O=C(CSc2nnc(COc1ccccc1)o2)NC3CCCCC3	ZINC000000087599	O=C(CSc2nnc(COc1ccccc1)o2)NC3CCCCC3
NCC[C@@H](O)[C@@H](N)C(O)=O	ZINC000013438173	nonring
Cn1cnnc1SCC(=O)Nc2cc(F)ccc2F	ZINC000000031597	O=C(CSc1nnc[nH]1)Nc2ccccc2
O=C(Cc1ccccc1)c2ccccc2C(=O)NCc3cccs3	ZINC000000031598	O=C(Cc1ccccc1)c2ccccc2C(=O)NCc3cccs3
CCN(CC)CCNc2nc1n(C)c(=O)n(C)c(=O)c1n2C(C)C	ZINC000000352327	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
Fc4ccc(n2nc(c1cccs1)cc2NS(=O)(=O)c3cccc(F)c3)cc4	ZINC000001047087	O=S(=O)(Nc2cc(c1cccs1)nn2c3ccccc3)c4ccccc4
COc3nc(NC1CC1)nc(Nc2ccc(OC(F)(F)F)cc2)n3	ZINC000000034505	C1CC1Nc3ncnc(Nc2ccccc2)n3
CN(C)CCNC(=O)C(=O)NC[C@@H]1CCCO1	ZINC000004476508	C1CCOC1
C[N+](C)(C)[C@@H]1CS(=O)(=O)C[C@@H]1O	ZINC000006183999	O=S1(=O)CCCC1
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
CCCN2CCC(N1CCN(S(C)(=O)=O)CC1)CC2	ZINC000000268253	C2CC(N1CCNCC1)CCN2
CN3C(=S)N[C@H](c1ccccc1)C(C(=O)Nc2ccccc2)=C3C	ZINC000000104284	O=C(Nc1ccccc1)C2=CNC(=S)NC2c3ccccc3
COc2ccc(CNC[C@@H](O)COc1ccc(C)cc1N(=O)=O)cc2	ZINC000000119359	C(CNCc1ccccc1)COc2ccccc2
NC1=N[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O	ZINC000005131858	C1CCN=CC1
C[C@@H]1COCCN1C(=O)CNC(=O)CN	ZINC000037482162	C1COCCN1
NCC(=O)N[C@@H](CCCNC(N)=N)C(O)=O	ZINC000001576211	nonring
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
N[C@H]1[C@H](O)[C@H](O)[C@H](CO)O/C1=N\O	ZINC000106380507	N=C1CCCCO1
OC[C@@H](O)CNC1=NCCN1	ZINC000165716839	C1CN=CN1
O=C(COC(=O)c1ccccc1C(=O)c2ccccc2)c3ccccc3	ZINC000000072816	O=C(COC(=O)c1ccccc1C(=O)c2ccccc2)c3ccccc3
CC(=O)Oc1ccccc1C(=O)Nc2ccc(C(N)=O)cc2	ZINC000000030338	O=C(Nc1ccccc1)c2ccccc2
CC(NC(C)=O)NC(C)=O	ZINC000000400151	nonring
O=S3(=O)N=C(N/N=C/c1ccccn1)c2ccccc23	ZINC000000033995	O=S3(=O)N=C(NN=Cc1ccccn1)c2ccccc23
Cc3cc(=O)c(Oc1ccc(F)cc1F)c(c2ccc(S(C)(=O)=O)cc2)o3	ZINC000000588145	O=c2ccoc(c1ccccc1)c2Oc3ccccc3
O=Cc4ccc(Sc2nnc(c1ccccc1)n2c3ccccc3)o4	ZINC000000071552	S(c1ccco1)c3nnc(c2ccccc2)n3c4ccccc4
CC(=O)Oc1cn(C(C)=O)c2ccc(Br)c(Cl)c12	ZINC000000056442	c2ccc1[nH]ccc1c2
CCOC(=O)CC(=O)N1CCS[C@H]1COc2ccccc2OC	ZINC000000003986	C2CSC(COc1ccccc1)N2
C(c1ccncc1)C5(Cc2ccncc2)c3cccnc3c4ncccc45	ZINC000000538342	C(c1ccncc1)C5(Cc2ccncc2)c3cccnc3c4ncccc45
Cc1nccn1CCCN2C(=O)CNC2=S	ZINC000000481630	O=C1CNC(=S)N1CCCn2ccnc2
Clc4ccc(Cn2c(CN1CCCC1)nc3ccccc23)cc4	ZINC000000057260	C4CCN(Cc2nc1ccccc1n2Cc3ccccc3)C4
C[C@@H](c2cccc(C(=O)c1ccccc1)c2)c3cc(N)on3	ZINC000000002928	O=C(c1ccccc1)c3cccc(Cc2ccon2)c3
O=C(N[C@@H]1CCCC[C@@H]1Cc2ccco2)c3cccc4ccccc34	ZINC000000284628	O=C(NC1CCCCC1Cc2ccco2)c3cccc4ccccc34
CN(C)C[C@](C)(O)CNC(=O)C(=O)Nc2cccc(n1cnnn1)c2C	ZINC000533568737	c2ccc(n1cnnn1)cc2
Nc1ccc(S(N)(=O)=O)cc1	ZINC000000002101	c1ccccc1
OC2(C(=O)N1CCNC(=O)C1)CNC2	ZINC000662441498	O=C2CN(C(=O)C1CNC1)CCN2
COc4ccc3CCc2sc(NC(=O)c1cccnc1)nc2c3c4	ZINC000000200007	O=C(Nc3nc2c(CCc1ccccc12)s3)c4cccnc4
CCc2nc(CC)nc(NS(=O)(=O)c1ccc(N)cc1)n2	ZINC000000002108	O=S(=O)(Nc1ncncn1)c2ccccc2
Brc3cccc(\C=N\N2CCN(c1ccccc1)CC2)c3	ZINC000000046640	C2CN(c1ccccc1)CCN2N=Cc3ccccc3
C[C@@H](N)C(=O)N1CCNC(=O)C1	ZINC000019488822	O=C1CNCCN1
NCC[C@H](N)C(=O)NCC(O)=O	ZINC000238557403	nonring
CC1CCN(C[C@@H](O)CNC(=O)CNC(=O)CN)CC1	ZINC000569720005	C1CCNCC1
O=C2CC[C@@H](C(=O)NCc1cccnc1)N2	ZINC000000174545	O=C2CCC(C(=O)NCc1cccnc1)N2
COc1ccccc1[C@H](N)C(=O)NC[C@@H]2CNC[C@@H]2O	ZINC000648133049	O=C(Cc1ccccc1)NCC2CCNC2
OCc3ccc(c2ccc(c1ccc(C=O)s1)s2)s3	ZINC000000023249	c3csc(c2ccc(c1cccs1)s2)c3
COc3ccc(Nc2nc(Cl)nc(NCc1cccnc1)n2)cc3	ZINC000000066944	C(Nc2ncnc(Nc1ccccc1)n2)c3cccnc3
CC(C)(C)NC[C@H](O)CO	ZINC000000403194	nonring
OC[C@@H]1C[C@@H]2CC[N@]1C[C@H]2C=C	ZINC000000403190	C1CN2CCC1CC2
OCCC(=O)[C@@H]1C[C@@H](O)CN1	ZINC000039060246	C1CCNC1
O=N(=O)c3ccc(Cn2cnc1[nH]cnc1c2=O)cc3	ZINC000000052561	O=c2n(Cc1ccccc1)cnc3[nH]cnc23
N[C@@H]1[C@H](N)C(=O)N[C@H]1CO	ZINC000204965924	O=C1CCCN1
Nc2cc(Oc1ccc(F)cc1)cc(N(=O)=O)c2	ZINC000000027783	O(c1ccccc1)c2ccccc2
C=CCn3c(SCc1cccc2ccccc12)nnc3c4ccco4	ZINC000000531831	C(Sc2nnc(c1ccco1)[nH]2)c3cccc4ccccc34
COc3nc(NCc1cccnc1)nc(N2CCC(C)CC2)n3	ZINC000000033266	C3CCN(c2ncnc(NCc1cccnc1)n2)CC3
C[C@@H](O)CN2[C@H](c1cccnc1)C(C(C)=O)=C(O)C2=O	ZINC000000082360	O=C2NC(c1cccnc1)C=C2
CCOC(=O)CNC	ZINC000000391928	nonring
COc2cc(C=Nn1cn[nH]c1=S)ccc2OCc3ccccc3	ZINC000000472634	S=c1[nH]ncn1N=Cc3ccc(OCc2ccccc2)cc3
CCOc2ccc(/C=C/C(=O)Sc1ccc(Cl)cc1)cc2	ZINC000000043113	O=C(Sc1ccccc1)C=Cc2ccccc2
OCn2c(=O)c1CCCCc1c2=O	ZINC000000403376	O=c2[nH]c(=O)c1CCCCc12
COc2ccc(C[C@@H]1NC[C@@H](O)[C@@H]1OC(C)=O)cc2	ZINC000000402718	C2CNC(Cc1ccccc1)C2
CN3CCC(NCc2ccc1OCOc1c2)CC3	ZINC000000280639	C3CC(NCc2ccc1OCOc1c2)CCN3
CS(=O)(=O)NCCNC(=O)C1CNC1	ZINC000084408983	C1CNC1
Clc3ccc(c2nnc(SCc1ccccc1)o2)c(Cl)c3	ZINC000000035519	C(Sc2nnc(c1ccccc1)o2)c3ccccc3
CN(C)CCCn1c(N)c(C#N)c2nc(C#N)c(C#N)nc12	ZINC000000138295	c2cnc1[nH]ccc1n2
O=C(CN1CCNCC1)N(CC#N)CC#N	ZINC000020521136	C1CNCCN1
NCC[C@H](N2C(=O)[C@H]1CNC[C@H]1C2=O)C(O)=O	ZINC000049088587	O=C2NC(=O)C1CNCC12
Nc2nc1NC(=O)Cc1c(=O)[nH]2	ZINC000018204232	O=C1Cc2c(N1)nc[nH]c2=O
C=CCn4c(c1cccnc1)nn([C@H]2CC(=O)[C@@H]3OC[C@H]2O3)c4=S	ZINC000000054404	O=C3CC(n2nc(c1cccnc1)[nH]c2=S)C4COC3O4
Cc3cccc(OC[C@@H](O)C[n+]1cn(C)c2ccccc12)c3	ZINC000000098555	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
C[C@H](C[C@@](C(N)=O)(c1ccccc1)c2ccccn2)N(C)C	ZINC000000005295	C(c1ccccc1)c2ccccn2
NC[C@H]2O[C@@H](CC(=O)NC1CC1)[C@H](O)[C@@H]2O	ZINC000015675310	O=C(CC1CCCO1)NC2CC2
