)OC2CN3CCC2CC3
COC(=O)C3=C2C(=O)N(c1ccc(C)cc1)C(=O)[C@@]2(C)NN3	ZINC000000081706	O=C2C1NNC=C1C(=O)N2c3ccccc3
C3CN(C(N1CCNCC1)c2ccccc2)CCN3	ZINC000019319020	C3CN(C(N1CCNCC1)c2ccccc2)CCN3
COc3cc2CC[C@H]1CCN[C@@H]1c2cn3	ZINC000000006424	C3CC2CCc1ccncc1C2N3
O=c2n(CCCN1CCCCC1)c(=S)[nH]c3ccccc23	ZINC000000425053	O=c2n(CCCN1CCCCC1)c(=S)[nH]c3ccccc23
COc3ccc(CN2CCN(c1ccccc1F)CC2)c(OC)c3C	ZINC000000201623	C2CN(c1ccccc1)CCN2Cc3ccccc3
CC2=C(NC(=S)NC(=O)c1ccccc1)NCc3ccccc23	ZINC000000031959	O=C(NC(=S)NC2=Cc1ccccc1CN2)c3ccccc3
Cc2cc(Cl)c(N1CCNCC1)cc2S(C)(=O)=O	ZINC000000154110	C2CN(c1ccccc1)CCN2
C[C@@H]1CCCC[N@]1CCNC(=O)c3ccc2SCC(=O)Nc2c3	ZINC000000217641	O=C3CSc2ccc(C(=O)NCCN1CCCCC1)cc2N3
CN(C)CCCN(CCCN(C)C)Cc1ccccc1C(F)(F)F	ZINC000002479871	c1ccccc1
CC(C)[C@H](N)C(=O)N1CCN(C(=O)C[C@@H](C)CC(C)(C)C)[C@H](C)C1	ZINC000000252099	C1CNCCN1
OCC[N+](CCO)(CCO)Cn1c(=O)sc2ccccc12	ZINC000000407622	O=c2[nH]c1ccccc1s2
NS(=O)(=O)c2ccc(F)c(CNC(=O)NCC(=O)N1CCNCC1)c2	ZINC000652201413	O=C(NCC(=O)N1CCNCC1)NCc2ccccc2
CC(C)(C)n1cn[n+](CC=C)n1	ZINC000000052204	c1nnn[nH]1
CN(C)C(=O)OCC[N+](C)(C)CCC[N+](C)(C)CCOC(=O)N(C)C	ZINC000005046553	nonring
CCCC(=O)c1cc(F)ccc1OC[C@H](O)CNC(C)(C)C	ZINC000000000112	c1ccccc1
COc2ccc(C(C)=NNC(=O)c1ccc(N(=O)=O)cc1)cc2	ZINC000000059560	O=C(NN=Cc1ccccc1)c2ccccc2
CN3CCC(c1c[nH]c2ccc(O)cc12)CC3	ZINC000000007339	C3CC(c1c[nH]c2ccccc12)CCN3
Nc2nc1ccccc1n2Cc3ccccc3	ZINC000000132982	C(c1ccccc1)n2cnc3ccccc23
COc2cc(C(=O)NCCN1CCCC1)cc(OC)c2OC	ZINC000000529575	O=C(NCCN1CCCC1)c2ccccc2
O=c2[nH]c1ccccc1n2C3CCNCC3	ZINC000000119391	O=c2[nH]c1ccccc1n2C3CCNCC3
COc2ccc([C@@H](O)Cc1nccn1C)cc2	ZINC000000378165	C(Cc1ncc[nH]1)c2ccccc2
CC(C)(C)C(=O)COn2c(=O)c1ccccc1c2=O	ZINC000000051520	O=c1[nH]c(=O)c2ccccc12
COc2cc(\C=N\NC(=S)NCc1ccco1)ccc2O	ZINC000000072591	S=C(NCc1ccco1)NN=Cc2ccccc2
OC3CCN(C[C@H]1C[C@H]2C[C@@H]1C=C2)CC3	ZINC000000215826	C3CCN(CC1CC2CC1C=C2)CC3
OCCN1CCOCCOCCOCC1	ZINC000000254786	C1COCCOCCOCCN1
CCN2CCC(NC1CCC(O)CC1)CC2	ZINC000000757688	C2CCC(NC1CCNCC1)CC2
CC(C)(C)c2cc(C[C@@H]1SCNC1=O)cc(C(C)(C)C)c2O	ZINC000000002274	O=C1NCSC1Cc2ccccc2
O=C3CS[C@@]1(CN2CCC1CC2)N3	ZINC000000191477	O=C3CSC1(CN2CCC1CC2)N3
C(CCCCCSC1=NCCN1)CCCCSC2=NCCN2	ZINC000004748147	C(CCCCCSC1=NCCN1)CCCCSC2=NCCN2
Nc2nc(c1ccccc1)cn2/N=C/c3cccc(N(=O)=O)c3	ZINC000000240640	C(=Nn2cnc(c1ccccc1)c2)c3ccccc3
OC[C@@H]1CCCC[N@]1Cc2cc(Br)cs2	ZINC000000209884	C2CCN(Cc1cccs1)CC2
Cc3oc(c2ccc1OCCOc1c2)cc3C(=O)NCC(O)=O	ZINC000000479862	C3COc2cc(c1ccco1)ccc2O3
O=N(=O)c2ccc(CN1CCNCC1)cc2	ZINC000000239618	C2CN(Cc1ccccc1)CCN2
CCN(CC)CCn2c(=O)[nH]c1ccccc1c2=O	ZINC000000139946	O=c2[nH]c(=O)c1ccccc1[nH]2
C[C@@H](Oc1ccccc1)C(=O)N2CCCc3ccccc23	ZINC000000030920	O=C(COc1ccccc1)N2CCCc3ccccc23
COC(=O)c3nn(c2c(C)n(C)n(c1ccccc1)c2=O)cc3O	ZINC000000142849	O=c2c(n1cccn1)c[nH]n2c3ccccc3
CC1(C)[C@H]3CC[C@]1(C)[C@H](NC(=O)CC[N+](C)(C)Cc2ccccc2)C3	ZINC000000206512	O=C(CCNCc1ccccc1)NC2CC3CCC2C3
ClC1=CC[C@@H]3[C@H](C1)C(=O)N(CCN2CCCCC2)C3=O	ZINC000000139734	O=C2C1CC=CCC1C(=O)N2CCN3CCCCC3
Cc3cccc(NC(=O)CSc2nc1c(=O)[nH]c(=O)[nH]c1n2C)c3	ZINC000000421116	O=C(CSc2nc1c(=O)[nH]c(=O)[nH]c1[nH]2)Nc3ccccc3
CN(C)CCOC(=O)[C@@]2(C#N)CC3c1ccccc1C2c4ccccc34	ZINC000000052332	C2CC3c1ccccc1C2c4ccccc34
CCn2c[n+](C[C@@H](O)COC1CCCCC1)c3cc(C)c(C)cc23	ZINC000000089056	C3CCC(OCCC[n+]1c[nH]c2ccccc12)CC3
C[N+](C)(C)Cc1ccc(C[N+](C)(C)C)cc1	ZINC000001504197	c1ccccc1
C[C@@H]2CN(C)C[C@H](C(=O)NC[C@@H](CO)NC(=O)[C@@H]1CN(C)C[C@H](C)O1)O2	ZINC000623023897	O=C(NCCNC(=O)C1CNCCO1)C2CNCCO2
COc4ccc([C@@H]1NCC[C@@]13C(=O)N(C)c2ccccc23)cc4	ZINC000000380375	O=C2Nc1ccccc1C23CCNC3c4ccccc4
CN1CCOC[C@H]1CNC(=O)C(=O)N(C)C[C@@H](O)CN2CCOCC2	ZINC000637104696	O=C(NCCCN1CCOCC1)C(=O)NCC2COCCN2
Cc4cc(N2CCN(C(=O)CN1CCCC1)CC2)cc([C@@H]3CCCN3)n4	ZINC000019697998	O=C(CN1CCCC1)N4CCN(c3ccnc(C2CCCN2)c3)CC4
Cc3ccc(Nc1cc(C)nc2ccc(Cl)cc12)cc3	ZINC000000143864	N(c1ccccc1)c2ccnc3ccccc23
N[C@H](C[C@H]2N(C(=O)[C@H]1CNCCS1)C=NC2=O)C(=O)N3CCC[C@H]3C(N)=O	ZINC000256000341	O=C(CCC2N(C(=O)C1CNCCS1)C=NC2=O)N3CCCC3
CC(C)NC[C@@H](O)c1ccc(N)c(C#N)c1	ZINC000000002307	c1ccccc1
COc4ccc(c3c[n+]2cn(Cc1ccccc1)c(C)c2c(=O)[nH]3)cc4	ZINC000000161368	O=c3[nH]c(c1ccccc1)c[n+]4cn(Cc2ccccc2)cc34
CCCc2cnc(N1CCCNCC1)nc2	ZINC000000066456	C2CNCCN(c1ncccn1)C2
Fc3ccc(NC(=O)N2CCN(CCc1ccccc1)CC2)cc3	ZINC000000146033	O=C(Nc1ccccc1)N3CCN(CCc2ccccc2)CC3
NC(=N)c2ccc(c1ccccc1N(=O)=O)o2	ZINC000000001818	c2ccc(c1ccco1)cc2
CN(C)CCC(=O)Nc2nc(c1ccc(Cl)cc1)cs2	ZINC000000073771	c2ccc(c1cscn1)cc2
COc1ccc(Br)cc1CCN	ZINC000000404234	c1ccccc1
Cc1ncc(N(=O)=O)n1CCOC(=O)Nc2ccccc2	ZINC000000031176	O=C(Nc1ccccc1)OCCn2ccnc2
CN4CCN(c2nc(C)nc3n(CCc1ccccc1)ncc23)CC4	ZINC000000082118	C4CN(c2ncnc3n(CCc1ccccc1)ncc23)CCN4
CCN(CC)CCn2c(NC(=O)c1ccccc1O)nc3ccccc23	ZINC000000784016	O=C(Nc2nc1ccccc1[nH]2)c3ccccc3
CN(C)c4ccc(C(=C1CN2CCC1CC2)c3ccc(N(C)C)cc3)cc4	ZINC000000762972	C1CN4CCC1C(=C(c2ccccc2)c3ccccc3)C4
N[C@@H](CO)Cc1ccc(Cl)cc1	ZINC000000119808	c1ccccc1
Cn2c([n+]1ccccc1)c(\C=N\NC(N)=S)sc2=O	ZINC000000206759	O=c2[nH]c([n+]1ccccc1)cs2
CC(=O)Nc2ccc(CN1CCSCC1)cc2	ZINC000000199508	C2CN(Cc1ccccc1)CCS2
C[N+](C)(C)C[C@@H](O)COc1ccc(Cl)cc1Cl	ZINC000000236833	c1ccccc1
OC5CCN(CCC(=O)Nc4ccc3[nH]c2ccc(NC(=O)CCN1CCC(O)CC1)cc2c(=O)c3c4)CC5	ZINC000028456133	O=C(CCN1CCCCC1)Nc5ccc4[nH]c3ccc(NC(=O)CCN2CCCCC2)cc3c(=O)c4c5
Fc3ccc(OCC2CCN(CC1CC1)CC2)cc3	ZINC000000013938	C1CC1CN3CCC(COc2ccccc2)CC3
CN2CCN(c1ccc(C=O)cc1)CC2	ZINC000000158906	C2CN(c1ccccc1)CCN2
CS(=O)(=O)N2CCN(S(=O)(=O)NCC[C@@]1(O)CCOC1)CC2	ZINC000651839064	O=S(=O)(NCCC1CCOC1)N2CCNCC2
Oc3ccc(CN2CCC(N1CCCCC1)CC2)cc3	ZINC000000212697	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
Cc2nnc(SCC(=O)Nc1ccc(F)cc1)s2	ZINC000000031556	O=C(CSc1nncs1)Nc2ccccc2
CS(=O)(=O)Nc2ccc(C(=O)N1CCN(CC(N)=O)C(=O)C1)cc2	ZINC000622690843	O=C2CN(C(=O)c1ccccc1)CCN2
Cc4ccc(n3c(=O)[nH]c(=O)c(=Cc1c[nH]c2ccccc12)c3=O)cc4	ZINC000000087558	O=c3[nH]c(=O)c(=Cc1c[nH]c2ccccc12)c(=O)n3c4ccccc4
COc1ccccc1[C@@H](O)Cc2cc[n+](C)cc2	ZINC000000369332	C(Cc1ccncc1)c2ccccc2
O=c3oc1ccccc1c(N2CCCC2)c3CN4CCCC4	ZINC000000236909	O=c3oc1ccccc1c(N2CCCC2)c3CN4CCCC4
NC(=O)C2CCN(C[C@@H](O)c1cccc(N(=O)=O)c1)CC2	ZINC000000119240	C2CCN(CCc1ccccc1)CC2
O=C(N1CCCC1)c2ccc(=O)[nH]c2	ZINC000000003545	O=C(N1CCCC1)c2ccc(=O)[nH]c2
C[n+]3ccc(\C=C\c1c[nH]c2ccc(Br)cc12)cc3	ZINC000000268502	C(=Cc1c[nH]c2ccccc12)c3ccncc3
CN4CCN(c2ncnc3n(Cc1ccccc1)ncc23)CC4	ZINC000000175728	C4CN(c2ncnc3n(Cc1ccccc1)ncc23)CCN4
COC[C@@H](C)NC1CCN(C(C)=O)CC1	ZINC000000214201	C1CCNCC1
Nc3c(c1nnnn1c2ccccc2)cnc4ccccc34	ZINC000000119488	c4ccc(n1nnnc1c3cnc2ccccc2c3)cc4
CC(C)NC(=O)NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN(C)CC#C	ZINC000020503937	C1CN2CCC1CC2
CCN1CCC3(CC1)C[C@@H]2C[C@@H]4O[C@@]2(CN3C(C)=O)C=C4	ZINC000000444298	C1CC3(CCN1)CC2CC4OC2(CN3)C=C4
COc1cc(C(=O)OCCN(C)C)cc(OC)c1OC	ZINC000000489517	c1ccccc1
COc1ccc(C(=S)NN)cc1	ZINC000000028271	c1ccccc1
NS(=O)(=O)c2ccc(CNC(=O)c1ccc(Br)o1)cc2	ZINC000000672011	O=C(NCc1ccccc1)c2ccco2
CN3CCN(Cc2ccc(C(=O)NC[C@@]1(O)CCCNCC1)o2)CC3	ZINC000072167651	O=C(NCC1CCCNCC1)c3ccc(CN2CCNCC2)o3
O[C@@H](CNC[C@@H](O)[C@H]2CCc1cc(F)ccc1O2)[C@H]4CCc3cc(F)ccc3O4	ZINC000000607986	C(CC2CCc1ccccc1O2)NCCC4CCc3ccccc3O4
N[C@H](CC[C@H](N)C(O)=O)C[C@H]2O[C@@H](N1CCC(=O)NC1=O)[C@H](O)[C@@H]2O	ZINC000049018012	O=C2CCN(C1CCCO1)C(=O)N2
CN(C)CCNC(=O)N2CCN(c1ccccc1Cl)CC2	ZINC000000024590	C2CN(c1ccccc1)CCN2
C2CN(Cc1ccccc1)CCC2n3nnc4cccnc34	ZINC000000171281	C2CN(Cc1ccccc1)CCC2n3nnc4cccnc34
CN(C)CCN(Cc1ccc(C#N)cc1)C(=O)C(=O)NC[C@@H]2COCCN2	ZINC000599961907	O=C(NCC1COCCN1)C(=O)NCc2ccccc2
CC[N@]1CC=C3[C@H](C1)[C@@H](c2ccncc2)C(C#N)=C(N)C3(C#N)C#N	ZINC000000483828	C3NCC2C(c1ccncc1)C=CCC2=C3
COc1ccccc1NS(=O)(=O)c3cccc(C(=O)Nc2ccccc2C(O)=O)c3	ZINC000000866123	O=C(Nc1ccccc1)c3cccc(S(=O)(=O)Nc2ccccc2)c3
CN3C(=O)C[C@H](N2CCC(N1CCCCC1)(C(N)=O)CC2)C3=O	ZINC000000127739	O=C3CC(N2CCC(N1CCCCC1)CC2)C(=O)N3
Ic1ccccc1C(=O)Nn2c(=O)ccc2=O	ZINC000000369794	O=C(Nn1c(=O)ccc1=O)c2ccccc2
Cc3cc(NC(=O)CN1CCCCC1)n(c2ccccc2)n3	ZINC000000159418	O=C(CN1CCCCC1)Nc2ccnn2c3ccccc3
CCN1C[C@H]2C[N@](C)C[C@@H](C1)C2OC(=O)c3ccc(Cl)cc3	ZINC000000001034	O=C(OC1C2CNCC1CNC2)c3ccccc3
CNC(=O)Cn3[nH]c(=NC(=O)N2CCN(Cc1nnc[nH]1)CC2)cc3C	ZINC000650107994	O=C(N=c1cc[nH][nH]1)N3CCN(Cc2nnc[nH]2)CC3
COCC[N@]1CCC[C@@H]1CNC(=O)N2CCN(CCN(C)C)C(=O)C2	ZINC000650863517	O=C2CN(C(=O)NCC1CCCN1)CCN2
CN(C1CC(C)(C)N(C)C(C)(C)C1)S(=O)(=O)c2ccc(C)cc2	ZINC000000052954	O=S(=O)(NC1CCNCC1)c2ccccc2
CN3CCN(C2CCN(Cc1ccccn1)CC2)CC3	ZINC000019889855	C3CN(C2CCN(Cc1ccccn1)CC2)CCN3
CN4CCN(C3CCN(C[C@@H]1C[C@H]2C[C@@H]1C=C2)CC3)CC4	ZINC000019889857	C4CN(C3CCN(CC1CC2CC1C=C2)CC3)CCN4
OC(=O)CCC(=O)Nc2ccc(N1CCOCC1)c3nonc23	ZINC000000204354	C3CN(c1cccc2nonc12)CCO3
NC(=O)c2c1CCCCc1sc2NC(NC(=O)c3cccnc3)(C(F)(F)F)C(F)(F)F	ZINC000000978332	O=C(NCNc2cc1CCCCc1s2)c3cccnc3
CC1(C)CC(=O)CC(C)(C)N1OC(=O)c2ccco2	ZINC000000036867	O=C2CCN(OC(=O)c1ccco1)CC2
S=C(NCc1ccco1)Nc3ccc2[nH]ccc2c3	ZINC000000026959	S=C(NCc1ccco1)Nc3ccc2[nH]ccc2c3
C[N@@](CCN1CCNCC1)CCC(=O)Nc2cccc(S(N)(=O)=O)c2	ZINC000647835269	O=C(CCNCCN1CCNCC1)Nc2ccccc2
COc1ccccc1N4CCN(CCc3ccc2[nH]c(=O)sc2c3)CC4	ZINC000000604740	O=c4[nH]c3ccc(CCN2CCN(c1ccccc1)CC2)cc3s4
O[C@@H](COc1ccc(Br)cc1)CN3CCN(Cc2ccc(Cl)cc2)CC3	ZINC000000703741	C(COc1ccccc1)CN3CCN(Cc2ccccc2)CC3
CO[C@H]1CNCC[C@H]1NC(=O)c2cc(Cl)c(N)cc2OC	ZINC000000404160	O=C(NC1CCNCC1)c2ccccc2
C3CCN(CCSc1nnnn1c2ccccc2)CC3	ZINC000000188469	C3CCN(CCSc1nnnn1c2ccccc2)CC3
C3COc2cnc1ccccc1c2N3	ZINC000000002542	C3COc2cnc1ccccc1c2N3
COc3ccc(C(=O)Nn1c(C)nnc1n2nc(C)cc2C)cc3	ZINC000000090555	O=C(Nn1cnnc1n2cccn2)c3ccccc3
C4CN(c2cc(c1ccncc1)nc3ccccc23)CCO4	ZINC000000163656	C4CN(c2cc(c1ccncc1)nc3ccccc23)CCO4
CN(C)CCN(C)n2cc(c1ccccc1)c3ccccc23	ZINC000000001032	c3ccc(c1c[nH]c2ccccc12)cc3
Nc3sc2C[N@@](CCc1ccccc1)CCc2c3C#N	ZINC000000258949	C(Cc1ccccc1)N3CCc2ccsc2C3
CN(CCNC(C)=O)C(=O)C(=O)N2CCN(C(=O)C(=O)NC1CC1)CC2	ZINC000573324515	O=C(NC1CC1)C(=O)N2CCNCC2
CN(C)S(=O)(=O)N2CC(NC(=O)CCn1cc(S(N)(=O)=O)cn1)C2	ZINC000629537679	O=C(CCn1cccn1)NC2CNC2
CC(C)N2CCC(N1CCCCC1)CC2	ZINC000000243837	C2CCN(C1CCNCC1)CC2
NC(=N)NCc1cccc(CNC(N)=N)n1	ZINC000000112064	c1ccncc1
C[N@]3CCCN(C[C@@H]2Cc1ccccc1CN2)CC3	ZINC000020217800	C3CNCCN(CC2Cc1ccccc1CN2)C3
CN2CCN(C(=O)CCNS(=O)(=O)c1ccc(S(N)(=O)=O)cc1)CC2	ZINC000515749750	O=C(CCNS(=O)(=O)c1ccccc1)N2CCNCC2
CCCN(c1ccncc1)n2ncc3ccccc23	ZINC000000010544	N(c1ccncc1)n2ncc3ccccc23
CCOC(=O)[C@@H]1CCC[N@]1Cc2ccccc2	ZINC000000056824	C2CCN(Cc1ccccc1)C2
CC(=O)N3CCC(N2CCN(c1ccccc1)CC2)CC3	ZINC000000212512	C3CC(N2CCN(c1ccccc1)CC2)CCN3
Clc2cccc(SC1CCNCC1)n2	ZINC000000000958	C2CC(Sc1ccccn1)CCN2
CC[C@@H](NC(=O)C(=O)N1CC[C@@H](S(N)(=O)=O)C1)C(=O)N2CCOCC2	ZINC000564016620	O=C(CNC(=O)C(=O)N1CCCC1)N2CCOCC2
CC(C)(C)[C@H](CN1CCCC1)OC(=O)c2ccccc2	ZINC000000111481	O=C(OCCN1CCCC1)c2ccccc2
CN4CCN(C(=S)c2cn(CCOc1ccccc1F)c3ccccc23)CC4	ZINC000000783746	S=C(N1CCNCC1)c3cn(CCOc2ccccc2)c4ccccc34
C[C@@H](Cc1ccc(O)c(O)c1)[C@H](C)Cc2ccc(O)c(O)c2	ZINC000000012342	C(CCc1ccccc1)Cc2ccccc2
C[C@H]2[C@@H](OC(C)=O)CC[N@](Cc1ccco1)[C@H]2C	ZINC000000111486	C2CCN(Cc1ccco1)CC2
C1CCc2c(C1)cccc2CC3=NCCN3	ZINC000000002128	C1CCc2c(C1)cccc2CC3=NCCN3
CCN3CCN(C(=O)c2ccc(N1CCC(NCCCOC(C)C)CC1)cc2)CC3	ZINC000012452570	O=C(N1CCNCC1)c3ccc(N2CCCCC2)cc3
O=C(CNC1CCCCC1)Nc4c2CCCc2nc3CCCc34	ZINC000000198588	O=C(CNC1CCCCC1)Nc4c2CCCc2nc3CCCc34
O[C@H](CN1CCCCC1)Cn2cc(N(=O)=O)cn2	ZINC000000331816	C2CCN(CCCn1cccn1)CC2
C[C@@H]2[C@@H](C)[N@@](CCc1ccccc1)CC[C@@H]2OC(C)=O	ZINC000000111488	C2CCN(CCc1ccccc1)CC2
CC3(C)C[C@]([C@@H](CO)CNCc1ccccc1)(c2ccccc2)CCO3	ZINC000000755051	C(CC2(c1ccccc1)CCOCC2)NCc3ccccc3
CNC[C@@H]1OCCc2ccccc12	ZINC000000290140	C2Cc1ccccc1CO2
C[N@]1CCCC[C@@H]1C(C)(C)OC(=O)C(c2ccccc2)c3ccccc3	ZINC000000608026	O=C(OCC1CCCCN1)C(c2ccccc2)c3ccccc3
COc1cc(NC(=O)[C@@H](N)CCCNC(N)=N)cc2ccccc12	ZINC000002522629	c2ccc1ccccc1c2
Cc2sc(NC(=O)\C=C\c1ccco1)c(C(O)=O)c2C	ZINC000000055503	O=C(Nc1cccs1)C=Cc2ccco2
CCN(CC)C(=O)[C@@H]2CCC[N@@](Cc1ccco1)C2	ZINC000000238952	C2CCN(Cc1ccco1)CC2
CC(C)(C)c2cc[n+](Cc1cc(Cl)nc(Cl)c1)cc2	ZINC000000163060	C(c1ccncc1)[n+]2ccccc2
CN(C(=O)CN1CCCCC1)C(C)(C)C(=O)c2ccccc2Cl	ZINC000000395796	O=C(CN1CCCCC1)NCC(=O)c2ccccc2
COc3ccc(NC(=O)CN2C(=O)[C@@H]1CC=C(Cl)C[C@H]1C2=O)cc3	ZINC000000110733	O=C(CN2C(=O)C1CC=CCC1C2=O)Nc3ccccc3
CNC3=Nc1ccc(Cl)cc1C(c2ccc[nH]2)=NC3	ZINC000000005304	C3C=Nc1ccccc1C(c2ccc[nH]2)=N3
CC(C)NC[C@@H](O)COc1cccn2nccc12	ZINC000000005305	c2ccn1nccc1c2
Cc2nc(c1cccnc1)nc(NN)c2Cl	ZINC000000162839	c2cnc(c1cccnc1)nc2
OC(=O)c1cccnc1S[C@H]3CC(=O)N(Cc2ccccc2)C3=O	ZINC000000083104	O=C2CC(Sc1ccccn1)C(=O)N2Cc3ccccc3
C3C[C@H](C1=NCCN1)c2ccccc2C3	ZINC000000113428	C3CC(C1=NCCN1)c2ccccc2C3
CCN2CCN(C(=O)c1ccc(F)cc1)CC2	ZINC000000041063	O=C(N1CCNCC1)c2ccccc2
c3ccc(c1c[nH]n2ccnc12)cc3	ZINC000000011608	c3ccc(c1c[nH]n2ccnc12)cc3
Cc2c(C(O)=O)sc(S(=O)(=O)N1CCNCC1)c2C(O)=O	ZINC000003394916	O=S(=O)(N1CCNCC1)c2cccs2
CN(C)CCCN4CCN(Cc3c(N1CCN(CCCN(C)C)CC1)c(=O)c2ccccc2c3=O)CC4	ZINC000022941756	O=c3c(CN1CCNCC1)c(N2CCNCC2)c(=O)c4ccccc34
C[N+]3(C)CCN(C[C@](O)(C1CCCCC1)c2ccccc2)CC3	ZINC000000000363	C3CCC(C(CN1CCNCC1)c2ccccc2)CC3
CCS(=O)(=O)NCCS(=O)(=O)N1CCO[C@@H](CNC(=O)NC)C1	ZINC000625370626	C1COCCN1
COc3ccc(C(=O)c2c1CCNCc1sc2NC(C)=O)cc3	ZINC000000156239	O=C(c1ccccc1)c3csc2CNCCc23
COc1ccc(C)cc1C(=O)CSc2nc(N)cc(N)n2	ZINC000000411984	O=C(CSc1ncccn1)c2ccccc2
CCS(=O)(=O)NCCS(=O)(=O)N2CCN(c1nccnn1)CC2	ZINC000625337119	C2CN(c1nccnn1)CCN2
COC(=O)CN3[C@@H](c1ccccc1)c2cc(Cl)ccc2N=C3C	ZINC000000069847	N2C=Nc1ccccc1C2c3ccccc3
COc2cc(NC(=S)N1CCN(C)CC1)cc(OC)c2	ZINC000000307233	S=C(Nc1ccccc1)N2CCNCC2
CN2CCC(NCC[C@@H]1CCC[N@]1C)CC2	ZINC000000182775	C2CNC(CCNC1CCNCC1)C2
COc3cc2C[N@](C)CC1(CCC(O)CC1)c2cc3OC	ZINC000000343931	C1CCC3(CC1)CNCc2ccccc23
CNC(=O)CN2CCN(S(=O)(=O)c1cn(C)c(=O)n(C)c1=O)CC2	ZINC000530669530	O=c2[nH]cc(S(=O)(=O)N1CCNCC1)c(=O)[nH]2
CN(C)C[C@@H](O)COc1c(Cl)cc(Cl)cc1Cl	ZINC000000303733	c1ccccc1
CCNC2(c1cccc(Cl)c1)CCC2	ZINC000000033730	C2CC(c1ccccc1)C2
CN3CCN(c2nc1n(C)c(=O)[nH]c(=O)c1n2CC=C(C)C)CC3	ZINC000000189485	O=c3[nH]c(=O)c2[nH]c(N1CCNCC1)nc2[nH]3
CC(C)(N)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@@H]5CCCCN5	ZINC000028220713	O=C(CCc1c[nH]c2ccccc12)NC(Cc3c[nH]c4ccccc34)NC(=O)C5CCCCN5
C[N@@](Cc1ccccc1N)C2CCCCC2	ZINC000000057065	C2CCC(NCc1ccccc1)CC2
C[N@]1[C@H]5CC[C@@H]1CC(NC(=O)c4cn(C2CCCCC2)c3ccccc3c4=O)C5	ZINC000000538018	O=C(NC1CC2CCC(C1)N2)c5cn(C3CCCCC3)c4ccccc4c5=O
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
C[C@@H](N)Cc1[nH]nc2ccc(O)cc12	ZINC000000027231	c2ccc1n[nH]cc1c2
C[N+](C)(CCOc1ccccc1)Cc2ccccc2	ZINC000000001023	C(COc1ccccc1)NCc2ccccc2
CCOC(=O)C(C(C)N)=C2CC(=O)N(c1ccccc1)C2=O	ZINC000000067619	C=C2CC(=O)N(c1ccccc1)C2=O
CN(C)C(=O)Oc2ccc[n+](Cc1ccccc1)c2	ZINC000000001020	C(c1ccccc1)[n+]2ccccc2
Cc2cc(C(=O)NCCN1CCCCC1)no2	ZINC000000128537	O=C(NCCN1CCCCC1)c2ccon2
O[C@](C#CCN1CCCC1)(C2CCCC2)c3ccccc3	ZINC000000198383	C3CCC(C(C#CCN1CCCC1)c2ccccc2)C3
OC(=O)c2[nH]c1ccccc1c2CC(=O)Nc3ccc(Cl)cn3	ZINC000000201632	O=C(Cc1c[nH]c2ccccc12)Nc3ccccn3
COc2ccc1n(C)c(C)c(C(=O)CN(C)C)c1c2	ZINC000000117550	c2ccc1[nH]ccc1c2
NNc2nnc(Cl)c1CCCCc12	ZINC000000039712	C2CCc1cnncc1C2