O[C@@H](CCCN2CCN(c1ncc(F)cn1)CC2)c3ccc(F)cc3	ZINC000000013635	C(CCc1ccccc1)CN3CCN(c2ncccn2)CC3
CNCCNC(=O)c1c[nH]c(=O)[nH]c1=O	ZINC000054244345	O=c1cc[nH]c(=O)[nH]1
CC(=O)c1ccccc1S(=O)(=O)c2ccccc2C(O)=O	ZINC000000136351	O=S(=O)(c1ccccc1)c2ccccc2
N[C@@H]1CNC[C@H](O)[C@@H]1O	ZINC000039038087	C1CCNCC1
OC(=O)c3ccc(\N=c2\[nH]c(=O)c(=C/c1ccccc1OCC=C)\s2)cc3	ZINC000002772991	O=c2[nH]c(=Nc1ccccc1)sc2=Cc3ccccc3
N[C@H](CC(N)=O)C(=O)NC1CC1	ZINC000037481614	C1CC1
C[C@@H]1CN(C(=O)C(=O)NCCN)CCO1	ZINC000037242821	C1COCCN1
Clc4ccc(N3CCN(Cc2cn1ccccc1n2)CC3)cc4	ZINC000000021403	C2CN(c1ccccc1)CCN2Cc4cn3ccccc3n4
COc1ccccc1NC(=O)CCN2CCCC2	ZINC000000176541	O=C(CCN1CCCC1)Nc2ccccc2
O=C1NCCNC1=CC(=O)c2ccccc2	ZINC000000054247	O=C1NCCNC1=CC(=O)c2ccccc2
CCCC2=C(C(=O)OCC)[C@@H](c1cccc(N(=O)=O)c1)NC(=O)N2C	ZINC000000036239	O=C2NC=CC(c1ccccc1)N2
Cn2c(SCCN1CCCCC1)nc3n(C)c(=O)[nH]c(=O)c23	ZINC000000351096	O=c3[nH]c(=O)c2[nH]c(SCCN1CCCCC1)nc2[nH]3
Cc1nc(C(N)=O)c(N)n1CCO	ZINC000000054248	c1c[nH]cn1
Cc2ccc(OCC(=O)Nc1cccc(N(=O)=O)c1C)cc2	ZINC000000038888	O=C(COc1ccccc1)Nc2ccccc2
O=C([C@@H](Sc2nc1ccccc1[nH]2)c3ccccc3)c4ccccc4	ZINC000000192044	O=C(C(Sc2nc1ccccc1[nH]2)c3ccccc3)c4ccccc4
COc3ccc(CN(C(=O)c1ccco1)c2ccccc2C(O)=O)cc3	ZINC000000704156	O=C(N(Cc1ccccc1)c2ccccc2)c3ccco3
Cn3c(c1nonc1NC(=O)c2ccc(F)cc2)nc4ccccc34	ZINC000000045639	O=C(Nc1nonc1c3nc2ccccc2[nH]3)c4ccccc4
COc3cccc(n2c(=S)[nH]c(=O)c(=Cc1ccc[nH]1)c2=O)c3	ZINC000000045633	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc3ccc[nH]3
CCOc2ccc(S(=O)(=O)Nc1cccc(C(=O)OC)c1C)cc2	ZINC000000470929	O=S(=O)(Nc1ccccc1)c2ccccc2
CC(C)c5ccc(c3c2c(=O)c1ccccc1c2nc4ncnn34)cc5	ZINC000000098800	O=c4c1ccccc1c5nc2ncnn2c(c3ccccc3)c45
NC(=N)NCCC[C@](N)(C(F)F)C(O)=O	ZINC000013533429	nonring
O=C(Cn1c(=O)c3cccc2cccc1c23)Nc5ccc4OCOc4c5	ZINC000000053814	O=C(Cn1c(=O)c3cccc2cccc1c23)Nc5ccc4OCOc4c5
CN(C)CCO[C@H](c1cccs1)c2ccnn2C	ZINC000000007743	C(c1ccn[nH]1)c2cccs2
O=C(c1cccs1)c3cn(CCOc2ccccc2)c4ccccc34	ZINC000000578851	O=C(c1cccs1)c3cn(CCOc2ccccc2)c4ccccc34
CC2(C)CC(=O)C(=NNc1cccc(OC(F)F)c1)C(=O)C2	ZINC000000041951	O=C1CCCC(=O)C1=NNc2ccccc2
N[C@@H]1[C@@H](O)CN(O)C1=O	ZINC000027864114	O=C1CCCN1
Nc3ccc(n2c(=O)c1ccccc1c2=O)c(Cl)c3	ZINC000000008695	O=c2n(c1ccccc1)c(=O)c3ccccc23
NCC(CN)NC=O	ZINC000575553586	nonring
Cc4ccc(C(=O)N2N=C(c1ccccc1)C[C@@H]2c3ccccc3)cc4	ZINC000000439710	O=C(N2N=C(c1ccccc1)CC2c3ccccc3)c4ccccc4
CNC[C@@H](O)Cn1c(=O)n(C)c(=O)c1=O	ZINC000020296381	O=c1[nH]c(=O)c(=O)[nH]1
CN(C)C[C@@](C)(O)CNS(=O)(=O)CCC#N	ZINC000332511155	nonring
NCC1(NS(N)(=O)=O)CC1	ZINC000167571656	C1CC1
COc3ccc(\C=c2/c(c1ccccc1)noc2=O)c(OC)c3	ZINC000000043602	O=c2onc(c1ccccc1)c2=Cc3ccccc3
NCCC(=O)CN	ZINC000001690288	nonring
Cn1nnnc1CC2(O)CNC2	ZINC000575574282	C1NCC1Cc2nnn[nH]2
Cc3cc2CSC(c1cccc(N(=O)=O)c1)SCc2cc3C	ZINC000000261746	C2SC(c1ccccc1)SCc3ccccc23
CCS[C@H]1CCC(=O)N1S(=O)(=O)c2ccccc2	ZINC000000025146	O=C1CCCN1S(=O)(=O)c2ccccc2
NCC(=O)NCC(=O)N1CCC[C@H]1C(N)=O	ZINC000037481879	C1CCNC1
CC(C)(O)CN2CCN(C(=O)C(=O)NCCN1CCCC1=O)CC2	ZINC000583330434	O=C1CCCN1CCNC(=O)C(=O)N2CCNCC2
NC2CC(NC(=O)c1c[nH]c(=O)[nH]c1=O)C2	ZINC000036236925	O=C(NC1CCC1)c2c[nH]c(=O)[nH]c2=O
Ic2ccc(/N=C/c1ccc(N(=O)=O)o1)cc2	ZINC000000065563	C(=Nc1ccccc1)c2ccco2
Cc1cc(Br)ccc1OCC(=O)Nc2cccc(C#N)c2	ZINC000000142672	O=C(COc1ccccc1)Nc2ccccc2
O=C2[C@@H](N1CCCCC1)CCN2c3ccccc3	ZINC000000000287	O=C2C(N1CCCCC1)CCN2c3ccccc3
NN=C(N)N1CC(O)C1	ZINC000306757890	C1CNC1
Cc2ccc[n+](Oc1ncccc1N)c2	ZINC000000335036	O(c1ccccn1)[n+]2ccccc2
Cc2cc(C)nc(NC(=O)Cc1ccsc1)c2	ZINC000000020687	O=C(Cc1ccsc1)Nc2ccccn2
N[C@@H](C1SCCS1)[C@H](O)[C@H](O)[C@H](O)CO	ZINC000005086085	C1CSCS1
OC(=O)[C@@H](Sc2nc(c1ccccc1)ccc2C#N)c3ccccc3	ZINC000000154674	C(Sc2cccc(c1ccccc1)n2)c3ccccc3
CCOC(=O)c3cc(C(=O)c1cccs1)n4ccc2ccccc2c34	ZINC000000407472	O=C(c1cccs1)c3ccc4c2ccccc2ccn34
CC[C@@H](C)NC(=O)[C@@H]3CCCN(c2nc1ccc(OC)cc1s2)C3	ZINC000000213148	C3CCN(c2nc1ccccc1s2)CC3
NC(=N)NCCC[C@@H]1NC(=S)NC1=O	ZINC000002564585	O=C1CNC(=S)N1
CNC(=O)NCC(=O)N1CCNCC1	ZINC000082638706	C1CNCCN1
CC(=O)NCCNC(=O)CN	ZINC000035206865	nonring
Nc3ccc2nc(SCC(=O)NCc1ccco1)sc2c3	ZINC000000051431	O=C(CSc2nc1ccccc1s2)NCc3ccco3
O=C(Cn2c(=O)c1cccc(N(=O)=O)c1c2=O)NC3CCCCC3	ZINC000000051438	O=C(Cn2c(=O)c1ccccc1c2=O)NC3CCCCC3
N[C@@H]2[C@H](O)[C@H]1CO[C@H](O1)[C@H]2Cl	ZINC000005638925	C1CC2COC(C1)O2
CN(C)CCOc1ccccc1c3nc(c2ccccc2)no3	ZINC000000007363	c3ccc(c2noc(c1ccccc1)n2)cc3
Clc3cccc(c2nnc(SCC(=O)NCc1ccco1)o2)c3	ZINC000000417677	O=C(CSc2nnc(c1ccccc1)o2)NCc3ccco3
CCOC(=O)c2cnc(Nc1nc(C(C)(C)C)cs1)nc2C	ZINC000000141670	N(c1ncccn1)c2nccs2
COc1ccc(CCNC(N)=N)cc1OC	ZINC000000081466	c1ccccc1
CNC1CCN(CC(=O)NC(N)=O)CC1	ZINC000037469325	C1CCNCC1
CCNC(=O)CNC(=O)C1CCNCC1	ZINC000036780613	C1CCNCC1
Nc2ncnc3[nH]c(SCc1ccccc1Cl)nc23	ZINC000000034127	C(Sc2nc1cncnc1[nH]2)c3ccccc3
COc3ccc([C@@H]1SCC(=O)N1C[C@@H](O)c2ccccc2)cc3	ZINC000000034641	O=C2CSC(c1ccccc1)N2CCc3ccccc3
O=C(CSc2nc1ccccc1s2)NCC(=O)c3ccccc3	ZINC000000206529	O=C(CSc2nc1ccccc1s2)NCC(=O)c3ccccc3
CCOc2cc(\C=N\NS(=O)(=O)c1ccc(C)cc1)ccc2O	ZINC000000042822	O=S(=O)(NN=Cc1ccccc1)c2ccccc2
O=C(c1ccccc1)c3ccc(NC(=S)Nc2ccccc2)cc3	ZINC000000046393	O=C(c1ccccc1)c3ccc(NC(=S)Nc2ccccc2)cc3
COc2cccc([C@H]1[C@@H](C(C)=O)C(=O)C[C@@](C)(O)[C@@H]1C(C)=O)c2	ZINC000000028220	O=C2CCCC(c1ccccc1)C2
N[C@@H]1C[C@@](O)(CO)[C@@H](O)[C@@H](O)[C@@H]1O	ZINC000014827287	C1CCCCC1