COc2cc1OCOc1cc2C=c3c(=O)[nH]c(=S)[nH]c3=O	ZINC000000465389	O=c1[nH]c(=S)[nH]c(=O)c1=Cc3ccc2OCOc2c3
C4Cc1ccccc1[C@@H](CNC[C@@H]3COc2ccccc2O3)O4	ZINC000000186665	C4Cc1ccccc1C(CNCC3COc2ccccc2O3)O4
Cc2nc1ccccc1c(N)c2CO	ZINC000000009782	c2ccc1ncccc1c2
C[C@@H](O)c2c(C)nc1ccccc1c2N	ZINC000000009783	c2ccc1ncccc1c2
O=N(=O)c1ccccc1CN4CCN(C[C@H]2C[C@H]3C[C@@H]2C=C3)CC4	ZINC000000178656	C2CN(Cc1ccccc1)CCN2CC3CC4CC3C=C4
Cc2c(CCN)c1ccccc1n2C	ZINC000000129265	c2ccc1[nH]ccc1c2
CC2(C)C(C(=O)N[C@H](C(N)=O)c1ccccc1)C2(C)C	ZINC000000020318	O=C(NCc1ccccc1)C2CC2
Fc1ccccc1NC3CCN(CCc2ccccc2)CC3	ZINC000000221453	C2CN(CCc1ccccc1)CCC2Nc3ccccc3
Fc3cccc(C(=O)c2ccc(N1CCNCC1)cc2)c3	ZINC000000280659	O=C(c1ccccc1)c3ccc(N2CCNCC2)cc3
CCOC(=O)Nc3ccc2CCc1ccccc1N(C(=O)CN)c2c3	ZINC000000303643	C2Cc1ccccc1Nc3ccccc23
NC2=N[C@@H](C[C@@H]1CO1)CCCC2	ZINC000000021633	C2CCC(CC1CO1)N=CC2
COc4ccc(CN2C[C@H](CN1CCOCC1)c3ccccc23)cc4CN(C)C	ZINC000012148206	C4CN(CC2CN(Cc1ccccc1)c3ccccc23)CCO4
COc1ccc(S(=O)(=O)N(CCO)CCO)cc1C(O)=O	ZINC000000304618	c1ccccc1
S=c2oc1ccccc1n2CNc3ccccn3	ZINC000000058591	S=c2oc1ccccc1n2CNc3ccccn3
CCN(CC)CCn2c1ccccc1n3c(C(=O)OC)c(C)nc23	ZINC000000305213	c1ccc2c(c1)[nH]c3nccn23
CN(C)CCNC(=O)CN1C(=O)COc2ccc(C(C)(C)C)cc12	ZINC000000218699	O=C2COc1ccccc1N2
CS(=O)(=O)c3ccc(C2=C(c1ccc(F)cc1)CCC2)cc3	ZINC000000018527	C3CC(c1ccccc1)=C(c2ccccc2)C3
Cc2ccc1cc(F)ccc1[n+]2C	ZINC000000150357	c2ccc1ncccc1c2
O=C(CNC(=O)C(=O)NC[C@@H]2COc1ccccc1O2)N3CCNCC3	ZINC000642770448	O=C(CNC(=O)C(=O)NCC2COc1ccccc1O2)N3CCNCC3
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
CNC(=O)c1ccc(CN(C(C)C)C(C)C)o1	ZINC000000186795	c1ccoc1
CN4CCC(c2n[nH]c3ccc(NC(=O)c1ccc(F)cc1)cc23)CC4	ZINC000000587656	O=C(Nc3ccc2[nH]nc(C1CCNCC1)c2c3)c4ccccc4
COc1cc(N)c(Cl)cc1C(=O)NCC[N@@](C)C2CC2	ZINC000000004300	O=C(NCCNC1CC1)c2ccccc2
COc2cc([C@@H]1NC(=O)CC[C@@H]1N(=O)=O)cc(Cl)c2O	ZINC000000085965	O=C2CCCC(c1ccccc1)N2
NC(=N)NC(=N)Nc1ccc(Cl)c(C(F)(F)F)c1	ZINC000000470878	c1ccccc1
Cc2cccc(NC(=O)N1CCCC1=O)c2	ZINC000000005274	O=C1CCCN1C(=O)Nc2ccccc2
Cn1ccnc1CN4CCC(C(=O)NC3CCN(C2CC2)CC3)CC4	ZINC000043285700	O=C(NC2CCN(C1CC1)CC2)C4CCN(Cc3ncc[nH]3)CC4
CN4CCN([n+]3c(C)cc(C=c2sc1ccccc1n2C)cc3C)CC4	ZINC000003179438	C4CN([n+]3ccc(C=c2[nH]c1ccccc1s2)cc3)CCN4
CCN(CC)CCOc3ccc(Cc2nc1n(C)c(=O)n(C)c(=O)c1n2CCN(CC)CC)cc3	ZINC000004775302	O=c3[nH]c(=O)c2[nH]c(Cc1ccccc1)nc2[nH]3
Nc2c(Cl)cc(CC1=NCCN1)cc2Cl	ZINC000000001790	C2CN=C(Cc1ccccc1)N2
OC2(Cc1ccccc1)CCNCC2	ZINC000000160306	C2CC(Cc1ccccc1)CCN2
C[N@@](CCc1ccccc1)Cc3c(C)n(C)n(c2ccccc2)c3=O	ZINC000000218983	O=c2c(CNCCc1ccccc1)c[nH]n2c3ccccc3
Nc2c1CCCCc1nc3cc(F)ccc23	ZINC000000010124	C3CCc2nc1ccccc1cc2C3
COC(=O)c3ccc(NC(=O)c2ccc(C)c(S(=O)(=O)Nc1ccccc1)c2)cc3	ZINC000001075425	O=C(Nc1ccccc1)c3cccc(S(=O)(=O)Nc2ccccc2)c3
Oc1ccccc1c4cc(c3ccc2OCOc2c3)c(C#N)c(=O)[nH]4	ZINC000000085982	O=c4cc(c2ccc1OCOc1c2)cc(c3ccccc3)[nH]4
C3CCN(Nc1ncnc2ccsc12)CC3	ZINC000000116566	C3CCN(Nc1ncnc2ccsc12)CC3
CCO[C@]3(C1=NCCN1)COc2ccccc2O3	ZINC000000005879	C3CN=C(C2COc1ccccc1O2)N3
CCOC(=O)CNC(=O)[C@@H]1COCCN1C(=O)[C@H]2C[C@@H](O)CN2C(C)=O	ZINC000597639274	O=C(C1CCCN1)N2CCOCC2
COC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](C)[N@]2CCC([C@H](C)NC(=O)[C@H](C)N)=C[C@@H](Cc1ccccc1)C2)C(C)C)C(C)C	ZINC000003942377	C2CC=CC(Cc1ccccc1)CN2
CC3(C)CC(NC(=O)c2cc1ccccc1oc2=O)CC(C)(C)N3	ZINC000000067265	O=C(NC1CCNCC1)c3cc2ccccc2oc3=O
CNC(=N)c1cc(Cl)cc(N(=O)=O)c1	ZINC000000048186	c1ccccc1
C[C@@H](Oc1ccccc1)C(=O)NC2CCCCCC2	ZINC000000030631	O=C(COc1ccccc1)NC2CCCCCC2
Cc4ccc3n(C[C@@H](O)Cn1ccnc1C)c2C(=O)CCCc2c3c4	ZINC000000572134	O=C1CCCc3c1n(CCCn2ccnc2)c4ccccc34
C[N@]1[C@H]3CC[C@@H]1CC(=NOC(=O)c2ccco2)C3	ZINC000000135880	O=C(ON=C1CC2CCC(C1)N2)c3ccco3
CC[C@@H](C)[C@H](N)C(=O)NCC(C)(C)N1CCCCC1	ZINC000011954066	C1CCNCC1
Oc2ccc(NS(=O)(=O)c1ccccc1)cc2CN3CCCCC3	ZINC000000114704	O=S(=O)(Nc2cccc(CN1CCCCC1)c2)c3ccccc3
NS(=O)(=O)c2ccc(CCNC(=O)c1cccs1)cc2	ZINC000000054314	O=C(NCCc1ccccc1)c2cccs2
CC[C@H]2NC(=O)c1cc(S(N)(=O)=O)c(Cl)cc1N2	ZINC000000000686	O=C1NCNc2ccccc12
Nc5ncc([C@H]3[C@H](CNC(=O)c1cc(Br)c[nH]1)[C@@H](CNC(=O)c2cc(Br)c[nH]2)Cc4[nH]c(N)nc34)[nH]5	ZINC000003914233	O=C(NCC3Cc1[nH]cnc1C(c2cnc[nH]2)C3CNC(=O)c4ccc[nH]4)c5ccc[nH]5
CCOC(=O)N1CCC(NCC(C)(C)CN(C)C)CC1	ZINC000000753465	C1CCNCC1
CCC[C@@H](N1CCCC1)C(=O)c2ccc(C)cc2	ZINC000000000681	O=C(CN1CCCC1)c2ccccc2
C[n+]1ccccc1CC(=O)c2ccc(Br)cc2	ZINC000000026307	O=C(Cc1ccccn1)c2ccccc2
C[C@@H](NC(=O)CN1CCCCC1)[C@@H]3COc2ccccc2O3	ZINC000000380916	O=C(CN1CCCCC1)NCC3COc2ccccc2O3
CN5CCN(C(=O)C[C@@H]1CCNC[C@@H]1Cc4cc(CN3CCN(c2ccccc2)CC3)on4)CC5	ZINC000012482988	O=C(CC1CCNCC1Cc4cc(CN3CCN(c2ccccc2)CC3)on4)N5CCNCC5
C[C@H](N1CCCCCC1)C(=O)c2ccc(N)cc2	ZINC000000004272	O=C(CN1CCCCCC1)c2ccccc2
CCOc3ccc(C(=O)[C@H](CN1CCCC1)c2ccccc2)cc3	ZINC000000063370	O=C(C(CN1CCCC1)c2ccccc2)c3ccccc3
Oc4ccc(N3CCN(Cc2ccc(OCCCN1CCCCC1)cc2)CC3)cc4	ZINC000004038377	C4CCN(CCCOc3ccc(CN2CCN(c1ccccc1)CC2)cc3)CC4
C[C@@H](O)CN([C@@H](C)CO)C(=O)C(=O)NCCS(=O)(=O)N1CCSCC1	ZINC000557732499	C1CSCCN1
O=C2NC[C@@H]3c1ccccc1Oc4cccc2c34	ZINC000000008787	O=C2NCC3c1ccccc1Oc4cccc2c34
CO[C@@H]3CC(=C(c1cccs1)c2cccs2)C[N+](C)(C)C3	ZINC000000000776	C3CNCC(=C(c1cccs1)c2cccs2)C3
CN4CCN(c2ncnc3scc(c1ccc(C)cc1)c23)CC4	ZINC000000098372	C4CN(c2ncnc3scc(c1ccccc1)c23)CCN4
COc3ccc(Cn2nnc(C(=O)Nc1ccc(F)cc1)c2N)cc3	ZINC000000099714	O=C(Nc1ccccc1)c3cn(Cc2ccccc2)nn3
Cc1ccc(F)cc1NC2=NCCN2	ZINC000000001480	C2CN=C(Nc1ccccc1)N2
Cc4ccc(C(=O)c2c(C)[n+](c1ccccc1)c3scc(C)n23)cc4	ZINC000000245799	O=C(c1ccccc1)c3c[n+](c2ccccc2)c4sccn34
COc3cc2CC[N@](C)C[C@@H](c1ccccc1)c2cc3OC	ZINC000000000800	C3Cc1ccccc1C(c2ccccc2)CN3
Oc1c(Br)cc(N(=O)=O)cc1\C=N\n2cnnc2	ZINC000000516910	C(=Nn1cnnc1)c2ccccc2
CC3CCN(CC(=O)Nc2sc1CCCc1c2C(N)=O)CC3	ZINC000000090014	O=C(CN1CCCCC1)Nc3cc2CCCc2s3
CNc1oncc1C2=CCC[N@@](C)C2	ZINC000000021868	C2CC=C(c1cnoc1)CN2
COc1cc(OC)c(CN)c(OC)c1	ZINC000000056681	c1ccccc1
COc2ncnc(Sc1ccc(Cl)cc1)c2N(=O)=O	ZINC000000040225	S(c1ccccc1)c2ccncn2
CCN3CCN(C(=O)CCC2CCN([C@@H](C)Cc1cccc(C)n1)CC2)CC3	ZINC000011821302	O=C(CCC2CCN(CCc1ccccn1)CC2)N3CCNCC3
C[C@@H]1CCCC[N@]1CC(=O)N2CCC(C(N)=O)CC2	ZINC000000520614	O=C(CN1CCCCC1)N2CCCCC2
COc2cccc(CCN1CCCC1)c2N	ZINC000000154212	C2CCN(CCc1ccccc1)C2
CC(=O)c2ccc(N1CCNCC1)cc2	ZINC000000029076	C2CN(c1ccccc1)CCN2
CCOC(=O)c1cnc(CN)c2c(OC)cc(OC)cc12	ZINC000000008765	c2ccc1cnccc1c2
COc3ccc(CN2CCN(c1ccc(C(C)=O)cc1)CC2)cc3	ZINC000000300512	C2CN(c1ccccc1)CCN2Cc3ccccc3
CC(C)(C)OC(=O)NC1CCC(CN)CC1	ZINC000000153953	C1CCCCC1
CN(C)CCCNS(=O)(=O)c3ccc2c(Cc1cc(S(=O)(=O)NCCCN(C)C)ccc12)c3	ZINC000001778240	C2c1ccccc1c3ccccc23
CCOc1ccccc1CN2CCC(O)CC2	ZINC000000240923	C2CCN(Cc1ccccc1)CC2
CC(NCC1CCNCC1)=C2C(=O)CC(C)(C)CC2=O	ZINC000000246936	O=C1CCCC(=O)C1=CNCC2CCNCC2
Cn2cc(OC[C@H](O)CNC(C)(C)C)c1ccccc1c2=O	ZINC000000004698	O=c1[nH]ccc2ccccc12
CCN([C@@H]1CC(=O)NC1=O)C(=O)CNS(=O)(=O)c2c[nH]c(C(N)=O)c2	ZINC000266825053	O=C(CNS(=O)(=O)c1cc[nH]c1)NC2CC(=O)NC2=O
CCN2CCN(CC(=O)NCCCn1c(=O)ccn(C)c1=O)C(=O)C2=O	ZINC000557516926	O=C(CN1CCNC(=O)C1=O)NCCCn2c(=O)cc[nH]c2=O
CCN3CCN(c2ccc(NC(=O)Cc1ccccc1)cc2)CC3	ZINC000000587395	O=C(Cc1ccccc1)Nc3ccc(N2CCNCC2)cc3
CCN2CCC(CNS(=O)(=O)c1ccc(CN)cc1)CC2	ZINC000044526186	O=S(=O)(NCC1CCNCC1)c2ccccc2
NC(=O)C3CCN([C@H]2CC(=O)N(Cc1ccc(Cl)cc1)C2=O)CC3	ZINC000000101140	O=C2CC(N1CCCCC1)C(=O)N2Cc3ccccc3
C[C@@H](O)[C@@H]3[C@H]2[C@H]1CCC[C@H](N(C)C(=O)NCCO)C1=C(C(O)=O)N2C3=O	ZINC000026665866	O=C3CC2C1CCCCC1=CN23
C[C@H](NC(=O)C1C(C)(C)C1(C)C)C(N)=O	ZINC000000020316	C1CC1
C4CN(CCn2c(NCc1ccco1)nc3ccccc23)CCO4	ZINC000000350258	C4CN(CCn2c(NCc1ccco1)nc3ccccc23)CCO4
C[C@@H]3CCCN(c2nc1ccccn1c(=O)c2C=O)C3	ZINC000000132996	O=c2cc(N1CCCCC1)nc3ccccn23
COc1ccncc1NC(=O)C(=O)NC2CN(S(=O)(=O)N(C)C)C2	ZINC000628031583	O=C(NC1CNC1)C(=O)Nc2cccnc2
CNc3nc(c1ccccc1)[n+](c2ccccc2)s3	ZINC000000041847	c3ccc(c1ncs[n+]1c2ccccc2)cc3
CN(C)CCCn2c1CCCCCCc1c3ccccc23	ZINC000000001576	C1CCCc2c(CC1)[nH]c3ccccc23
COc3ccc(NS(=O)(=O)c2ccc(NC(=O)[C@@H]1CCCC[C@@H]1C(O)=O)cc2)cc3	ZINC000001088069	O=C(Nc2ccc(S(=O)(=O)Nc1ccccc1)cc2)C3CCCCC3
Cc3cc(N1CCOCC1)c2c(N)c(C)cc(C)c2n3	ZINC000000183367	C3CN(c1ccnc2ccccc12)CCO3
COc3ccc([C@@H]1NC(=N)NC(=N)N1c2ccc(Cl)cc2)cc3	ZINC000000046885	N=C3NC(c1ccccc1)N(c2ccccc2)C(=N)N3
CC[N@]3CCC[C@H](NC1=CC(=O)OC12CCCCC2)C3	ZINC000000140231	O=C3OC1(CCCCC1)C(NC2CCCNC2)=C3
C[N+]2(C)CCc1ccc(Cl)cc12	ZINC000000021671	C2Cc1ccccc1N2
Cn2n[n+](Cc1ccc(N(=O)=O)cc1)c3ccccc23	ZINC000000362847	C(c1ccccc1)[n+]2n[nH]c3ccccc23
C[N@]1C[C@H]2C[C@@H]1CN2c3cnccn3	ZINC000000020795	C1NC3CC1N(c2cnccn2)C3
COc2ccc([C@@H]1SCC(=O)N1CCCN(C)C)cc2	ZINC000000196390	O=C2CSC(c1ccccc1)N2
CCOc3ccc(/C=C/C(=O)Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)cc3	ZINC000000947476	O=C(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)C=Cc3ccccc3
N[C@H](C(=O)N2CCN(c1ccccn1)CC2)c3ccccc3	ZINC000011754845	O=C(Cc1ccccc1)N3CCN(c2ccccn2)CC3
C/C=C(\C)CN1CCC(C(N)=O)CC1	ZINC000000219839	C1CCNCC1
CCOc3ccc(n2c(=O)[nH]c(=O)c(=Cc1ccc(N(CC)CC)cc1OC)c2=O)cc3	ZINC000001203800	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)n2c3ccccc3
CC(C)n2c(N1CCN(C)CC1)nc3n(C)c(=O)[nH]c(=O)c23	ZINC000000237780	O=c3[nH]c(=O)c2[nH]c(N1CCNCC1)nc2[nH]3
Cc2ncc(C[n+]1cccc(C(N)=O)c1)c(N)n2	ZINC000000263508	C(c1cncnc1)[n+]2ccccc2
C[C@@H]1CC(C)(C)O[C@@H](C(C)(C)CN(C)C)O1	ZINC000000171820	C1COCOC1
O=C1NCCN1C(=O)C(c2ccccc2)c3ccccc3	ZINC000000037038	O=C1NCCN1C(=O)C(c2ccccc2)c3ccccc3
Cc1nccn1c3ccc(NC(=O)[C@@H]2CCCN2)cc3	ZINC000019288273	O=C(Nc2ccc(n1ccnc1)cc2)C3CCCN3
C[N@]5C[C@H]1CNC[C@@]1(C(=O)NCC3(O)C2CC4CC(C2)CC3C4)C5	ZINC000065533511	O=C(NCC2C1CC3CC(C1)CC2C3)C45CNCC4CNC5
CCN(CC)CC(=O)Nc2scc3c1ccccc1oc(=O)c23	ZINC000000131405	O=c2oc1ccccc1c3cscc23
CN1CCC2(CC1)OC(=O)NC2=O	ZINC000000011055	O=C2NC(=O)C1(CCNCC1)O2
COCCN2CCN(C(=O)C(=O)N1CCC[C@@](O)(CC(N)=O)C1)CC2	ZINC000644909326	O=C(N1CCCCC1)C(=O)N2CCNCC2
CC2(C)CC(=O)[C@@H]([C@@H](O)c1ccccc1)C(C)(C)N2	ZINC000000052236	O=C1CCNCC1Cc2ccccc2
COC(=O)CCc1ccc(OC)c(C[N+](C)(C)C)c1	ZINC000000502617	c1ccccc1
O=C(Cc1ccccc1N(=O)=O)Oc2cc(=O)oc3ccccc23	ZINC000000042972	O=C(Cc1ccccc1)Oc2cc(=O)oc3ccccc23
COc3ccc(COC[C@@H](O)CNC2Cc1ccccc1C2)cc3	ZINC000000119013	C(CNC2Cc1ccccc1C2)COCc3ccccc3
CN3CCN(C(=O)c2ccc(CNS(=O)(=O)c1cccc(Cl)c1)cc2)CC3	ZINC000000630924	O=C(N1CCNCC1)c3ccc(CNS(=O)(=O)c2ccccc2)cc3
FC(F)(F)c2cc(NCC[C@@H]1CCCCN1)cc(C(F)(F)F)c2	ZINC000000068075	C2CCC(CCNc1ccccc1)NC2
C[N+](C)(CC[N+](C)(C)CN1CCCC1=O)CN2CCCC2=O	ZINC000003066226	O=C1CCCN1CNCCNCN2CCCC2=O
OC(=O)c4cn(C1CC1)c3cc(N2CCNCC2)c(F)cc3c4=O	ZINC000000020220	O=c3ccn(C1CC1)c4cc(N2CCNCC2)ccc34
CNC(=O)[C@@H]1CCCN1C(=O)CNC(=O)CN2C(=O)NC(C)(C)C2=O	ZINC000600128448	O=C(CN1C(=O)CNC1=O)NCC(=O)N2CCCC2
C[C@H]2C\C(=N\OC(=O)c1ccc(Br)cc1)[C@H](C)C[N@]2C	ZINC000000235781	O=C(ON=C1CCNCC1)c2ccccc2
CN1CCC2(CC1)OC(=O)N(CC=C)C2=O	ZINC000000011058	O=C2NC(=O)C1(CCNCC1)O2
CN(C)CCNC(=O)c1coc(=O)c(Br)c1	ZINC000000529103	O=c1cccco1
Nc4n[nH]c(CCNc3nccc(N2CCN[C@H]1CS(=O)(=O)C[C@H]12)n3)n4	ZINC000097413363	O=S4(=O)CC3NCCN(c2ccnc(NCCc1ncn[nH]1)n2)C3C4
C[C@@H]1CN(C(=O)C(=O)NC[C@H](C)S(N)(=O)=O)CCN1S(C)(=O)=O	ZINC000658652350	C1CNCCN1
C[N@]1[C@H]3CC[C@@H]1C=C(c2cccnc2)C3	ZINC000000007501	C1CC3NC1CC(c2cccnc2)=C3
COc2ccc(OC[C@@H](O)C[N@]1CCCC[C@H]1C)cc2	ZINC000000167003	C2CCN(CCCOc1ccccc1)CC2
C[C@@H](NC[C@H](O)Cn2c1ccccc1c3ccccc23)c4ccccc4	ZINC000000406582	C(CNCc1ccccc1)Cn3c2ccccc2c4ccccc34
C[n+]1ccccc1COc2ccc(C(N)=O)cc2	ZINC000000387350	C(Oc1ccccc1)c2ccccn2
NC(=O)CCNC[C@]2(O)CN(S(=O)(=O)c1ccccc1)C[C@H]2O	ZINC000585290437	O=S(=O)(N1CCCC1)c2ccccc2
Cc2cc(Br)c(O)c(\C=N\CCNC(=O)c1nonc1N)c2	ZINC000001761535	O=C(NCCN=Cc1ccccc1)c2cnon2
CC(C)(C)CC(C)(C)NC(N)=N	ZINC000000000356	nonring
NC(=N)NC[C@H]2COc1ccccc1O2	ZINC000000000357	C2COc1ccccc1O2
COc1ccc([C@@H](C)NC(N)=N)cc1Cl	ZINC000000527259	c1ccccc1
CN3CCN(NC(=O)CCn2c(=S)[nH]c1ccccc1c2=O)CC3	ZINC000000425048	O=C(CCn2c(=S)[nH]c1ccccc1c2=O)NN3CCNCC3
CN(C)C(On1ccccc1=O)=[N+](C)C	ZINC000000156072	O=c1cccc[nH]1
CCN[C@H](C)COc1c(C)cccc1C	ZINC000000006926	c1ccccc1
O=n2onc(c1ccccc1)c2S(=O)(=O)c3ccccc3	ZINC000000005966	O=n2onc(c1ccccc1)c2S(=O)(=O)c3ccccc3
CCOC(=O)c2ccc(NC(=S)NCCN1CCC(C)CC1)cc2	ZINC000000614286	S=C(NCCN1CCCCC1)Nc2ccccc2
NNc2ccnc(c1ccccc1)n2	ZINC000000331254	c2ccc(c1ncccn1)cc2
Cc3nn(Cc1n[nH]c(=S)n1c2ccccc2)c(=O)n3N	ZINC000001106870	O=c1[nH]cnn1Cc2n[nH]c(=S)n2c3ccccc3
C[C@@H]3CC[C@@H](N2CCC(N1CCCCC1)CC2)C3	ZINC000000217650	C3CCN(C2CCN(C1CCCC1)CC2)CC3
Cc2cccc(OCC(=O)Nc1ccc(C(N)=O)cc1)c2	ZINC000000028419	O=C(COc1ccccc1)Nc2ccccc2
Cc2ccc(NS(=O)(=O)Cc1ccccc1)c(=O)n2Cc3c(C)ncn3CC(=O)NC(C)(C)CN	ZINC000029125541	O=c2c(NS(=O)(=O)Cc1ccccc1)cccn2Cc3cnc[nH]3
CCOc3ccc(CN2CCN(c1ccccc1)CC2)cc3	ZINC000000238314	C2CN(c1ccccc1)CCN2Cc3ccccc3
Nc2cc[n+](CCCC#CC#CCCC[n+]1ccc(N)cc1)cc2	ZINC000013740384	C(CC#CC#CCCC[n+]1ccccc1)C[n+]2ccccc2
C[C@]13CC2(N)CC(O)(C1)C[C@@](C)(C2)C3	ZINC000000246606	C1C2CC3CC1CC(C2)C3
C[N@@]2[C@@H](CCC(=O)N1CCC(O)CC1)CNC(=O)[C@@H]3[C@H]2CCN3Cc4ncc[nH]4	ZINC000022923695	O=C(CCC3CNC(=O)C1C(CCN1Cc2ncc[nH]2)N3)N4CCCCC4
Cc2nc(NN)cc(c1ccccn1)n2	ZINC000000331259	c2ccc(c1ccncn1)nc2
ClC3=C(N1CCOCC1)c2ccc(Cl)cc2S3(=O)=O	ZINC000000049051	O=S3(=O)C=C(N1CCOCC1)c2ccccc23
C[N@]1[C@H]3CC[C@@H]1CC(=NOC(=O)C2CCCCC2)C3	ZINC000000135873	O=C(ON=C1CC2CCC(C1)N2)C3CCCCC3
Fc3ccc(NC(=O)CN2CCN(c1ccccn1)CC2)cc3F	ZINC000000135874	O=C(CN2CCN(c1ccccn1)CC2)Nc3ccccc3
CC3(C)CCCN(c1ncnc2[nH]ccc12)C3	ZINC000000024367	C3CCN(c1ncnc2[nH]ccc12)CC3
C[C@@H](C[N+](C)(C)C)OC(=O)c1ccc(S(=O)(=O)N(C)C)o1	ZINC000000180497	c1ccoc1
CN(C)CCCN1CNC(=S)NC1	ZINC000000180366	S=C1NCNCN1
C[C@@H](C[N@@](C)CCCN(C)C)NC(=O)N1CC[C@@]2(C1)NC(=O)N(C)C2=O	ZINC000665760571	O=C2NC(=O)C1(CCNC1)N2
O=S(=O)(N[C@@H]1CCCC[C@@H]1NCc2ccco2)c3ccccc3	ZINC000000317243	O=S(=O)(NC1CCCCC1NCc2ccco2)c3ccccc3
COC(=O)c2ccc(OC[C@H](O)CN1C[C@@H](C)C[C@H](C)C1)cc2	ZINC000000466469	C2CCN(CCCOc1ccccc1)CC2
CCOC(=O)c3ccc2nc(C)cc(Nc1ccc(O)cc1)c2c3	ZINC000000081069	N(c1ccccc1)c2ccnc3ccccc23
C[C@H](CN(C)C)Cn2c1ccccc1sc3ccccc23	ZINC000000000808	c3ccc2sc1ccccc1[nH]c2c3
CC[C@H](C(=O)N1C[C@@H](C)O[C@H](C)C1)c2ccccc2	ZINC000000030789	O=C(Cc1ccccc1)N2CCOCC2
CCOC(=O)c2ccc1n(CCO)c(C)[n+](CCO)c1c2	ZINC000000262673	c2ccc1[nH]cnc1c2
COc3cc(OC)c(\C=c2/oc1cc(O)ccc1c2=O)cc3OC	ZINC000000025569	O=c2c(=Cc1ccccc1)oc3ccccc23
CCOC(=O)CC12CN(C)CC(CC(=O)OCC)(CN(C)C1)C2=O	ZINC000000359984	O=C1C2CNCC1CNC2
CC(=O)Nc3ccc2[n+](c1ccccc1)c(C)n(C)c2c3	ZINC000000262676	c3ccc([n+]1c[nH]c2ccccc12)cc3
COc2cc(NC(=O)COc1ccc(F)cc1)nc(OC)n2	ZINC000000084166	O=C(COc1ccccc1)Nc2ccncn2
Cc2cc(Nc1ccc(F)c(Cl)c1)nc(N)n2	ZINC000000089184	N(c1ccccc1)c2ccncn2
Cc3ccc(CNC(=O)CN2C(=O)c1ccccc1S2(=O)=O)cc3	ZINC000000479682	O=C(CN2C(=O)c1ccccc1S2(=O)=O)NCc3ccccc3
CCN3CCC(NC(=O)C[N@]2CCC[C@@H](C(=O)N1CCOCC1)C2)CC3	ZINC000054994180	O=C(CN2CCCC(C(=O)N1CCOCC1)C2)NC3CCNCC3
COCCN(CCN(C)C)C(=O)C(=O)N1CCN(CC(C)(C)O)CC1	ZINC000410503277	C1CNCCN1
CN(C)CCNC(=O)c2scc1CCCCc12	ZINC000000119128	C2CCc1cscc1C2
CN(C)CCN(CCN(C)C)C(=O)Cn1cc(Br)c(=O)[nH]c1=O	ZINC000103211016	O=c1cc[nH]c(=O)[nH]1
CCCc2cc(=O)n(c1ccc(S(N)(=O)=O)cc1)[nH]2	ZINC000000092092	O=c1cc[nH]n1c2ccccc2