COC(=O)C=Cc1c(C)[nH]c(=O)[nH]c1=O	ZINC000000503382	O=c1cc[nH]c(=O)[nH]1
CCOC(=O)c1[nH]c(=O)[nH]c1CNc2ccccc2C#N	ZINC000000052028	O=c2[nH]cc(CNc1ccccc1)[nH]2
COc2nc(Nc1ccccc1)nc(OCC(F)(F)F)n2	ZINC000000034463	N(c1ccccc1)c2ncncn2
COCC[N@]1CCC[C@@H]1CNC(=O)N[C@@H]2CS(=O)(=O)C[C@@H]2OC	ZINC000660702271	O=C(NCC1CCCN1)NC2CCS(=O)(=O)C2
NC[C@H]1CN(CC(N)=O)CCO1	ZINC000041059143	C1COCCN1
Cc2cc(C)nc(SCC(=O)Nc1ccc(F)cc1F)n2	ZINC000000031563	O=C(CSc1ncccn1)Nc2ccccc2
CC(C)(C)c1cc(C(O)=O)nn1c2c(Cl)cc(Cl)cc2Cl	ZINC000000115229	c2ccc(n1cccn1)cc2
CC[C@@](C)(NS(=O)(=O)c1ccc(C)c(C)c1C)C#C	ZINC000000032921	c1ccccc1
CCc2c(C)sc(NC(=O)c1ccncc1)c2C(=O)OC	ZINC000000027960	O=C(Nc1cccs1)c2ccncc2
NC(=O)[C@H]1CN[C@H](C(N)=O)CN1	ZINC000034079766	C1CNCCN1
Cc2nc1ccccc1c(=O)n2c3ccc(F)c(F)c3F	ZINC000000031587	O=c2n(c1ccccc1)cnc3ccccc23
N[C@@H](CO)[C@@H](O)CO	ZINC000003652110	nonring
CNc2nc1c(=O)[nH]c(=O)n(C)c1[nH]2	ZINC000000039595	O=c2[nH]c(=O)c1nc[nH]c1[nH]2
NCCNC(=O)[C@@]1(O)C[C@@H](O)[C@H](O)[C@H](O)C1	ZINC000101839148	C1CCCCC1
COC(=O)c2cc(C(=O)N[C@@H](C)c1ccccc1)cc(N(=O)=O)c2	ZINC000000060827	O=C(NCc1ccccc1)c2ccccc2
Brc3ccc(CC(=O)Nn2c(c1ccccc1)csc2=S)cc3	ZINC000000622913	O=C(Cc1ccccc1)Nn3c(c2ccccc2)csc3=S
FC(F)(F)c3cccc(c2nnc(SCc1ccccc1)o2)n3	ZINC000000127142	C(Sc2nnc(c1ccccn1)o2)c3ccccc3
O=C(CN1CCNCC1=O)N[C@@H]2CCNC2	ZINC000638792100	O=C(CN1CCNCC1=O)NC2CCNC2
NC(=O)C3CCN(C[C@@H](O)Cc2ccc1OCOc1c2)CC3	ZINC000000119365	C3CCN(CCCc2ccc1OCOc1c2)CC3
Nc2ccc1oc(=O)ccc1c2I	ZINC000000016193	O=c2ccc1ccccc1o2
NCCNC(=O)N1CCN(CC(O)=O)CC1	ZINC000042420441	C1CNCCN1
CCN(CC)c3ccc(C=c2c(=O)[nH]c(=S)n(c1ccc(Cl)cc1)c2=O)o3	ZINC000000646088	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc3ccco3
CC[N@]1CCC[C@@H]1CNC(=O)c2cc(N)ccc2OC	ZINC000000347683	O=C(NCC1CCCN1)c2ccccc2
CNC[C@@H](O)CS(C)(=O)=O	ZINC000019685870	nonring
CCOC(=O)[C@H](N)CCN	ZINC000005856741	nonring
NCCN1CCNC[C@H]1S(N)(=O)=O	ZINC000616635769	C1CNCCN1
Cc3ccc(S(=O)(=O)Nc1ccccc1\C=N\n2cnnc2)cc3	ZINC000000052153	O=S(=O)(Nc1ccccc1C=Nn2cnnc2)c3ccccc3
CCOc2ccc1ccccc1c2\C=N\c3ccc(NC(C)=O)cc3	ZINC000000131340	C(=Nc1ccccc1)c2cccc3ccccc23
Brc3ccc(\C=C2/CC[C@@H](C1CCCC1)C2=O)s3	ZINC000000247961	O=C2C(C1CCCC1)CCC2=Cc3cccs3
C[C@H]2N(C(=S)Nc1ccccc1Cl)CCc3sccc23	ZINC000000106607	S=C(Nc1ccccc1)N3CCc2sccc2C3
Clc4ccc(N(Cc2nnc1CCCCCn12)C(=O)Nc3ccccc3)cc4	ZINC000000622861	O=C(Nc1ccccc1)N(Cc3nnc2CCCCCn23)c4ccccc4
Cn1cnn(C[C@@H](O)CN)c1=O	ZINC000128358837	O=c1[nH]cn[nH]1
CO[C@H]1C[C@@H](C(=O)NC[C@@](C)(CO)OC)[N@@](C)C1	ZINC000655215693	C1CCNC1
NCCNc1cnnc(=O)[nH]1	ZINC000019689594	O=c1nncc[nH]1
NNc3cc(N1CCOCC1)nc(OCCc2ccccn2)n3	ZINC000000033983	C3CN(c2ccnc(OCCc1ccccn1)n2)CCO3
C[C@@H](CO)NC(=O)CN1CCNCC1	ZINC000037482533	C1CNCCN1
C[C@@H](NCCO)C(=O)NC(N)=O	ZINC000035114117	nonring
CC(C)O[P@@](=O)([C@@H](O)c1ccc(C)cc1)c2ccc(N(C)C)cc2	ZINC000000524815	O=P(Cc1ccccc1)c2ccccc2
Cc2ccc(NC(=O)COc1c(C)cc(Cl)cc1Cl)cc2C	ZINC000000450777	O=C(COc1ccccc1)Nc2ccccc2
CN4CCN(c2c1CCCc1nc3ncnn23)CC4	ZINC000000156088	C4Cc3nc1ncnn1c(N2CCNCC2)c3C4
NCCc1nc(N)n[nH]1	ZINC000005410709	c1nc[nH]n1
NC(=O)CSc2nc1ccccc1n2Cc3ccccc3Cl	ZINC000000074497	C(c1ccccc1)n2cnc3ccccc23
COC(=O)COc2ccc(NC(=O)COc1ccccc1Cl)cc2	ZINC000000619410	O=C(COc1ccccc1)Nc2ccccc2
COc1ccccc1\C=c3\c(c2ccccc2N(=O)=O)noc3=O	ZINC000000032217	O=c2onc(c1ccccc1)c2=Cc3ccccc3
NC(=O)CCN(CCC(N)=O)C1=NCCS1	ZINC000004644906	C1CN=CS1
COc3ccc2nc(C)cc(SCC(=O)OC1CCCCC1)c2c3	ZINC000000410797	O=C(CSc1ccnc2ccccc12)OC3CCCCC3
COC(=O)N2CC(NC(=O)C(=O)NC1CNC1)C2	ZINC000497122093	O=C(NC1CNC1)C(=O)NC2CNC2
Cn4c(=O)n(C)c3cn(Cc1ccccc1)c(c2ccccc2)c3c4=O	ZINC000000033678	O=c4[nH]c(=O)c3c(c1ccccc1)n(Cc2ccccc2)cc3[nH]4
CCN(CC)c2ccc(\C=c1\c(=O)[nH]c(=O)n(CC=C)c1=O)cc2	ZINC000000192679	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)[nH]2
NC(=S)CNC(=O)C(=O)NCCCN1CCOCC1	ZINC000037244664	C1COCCN1
COc2ccc(NC(=S)Nc1c(C)cccc1C)cc2OC	ZINC000000066976	S=C(Nc1ccccc1)Nc2ccccc2
CN2CCO[C@@H](CNC(=O)C1CNC1)C2	ZINC000085790583	O=C(NCC1CNCCO1)C2CNC2
N[C@@H](Cn1cc(Cl)c(=O)[nH]c1=O)C(N)=O	ZINC000127850437	O=c1cc[nH]c(=O)[nH]1
Cc2csc(NC(=O)CNC1CC1)n2	ZINC000000325404	O=C(CNC1CC1)Nc2nccs2
NS(=O)(=O)c2cccc3c(C(=O)NC[C@@H]1CNC[C@@H]1O)nccc23	ZINC000648133707	O=C(NCC1CCNC1)c2nccc3ccccc23
COc3ccc2nc(NS(=O)(=O)c1ccc(F)cc1)sc2c3	ZINC000000068382	O=S(=O)(Nc2nc1ccccc1s2)c3ccccc3
CC(=C)C(=O)NCCCNC(=O)[C@H](N)CN	ZINC000148742302	nonring
Cn1cnccc1=O	ZINC000000330833	O=c1ccnc[nH]1
O=C1NCCCC[C@H]1NS(=O)(=O)c2ccc(C#N)cc2	ZINC000000142028	O=C1NCCCCC1NS(=O)(=O)c2ccccc2
CC3=C(C(=O)OCC1CCCCC1)[C@@H](c2ccccc2F)NC(=O)N3	ZINC000000068659	O=C3NC=C(C(=O)OCC1CCCCC1)C(c2ccccc2)N3
COCC[N@]1CCC[C@@H]1CNC(=O)[C@@H]2CC(=O)NC(=O)N2	ZINC000668261929	O=C2CC(C(=O)NCC1CCCN1)NC(=O)N2
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
NCC[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O	ZINC000026831645	C1CCOCC1
Cc3ccc(NC(=O)COc2cccc(\C=N\n1cnnc1)c2)cc3C	ZINC000000566201	O=C(COc2cccc(C=Nn1cnnc1)c2)Nc3ccccc3
Oc2ccc(CCN1C(=O)CNC1=S)cc2O	ZINC000000076796	O=C1CNC(=S)N1CCc2ccccc2
CN(C)CCN1NC(=O)COCC1=O	ZINC000634589088	O=C1COCC(=O)NN1
CN(CC(C)(C)N)C(=O)CNS(=O)(=O)c1c[nH]c(C(N)=O)c1	ZINC000662845180	c1cc[nH]c1
CC(C)(NS(=O)(=O)c1cc(Cl)c(Cl)cc1Cl)C#C	ZINC000000079199	c1ccccc1
NC[C@@H]1NC(=O)CNC1=O	ZINC000043120518	O=C1CNC(=O)CN1
Cc1ccccc1C(=O)Nc3nc2c(Cl)c(Cl)ccc2s3	ZINC000000557491	O=C(Nc2nc1ccccc1s2)c3ccccc3
CC(C)(N)C(=O)NC[C@@H](O)CO	ZINC000083340261	nonring
CC(=O)NCCc1cnc[nH]1	ZINC000000404262	c1c[nH]cn1
Cc2ccc(N1CCS[C@@H]1C(N)=O)cc2	ZINC000000053195	C2CN(c1ccccc1)CS2
O=C2[C@@H](Cc1cnc[nH]1)NC(=S)N2c3ccccc3	ZINC000000403544	O=C2C(Cc1cnc[nH]1)NC(=S)N2c3ccccc3
NCCNC1=N[C@H](CO)[C@@H](O)[C@H](O)[C@@H]1O	ZINC000016052635	C1CCN=CC1
CCn1c(NCCN(C)C)nc2n(C)c(=O)n(C)c(=O)c12	ZINC000000067718	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
Clc1ccccc1CSc3nc2ccccc2o3	ZINC000000036138	C(Sc2nc1ccccc1o2)c3ccccc3
Brc2cnc(N1CCNCC1)nc2	ZINC000000083576	C2CN(c1ncccn1)CCN2
CNC(=O)NC(=O)CC[N@]1CCC[C@@H](NS(C)(=O)=O)C1	ZINC000608779708	C1CCNCC1
Cc2ccc(C)c(NC(=O)COc1cc(C)cc(C)c1)c2	ZINC000000044478	O=C(COc1ccccc1)Nc2ccccc2
CC(C)OC(=O)Nc1nonc1C	ZINC000000039616	c1cnon1
CCOC(=O)COc2cc(C)cc3oc(=O)c1CCCCc1c23	ZINC000000044471	O=c3oc1ccccc1c2CCCCc23
COC(=O)[C@@H](C)Oc2cc(C)cc3oc(=O)cc(c1ccccc1)c23	ZINC000000044944	O=c3cc(c1ccccc1)c2ccccc2o3
C2CN1CCNCC1CN2	ZINC000024181430	C2CN1CCNCC1CN2
C[C@@]1(C(N)=O)CNCCO1	ZINC000019747072	C1COCCN1
O=C(NCCCN1CCNCC1)C(=O)NCC2CC2	ZINC000517743406	O=C(NCCCN1CCNCC1)C(=O)NCC2CC2
CN2CCC([N@]1CCC[C@@H](CO)C1)CC2	ZINC000000221550	C2CCN(C1CCNCC1)CC2
Cc2cn([C@@H]1C[C@@H](N)[C@H](CO)O1)c(=O)[nH]c2=O	ZINC000000402630	O=c2ccn(C1CCCO1)c(=O)[nH]2
NCCNN	ZINC000019170359	nonring
O=C(COC1CNC1)NC2=NCC(=O)N2	ZINC000582664972	O=C(COC1CNC1)NC2=NCC(=O)N2
NCC(=O)N2CC[N@]1CCC[C@H]1C2	ZINC000037812584	C2CC1CNCCN1C2
CN(CCN)[C@@H]1CS(=O)(=O)C[C@@H]1O	ZINC000054419340	O=S1(=O)CCCC1
CC(C)N2C(=O)[C@](O)(CC(=O)c1ccc(C)cc1C)c3ccccc23	ZINC000000095604	O=C(CC1C(=O)Nc2ccccc12)c3ccccc3
CCC(CC)n1ccc3c1ccc2nc(N)nc(N)c23	ZINC000000015885	c3ncc2c(ccc1[nH]ccc12)n3
NC(=O)[C@@H]1CNCCN1C=O	ZINC000575554435	C1CNCCN1
CCC(=O)Nc3nc1CCCCc1c4c2ccccc2oc(=O)c34	ZINC000000036228	O=c3oc1ccccc1c4c2CCCCc2ncc34
CCN(CC(=O)N(C)C)C(=O)CN	ZINC000036200244	nonring
CNC(=O)NC(=O)CC[N@@](C)[C@@H](C)CS(C)(=O)=O	ZINC000332450966	nonring
CCN2CCN(C(=O)c1cccc(N(=O)=O)c1)CC2	ZINC000000127890	O=C(N1CCNCC1)c2ccccc2
Cc2n[nH]c(SCC(=O)Nc1ccc(Br)cn1)n2	ZINC000000051123	O=C(CSc1ncn[nH]1)Nc2ccccn2
NCC(=O)NCC(=O)Nc2nccc(Nc1ccc(S(N)(=O)=O)cc1)n2	ZINC000013800665	N(c1ccccc1)c2ccncn2
CC(C)NC[C@@H](O)c1ccc(N)c(C#N)c1	ZINC000000002307	c1ccccc1
FC(F)(F)c2cccc(NS(=O)(=O)c1ccc(I)cc1)c2	ZINC000000644822	O=S(=O)(Nc1ccccc1)c2ccccc2
CN3CCN(c1cccc2[nH]c(=O)oc12)CC3	ZINC000000008736	O=c3[nH]c2cccc(N1CCNCC1)c2o3
CNC[C@@H]1C[C@H](F)CN1C(=O)CCC(=O)NCCNC(C)=O	ZINC000648132162	C1CCNC1
C[C@@H](N)C(=O)N[C@@H]1[C@@H](O)O[C@@H](CO)[C@@H](O)[C@H]1O	ZINC000005439366	C1CCOCC1
CN(C)c2nc(F)c(F)c(S(=O)(=O)c1ccccc1)c2F	ZINC000000036918	O=S(=O)(c1ccccc1)c2ccncc2
C[C@](Cc1ccccc1)(NC(=O)CN)c2ccccc2	ZINC000000004153	C(Cc1ccccc1)c2ccccc2
CCn1c(=O)c(N(C)C)nc2ccccc12	ZINC000000021500	O=c2cnc1ccccc1[nH]2
NNC2=N[C@H]1CS(=O)(=O)C[C@@H]1S2	ZINC000005613089	O=S2(=O)CC1SC=NC1C2
CNCCCC(=O)N1CCNC(=O)C1	ZINC000037477602	O=C1CNCCN1
CC(C)CN(CC(C)C)S(=O)(=O)c1ccc(C(O)=O)cc1	ZINC000000036826	c1ccccc1
CC1(C)[C@H](C=C(Cl)Cl)[C@@H]1C(=O)NC2CCCCCC2	ZINC000000036354	O=C(NC1CCCCCC1)C2CC2
Nc1ncc(O)c(N)n1	ZINC000013829353	c1cncnc1
Cc4oc3cc2oc(=O)c1CCCCc1c2cc3c4c5ccccc5	ZINC000000095190	O=c5oc3cc2occ(c1ccccc1)c2cc3c4CCCCc45
O=C2C[C@@H](C(=O)NCc1ccco1)CN2c3ccccc3	ZINC000000048397	O=C2CC(C(=O)NCc1ccco1)CN2c3ccccc3
C[C@H](c1ccc(Cl)c(Cl)c1)n2[nH]c(N)cc2=O	ZINC000000000521	O=c1cc[nH]n1Cc2ccccc2
C2CO[C@H](CNCc1ccncc1)C2	ZINC000000266017	C2COC(CNCc1ccncc1)C2
NCCNS(=O)(=O)C1COC1	ZINC000624352443	C1COC1
Cc3ccc(C(=O)Oc2ccc1c(Br)cccc1c2)cc3	ZINC000000383802	O=C(Oc2ccc1ccccc1c2)c3ccccc3
CN1CC(=O)N=C(N)NC1=N	ZINC000001683174	N=C1NCC(=O)N=CN1
O[C@@H]2[C@H]1CO[C@H](C1)[C@H](O)[C@H]2O	ZINC000585656287	C1CC2COC(C1)C2
NC(=N)N[C@H]1CCNC1=O	ZINC000575526824	O=C1CCCN1
CNC(=O)CC(=O)NCC(=O)NCCN1CCCCCC1	ZINC000356488140	C1CCCNCC1
CNC(=O)c3sc2nc(c1ccc(OC)c(OC)c1)ccc2c3N	ZINC000000125897	c3ccc(c2ccc1ccsc1n2)cc3
N[C@@H](CO)[C@@H](N)CO	ZINC000022043034	nonring
CCOC(=O)c3nc(Nc1cc(C)cc(C)c1)c2ccccc2n3	ZINC000000106387	N(c1ccccc1)c2ncnc3ccccc23
C[C@@H]2[C@@H]4N(CC1CC1)CC[C@@]2(C)c3cc(O)ccc3C4=O	ZINC000000000410	O=C3C1CC(CCN1CC2CC2)c4ccccc34
Clc4ccc(C3=NN2COc1ccc(Cl)cc1[C@H]2C3)cc4	ZINC000000115046	C3Oc1ccccc1C4CC(c2ccccc2)=NN34
C[C@@H]2CC(=O)Nc1ccccc1N2C(=O)c3ccc(Cl)cc3Cl	ZINC000000067092	O=C3CCN(C(=O)c1ccccc1)c2ccccc2N3
COc3ccc([C@@H](C)NS(=O)(=O)c2ccc1OCCOc1c2)cc3	ZINC000000323903	O=S(=O)(NCc1ccccc1)c3ccc2OCCOc2c3
COc2ccc(c1csc(=S)s1)cc2	ZINC000000011241	S=c2scc(c1ccccc1)s2
CCN(CC)CCn1c(OC)cc(=O)[nH]c1=O	ZINC000000247613	O=c1cc[nH]c(=O)[nH]1
C[C@@](O)(CNC(=O)[C@@H]1CNC(=O)C1)CN2CCOCC2	ZINC000530719912	O=C2CC(C(=O)NCCCN1CCOCC1)CN2
CC(=O)c3cccc(NC(=O)CSc1nnc2ccccn12)c3	ZINC000000053999	O=C(CSc1nnc2ccccn12)Nc3ccccc3
N[C@@H]1CCCN(CC(=O)NCCO)C1=O	ZINC000225597893	O=C1CCCCN1
C[C@H](CO)c2cccc(C(=O)c1ccccc1)c2	ZINC000000006711	O=C(c1ccccc1)c2ccccc2
C[C@@H]1CN(CCO)CCN1c2nc(N)nc(N)n2	ZINC000624266129	C2CN(c1ncncn1)CCN2
Cn2c(=O)[nH]c(=O)c3nc(NCCCN1CCOCC1)[nH]c23	ZINC000012531735	O=c3[nH]c(=O)c2nc(NCCCN1CCOCC1)[nH]c2[nH]3
COCCN(CCN(C)C)C(=O)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1	ZINC000668310057	C1CCC=CC1
CNC(=O)[C@@H]1CNCCN1C(=O)COC	ZINC000084211874	C1CNCCN1
CC(C)c3cc(\C=C1/CN2CCC1CC2)on3	ZINC000000006806	C1CN3CCC1C(=Cc2ccno2)C3
COc3ccc(OC)c(NC(=O)Cn2c(=O)c1ccccc1c2=O)c3	ZINC000000044288	O=C(Cn2c(=O)c1ccccc1c2=O)Nc3ccccc3
CNC(=O)Cn2cc(NC(=O)N1CCN(CCN(C)C)C(=O)C1)cn2	ZINC000650110211	O=C2CN(C(=O)Nc1cn[nH]c1)CCN2