Cc3ccc2c(ccc1[n+](C)c(C)ccc12)[n+]3C	ZINC000001504106	c3cnc2ccc1ncccc1c2c3
CC(C)(C)NC[C@@H](O)c1cc(O)cc(O)c1	ZINC000000002281	c1ccccc1
COCCNc3nc(N[C@@H]1CNC(=O)C1)nc(N[C@@H]2CNC(=O)C2)n3	ZINC000485979516	O=C3CC(Nc2ncnc(NC1CNC(=O)C1)n2)CN3
O[C@@H](COc1cccc2ccccc12)C[N+]3(CC=C)CCOCC3	ZINC000000309672	C(COc1cccc2ccccc12)CN3CCOCC3
CN(C)c2ccc(C=C1C(=O)OC(C)(C)OC1=O)o2	ZINC000000059428	O=C1OCOC(=O)C1=Cc2ccco2
CCOc3cc(CN2CCN(c1ccccn1)CC2)ccc3O	ZINC000000291961	C2CN(c1ccccn1)CCN2Cc3ccccc3
COc4cc6nc2c(Cc1cc(OCCN)ccc12)c5CCN(C(=O)CN3CCN(C)CC3)c(c4OC)c56	ZINC000027189867	O=C(CN1CCNCC1)N4CCc5c3Cc2ccccc2c3nc6cccc4c56
OC2(\C=C\CN1CCCCC1)CCCCC2	ZINC000000123377	C2CCC(C=CCN1CCCCC1)CC2
NC(=N)SCc1ccccc1Cl	ZINC000000096711	c1ccccc1
N=C3Nc1ccccc1[C@H]2CCCC[C@H]23	ZINC000000024092	N=C3Nc1ccccc1C2CCCCC23
C[C@H](O)CN2CCN(C(=O)N[C@H]1CCN(S(C)(=O)=O)C1)CC2	ZINC000568019237	O=C(NC1CCNC1)N2CCNCC2
Brc1ccccc1OCC(=O)Nc3ccc(S(=O)(=O)Nc2nccs2)cc3	ZINC000000943119	O=C(COc1ccccc1)Nc3ccc(S(=O)(=O)Nc2nccs2)cc3
Cc2ncc(C[n+]1csc(C)c1C)c(N)n2	ZINC000000278001	C(c1cncnc1)[n+]2ccsc2
Cn2ccc3c(NC(=O)Nc1cccnc1)cccc23	ZINC000000016405	O=C(Nc1cccnc1)Nc2cccc3[nH]ccc23
CSc1ccc(CN(CCO)CCO)cc1	ZINC000000041591	c1ccccc1
NC[C@@H](c1ccc[nH]1)C(F)(F)F	ZINC000000110298	c1cc[nH]c1
CCN2CCO[C@@H](CC(=O)Nc1ccc(Br)cc1)C2=O	ZINC000000198067	O=C(CC1OCCNC1=O)Nc2ccccc2
O[C@@H](COc1ccccc1)CN3C(=O)c2ccccc2S3(=O)=O	ZINC000000072743	O=C2N(CCCOc1ccccc1)S(=O)(=O)c3ccccc23
Oc2ccc(O)c(CN1CCCCCC1)c2	ZINC000000127433	C2CCCN(Cc1ccccc1)CC2
Nc2c1COCCc1nc3ccccc23	ZINC000000024965	C3Cc2nc1ccccc1cc2CO3
CN(C)CCNc2oc(COc1ccccc1)nc2C#N	ZINC000000108756	C(Oc1ccccc1)c2ncco2
Cc2nc1ccccc1c(=O)n2CCCn3ccnc3	ZINC000000181323	O=c2n(CCCn1ccnc1)cnc3ccccc23
C[C@@]2(O)CC1(CCN(C(=O)[C@H](N)CC(N)=O)CC1)OC[C@H]2n3cnc4c(N)ncnc34	ZINC000585291703	C1CC4(CCN1)CCC(n2cnc3cncnc23)CO4
COC(=O)CCC(=O)Nc1ccc(Cl)c(Cl)c1	ZINC000000031540	c1ccccc1
Cc2ccc(CNC1=NCCS1)cc2	ZINC000000104585	C2CN=C(NCc1ccccc1)S2
Cc2nnc(c1ccccc1)c(=O)n2/N=C/c3cccs3	ZINC000000032944	O=c2c(c1ccccc1)nncn2N=Cc3cccs3
CN5CCN(c3c1CCCc1c(C#N)c4nc2ccccc2n34)CC5	ZINC000000135264	C5Cc4cc2nc1ccccc1n2c(N3CCNCC3)c4C5
CCOC(=O)C1=C(C)NC(=O)C[C@@H]1c2ccc(OC(F)(F)F)cc2	ZINC000000042710	O=C2CC(c1ccccc1)C=CN2
Nc1cc3c(cn1)[nH]c2ccccc23	ZINC000000025302	c1ccc3c(c1)[nH]c2cnccc23
CN(C)CCNC(=O)NC2(C(F)(F)F)Oc1ccccc1O2	ZINC000000212686	C2Oc1ccccc1O2
c4ccc(c1n[nH]cc1c3ccc2ncccc2n3)nc4	ZINC000000003553	c4ccc(c1n[nH]cc1c3ccc2ncccc2n3)nc4
O=C(N([C@@H]1CN2CCC1CC2)c3ccccn3)c4ccccc4	ZINC000000330919	O=C(N(C1CN2CCC1CC2)c3ccccn3)c4ccccc4
COc3cc2[C@@H](C)N(C(=O)CN1CCCCC1)CCc2cc3O	ZINC000000525714	O=C(CN1CCCCC1)N3CCc2ccccc2C3
O=C(c1ccccc1)c3cc[n+](Cc2ccccn2)cc3	ZINC000000028248	O=C(c1ccccc1)c3cc[n+](Cc2ccccn2)cc3
Cc1ccsc1C[N@]2CCC[C@@H](O)C2	ZINC000000238546	C2CCN(Cc1cccs1)CC2
O=C(NCCCN2CCN(c1ccncc1)CC2)C(=O)NCCNC3CC3	ZINC000642724563	O=C(NCCCN2CCN(c1ccncc1)CC2)C(=O)NCCNC3CC3
C3CC(CNCc2ccc(OCc1ccccc1)cc2)CCN3	ZINC000010434548	C3CC(CNCc2ccc(OCc1ccccc1)cc2)CCN3
Cc2cc(C)n1n[s+]cc1n2	ZINC000000039573	c2cnc1c[s+]nn1c2
CCOC(=O)N3CCC(NCCc1c[nH]c2ccccc12)CC3	ZINC000000221604	C3CC(NCCc1c[nH]c2ccccc12)CCN3
CCC(=O)NCCC2=CCc3ccc1OCCc1c23	ZINC000000022929	C1Cc3c(O1)ccc2CC=Cc23
COc3ccnc(N2CCN(C(=O)c1ccco1)CC2)n3	ZINC000000017599	O=C(N2CCN(c1ncccn1)CC2)c3ccco3
CC(C)c3ccc(OCC(=O)Nc2ccc(N1CCN(C)CC1)cc2)cc3	ZINC000000679586	O=C(COc1ccccc1)Nc3ccc(N2CCNCC2)cc3
Cc3cc(C)nc(NC1=NCC(=O)N1c2ccccc2Cl)n3	ZINC000000069290	O=C2CN=C(Nc1ncccn1)N2c3ccccc3
C2CN(Cc1ccco1)CCC2N4CCN(c3ccccc3)CC4	ZINC000000207675	C2CN(Cc1ccco1)CCC2N4CCN(c3ccccc3)CC4
CC2(C)C[C@]1(CCC[N@@](CCC(N)=O)C1)CCO2	ZINC000000330629	C1CNCC2(C1)CCOCC2
CC[n+]1c(C)sc2ccccc12	ZINC000000087588	c2ccc1scnc1c2
CN(C)CCCOC(=O)c1ccccc1C(=O)OCCCN(C)C	ZINC000001898995	c1ccccc1
OC(=O)CCNC(=O)c2ccc(C#CC1(O)CCCCC1)cc2	ZINC000000477067	C2CCC(C#Cc1ccccc1)CC2
O=S(=O)(NC1CCCCC1)c2cccc3nsnc23	ZINC000000063817	O=S(=O)(NC1CCCCC1)c2cccc3nsnc23
COc2cc(C(=O)NN1CCN(C)CC1)cc(OC)c2OC	ZINC000000168530	O=C(NN1CCNCC1)c2ccccc2
Cc2[nH]c1c(Cl)c(Cl)ccc1c2CCN	ZINC000000091949	c2ccc1[nH]ccc1c2
C[N@]1CCCC[C@@H]1CCn3c2ccccc2sc4ccc(S(C)(=O)=O)cc34	ZINC000000608085	C4CCC(CCn2c1ccccc1sc3ccccc23)NC4
O=Cc3ccc(N2CCN(Cc1ccccc1)CC2)nc3	ZINC000000169336	C2CN(c1ccccn1)CCN2Cc3ccccc3
O=c1[nH]c(=S)[nH]c1=Cc3ccc(N2CCCC2)cc3	ZINC000000037511	O=c1[nH]c(=S)[nH]c1=Cc3ccc(N2CCCC2)cc3
Cc3cc(C)cc(OCC(=O)NCCc2nc1ccccc1[nH]2)c3	ZINC000000032015	O=C(COc1ccccc1)NCCc3nc2ccccc2[nH]3
CNCCc1ccccc1CC2CCNCC2	ZINC000001791385	C2CC(Cc1ccccc1)CCN2
Cn3c([n+]1ccccc1)c(C=O)n(c2ccccc2)c3=O	ZINC000000042621	O=c2[nH]c([n+]1ccccc1)cn2c3ccccc3
O=S(=O)(N[C@@H]1CCCC[C@@H]1N2CCCCC2)c3ccccc3	ZINC000000204580	O=S(=O)(NC1CCCCC1N2CCCCC2)c3ccccc3
CC3(C)C=C(n1ccccc1=O)c2cc(N(=O)=O)ccc23	ZINC000000010426	O=c1ccccn1C2=CCc3ccccc23
CCN(CC)CCN1CCN=C1Cc2ccccc2	ZINC000001669270	C2CN=C(Cc1ccccc1)N2
NC(=N)Nc3ccc(c2cc1cc(NC(N)=N)ccc1s2)cc3	ZINC000006536338	c3ccc(c2cc1ccccc1s2)cc3
C[C@@H]([N@]4CCc3nc(=O)n2cc(c1ccccc1F)[nH]c2c3C4)c5ccccc5	ZINC000000604785	O=c4nc2CCN(Cc1ccccc1)Cc2c5[nH]c(c3ccccc3)cn45
Cn3nc2ncc1CCCCc1[n+]2n3	ZINC000000078041	C1CCc2c(C1)cnc3n[nH]n[n+]23
Fc2ccc(C(=O)CCCN1CCCCC1)cc2	ZINC000000001978	O=C(CCCN1CCCCC1)c2ccccc2
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
C[C@@H](N)Cc1c[nH]c2ccc(F)cc12	ZINC000000057323	c2ccc1[nH]ccc1c2
O=C(COC[C@@H]1CCC[N@]2CCCC[C@@H]12)N3CCOCC3	ZINC000000035447	O=C(COCC1CCCN2CCCCC12)N3CCOCC3
C[C@@]2(O)CC1(CCN(C(=O)CC[C@H](N)C(N)=O)CC1)OC[C@H]2n3ccc(N)nc3=O	ZINC000585287025	O=c1ncccn1C3CCC2(CCNCC2)OC3
C[C@H](N)Cn1nc(C)c2cc(F)c(F)cc12	ZINC000000025572	c2ccc1[nH]ncc1c2
O=N(=O)c3cccc(c2csc1CCC[n+]12)c3	ZINC000000161787	C3Cc2scc(c1ccccc1)[n+]2C3
COc3cc(C(=O)OC1C[C@@H]2CC[C@H](C1)[N@]2C)ccc3O	ZINC000000525904	O=C(OC1CC2CCC(C1)N2)c3ccccc3
COc5ccc(n3cc(c1ccccc1)c4c(N2CCCC2)ncnc34)cc5	ZINC000000756781	C5CCN(c3ncnc4n(c1ccccc1)cc(c2ccccc2)c34)C5
COc3cc(C[N@]2CCc1ccccc1C2)cc4OCOc34	ZINC000000210338	C4Oc3ccc(CN2CCc1ccccc1C2)cc3O4
C[n+]1ccccc1COc2ccc(\C=N\O)cc2	ZINC000000337568	C(Oc1ccccc1)c2ccccn2
Fc4ccc(C(=O)C3CCN(CCn2c(=O)nc1CCCCn1c2=O)CC3)cc4	ZINC000000597570	O=C(C3CCN(CCn2c(=O)nc1CCCCn1c2=O)CC3)c4ccccc4
Cc3ccc2c(C(=O)C[N@]1CCCC[C@@H]1CCO)c(C)[nH]c2c3	ZINC000000535172	O=C(CN1CCCCC1)c2c[nH]c3ccccc23
CC(C)Oc1ccccc1CN	ZINC000000153924	c1ccccc1
CN(C)CCNc2nc(c1ccccc1)nc3ccccc23	ZINC000000084056	c3ccc(c2ncc1ccccc1n2)cc3
C1C[n+]2c(S1)sc3ccccc23	ZINC000000053150	C1C[n+]2c(S1)sc3ccccc23
CC(C)(C)Nc3nc(n1ccnc1)nc(n2ccnc2)n3	ZINC000000110724	c3cn(c2ncnc(n1ccnc1)n2)cn3
O=c2c(=CNCC1CCNCC1)c(=O)c3ccccc23	ZINC000000246940	O=c2c(=CNCC1CCNCC1)c(=O)c3ccccc23
OC(=O)C[C@@H](Cc1ccc(Cl)cc1)C(=O)NC2CCCCC2	ZINC000000049606	O=C(CCc1ccccc1)NC2CCCCC2
CCN(CC)CCNC(=O)C(=O)NC1CCN(C(=O)CCCNC)CC1	ZINC000570178236	C1CCNCC1
Cc1nn(C)cc1[C@@H]3C[C@@H](C(F)(F)F)n2nc(C(O)=O)cc2N3	ZINC000000039411	C2Cn1nccc1NC2c3cn[nH]c3
C[N@]1[C@H]3CC[C@@H]1CC(NC(=O)CSc2ccc(C)cc2)C3	ZINC000000136053	O=C(CSc1ccccc1)NC2CC3CCC(C2)N3
NCc2cc(c1ccccc1)no2	ZINC000000169750	c2ccc(c1ccon1)cc2
O[C@H](CN2CCN(C(=O)C(=O)N1CCOCC1)CC2)CC3(O)CCC3	ZINC000625044920	O=C(N1CCOCC1)C(=O)N3CCN(CCCC2CCC2)CC3
CCOC(=O)C(=C/N=c1\ccn(C)c2ccccc12)/C#N	ZINC000000289847	N=c1cc[nH]c2ccccc12
CN(C)CCOC(=O)Nc1ccc(Br)cc1	ZINC000000398078	c1ccccc1
CN2CCC([N@@](C)Cc1cccc(C)c1)CC2	ZINC000000236790	C2CC(NCc1ccccc1)CCN2
CN4C(=O)C[C@H](N3CCC(c2nc1ccccc1[nH]2)CC3)C4=O	ZINC000000112179	O=C4CC(N3CCC(c2nc1ccccc1[nH]2)CC3)C(=O)N4
C[C@@H](Oc1ccccc1F)C(=O)NCCN2CCCCC2	ZINC000000194049	O=C(COc1ccccc1)NCCN2CCCCC2
NCc2cnc(c1ccccc1)s2	ZINC000000038493	c2ccc(c1nccs1)cc2
CCOc2ccc(/C=C/c1cc[n+](C)cc1)cc2CN3CCCCC3	ZINC000005002294	C3CCN(Cc2cccc(C=Cc1ccncc1)c2)CC3
C[N@]6C[C@H]1CNC[C@@]1(C(=O)NC25C[C@@H]4C[C@H](C2)CC(n3cncn3)(C4)C5)C6	ZINC000065422132	O=C(NC14CC3CC(C1)CC(n2cncn2)(C3)C4)C56CNCC5CNC6
C[N@]1CCC[C@H]1Cc3c[nH]c4ccc(CCS(=O)(=O)c2ccccc2)cc34	ZINC000000607845	O=S(=O)(CCc3ccc2[nH]cc(CC1CCCN1)c2c3)c4ccccc4
CC(=O)N3CCN(c1ccnc2cc(Cl)ccc12)CC3	ZINC000000171631	C3CN(c1ccnc2ccccc12)CCN3
Nc2cc(=O)n(Cc1ccccc1)c(=O)n2c3ccc(F)cc3	ZINC000000170895	O=c2ccn(c1ccccc1)c(=O)n2Cc3ccccc3
Cc5ccnc(N4CCN(CCc1c(C)n3CCCc2cccc1c23)CC4)c5	ZINC000000598506	C3Cc4cccc5c(CCN2CCN(c1ccccn1)CC2)cn(C3)c45
CS(=O)(=O)N2CCN(S(=O)(=O)N1CC[C@@H]([C@@H](O)C(F)(F)F)C1)CC2	ZINC000570344285	O=S(=O)(N1CCCC1)N2CCNCC2
CNC(=O)CN2CCC(NC(=O)NC[C@@H](C1CCCCC1)N(C)C)CC2	ZINC000046312641	O=C(NCCC1CCCCC1)NC2CCNCC2
CN(C)Cc2cc(CCNC(=O)c1ccc(Cl)cc1)ccc2O	ZINC000000210059	O=C(NCCc1ccccc1)c2ccccc2
O=c2oc1cccnc1n2CCN4CCN(c3ccccc3)CC4	ZINC000000005314	O=c2oc1cccnc1n2CCN4CCN(c3ccccc3)CC4
CN2CCC[C@@]1(CCCNC1)C2	ZINC000000106624	C1CNCC2(C1)CCCNC2
OC4CCN(CCCn2c1ccccc1sc3ccc(C#N)cc23)CC4	ZINC000000538159	C4CCN(CCCn2c1ccccc1sc3ccccc23)CC4
CC1(C)CC4(CC(C)(C)N1)OC(=O)N3CCc2ccccc2[C@@]34C	ZINC000000105572	O=C2OC1(CCNCC1)C3N2CCc4ccccc34
O=Cc3ccc(c2ccc(c1cccs1)s2)s3	ZINC000000009880	c3csc(c2ccc(c1cccs1)s2)c3
NC(=O)C(Sc2nc1ccccc1n2C(C(N)=O)C(N)=O)C(N)=O	ZINC000016545213	c2ccc1[nH]cnc1c2
Cc2ccc(NC1=NCCCS1)cc2	ZINC000000093579	C2CSC(Nc1ccccc1)=NC2
CCc3cccc(NS(=O)(=O)c2ccc1[nH]c(=O)c(=O)[nH]c1c2)c3	ZINC000000423460	O=c3[nH]c2ccc(S(=O)(=O)Nc1ccccc1)cc2[nH]c3=O
C[N@]2CCC[C@@H](OC(=O)c1ccco1)C2	ZINC000000187980	O=C(OC1CCCNC1)c2ccco2
CO[C@H]2C[C@@H](CN(C)C(=O)NCCCN1CCC[C@@H]1C(N)=O)[N@@](C)C2	ZINC000561546220	O=C(NCCCN1CCCC1)NCC2CCCN2
O=C(NCCCN1CCOCC1)C3CCN(Cc2ccccc2)CC3	ZINC000020100531	O=C(NCCCN1CCOCC1)C3CCN(Cc2ccccc2)CC3
CC[C@@H](C(=O)O[C@@H]1CN2CCC1CC2)c3ccccc3	ZINC000000192654	O=C(Cc1ccccc1)OC2CN3CCC2CC3
CN3CCN(c2ccc(CNC(=O)c1ccco1)cc2)CC3	ZINC000000130994	O=C(NCc2ccc(N1CCNCC1)cc2)c3ccco3
CC(=O)c1cc(Br)cc(N(=O)=O)c1O	ZINC000000058218	c1ccccc1
C[C@@H](N)C(=O)Nc1c(C)cccc1C	ZINC000000000786	c1ccccc1
Cc2cc(=O)oc3cc(NC(=O)[C@@H]1CCCN1)ccc23	ZINC000000403569	O=C(Nc2ccc1ccc(=O)oc1c2)C3CCCN3
CC[N@]2C[C@@H](C)[C@H](NC(=O)C(=O)NCCS(=O)(=O)N1CCSCC1)C2	ZINC000672352275	O=C(NCCS(=O)(=O)N1CCSCC1)C(=O)NC2CCNC2
CS(=O)(=O)NC2CC(NC(=O)N1CCN(CCS(N)(=O)=O)CC1)C2	ZINC000669889398	O=C(NC1CCC1)N2CCNCC2
CN2CCN(NC(=O)c1ccc(N(=O)=O)cc1Cl)CC2	ZINC000000258982	O=C(NN1CCNCC1)c2ccccc2
C\C(=C\CCN1CCC3(CC1)N(c2ccccc2)CNC3=O)c4ccc(F)cc4	ZINC000000538370	O=C2NCN(c1ccccc1)C24CCN(CCC=Cc3ccccc3)CC4
CC(C)Nc3nc(N1CCCC1)nc(N2CCCC2)n3	ZINC000000087389	C3CCN(c2ncnc(N1CCCC1)n2)C3
Cc3ccc(c2noc(CN(Cc1ccco1)S(C)(=O)=O)n2)cc3	ZINC000000033617	C(NCc2nc(c1ccccc1)no2)c3ccco3
CN(C)Cc3ccc(N2CCN(C(=O)C(=O)NCCNC1CC1)CC2)nc3	ZINC000642919785	O=C(NCCNC1CC1)C(=O)N3CCN(c2ccccn2)CC3
CCn2c(/C=C/N(C(C)=O)c1ccccc1)[n+](CC)c3cc(OC)ccc23	ZINC000000777896	N(C=Cc2nc1ccccc1[nH]2)c3ccccc3
Brc4cc(C(=O)N[C@@H]1CN2CCC1CC2)c3[nH]cnc3c4	ZINC000000385643	O=C(NC1CN2CCC1CC2)c3cccc4nc[nH]c34
COc2ccc(NC(=O)CC[N@@](C)Cc1ccccc1)c(OC)c2	ZINC000000455059	O=C(CCNCc1ccccc1)Nc2ccccc2
CN3CCN(c2ccc(NC(=O)c1cccc(C)c1)cc2)CC3	ZINC000000514999	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
ON=C2CCN(Cc1ccccc1)CC2	ZINC000000184878	N=C2CCN(Cc1ccccc1)CC2
Nc3cc(N)nc(Sc1ncnc2ccccc12)n3	ZINC000000033720	S(c1ncccn1)c2ncnc3ccccc23
COC(=O)CCN2CC[C@@H](N1CCC(C(=O)NCCN(C)C)CC1)C2=O	ZINC000595364974	O=C1NCCC1N2CCCCC2
O=C(O[C@@H]1CN2CCC1CC2)c3cccc4nc[nH]c34	ZINC000000385645	O=C(OC1CN2CCC1CC2)c3cccc4nc[nH]c34
FC(F)(F)c3cc(N1CCNCC1)c2ccccc2n3	ZINC000000170653	C3CN(c1ccnc2ccccc12)CCN3
Fc3ccc(NC(=O)CCN2CCN(c1ccccn1)CC2)cc3	ZINC000000224521	O=C(CCN2CCN(c1ccccn1)CC2)Nc3ccccc3
O=C3C[C@H](Nc2ccc(N1CCCCC1)cc2)C(=O)N3Cc4ccccc4	ZINC000000639860	O=C3CC(Nc2ccc(N1CCCCC1)cc2)C(=O)N3Cc4ccccc4
CCC(=O)c3ccc2sc1ccccc1n(C[C@H](C)N(C)C)c2c3	ZINC000000000669	c3ccc2sc1ccccc1[nH]c2c3
CN3CCN(c1ccccc1Cc2ccccc2)CC3	ZINC000000002068	C3CN(c1ccccc1Cc2ccccc2)CCN3
Cc2cc[n+](CCC[n+]1ccc(C)cc1)cc2	ZINC000000396355	C(C[n+]1ccccc1)C[n+]2ccccc2
CN1CCC3(CC1)C[C@@H]2C[C@H]4O[C@]2(CN3)C=C4	ZINC000005904386	C1CC3(CCN1)CC2CC4OC2(CN3)C=C4
CC(=O)c2cc1OCOc1cc2NC(=O)c3c(Cl)cnn3C	ZINC000000046872	O=C(Nc2ccc1OCOc1c2)c3ccn[nH]3
O=C(NC[C@@H]1COCCN1)C(=O)N3CCN(C(=O)C(=O)NC2CC2)CC3	ZINC000627470532	O=C(NCC1COCCN1)C(=O)N3CCN(C(=O)C(=O)NC2CC2)CC3
NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc2cnc[nH]2)NC(=O)c3cc(=O)[nH]c(=O)[nH]3	ZINC000004217208	O=C(NC(Cc1cnc[nH]1)C(=O)N2CCCC2)c3cc(=O)[nH]c(=O)[nH]3
NCC23C[C@H]1C[C@H](CC(O)(C1)C2)C3	ZINC000000244201	C1C2CC3CC1CC(C2)C3
Nc3ccc(S(=O)(=O)Nc1ccccc1c2nc(N)nc(N)n2)cc3	ZINC000001559914	O=S(=O)(Nc1ccccc1c2ncncn2)c3ccccc3
C[C@H]2[C@@H](c1ccccc1)NCCC2=O	ZINC000000270720	O=C2CCNC(c1ccccc1)C2
COc3ccc(C(=O)Nn2c(=O)c1ccccc1c2=O)cc3	ZINC000000065990	O=C(Nn2c(=O)c1ccccc1c2=O)c3ccccc3
CN4CCN(/N=C/c2nc(c1ccccc1)n3ccccc23)CC4	ZINC000000079320	C4CN(N=Cc2nc(c1ccccc1)n3ccccc23)CCN4
COc4ccc(C3=[N+]1CCCCN1[C@@](O)(c2ccc(OC)cc2)C3)cc4	ZINC000000637382	C4CC[N+]3=C(c1ccccc1)CC(c2ccccc2)N3C4
CC4CCN(C(=O)C[N@@]3CCc2nnc([C@@H]1CCCN1)n2CC3)CC4	ZINC000019706304	O=C(CN3CCc2nnc(C1CCCN1)n2CC3)N4CCCCC4
S=C(NC2CCN(Cc1ccccc1)CC2)Nc3cccnc3	ZINC000000066436	S=C(NC2CCN(Cc1ccccc1)CC2)Nc3cccnc3
O[C@H](C#CCN1CCCC1)c2ccccc2	ZINC000000052044	C2CCN(CC#CCc1ccccc1)C2
CCN(CC)CCn1c(=O)[nH]c(=O)c2n(C)cnc12	ZINC000000485860	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
CC(C)CC[N@@](C)C2CCN(S(=O)(=O)c1ccc(C)cc1)CC2	ZINC000000261601	O=S(=O)(N1CCCCC1)c2ccccc2
CC(C)(C)n2c[n+](c1ccccc1)nn2	ZINC000000071140	c2ccc([n+]1c[nH]nn1)cc2
NC(=O)CNC2Cc1ccccc1C2	ZINC000000009005	C2Cc1ccccc1C2
O=C([C@@H]1CCCO1)N3CCN(C(=S)NCCc2ccccc2)CC3	ZINC000000469381	O=C(C1CCCO1)N3CCN(C(=S)NCCc2ccccc2)CC3
CCN(CC)C(=O)CSc1nc(N)cc(N)n1	ZINC000000495389	c1cncnc1
C[C@H]1CC(C)=C[C@@H](C)C13COC(CN2CCCCC2)OC3	ZINC000000238659	C3CCN(CC2OCC1(CCC=CC1)CO2)CC3
COC(=O)[C@@H](CCCNC(N)=N)NC(=O)CCNC(=O)c4cccc(c2[n+](C)c1cc(N)ccc1c3ccc(N)cc23)c4	ZINC000027318146	c4ccc(c2nc1ccccc1c3ccccc23)cc4
COC(=O)c1ccccc1C(=O)c3ccc(OCCN2CCCCC2)cc3	ZINC000000538207	O=C(c1ccccc1)c3ccc(OCCN2CCCCC2)cc3
CCCCCOc1ccc(CCNC(=N)NC(N)=N)cc1Cl	ZINC000001831854	c1ccccc1
C[N@]1CCc2c(C1)nnn2c3ccccc3	ZINC000000034254	C1Cc2c(CN1)nnn2c3ccccc3
Cc2ccc(OC[C@@H](O)CN1C(=O)NC(C)(C)C1=O)c(Cl)c2	ZINC000000112277	O=C1CNC(=O)N1CCCOc2ccccc2
Fc4ccc([C@@H]2CCCN(CCN1CCCC1)c3cc(F)ccc23)cc4	ZINC000000717559	C4CCN(CCN2CCCC(c1ccccc1)c3ccccc23)C4
O=C(CN2CCN(C(=O)C(=O)NC1CC1)CC2)NC(=O)NC3CC3	ZINC000048007665	O=C(CN2CCN(C(=O)C(=O)NC1CC1)CC2)NC(=O)NC3CC3
CC2(C)NC(=O)N(C[C@@H](O)COc1ccccc1)C2=O	ZINC000000114862	O=C1CNC(=O)N1CCCOc2ccccc2
CSc2nn(c1ccccc1)c(C)[n+]2c3ccccc3	ZINC000000156078	c3ccc(n2c[n+](c1ccccc1)cn2)cc3
COCC[N@@](C)CCN1C[C@@H](NC(=O)[C@@H](CO)NC(N)=O)CC1=O	ZINC000647721267	O=C1CCCN1
COc2ccc(\C=c1\[nH]c(=O)[nH]c1=O)cc2Cl	ZINC000000072961	O=c2[nH]c(=O)c(=Cc1ccccc1)[nH]2
CCN4CCC(COc2nc1ccsc1n3cccc23)CC4	ZINC000000026795	C4CC(COc2nc1ccsc1n3cccc23)CCN4
COc3ccc2n(C)c1C(=O)N(N(C)C)Cc1c2c3	ZINC000000041524	O=C1NCc2c1[nH]c3ccccc23
CN(C)c1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2	ZINC000000001167	O=C(NC(=O)c1ccccc1)Nc2ccccc2
COc5ccc3c(cn(C)c4c2cc1OCOc1cc2ccc34)c5=O	ZINC000000004996	O=c1cccc2c1c[nH]c5c2ccc4cc3OCOc3cc45
NC(=O)C2c1ccccc1C=Cc3ccccc23	ZINC000000001162	C2c1ccccc1C=Cc3ccccc23
CN3CCN(c2nc1c(N)ncnc1[nH]2)CC3	ZINC000000130101	C3CN(c2nc1cncnc1[nH]2)CCN3
C[N@]3CC[C@H]2Nc1ccc(C)cc1[C@@H]2C3	ZINC000000001161	C3CC2Nc1ccccc1C2CN3