Oc1ccccc1\C=N\c2ccccc2C(=O)Nc3ccc(F)cc3	ZINC000000067161	O=C(Nc1ccccc1)c2ccccc2N=Cc3ccccc3
CCN2CCC(NC(=O)CN1CC[C@@H](NS(C)(=O)=O)C1)CC2	ZINC000116889931	O=C(CN1CCCC1)NC2CCNCC2
CN(C)c3ccc(NC(=O)c2ccc(Cn1cc(Cl)cn1)o2)cc3	ZINC000000214422	O=C(Nc1ccccc1)c3ccc(Cn2cccn2)o3
C[C@@H]1CC[C@@H](C(=O)NCC(N)=O)CN1	ZINC000019505345	C1CCNCC1
Clc4ccc3n(C[C@@H]1CO1)c2ccc(Cl)cc2c3c4	ZINC000000041704	C1OC1Cn3c2ccccc2c4ccccc34
Cc2cccc(S[C@@H](CC(=O)c1ccc(Br)cc1)C(O)=O)c2	ZINC000001057753	O=C(CCSc1ccccc1)c2ccccc2
Cc1ccccc1n3cc(c2ccc(Br)cc2)[nH]c3=S	ZINC000000160536	S=c2[nH]c(c1ccccc1)cn2c3ccccc3
Cc2cc(S(=O)(=O)Cc1ccc(N(=O)=O)cc1)c(C)cc2Cl	ZINC000000120045	O=S(=O)(Cc1ccccc1)c2ccccc2
Clc2cc(NC(=O)c1ccc(N(=O)=O)cc1)cc3OCCOc23	ZINC000000041701	O=C(Nc2ccc1OCCOc1c2)c3ccccc3
CCOc3ccc(N2C(=O)C[C@H](NCCc1ccccn1)C2=O)cc3	ZINC000000084312	O=C2CC(NCCc1ccccn1)C(=O)N2c3ccccc3
COc1cccc(CNC[C@@H](C)O)c1OC	ZINC000000249564	c1ccccc1
CCOC(=O)c1c(C)csc1NC(=O)C(Cl)(Cl)Cl	ZINC000000080325	c1ccsc1
CCOc2cc1OCOc1cc2Cc3ccc(OC)cc3	ZINC000000014542	C3Oc2ccc(Cc1ccccc1)cc2O3
O=S(=O)(Nc2ccc1ccccc1n2)c3ccc(C#N)cc3	ZINC000000153429	O=S(=O)(Nc2ccc1ccccc1n2)c3ccccc3
Nc1[nH]c(Br)c(C#N)c1C#N	ZINC000000034215	c1cc[nH]c1
NC(=O)c1ccc(N(=O)=O)cc1S(=O)(=O)Cc2ccccc2	ZINC000000053519	O=S(=O)(Cc1ccccc1)c2ccccc2
Cc2cc(C)nc(SCC(=O)Nc1cccc(N(=O)=O)c1)n2	ZINC000000041416	O=C(CSc1ncccn1)Nc2ccccc2
CC(C)(C)c2ccc(C(=O)N/C(=C/c1ccco1)C(O)=O)cc2	ZINC000000375465	O=C(NC=Cc1ccco1)c2ccccc2
CCS(=O)(=O)N2CCC[C@@H](C(=O)NCCN1CCCC1)C2	ZINC000000220603	O=C(NCCN1CCCC1)C2CCCNC2
O[C@H]2CN(CC#CCN1C[C@@H](O)[C@H](O)C1)C[C@@H]2O	ZINC000342141235	C2CCN(CC#CCN1CCCC1)C2
C[N@@]1[C@@H](CCC(=O)NCC#C)CNC(=O)[C@@H]2[C@H]1CCN2Cc3ncc[nH]3	ZINC000022922447	O=C3NCCNC2CCN(Cc1ncc[nH]1)C23
CC(C)(C)C(=O)C[n+]1cn(N)cn1	ZINC000000298127	c1nnc[nH]1
CCOC(=O)[C@@H]2C3c1ccccc1C([C@@H]2C(O)=O)c4ccccc34	ZINC000000400393	C2CC3c1ccccc1C2c4ccccc34
CN2CCN(c1ccc(NC(=S)NC(C)=O)cc1)CC2	ZINC000000359981	C2CN(c1ccccc1)CCN2
CC1(C)CC(=O)C2=C(C1)OC5=C(C2c4ccc(c3ccccc3)o4)C(=O)CC(C)(C)C5	ZINC000000623278	O=C1CCCC5=C1C(c3ccc(c2ccccc2)o3)C4=C(CCCC4=O)O5
CN1CCN(C(=O)CNC(CO)CO)CC1	ZINC000083695432	C1CNCCN1
N[C@@H]1CCNC1=O	ZINC000019737051	O=C1CCCN1
COC(=O)CNC(=O)[C@@H]1COCCN1	ZINC000083872764	C1COCCN1
OC[C@H](O)C(O)(O)[C@@H](O)[C@@H]1NCCS1	ZINC000408722645	C1CSCN1
Cc2nn(c1ccccc1)c(Cl)c2CNc3cccc4ccccc34	ZINC000000367552	C(Nc1cccc2ccccc12)c4cnn(c3ccccc3)c4
CN(C)C=c1c(=O)[nH]c(=O)[nH]c1=O	ZINC000001673695	C=c1c(=O)[nH]c(=O)[nH]c1=O
CS(=O)(=O)C(=C/c2ccc(OCc1cc(F)cc(F)c1)cc2)/C#N	ZINC000000113065	C(Oc1ccccc1)c2ccccc2
CC[C@@H](C)Nc2nc(C)nc3c(c1c(C)cc(OC)cc1OC)c(C)nn23	ZINC000000588890	c3ccc(c1cnn2cncnc12)cc3
CNC(=O)[C@@H]1OC(C)(C)O[C@H]1C(=O)NC	ZINC000000405636	C1COCO1
CC(C)(C)C(=O)Nc2nnc(Cc1ccc(Cl)cc1Cl)s2	ZINC000000103539	C(c1ccccc1)c2nncs2
C3CN(c2nc(c1ccccc1)cs2)C[C@@H]3c4ccccc4	ZINC000000038352	C3CN(c2nc(c1ccccc1)cs2)CC3c4ccccc4
CNC(=O)NC(=O)Cc2cc1OCOc1cc2Cc3ccc(N)cc3	ZINC000000003612	C3Oc2ccc(Cc1ccccc1)cc2O3
CC(=O)c2nn(c1ccc(N(=O)=O)cc1)cc2C(=O)c3cccs3	ZINC000000035106	O=C(c2cnn(c1ccccc1)c2)c3cccs3
CCOC(=O)NC(=O)CN1CCNCC1	ZINC000036923914	C1CNCCN1
CSc1nc(N)c(N)c(=O)n1C	ZINC000000330501	O=c1ccnc[nH]1
COc1cccc(OC)c1OC[C@@H](O)CN2CCCCC2	ZINC000000166973	C2CCN(CCCOc1ccccc1)CC2
OCCn2c(c1ccc(F)cc1)cs\c2=N/c3cccc(Cl)c3	ZINC000000074242	N(c1ccccc1)=c3[nH]c(c2ccccc2)cs3
Cc3cc(C)n(c2nc1c(=O)n(C)c(=O)n(C)c1[nH]2)n3	ZINC000000049541	O=c3[nH]c(=O)c2nc(n1cccn1)[nH]c2[nH]3
O=S(=O)(\N=c2/cc(c1ccccc1)ss2)c3ccccc3	ZINC000000049542	O=S(=O)(N=c2cc(c1ccccc1)ss2)c3ccccc3
O=C(Cn1cnnn1)N[C@@H]2CCNC2	ZINC000036286802	O=C(Cn1cnnn1)NC2CCNC2
OC[C@@H]1CNC(=O)NC1=O	ZINC000013511682	O=C1CCNC(=O)N1
COc1c(Cl)scc1C(=O)O/N=C/c2c(F)cccc2Cl	ZINC000000165901	O=C(ON=Cc1ccccc1)c2ccsc2
Cc2onc(c1c(F)cccc1Cl)c2C(=O)Nc4nnc(C3CCCCC3)s4	ZINC000000649245	O=C(Nc2nnc(C1CCCCC1)s2)c3conc3c4ccccc4
CCn2cc(C(O)=O)c(=O)c3c(C)c(F)c(N1CCNCC1)cc23	ZINC000000010683	O=c2cc[nH]c3cc(N1CCNCC1)ccc23
CNC(=O)[C@@H]1CCCN1C(=O)CNC(=O)CC(F)(F)CN	ZINC000653086195	C1CCNC1
OCC(CO)C[C@@H]1COCCN1	ZINC000145791636	C1COCCN1
OCCNC(=O)CN1CCNCC1	ZINC000037482527	C1CNCCN1
CC(C)(C)NC[C@@H](O)COc1nsnc1N2CCOCC2	ZINC000000403609	C2CN(c1cnsn1)CCO2
Cc2cc(NC(=O)C(=O)N1CCCC[C@@H]1CNC(=O)CCN)no2	ZINC000648128312	O=C(Nc1ccon1)C(=O)N2CCCCC2
O=N(=O)c3ccc(\C=N\c2ccc(N1CCOCC1)cc2)s3	ZINC000000032029	C3CN(c2ccc(N=Cc1cccs1)cc2)CCO3
NCCn1c(=O)ccc1=O	ZINC000002572342	O=c1ccc(=O)[nH]1
NNCCNCCO	ZINC000039643926	nonring
CSc2nc(O)c(Cc1ccccc1)c(=O)n2c3ccccc3	ZINC000000447258	O=c2c(Cc1ccccc1)cncn2c3ccccc3
N[C@@H]1S[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O	ZINC000038665159	C1CCSCC1
Cc2nc1sc(C(N)=O)c(N)c1c(C)c2CC(=O)c3ccccc3	ZINC000000078742	O=C(Cc2cnc1sccc1c2)c3ccccc3
C[N+](C)(CCO)Cc1ccc(N(=O)=O)cc1	ZINC000000226038	c1ccccc1
C[C@@H](NC(=O)[C@H]2CN(C1CC1)C(=O)C2)C(=O)NCCN(C)C	ZINC000583944564	O=C1CCCN1C2CC2
Cc3cc(C)c(S(=O)(=O)Nc1cccc2cccnc12)c(C)c3	ZINC000000175215	O=S(=O)(Nc1cccc2cccnc12)c3ccccc3
COc2ccc(CN(CCN(C)C)c1ncccn1)cc2	ZINC000000057513	C(Nc1ncccn1)c2ccccc2
OC(=O)CSCC(=O)Nc1csc(C(F)(F)F)c1c2ccccc2	ZINC000001039650	c2ccc(c1ccsc1)cc2
COC(=O)c/1c(C)n(CC(C)C)c(=O)c\1=C/c2cccc(Cl)c2	ZINC000000068626	O=c1[nH]ccc1=Cc2ccccc2
O=S(=O)(Nc2ccc1OCCOc1c2)c3cccs3	ZINC000000106709	O=S(=O)(Nc2ccc1OCCOc1c2)c3cccs3
Brc2ccc(NC(=S)NCCc1ccccn1)nc2	ZINC000000005722	S=C(NCCc1ccccn1)Nc2ccccn2