Oc1ccccc1C[C@@H]2CC3CCN2CC3	ZINC000000092975	C1CN2CCC1CC2Cc3ccccc3
CC[N@]1CCC[C@@H]1CNS(=O)(=O)c2cccc3cccnc23	ZINC000000423519	O=S(=O)(NCC1CCCN1)c2cccc3cccnc23
C[C@@H](NC(=O)C2CCN(Cc1ccc(F)cc1)CC2)c3ccccc3	ZINC000000455582	O=C(NCc1ccccc1)C3CCN(Cc2ccccc2)CC3
OCCN4CCN([C@H]2C[C@H](c1ccc(Cl)c(Cl)c1)c3ccccc23)CC4	ZINC000000596855	C4CN(C2CC(c1ccccc1)c3ccccc23)CCN4
C[N+]4(CN3C(=O)[C@H]2[C@H]1C[C@H](C=C1)[C@H]2C3=O)CCCCC4	ZINC000000510471	O=C3C2C1CC(C=C1)C2C(=O)N3CN4CCCCC4
CC[C@H](OC(C)=O)C#CCN1CCCCC1	ZINC000000208678	C1CCNCC1
Cc1cccc(Cl)c1Nc2ncnc(N)n2	ZINC000000089342	N(c1ccccc1)c2ncncn2
Clc6ccc5CCc1ccccc1N(CCCN2CCC4(CC2)N3CCCC[C@@H]3NC4=O)c5c6	ZINC000000597691	O=C2NC1CCCCN1C26CCN(CCCN4c3ccccc3CCc5ccccc45)CC6
COC(=O)c1cc(O)c(O)c(O)c1	ZINC000000021789	c1ccccc1
Nc2c1CCCCc1nc3cccc(F)c23	ZINC000000010131	C3CCc2nc1ccccc1cc2C3
Cc2cc(C)[n+]1nc(C)sc1n2	ZINC000000124253	c2cnc1scn[n+]1c2
CC[N@]1CCC[C@@H]1CN2C[C@H](C(=O)NC[C@](C)(O)CN(C)C)CC2=O	ZINC000152633352	O=C1CCCN1CC2CCCN2
COC[C@@H](C)N[C@@H]2CCc1ccccc1C2	ZINC000000219935	C2CCc1ccccc1C2
Cc3ccc(N2C(=O)C[C@H](NC1CCCC1)C2=O)cc3	ZINC000000183123	O=C2CC(NC1CCCC1)C(=O)N2c3ccccc3
CC(C)(C)[N@@](C[C@@H](O)COc1ccccc1)Cc2ccc(N(=O)=O)cc2	ZINC000000753782	C(CNCc1ccccc1)COc2ccccc2
CN(C)CC(=O)Nc3ccc2[nH]c(=O)c1ccccc1c2c3	ZINC000000008960	O=c2[nH]c1ccccc1c3ccccc23
COc3ccc([C@](CCCN2CCN(C(=O)c1ccco1)CC2)(C#N)C(C)C)cc3OC	ZINC000000627644	O=C(N2CCN(CCCCc1ccccc1)CC2)c3ccco3
CCN(CC)CCN(Cc3cc2cc1OCOc1cc2[nH]c3=O)C(=S)NCCCN4CCOCC4	ZINC000006193395	O=c3[nH]c2cc1OCOc1cc2cc3CNC(=S)NCCCN4CCOCC4
CC(C)CCNC(=O)c2c[nH]c1ccccc1c2=O	ZINC000000026374	O=c1cc[nH]c2ccccc12
CS(=O)(=O)N3CCN(S(=O)(=O)N[C@@H]1CCC[C@@H]1[N@]2CC[C@@H](O)C2)CC3	ZINC000643770857	O=S(=O)(NC1CCCC1N2CCCC2)N3CCNCC3
C[C@H](CCc1ccc(O)cc1)NC[C@@H](O)c2ccc(O)cc2	ZINC000000000694	C(CNCCc1ccccc1)Cc2ccccc2
CN(C)CCCn3c(N)c(S(=O)(=O)c1ccccc1)c4nc2ccccc2nc34	ZINC000000754370	O=S(=O)(c1ccccc1)c3c[nH]c4nc2ccccc2nc34
Oc3ccc2C(=O)C[C@@H](c1ccccc1)Oc2c3	ZINC000000057920	O=C2CC(c1ccccc1)Oc3ccccc23
CC(C)NC[C@@H](O)c1ccc(O)c2ncccc12	ZINC000000000690	c2ccc1ncccc1c2
C[N+]3(CC[C@](O)(c1ccccc1)c2cccs2)CCOCC3	ZINC000000000769	C3CN(CCC(c1ccccc1)c2cccs2)CCO3
CCN[C@H]2CCCc3nc1ccccc1c(N)c23	ZINC000000011458	C3CCc2nc1ccccc1cc2C3
Fc3cccc(NS(=O)(=O)c1cccc2nsnc12)c3	ZINC000000054526	O=S(=O)(Nc1ccccc1)c2cccc3nsnc23
CS(=O)(=O)N3CCC[C@@H](NC(=O)c1cccn2CCS(=O)(=O)N=c12)C3	ZINC000139188660	O=C(NC1CCCNC1)c2cccn3CCS(=O)(=O)N=c23
C[N@]1[C@H]3CC[C@@H]1CC(OC(=O)c2ccccc2)C3	ZINC000000271983	O=C(OC1CC2CCC(C1)N2)c3ccccc3
C[N@]1CC[C@@H]3[C@H](C1)c2cc(C)ccc2N3S(C)(=O)=O	ZINC000000055306	C3CC2Nc1ccccc1C2CN3
CN(C)C2=NC(=O)[C@H](c1ccccc1)O2	ZINC000000000764	O=C1N=COC1c2ccccc2
CN(C)CCCN(CCCN(C)C)Cc1ccc(Cl)c(N(=O)=O)c1	ZINC000003682117	c1ccccc1
CC(=O)Nc2cnn3c(C)nc1ccccc1c23	ZINC000000002017	c1ccc2c(c1)ncn3nccc23
COC(=O)c2[nH]c1ccc(C)cc1c2NC(=O)C[N@]3CCCC[C@@H]3C	ZINC000000507499	O=C(CN1CCCCC1)Nc2c[nH]c3ccccc23
Cc4ccc(c2nnc(N1CCC(C(N)=O)CC1)c3ccccc23)cc4	ZINC000000031882	C4CCN(c2nnc(c1ccccc1)c3ccccc23)CC4
Oc1ccccc1C=c2c(=O)[nH]c(=S)[nH]c2=O	ZINC000000040239	O=c1[nH]c(=S)[nH]c(=O)c1=Cc2ccccc2
CC3CCN([C@@H]2CC(=O)N(c1ccc(F)cc1)C2=O)CC3	ZINC000000059892	O=C2CC(N1CCCCC1)C(=O)N2c3ccccc3
CN(C)CCOC(=O)[C@@H](c1ccccc1)C2(O)CCCC2	ZINC000000155531	C2CCC(Cc1ccccc1)C2
O=C(CCn2[nH]c(=O)c1ccccc1c2=O)NCc3ccccc3	ZINC000000308278	O=C(CCn2[nH]c(=O)c1ccccc1c2=O)NCc3ccccc3
CCn3cc2[nH]c(N1CCNCC1)ncc2c3=O	ZINC000000013627	O=c2[nH]cc3[nH]c(N1CCNCC1)ncc23
COc3ccc(CN2CCN(c1ccc(Cl)cc1)CC2)c(C)c3C	ZINC000000293936	C2CN(c1ccccc1)CCN2Cc3ccccc3
C[C@H](CN(C)C)[C@](C)(O)Cc1ccc(Cl)cc1	ZINC000000000166	c1ccccc1
CN(C)C[C@@H](O)[C@H](c1ccccc1)c2cccc(Cl)c2	ZINC000000000161	C(c1ccccc1)c2ccccc2
CN(C)Cc1cc(C(C)(C)C)cc(CN(C)C)c1O	ZINC000000610623	c1ccccc1
CCN(CCN(C)C)C(=O)c3ccc(N1CCNCC1)c(NS(=O)(=O)c2ccc(C)cc2)c3	ZINC000033033169	O=S(=O)(Nc1ccccc1N2CCNCC2)c3ccccc3
CN(C)CCc2c[nH]c3ccc(c1ccc(C)s1)cc23	ZINC000000022997	c3csc(c2ccc1[nH]ccc1c2)c3
NCCCCNc2nc1c(=O)[nH]cnc1n2[C@@H]3O[C@@H](CO)[C@@H](O)[C@@H]3O	ZINC000009886089	O=c2[nH]cnc3n(C1CCCO1)cnc23
OC3([C@@]2(O)C[C@@H](c1ccco1)NO2)CCCCC3	ZINC000000036916	C3CCC(C2CC(c1ccco1)NO2)CC3
CN(C)C(=N)Nc4nc(=O)c(=Cc3ccc(N2CCC(NC[C@H](O)c1ccc(O)c(NS(C)(=O)=O)c1)CC2)cc3)s4	ZINC000028105867	O=c1ncsc1=Cc4ccc(N3CCC(NCCc2ccccc2)CC3)cc4
CCO[C@@H]2CN(C(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1)C[C@H]2CN	ZINC000653247232	O=C(CNS(=O)(=O)c1cc[nH]c1)N2CCCC2
Cc3cc[n+](CCOn2c(=O)c1ccccc1c2=O)cc3	ZINC000000406269	O=c2n(OCC[n+]1ccccc1)c(=O)c3ccccc23
NC(=O)c1ccccc1NS(=O)(=O)c2ccc(N(=O)=O)cc2	ZINC000000335488	O=S(=O)(Nc1ccccc1)c2ccccc2
COC4=C[C@H]2[C@@H]3Cc1ccc(OC)c(O)c1[C@]2(CC[N@]3C)CC4=O	ZINC000000000181	O=C4CC23CCNC(Cc1ccccc12)C3C=C4
COc2ccc1nccc(NCCN(C)C)c1c2	ZINC000005688935	c2ccc1ncccc1c2
Cc1cccc(C)c1NC(=O)CN2CCCC2	ZINC000000002011	O=C(CN1CCCC1)Nc2ccccc2
CCOc1ccccc1CN3CCC(C(=O)N2CCCC2)CC3	ZINC000000236163	O=C(C2CCN(Cc1ccccc1)CC2)N3CCCC3
N[C@@H](c1ccccc1)c2ccccn2	ZINC000000133211	C(c1ccccc1)c2ccccn2
COc1ccccc1C(=O)N2CCN(C(C)C)CC2	ZINC000000300506	O=C(N1CCNCC1)c2ccccc2
CCOC(=O)[C@@H]2CCC[N@@](Cc1ccc(OC)c(Br)c1)C2	ZINC000000752300	C2CCN(Cc1ccccc1)CC2
CCc3cc2c(Nc1ccncc1)ncnc2s3	ZINC000000126393	N(c1ccncc1)c2ncnc3sccc23
NCCN=C(Nc1ccccc1)Nc2ccccc2	ZINC000005741935	N=C(Nc1ccccc1)Nc2ccccc2
CC[N@]1CCC[C@@H]1CN(CCN(C)C)C(=O)NCC(=O)N2CCNCC2	ZINC000562814087	O=C(NCC1CCCN1)NCC(=O)N2CCNCC2
S=C(NC1CCCCC1)NN2CCOCC2	ZINC000000037285	S=C(NC1CCCCC1)NN2CCOCC2
COC(=O)[C@@H](Cc2c(Sc1ccccc1N(=O)=O)[nH]c3ccccc23)NC(=O)[C@@H](O)[C@H](N)CCCCN	ZINC000028000417	S(c1ccccc1)c3cc2ccccc2[nH]3
CC(C)C[C@@H]1CNC[C@H]1C(O)=O	ZINC000000008681	C1CCNC1
CC3(C)C[C@@H](C(=O)COc2ccc1ccc(=O)oc1c2)CCO3	ZINC000000046539	O=C(COc2ccc1ccc(=O)oc1c2)C3CCOCC3
COc1ccc(OC)c([C@H](O)CNC(=O)CN)c1	ZINC000000000507	c1ccccc1
C[C@@H]2CN(C(=O)CS(=O)(=O)CC(=O)N1C[C@@H](C)NC(=O)C1)CC(=O)N2	ZINC000655129358	O=C2CN(C(=O)CS(=O)(=O)CC(=O)N1CCNC(=O)C1)CCN2
C3CN=C(C[C@@H](c1ccccc1)c2ccccn2)N3	ZINC000000000505	C3CN=C(CC(c1ccccc1)c2ccccn2)N3
Cc4cc(Nc2ccc1OCCOc1c2)c3ccc(Cl)cc3n4	ZINC000000120848	C4COc3cc(Nc1ccnc2ccccc12)ccc3O4
COc2ccc([C@@H]1NC(=O)[C@H](C)S1)cc2OC	ZINC000000000503	O=C2CSC(c1ccccc1)N2
Cc1nccn1C[C@@H]2CCc4c(C2=O)c3ccccc3n4C	ZINC000000075126	O=C3C(Cn1ccnc1)CCc4[nH]c2ccccc2c34
CN(CCNS(C)(=O)=O)[C@H]1CCC[N@@](CCNS(C)(=O)=O)CC1	ZINC000372880138	C1CCCNCC1
Cc2ccc([C@H](CC(=O)C(C)(C)C)c1c(O)[nH]c(=O)[nH]c1=O)cc2	ZINC000000296264	O=c2[nH]cc(Cc1ccccc1)c(=O)[nH]2
COCCN(C)CCCNC(=O)C(=O)N[C@@H]1CCC[C@@H]1[N@]2CC[C@@H](O)C2	ZINC000645063015	C2CCC(N1CCCC1)C2
CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c3ccccc3	ZINC000000038769	O=C1CCCC3=C1C(c2ccccc2)C=CO3
COc2cc(C(=O)NN=C(C)c1ccc(N)cc1)cc(OC)c2OC	ZINC000000058540	O=C(NN=Cc1ccccc1)c2ccccc2
O=S(=O)(Nc1ccncc1)c2ccccc2	ZINC000000029664	O=S(=O)(Nc1ccncc1)c2ccccc2
O=c/2[nH]c1ccccc1c\2=c5\sc4nc3ccccc3n4c5=O	ZINC000000045247	O=c2[nH]c1ccccc1c2=c5sc4nc3ccccc3n4c5=O
COc4ccc([C@@H]2C(C(O)=O)=C(C)Oc3cc1OCOc1cc23)cc4	ZINC000000044642	C4Oc3cc2OC=CC(c1ccccc1)c2cc3O4
COC(=O)c2ccc(CN1CCCC1)o2	ZINC000000315188	C2CCN(Cc1ccco1)C2
O=c3ccc2[nH]cc(C1=CCNCC1)c2[nH]3	ZINC000000004439	O=c3ccc2[nH]cc(C1=CCNCC1)c2[nH]3
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
CCNc1nc(C)c(N)c(NCC)n1	ZINC000000330504	c1cncnc1
Cn1ccnc1SCC(=O)c3cc2ccccc2oc3=O	ZINC000000052950	O=C(CSc1ncc[nH]1)c3cc2ccccc2oc3=O
CC(C)(C)c2cc(C(=O)N1CCCNCC1)cc(C(C)(C)C)c2O	ZINC000000004734	O=C(N1CCCNCC1)c2ccccc2
FC(F)(F)c1ccccc1CN3CCC(N2CCCCC2)CC3	ZINC000000276866	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
CN2CCC(NCc1ccccc1F)CC2	ZINC000000276864	C2CC(NCc1ccccc1)CCN2
CCN(CC)CC(=O)Nc1c(C)cccc1C	ZINC000000020237	c1ccccc1
CC[n+]2ccnc3cc1ccccc1cc23	ZINC000000028372	c3ccc2cc1nccnc1cc2c3
Cc2cc(C(=O)NC1CC(C)(C)NC(C)(C)C1)ccc2N(=O)=O	ZINC000000315802	O=C(NC1CCNCC1)c2ccccc2
CCN(CC)C[C@@H](O)Cn2c1C(=O)CCCc1c3ccccc23	ZINC000000074835	O=C1CCCc2c1[nH]c3ccccc23
Nc2cc(Cl)c(NC1=NCCN1)c(Cl)c2	ZINC000000020231	C2CN=C(Nc1ccccc1)N2
CC(C)(C)NC[C@@H](O)c1ccc(O)c(CO)c1	ZINC000000020230	c1ccccc1
CC(C)N4C(=O)CC3(CC[N+](C)(CCOC(=O)C(c1ccccc1)c2ccccc2)CC3)C4=O	ZINC000000702166	O=C4CC3(CCN(CCOC(=O)C(c1ccccc1)c2ccccc2)CC3)C(=O)N4
CCN(CC)CC(=O)Nc1c(C(=O)OC)[nH]c2ccc(C)cc12	ZINC000000522610	c2ccc1[nH]ccc1c2
Nc3cc(N)nc(SCc2nc(c1ccccc1)no2)n3	ZINC000000092402	C(Sc1ncccn1)c3nc(c2ccccc2)no3
O=c4c(CN1CCC3(CC1)C=Cc2ccccc23)coc5ccccc45	ZINC000000217225	O=c4c(CN1CCC3(CC1)C=Cc2ccccc23)coc5ccccc45
COc2ccc(CNC(=O)[C@@H]1CCCN1)cc2OC	ZINC000000251665	O=C(NCc1ccccc1)C2CCCN2
C[C@H]2Oc1ccc(Cl)cc1N(C[C@H](O)CO)C2=O	ZINC000000000235	O=C2COc1ccccc1N2
O[C@@]13NC(=O)N(CC=C)[C@]1(O)c2ccccc2C3=O	ZINC000000052881	O=C1NC3C(N1)c2ccccc2C3=O
C[C@H]2C\C(=N\Oc1ccccc1N(=O)=O)[C@H](C)C[N@]2C	ZINC000000271075	C2CC(=NOc1ccccc1)CCN2
CN4CCN(c2nc(c1cccc(C)c1)nc3ccccc23)CC4	ZINC000000144307	C4CN(c2nc(c1ccccc1)nc3ccccc23)CCN4
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
S=C(NCCc1ccccc1)Nc2nccs2	ZINC000000005723	S=C(NCCc1ccccc1)Nc2nccs2
Nc2cc(N)nc(SCc1ccccc1)n2	ZINC000000037758	C(Sc1ncccn1)c2ccccc2
Cc1ccccc1OC[C@@H](O)CN2C(C)(C)CCC2(C)C	ZINC000000000434	C2CCN(CCCOc1ccccc1)C2
COc3ccc2n(C)c1c(C)cnc(NC[C@H](C)CN(C)C)c1c2c3	ZINC000005161444	c1ccc3c(c1)[nH]c2ccncc23
Clc3ccc(N1C[C@@H]2CC[C@H](C1)N2)nn3	ZINC000000007429	C2CC3CN(c1cccnn1)CC2N3
N#Cc3cc(OC1CCNCC1)c(OC2CCNCC2)cc3C#N	ZINC000000407442	C3CC(Oc1ccccc1OC2CCNCC2)CCN3
CC(C)Sc1nnc(N)s1	ZINC000000017831	c1nncs1
CC1(C)OCO/C1=C\C[N+](C)(C)C	ZINC000000123406	C=C1COCO1
Cc2ccc1[nH]cc(CCN)c1c2	ZINC000000066085	c2ccc1[nH]ccc1c2
CC(C)(C)NC(=O)COc2ccc(CNCc1ccccn1)cc2	ZINC000000360654	C(NCc1ccccn1)c2ccccc2
Cc1coc(CC[N+](C)(C)C)c1	ZINC000000123403	c1ccoc1
Clc2ccc(NC(=O)Cn1cnc(N(=O)=O)c1)cc2Cl	ZINC000000035919	O=C(Cn1ccnc1)Nc2ccccc2
Fc4ccc(C(=O)C3CCN(CCn2c(=O)[nH]c1ccccc1c2=O)CC3)cc4	ZINC000000537877	O=C(C3CCN(CCn2c(=O)[nH]c1ccccc1c2=O)CC3)c4ccccc4
C[C@@H](O)\C=C\c2ccc1ccccc1[n+]2C	ZINC000000047472	c2ccc1ncccc1c2
CCN4CCN(c3cc(C)c2cc(NC(=O)CCC(=O)NCCCN1CCOCC1)ccc2n3)CC4	ZINC000020104699	O=C(CCC(=O)Nc3ccc2nc(N1CCNCC1)ccc2c3)NCCCN4CCOCC4
NC(=N)NC=Cc1ccc(O)c(O)c1	ZINC000000003953	c1ccccc1
Fc2ccc(NC(=O)Cc1ccccc1)cc2	ZINC000000029272	O=C(Cc1ccccc1)Nc2ccccc2
NC(=O)CN3CCN(c2ccc1ccccc1n2)CC3	ZINC000000117036	C3CN(c2ccc1ccccc1n2)CCN3
CCN(CC)CCSc3nnc2c1ccccc1n(C)c2n3	ZINC000000175632	c1ccc2c(c1)[nH]c3ncnnc23
Fc4ccc(c1oc(=O)oc1CCN3CCN(c2ccccc2)CC3)cc4	ZINC000000537737	O=c4oc(CCN2CCN(c1ccccc1)CC2)c(c3ccccc3)o4
CN(C)CCNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]2C[N@@](C)CCO2	ZINC000151585630	O=C(NCCc1ccccc1)C2CNCCO2
C1O[C@H]1C[N+]5(Cc2ccccc2)CC[N+](C[C@H]3CO3)(Cc4ccccc4)CC5	ZINC000005603689	C1OC1C[N+]5(Cc2ccccc2)CC[N+](CC3CO3)(Cc4ccccc4)CC5
Cn4cc[n+](c3ccc(C(=O)c2ccc([n+]1ccn(C)c1)cc2)cc3)c4	ZINC000001395745	O=C(c2ccc([n+]1cc[nH]c1)cc2)c4ccc([n+]3cc[nH]c3)cc4
C[C@@H]2C[C@@H](OC(=O)CN1CCCCC1)CC(C)(C)C2	ZINC000000171967	O=C(CN1CCCCC1)OC2CCCCC2
COCCN(CCN(C)C)C(=O)C(=O)NCCC(=O)N1CCN(C)CC1	ZINC000559772641	C1CNCCN1
Cc2cc1C[N+](=O)C(C)(C)CCc1c(C)c2O	ZINC000000006772	O=[N+]2CCCc1ccccc1C2
N[C@H](C(=O)N2CCN(C1CCCC1)CC2)c3ccccc3	ZINC000019687801	O=C(Cc1ccccc1)N3CCN(C2CCCC2)CC3
Cc3c(N1CCCCC1)ccc4c(=O)c(C(O)=O)cn(C2CC2)c34	ZINC000000006771	O=c3ccn(C1CC1)c4cc(N2CCCCC2)ccc34
NC(=S)N/N=C/c1cccn1c3sc2CCCCc2c3C#N	ZINC000000068023	C3CCc2sc(n1cccc1)cc2C3
CC(C)(C)NC(=O)CSc1nnnn1c2ccc(C(O)=O)cc2	ZINC000000080586	c2ccc(n1cnnn1)cc2
CC(=O)Nc3cccc(c2cc(=O)c1ccccc1o2)c3O	ZINC000000034370	O=c2cc(c1ccccc1)oc3ccccc23
C[C@@H](CCN1CCN(S(N)(=O)=O)CC1)N2CCN(S(N)(=O)=O)CC2	ZINC000470964882	C(CN1CCNCC1)CN2CCNCC2
Cn2cc(S(=O)(=O)NCC(=O)NCCC[N@]1CCC[C@@H]1C(N)=O)cn2	ZINC000593896593	O=C(CNS(=O)(=O)c1cn[nH]c1)NCCCN2CCCC2
CN(C)CC#CC[N@]2CCC[C@@]1(CCOC(C)(C)C1)C2	ZINC000003155524	C1CNCC2(C1)CCOCC2
CCOC(=O)n1c(=O)sc2cc(Br)ccc12	ZINC000000039982	O=c2[nH]c1ccccc1s2
CC(=O)[n+]2ccc(c1cc[n+](C(C)=O)cc1)cc2	ZINC000003154265	c2cc(c1ccncc1)ccn2
O[C@H]2CN(C1CCCCC1)C[C@H]2[C@@]4(O)CC[N@](C3CCCCC3)C4	ZINC000004783192	C4CCC(N3CCC(C2CCN(C1CCCCC1)C2)C3)CC4
CC(C)C(=O)Nc2cccc(C(=O)Nc1ccc(C(O)=O)cc1)c2	ZINC000000087851	O=C(Nc1ccccc1)c2ccccc2
CN(C)CCCNc2nccc3n(C)c1ccc(O)cc1c23	ZINC000005161534	c1ccc3c(c1)[nH]c2ccncc23
CCOC(=O)c1c(C)n(C)c2cc(CN(C)C)c(O)c(CN(C)C)c12	ZINC000000190254	c2ccc1[nH]ccc1c2
CCN2CCC(NCc1cccc(Br)c1)CC2	ZINC000000757571	C2CC(NCc1ccccc1)CCN2
CN(C)CCNc1cn[nH]c(=O)c1Cl	ZINC000000126687	O=c1cccn[nH]1
CN(C)CCNc2ccc3n(CCN)nc4c1cnccc1c(=O)c2c34	ZINC000000835581	O=c2c1ccncc1c4n[nH]c3cccc2c34
CCCC[C@@H]3CC(=O)[C@]2(O)O[C@@H]1[C@@H](NC)[C@@H](O)[C@@H](NC)[C@H](O)[C@H]1O[C@@H]2O3	ZINC000004214587	O=C3CCOC2OC1CCCCC1OC23
C[C@H](N)C(O)(c1ccccc1)c2ccccc2	ZINC000000047273	C(c1ccccc1)c2ccccc2
CN(C)c1ccc(C[N+](=O)C(C)(C)\C=N\O)cc1	ZINC000000300048	c1ccccc1
CC(C)N(CCCNC(=O)C[N@]1C[C@H](O)[C@H](O)C1)S(C)(=O)=O	ZINC000444692497	C1CCNC1
Nc2cnc(c1cc(Cl)cc(Cl)c1Cl)c(N)n2	ZINC000000009967	c2ccc(c1cnccn1)cc2
COc1cc(CNCCCN(C)C)ccc1OCc2cccs2	ZINC000007523886	C(Oc1ccccc1)c2cccs2
CN(N[C@@H]1OC(=O)c2ccccc12)c3cc(C(F)(F)F)cc(C)n3	ZINC000000142869	O=C2OC(NNc1ccccn1)c3ccccc23
COc1ccccc1NC(=O)N2CCN(C(=O)OC(C)(C)C)CC2	ZINC000000066551	O=C(Nc1ccccc1)N2CCNCC2
O=N(=O)c3ccc(Cc2cc[n+](Cc1ccccn1)cc2)cc3	ZINC000000028250	C(c1ccccc1)c3cc[n+](Cc2ccccn2)cc3
Nc2ccc[n+](Cc1ccccn1)c2	ZINC000000028253	C(c1ccccn1)[n+]2ccccc2
N=c1ccccn1Cc2ccccn2	ZINC000000028252	N=c1ccccn1Cc2ccccn2
CC(C)COC(=O)N(C)C3CCN(C2Cc1ccccc1C2)CC3	ZINC000000006178	C3CCN(C2Cc1ccccc1C2)CC3
COc3ccc(N1C(=N)NC(=N)NC12CCCC2)cc3	ZINC000000203702	N=C3NC(=N)N(c1ccccc1)C2(CCCC2)N3
OC(=O)\C=C\C(=O)Nc1cccc(N(=O)=O)c1	ZINC000000028259	c1ccccc1
COc3c1OCOc1cc2CC[N+](C)(C)[C@H](NC(=O)C=C)c23	ZINC000000486315	C3Cc2cc1OCOc1cc2CN3
NS(=O)(=O)c2cc1ccncc1s2	ZINC000000002320	c2cc1ccsc1cn2
O=C2C[C@@H](N1CCCCC1)C=C2Nc3ccccc3	ZINC000000118195	O=C2CC(N1CCCCC1)C=C2Nc3ccccc3
NC(N)=NNc2c1ccccc1nc3ccccc23	ZINC000004738462	c3ccc2nc1ccccc1cc2c3
CCN(CC)C(=S)SC	ZINC000000001289	nonring
CC(=O)O[C@@H](CN1CCCC1)C(C)(C)C	ZINC000000106432	C1CCNC1
COc3c(O)cc2ccc1cc(O)ccc1c2c3OC	ZINC000000004046	c1ccc3c(c1)ccc2ccccc23
C[N@]1CCC[C@@H]1CCSc2ccccn2	ZINC000000023860	C2CNC(CCSc1ccccn1)C2
CC(=O)Nc1ccc(C(N)=O)cc1Cl	ZINC000000028500	c1ccccc1
CN2CCN(\C=N\c1ncc(C(F)(F)F)cc1Cl)CC2	ZINC000000133240	C2CN(C=Nc1ccccn1)CCN2
COc2cc1CC(C)(C)[N+](C)=C(C)c1cc2OC	ZINC000000178873	C2Cc1ccccc1C=N2
C[C@H](Oc1ccc(C)c(C)c1)c3nc(c2nonc2N)no3	ZINC000000035171	C(Oc1ccccc1)c3nc(c2cnon2)no3
O=C(COc1ccccc1)NC3CCN(Cc2ccccc2)CC3	ZINC000000406714	O=C(COc1ccccc1)NC3CCN(Cc2ccccc2)CC3
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
Cc1nc(C)c(I)c(NN)n1	ZINC000000153443	c1cncnc1
COc1ccc(OC)c(S(=O)(=O)NCCC(O)=O)c1	ZINC000000081697	c1ccccc1
Clc4ccc(c3noc(CSC2=NC[C@@H]1CCC[C@@H]1N2)n3)cc4	ZINC000000137824	C4CC3CN=C(SCc2nc(c1ccccc1)no2)NC3C4
O=CN5CCC(C(=O)NCCN4CCC(=c2c1ccccc1ccc3ccccc23)CC4)CC5	ZINC000000600657	O=C(NCCN4CCC(=c2c1ccccc1ccc3ccccc23)CC4)C5CCNCC5
CC(C)NC(=O)CNS(=O)(=O)CCC(=O)N1C[C@H](O)[C@@H](N(C)C)C1	ZINC000580215440	C1CCNC1
CNC(=O)\C=C(/c1ccccc1)c3ccc2nc(N)c(C(C)=O)n2c3	ZINC000000024225	C=C(c1ccccc1)c3ccc2nccn2c3