O=C2CN[C@@H]([C@@H]1CNCCN1)CN2	ZINC000669378617	O=C2CNC(C1CNCCN1)CN2
CC[C@@H](C)NCC(=O)Nc1ccc(S(N)(=O)=O)cc1	ZINC000000174588	c1ccccc1
C[C@@H](O)CNC(=O)[C@@H](O)CN	ZINC000083339745	nonring
CCN(CC)C(=O)N1CCN(C)CC1	ZINC000000001288	C1CNCCN1
CCOC(=O)c1c(C)c(C)sc1NC(=O)CN2CCCCCC2	ZINC000000027746	O=C(CN1CCCCCC1)Nc2cccs2
Cc2cccc(NCN1C(=O)CCC1=O)n2	ZINC000000138632	O=C1CCC(=O)N1CNc2ccccn2
CN(C)CCNC(=O)C2CCN(S(=O)(=O)N1CCOCC1)CC2	ZINC000000218161	O=S(=O)(N1CCCCC1)N2CCOCC2
C[C@@H]2CN(C(=O)[C@H]1C[C@H](O)CN1)CCO2	ZINC000036906971	O=C(C1CCCN1)N2CCOCC2
Nc1nnc(N)c(N)n1	ZINC000038864299	c1cnncn1
CCN(CC)c4c(n1nnc2ccccc12)c(=O)c3ccccc3c4=O	ZINC000000033641	O=c3cc(n1nnc2ccccc12)c(=O)c4ccccc34
Fc1ccccc1[C@@H]3CC(=O)Nc4cc2OCOc2cc34	ZINC000000033645	O=C4CC(c1ccccc1)c3cc2OCOc2cc3N4
NS(=O)(=O)N2CCN(C1CNC1)CC2	ZINC000071788800	C2CN(C1CNC1)CCN2
O=C(NC(=S)Nc2ccc(N1CCCCC1)cc2)c3cccs3	ZINC000000114894	O=C(NC(=S)Nc2ccc(N1CCCCC1)cc2)c3cccs3
C[C@@H](NCC(N)=O)C(N)=O	ZINC000020361889	nonring
CC(=O)N1CN(C(C)=O)[C@@H](O)[C@@H]1O	ZINC000000039626	C1CNCN1
CCCc4cc3c(=O)c(c2cc1ccccc1o2)coc3cc4OC=O	ZINC000000518120	O=c3c(c2cc1ccccc1o2)coc4ccccc34
CN(C)CCNC=O	ZINC000001688176	nonring
Cc1ccccc1Nc2c(Cl)c(Cl)nc3c(C)cccc23	ZINC000000083310	N(c1ccccc1)c2ccnc3ccccc23
O[C@H]3CC[N@@](CCNC(=O)C(=O)Nc2cc(n1cnnn1)ccc2F)C3	ZINC000628103950	O=C(NCCN1CCCC1)C(=O)Nc3cccc(n2cnnn2)c3
N[C@@]1(CO)CCCNC1=O	ZINC000039596708	O=C1CCCCN1
CC(C)Sc1ccc(N(=O)=O)cc1C(=O)Nc2ccncc2	ZINC000000079233	O=C(Nc1ccncc1)c2ccccc2
CN(C)CCNC(=O)CN1CCNCC1=O	ZINC000357243154	O=C1CNCCN1
CC(=O)NCC(=O)N1CC(N)C1	ZINC000083635003	C1CNC1
C[N@]1CCC[C@@H]1CNC(=O)NCCNS(C)(=O)=O	ZINC000139512802	C1CCNC1
COC(=O)[C@H](Cc1cnc[nH]1)NCc2ccccc2	ZINC000000402730	C(Cc1cnc[nH]1)NCc2ccccc2
Cc2cc(\C=c1\[nH]c(=O)[nH]c1=O)c(C)n2c3ccc(Cl)cc3	ZINC000000036584	O=c3[nH]c(=O)c(=Cc2ccn(c1ccccc1)c2)[nH]3
CC(C)(CO)NC[C@@H](O)c1ccccc1	ZINC000000004237	c1ccccc1
OCC1(CO)C[C@@H](O)CN1	ZINC000575493596	C1CCNC1
CC(=C)COc3ccc2c(c1ccccc1)cc(=O)oc2c3C	ZINC000000082782	O=c3cc(c1ccccc1)c2ccccc2o3
COc4ccc(NC(=O)C3(C)c1ccccc1c2ccccc23)cc4	ZINC000000036746	O=C(Nc1ccccc1)C3c2ccccc2c4ccccc34
Cc3c(C(=O)CCN2CCC(c1ccc(F)cc1)=CC2)cnn3CCO	ZINC000000537749	O=C(CCN2CCC(c1ccccc1)=CC2)c3cn[nH]c3
CC(C)NC[C@@H](O)COc1nccs1	ZINC000000000738	c1cscn1
O=C(Nc2ccc(N1CCOCC1)cc2)c3ccc(N(=O)=O)cc3	ZINC000000043952	O=C(Nc2ccc(N1CCOCC1)cc2)c3ccccc3
NN=C(N)N[C@@H]1COC[C@@H]1O	ZINC000306412536	C1CCOC1
NCCN[C@@H]1CC(=O)NC1=O	ZINC000036853653	O=C1CCC(=O)N1
CCOc1nc(N)nc(NC)n1	ZINC000000066140	c1ncncn1
CC(=O)NCCc2cccc3ccc1OCCCc1c23	ZINC000000020590	C3COc2ccc1ccccc1c2C3
N[C@@H]1C[C@H]2N(C1)C(=O)CNC2=O	ZINC000082401565	O=C2CNC(=O)C1CCCN12
CC(CO)(CO)NC(N)=NN	ZINC000129267201	nonring
O=C(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c3ccoc3	ZINC000000036964	O=C(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c3ccoc3
Cc3ccc(S(=O)(=O)N1CCC[C@H]1c2ccsc2)cc3	ZINC000000026230	O=S(=O)(N1CCCC1c2ccsc2)c3ccccc3
Clc3ccc(/N=C/c2cc1OCOc1cc2N(=O)=O)cc3Cl	ZINC000000061739	C3Oc2ccc(C=Nc1ccccc1)cc2O3
CC(C)CC[n+]1ccc(C(N)=O)cc1	ZINC000000394263	c1ccncc1
CC[C@@H](N)CNC(=O)N1CCN(C)C(=O)C1	ZINC000583998588	O=C1CNCCN1
CC[C@H](C)NC(=O)c2c(CC)c(c1ccccc1)nc3ccccc23	ZINC000000260875	c3ccc(c2ccc1ccccc1n2)cc3
CN(CCN)C(=O)C1(O)CNC1	ZINC000662813041	C1CNC1
Ic2ccc(C=c1[nH]c(=S)[nH]c1=O)o2	ZINC000000048383	O=c1[nH]c(=S)[nH]c1=Cc2ccco2
Cc2cc(\C=N\n1cnnc1)c(C)n2c3cccc(Cl)c3C	ZINC000000037504	C(=Nn1cnnc1)c3ccn(c2ccccc2)c3
Cc1cc(\C=N\NC(N)=O)c(C)n1c3sc2CCCCc2c3C#N	ZINC000000037507	C3CCc2sc(n1cccc1)cc2C3
CNC(=O)CN(C)[C@@H]1CS(=O)(=O)C[C@@H]1N	ZINC000054492976	O=S1(=O)CCCC1
Cc2cnc(C(=O)NCCC(=O)NC1CCCCC1)cn2	ZINC000000329823	O=C(CCNC(=O)c1cnccn1)NC2CCCCC2
CNS(=O)(=O)Cc2ccc(CNC(=O)C1(O)CNC1)cc2	ZINC000662457566	O=C(NCc1ccccc1)C2CNC2
Cc3c(CNC[C@]1(O)O[C@H](CO)[C@@H](O)[C@@H]1O)c(=O)n(c2ccccc2)n3C	ZINC000255979833	O=c2c(CNCC1CCCO1)c[nH]n2c3ccccc3
COC(=O)Nc2ccc(SCC(=O)c1ccc(Cl)cc1)cc2	ZINC000000048369	O=C(CSc1ccccc1)c2ccccc2
CC(C)C[C@H](CO)NC[C@H]1O[C@H](CO)[C@@H](O)[C@@H]1O	ZINC000040379679	C1CCOC1
O=C(N1CCNCC1)c2ccccc2	ZINC000000235748	O=C(N1CCNCC1)c2ccccc2
OC[C@@H](O)[C@H](CO)NCc1c[nH]c2c(=O)[nH]cnc12	ZINC000040422365	O=c1[nH]cnc2cc[nH]c12
OCC(CO)(CO)NC[C@@H](S)CS	ZINC000005830242	nonring
N[C@H]1C[C@H](N)[C@H](C(N)=O)C[C@H]1O	ZINC000040479427	C1CCCCC1
NC(=N)N1CCNCC1	ZINC000002585910	C1CNCCN1
CC[N@]1CCO[C@@H](C(=O)NC[C@@](C)(CO)OC)C1	ZINC000655212350	C1COCCN1
O[C@@H](CNCc2ccc1OCOc1c2)COc3ccccc3	ZINC000000119165	C(CNCc2ccc1OCOc1c2)COc3ccccc3
CCOC(=O)c2cn(CC)c1ccc(Br)cc1c2=O	ZINC000000052340	O=c1cc[nH]c2ccccc12
Cn1cnc(N(=O)=O)c1SC[C@@H](O)CN2CCCCC2	ZINC000000346175	C2CCN(CCCSc1cnc[nH]1)CC2
CC(=O)N(CC(N)=O)[C@@H]1CCNC1	ZINC000037470021	C1CCNC1
CN([C@@H](Cc1ccccc1)C(O)=O)C(=O)OCc2ccccc2	ZINC000000392030	O=C(NCCc1ccccc1)OCc2ccccc2
Cc2ccc(\C=N\c1ccc(I)cc1)o2	ZINC000000047487	C(=Nc1ccccc1)c2ccco2
O=C(CSCc1ccccc1)Nc2ccc4CCc3cccc2c34	ZINC000000306887	O=C(CSCc1ccccc1)Nc2ccc4CCc3cccc2c34
NC(=N)c1cccc(N(=O)=O)c1	ZINC000000155927	c1ccccc1
CSc2nc(c1ccccc1)nc(SC)c2C(C)=O	ZINC000000034196	c2ccc(c1ncccn1)cc2
NC(=N)CCNS(N)(=O)=O	ZINC000167578047	nonring
NC(=O)NC(=O)CN1CCC(CCO)CC1	ZINC000400922442	C1CCNCC1
CCN2C(=O)N[C@@H](c1ccc(OC(F)F)cc1)C(C(=O)OC)=C2C	ZINC000000067375	O=C2NC=CC(c1ccccc1)N2
COc3ccc(C=c1sc(=O)nc1Nc2ccccc2)c(OC)c3	ZINC000000084124	O=c3nc(Nc1ccccc1)c(=Cc2ccccc2)s3
N[C@@H]1[C@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@@H]12	ZINC000035904595	C2COC1CC1C2
O=C(Nc2ccc(C(=O)Nc1nccs1)cc2)\C=C\c3ccco3	ZINC000000081336	O=C(Nc2ccc(C(=O)Nc1nccs1)cc2)C=Cc3ccco3
CC(C)(N)C(=O)N1CCNC(=O)C1	ZINC000040920297	O=C1CNCCN1
C=CNC(=O)CC#N	ZINC000000397606	nonring
CC(C)OC(=O)CSc2nnc(c1ccc(C(C)(C)C)cc1)n2N	ZINC000000524160	c2ccc(c1nnc[nH]1)cc2
COCCN[C@@H]1[C@@H](O)[C@H](N)[C@H]2CO[C@@H]1O2	ZINC000012483792	C1CC2COC(C1)O2
Clc3ccc(NC(=O)c1cccnc1)c(C(=O)c2ccccc2)c3	ZINC000000029330	O=C(Nc1ccccc1C(=O)c2ccccc2)c3cccnc3
CC(C)OC(=O)[C@@H]1CC=CC[C@@H]1C(=O)Nc2ccc(C(O)=O)cc2	ZINC000000135947	O=C(Nc1ccccc1)C2CCC=CC2
COc2ccc(NC(=O)C(C)(C)Oc1ccc(Cl)cc1)c(OC)c2	ZINC000000462011	O=C(COc1ccccc1)Nc2ccccc2
COc1nc(C#N)c(C#N)nc1OC	ZINC000000337868	c1cnccn1
COc4ccc3[C@H]2CC(c1ccc(Cl)cc1)=NN2C(=O)c3c4OC	ZINC000000064634	O=C3N2N=C(c1ccccc1)CC2c4ccccc34
O=C(NC1CCNCC1)[C@@H]2COCCO2	ZINC000036900669	O=C(NC1CCNCC1)C2COCCO2
C[C@@H]1CS(=O)(=O)CCN1C(=O)CN	ZINC000225497170	O=S1(=O)CCNCC1
CC(C)(CNC(=O)[C@]1(O)CCCNC1)NS(C)(=O)=O	ZINC000662594631	C1CCNCC1
NC(=O)CSc3nc2CC1=C(CCC1)c2c(=O)n3c4ccccc4	ZINC000000031342	O=c3c2C1=C(CCC1)Cc2ncn3c4ccccc4
Clc1cccc(Cl)c1CSc3nc(=O)n2[nH]ccc2n3	ZINC000000080552	O=c2nc(SCc1ccccc1)nc3cc[nH]n23
COc1cc(C(N)=O)ccn1	ZINC000000126891	c1ccncc1
O=C1NCC[C@H]1NC(=O)C(=O)NCCN3CCN(Cc2ccccc2)CC3	ZINC000668371368	O=C1NCCC1NC(=O)C(=O)NCCN3CCN(Cc2ccccc2)CC3
C[n+]2cccc(C(=O)NC[C@@H]1CCCO1)c2	ZINC000000383140	O=C(NCC1CCCO1)c2cccnc2
CSc2ccc(Oc1cccc(C(=O)CC#N)c1)cc2	ZINC000000042287	O(c1ccccc1)c2ccccc2
O=C(NCc2ccc1[nH]c(=O)[nH]c1c2)c4cn(CCN3CCNCC3)nn4	ZINC000077556518	O=C(NCc2ccc1[nH]c(=O)[nH]c1c2)c4cn(CCN3CCNCC3)nn4
COc1ccc(OC)c(NC(=O)CC(C)(C)C)c1	ZINC000000030831	c1ccccc1
COc3ccc([C@@H]2Cc1cccc(O)c1C(=O)O2)cc3O	ZINC000000001937	O=C2OC(c1ccccc1)Cc3ccccc23
C[C@@H](CN)NCCO	ZINC000019367529	nonring
C[C@@H](N)[C@@H](O)c1ccccc1	ZINC000000001930	c1ccccc1
CNS(=O)(=O)[C@@H]1CCC[N@@](CCC(=O)NC(N)=O)C1	ZINC000533381325	C1CCNCC1
C[C@@H](NC(C)=O)C(=O)N1CCNCC1	ZINC000020183864	C1CNCCN1
CN4CCN(c2nc1ccccc1n3c(C)nnc23)CC4	ZINC000000236466	C4CN(c2nc1ccccc1n3cnnc23)CCN4
Cn3c(=O)n(C)c2ncn(CC1NCCN1)c2c3=O	ZINC000019324464	O=c3[nH]c(=O)c2n(CC1NCCN1)cnc2[nH]3
Cc1n[nH]c(C)c1CCN	ZINC000000316939	c1cn[nH]c1
CCOC(=O)[C@@]3(CC)C[C@@H](CSc2nc1ccccc1[nH]2)OC3=O	ZINC000000034337	O=C3CCC(CSc2nc1ccccc1[nH]2)O3
Clc3ccc(C(=O)OCCc1csc2ccccc12)cc3	ZINC000000101414	O=C(OCCc1csc2ccccc12)c3ccccc3
NC(=O)c2cc(Oc1ccc(Br)cc1)nc3ccccc23	ZINC000000197770	O(c1ccccc1)c3ccc2ccccc2n3
COc2cc(C(=O)Oc1cccc(N(=O)=O)c1)cc(OC)c2OC	ZINC000000045895	O=C(Oc1ccccc1)c2ccccc2
COc3ccc(NC(=O)CSc1nnc2nc(C)cc(C)n12)cc3	ZINC000000089562	O=C(CSc1nnc2ncccn12)Nc3ccccc3
CC(C)(C)c3cc(C(F)(F)F)c2c(=O)n(c1ccccc1)nc2[nH]3	ZINC000000053436	O=c2n(c1ccccc1)nc3[nH]cccc23
NC(=O)C2CCN([C@@H]1CC(=O)NC1=O)CC2	ZINC000019866250	O=C2CC(N1CCCCC1)C(=O)N2
O[C@H]2CN(C1CCNCC1)C(=O)C2	ZINC000016698014	O=C1CCCN1C2CCNCC2
NC2CN(C(=O)[C@H]1CNC(=O)C1)C2	ZINC000134907690	O=C2CC(C(=O)N1CCC1)CN2
N[C@H]1C[C@@H](O)[C@@H](O)C[C@H]1N	ZINC000039058947	C1CCCCC1
CN(C)C2(CNC(=O)C(=O)c1cc(S(N)(=O)=O)cn1C)CC2	ZINC000616342205	O=C(NCC1CC1)C(=O)c2ccc[nH]2
COCC[N@]1CC[C@@H](S(N)(=O)=O)C1	ZINC000407947492	C1CCNC1
COc2ccc1cccc(CCNC(C)=O)c1c2	ZINC000000005608	c2ccc1ccccc1c2
COc1nc(C(Cl)(Cl)Cl)c(Cl)c(OC)c1Cl	ZINC000000003868	c1ccncc1
COc2cccc(C=Nc1ccc(S(=O)(=O)NC(C)=O)cc1)c2O	ZINC000000588370	C(=Nc1ccccc1)c2ccccc2
CN(C1CC1)S(=O)(=O)N[C@@H]2CCNC2	ZINC000308870869	O=S(=O)(NC1CC1)NC2CCNC2
Cc3ccc(Nc1nc(C)nc2sc(C)cc12)c(Br)c3	ZINC000000224138	N(c1ccccc1)c2ncnc3sccc23
CC(C)(c1ccccc1)c4ccc(O)c(n3nc2ccccc2n3)c4	ZINC000000254455	C(c1ccccc1)c4cccc(n3nc2ccccc2n3)c4
CC(=O)Nc1ccc(S(=O)(=O)COC(C)=O)cc1	ZINC000000049956	c1ccccc1
FC(F)(F)c2cc(C(F)(F)F)c(C#N)c(Sc1ccccc1)n2	ZINC000000495775	S(c1ccccc1)c2ccccn2
Cn1cccc1CNCc2cccnc2	ZINC000000360294	C(NCc1ccc[nH]1)c2cccnc2
Clc3ccc(Cl)c(c2ccc(C(=O)Nc1ccccc1)o2)c3	ZINC000000271346	O=C(Nc1ccccc1)c3ccc(c2ccccc2)o3
NC(=O)C2CCN(C[C@@H](O)COc1ccc(F)cc1)CC2	ZINC000000118412	C2CCN(CCCOc1ccccc1)CC2
O=c2oc1cccnc1n2CCN3CCCCC3	ZINC000000015441	O=c2oc1cccnc1n2CCN3CCCCC3
NC(=O)c1ccncc1	ZINC000000391130	c1ccncc1
COc3ccc(\C=N\c2c(C)n(C)n(c1ccccc1)c2=O)cc3	ZINC000000061137	O=c2c(N=Cc1ccccc1)c[nH]n2c3ccccc3
O=C(NCCN1CCCC1)c2n[nH]c(=O)c3ccccc23	ZINC000000211519	O=C(NCCN1CCCC1)c2n[nH]c(=O)c3ccccc23
Cc3c(/N=C/c1ccccc1N(=O)=O)c(=O)n(c2ccccc2)n3C	ZINC000000061135	O=c2c(N=Cc1ccccc1)c[nH]n2c3ccccc3
CC1(C)[C@@H](O)C[C@@H]1NCC(=O)NC(N)=O	ZINC000168220453	C1CCC1
C[C@H](C(=O)NC[C@H]1CCCN1)S(C)(=O)=O	ZINC000158401561	C1CCNC1
Cc4ccc(Cn2c(NC(=O)c1ccccc1)nc3ccccc23)cc4	ZINC000000274167	O=C(Nc2nc1ccccc1n2Cc3ccccc3)c4ccccc4
CCOc3ccc2c(C)nc(NC1=NC(C)(C)C=C(C)N1)nc2c3	ZINC000000028976	C3C=CNC(Nc2ncc1ccccc1n2)=N3
OCCNc1n[nH]c(NCCO)c2ncnc12	ZINC000001692108	c2nc1cn[nH]cc1n2
COC(=O)CNC(=O)C[N@]1CC[C@H](O)[C@@H](C)C1	ZINC000186931124	C1CCNCC1
NC(N)=C(N)C(N)=O	ZINC000001627362	nonring
COc2ccc(NC(=O)Nc1cccc(C(F)(F)F)c1)c(OC)n2	ZINC000000111545	O=C(Nc1ccccc1)Nc2cccnc2
CCOC(=O)c2[nH]c1ccc(OC)cc1c2NC(=O)CNC	ZINC000000294041	c2ccc1[nH]ccc1c2
CCC(C)(C)C(=O)Nc1ccc(C(N)=O)cc1	ZINC000000030844	c1ccccc1
CO[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H]1N	ZINC000073402466	C1CCOC1
CC(C)(C)NC[C@@H](O)c1cc(O)cc(O)c1	ZINC000000002281	c1ccccc1
CN1C[C@@H](NC(=O)CN)C(=O)N1	ZINC000307166655	O=C1CCNN1
CNS(=O)(=O)NC2CCN(C[C@@H](O)C[N@]1C[C@H](C)O[C@H](C)C1)CC2	ZINC000463190575	C2CCN(CCCN1CCOCC1)CC2
CNc2nc1[nH]cnc1c(=O)[nH]2	ZINC000000402941	O=c1[nH]cnc2[nH]cnc12
CC[C@@H](C(=O)Nc2ccc1OCOc1c2)c3ccccc3	ZINC000000046830	O=C(Cc1ccccc1)Nc3ccc2OCOc2c3
CS(=O)(=O)N[C@H]2CN(C1CNC1)C(=O)C2	ZINC000725273130	O=C1CCCN1C2CNC2
Fc3ccc(Cc2cnc(NC(=O)c1ccc(Cl)cc1)s2)cc3	ZINC000000134150	O=C(Nc2ncc(Cc1ccccc1)s2)c3ccccc3
Nc4nc(N1CCCCC1)nc(N(c2ccccc2)c3ccccc3)n4	ZINC000000105017	C4CCN(c3ncnc(N(c1ccccc1)c2ccccc2)n3)CC4
O=c3n(Cc1ccccc1)c(c2cccs2)nc4ccccc34	ZINC000000083796	O=c3n(Cc1ccccc1)c(c2cccs2)nc4ccccc34
CC2=NN(C(=O)Cc1ccc(N(=O)=O)cc1)[C@@](C)(O)C2	ZINC000000033256	O=C(Cc1ccccc1)N2CCC=N2
Cc2ccc1ccccc1c2NC(=O)COc3cccc4ccccc34	ZINC000000411593	O=C(COc1cccc2ccccc12)Nc3cccc4ccccc34
COCc2cc(C)nc(SCC(=O)Nc1ccccc1)c2C#N	ZINC000000058321	O=C(CSc1ccccn1)Nc2ccccc2
OC(c3ccc(=C(c1ccccn1)c2ccccn2)c3)(c4ccccn4)c5ccccn5	ZINC000000538243	c5ccc(C(c3ccc(=C(c1ccccn1)c2ccccn2)c3)c4ccccn4)nc5
C[N+](C)(C)C[C@@H](O)CC#N	ZINC000000393601	nonring
Clc3ccc(S[C@@H]2CC(=O)N(Cc1cccnc1)C2=O)cc3	ZINC000000068833	O=C2CC(Sc1ccccc1)C(=O)N2Cc3cccnc3
COc1ccccc1\C=N\c3nc2ccc(Br)cc2s3	ZINC000000050184	C(=Nc2nc1ccccc1s2)c3ccccc3
COc3cccc(c2nnc(c1ccc(OC)c(OC)c1)o2)c3	ZINC000000049374	c3ccc(c2nnc(c1ccccc1)o2)cc3
NCCNC(=O)C(=O)N1CCC[C@@H]1CO	ZINC000042433222	C1CCNC1
NCCNC(=O)C(=O)N1CC[C@@H](O)C1	ZINC000061707656	C1CCNC1
COc2ccc(c1nc(N)nc(N)n1)cc2OC	ZINC000000011431	c2ccc(c1ncncn1)cc2
CC(C)NS(=O)(=O)CCNC(=O)[C@@]1(N)CC[N@@](C)C1	ZINC000643667031	C1CCNC1
Cc3cccc(n2c(=S)[nH]c(=O)c(=Cc1ccc[nH]1)c2=O)c3	ZINC000000045640	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc3ccc[nH]3
CNS(=O)(=O)CCNC(=O)[C@H](C(C)C)N(C)C	ZINC000332432384	nonring
NCCNC(=O)[C@H](N)CC(N)=O	ZINC000041664773	nonring
COc2ccc(C1(CNCC(N)=O)CCCC1)cc2OC	ZINC000000174641	C2CCC(c1ccccc1)C2
N[C@@H]1CCN(CC(=O)NC(N)=O)C1	ZINC000050243810	C1CCNC1
COC(=O)c1ccc(NC(C)=O)cc1O	ZINC000000036681	c1ccccc1
CCCc3nn2c(=N)c(=C/c1ccccc1C)/c(=O)nc2s3	ZINC000000054169	N=c2c(=Cc1ccccc1)c(=O)nc3scnn23
CN(C)S(=O)(=O)c2ccc(NCC[N@]1CC[C@@H](O)C1)c(S(N)(=O)=O)c2	ZINC000624683868	C2CCN(CCNc1ccccc1)C2
CN2CCN(C(=O)c1ccc(N(C)C)cc1)CC2	ZINC000000284879	O=C(N1CCNCC1)c2ccccc2
Nc2cc(N)nc(SCc1ccccn1)n2	ZINC000000411061	C(Sc1ncccn1)c2ccccn2
CC[C@H](C(=O)OC)n3cnc2scc(c1ccc(C)cc1)c2c3=O	ZINC000000098456	O=c2[nH]cnc3scc(c1ccccc1)c23
O=C(CSc1ncnc2[nH]cnc12)c3cccc(N(=O)=O)c3	ZINC000000036757	O=C(CSc1ncnc2[nH]cnc12)c3ccccc3
CCOC(CNCc1cccs1)OCC	ZINC000000164290	c1ccsc1
CC[C@@](C)(O)CN1C[C@H](O)[C@@H](O)C1	ZINC000233964436	C1CCNC1
N[C@@H]1NC(=S)N[C@H]1N	ZINC000090601498	S=C1NCCN1
C[C@@H]2CN(C(=O)C1(O)CNC1)CCS2(=O)=O	ZINC000662612733	O=C(C1CNC1)N2CCS(=O)(=O)CC2
CO[C@H]1OC[C@@H](O)[C@@H](N(C)C)[C@H]1O	ZINC000004973261	C1CCOCC1
COc2ccc1ccccc1c2\C=c4/nc(c3cccc(C)c3)oc4=O	ZINC000000177209	O=c2oc(c1ccccc1)nc2=Cc3cccc4ccccc34
Clc2ccc(CC(=O)Nc1ccccc1C#N)cc2	ZINC000000030755	O=C(Cc1ccccc1)Nc2ccccc2
CC[C@@H](C)[C@@H](NC(=O)c1ccccc1NC(=O)c2ccco2)C(O)=O	ZINC000000351515	O=C(Nc1ccccc1)c2ccco2
C[C@@H]1O[C@H](NC(=O)CCCCCN)[C@@H](O)[C@@H](O)[C@@H]1O	ZINC000022048147	C1CCOCC1
CN[C@@H](C)CNC(=O)[C@@H]1CCCN1C(=O)CNC(C)=O	ZINC000648131778	C1CCNC1
CCOC(=O)c2cnc1ccccc1c2NCCN3CCOCC3	ZINC000000037971	C(CN1CCOCC1)Nc2ccnc3ccccc23
COc3ccc([C@@H]2CC(=O)c1cc(OC)ccc1O2)c(OC)c3	ZINC000000057856	O=C2CC(c1ccccc1)Oc3ccccc23
NCC(=O)N1C[C@H]2[C@H](C1)C(=O)NC2=O	ZINC000306759466	O=C2NC(=O)C1CNCC12
CC(C)(C)NC[C@@H](O)COc1ccccc1c2ccc(NN)nn2	ZINC000000000658	c2ccc(c1cccnn1)cc2
CN(C)S(=O)(=O)c2ccc(N)c(C(=O)N1CCN(C)CC1)c2	ZINC000000001255	O=C(N1CCNCC1)c2ccccc2
NC(=O)CCS(=O)(=O)CCN1CCCC1	ZINC000000188933	C1CCNC1
Cn1c(=O)[nH]cc(CCN)c1=O	ZINC000034927110	O=c1cc[nH]c(=O)[nH]1
COCC[N@]1CCC[C@@H]1CNC(=O)C2=C[C@@H](O)[C@@H](O)[C@H](O)C2	ZINC000668261986	O=C(NCC1CCCN1)C2=CCCCC2
OCCN1C[C@@H]2[C@@H](C1)C(=O)NC2=O	ZINC000409426329	O=C2NC(=O)C1CNCC12
COC(=O)C3[C@@H](c1c[nH]c2ccccc12)[C@@H](C(=O)OC)O[N+]3=O	ZINC000000192327	O=[N+]3CC(c1c[nH]c2ccccc12)CO3
CC(C)[N@@](C)CC(=O)NC[C@@](C)(O)CO	ZINC000332511106	nonring
CN(C)CC(C)(C)CNC1CCN(C(C)=O)CC1	ZINC000000213111	C1CCNCC1
N[C@H]1[C@@H](N)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O	ZINC000084615300	C1CCCCC1
C[C@H](NC(=O)[C@H]1C[C@H](N)C1)C(N)=O	ZINC000662457005	C1CCC1
C/C(CCc2oc1ccccc1c2c3ccc(C)o3)=N\NC(N)=S	ZINC000000089029	c3ccc2c(c1ccco1)coc2c3
CC(=O)Nc3nc2cc1nc(NC(C)=O)sc1cc2s3	ZINC000000040581	c3nc2cc1ncsc1cc2s3
NC(NC[C@H](N)C(O)=O)N=O	ZINC000016051513	nonring
CN(CC(=O)NC[C@@H]1CCCO1)S(=O)(=O)c2ccc(C)cc2	ZINC000000048592	O=C(CNS(=O)(=O)c1ccccc1)NCC2CCCO2
Cn1c(=O)n(C)c(=O)n(C)c1=O	ZINC000000133523	O=c1[nH]c(=O)[nH]c(=O)[nH]1
COC[C@H]1C[C@H](N)[C@H](O)[C@@H](O)[C@@H]1O	ZINC000038190851	C1CCCCC1
CCOc1ccnc(N)c1	ZINC000000332011	c1ccncc1
CC(C)NC[C@@H](O)COc2cccc1CC=Cc12	ZINC000000000389	C1C=Cc2ccccc12
CC[C@@H](N)C2(O)Cc1ccccc1C2	ZINC000000000388	C2Cc1ccccc1C2
O=c3n(c1ccccc1)c(=O)c4n(Cc2ccccc2)[nH][nH]c34	ZINC000000114796	O=c3n(c1ccccc1)c(=O)c4n(Cc2ccccc2)[nH][nH]c34
N[C@@H]1C[C@@H](CO)N(O)C1=O	ZINC000219135033	O=C1CCCN1
C[C@@H](OC(=O)CN)[C@H](N)C(O)=O	ZINC000038202311	nonring
COc3ccc(c1nnsc1NC(=O)c2ccccc2CO)cc3	ZINC000000158039	O=C(Nc1snnc1c2ccccc2)c3ccccc3
NC(=O)C(=[N+]=N)C(N)=O	ZINC000096294904	nonring
C[C@@H]1CNC[C@@H]1NS(N)(=O)=O	ZINC000167414618	C1CCNC1
CN(C)CCCn1c(N)cc(=O)[nH]c1=O	ZINC000013639025	O=c1cc[nH]c(=O)[nH]1
Cn2c(=O)[nH]c(=O)c3n(CCNC1=NCCCCC1)cnc23	ZINC000000093807	O=c3[nH]c(=O)c2n(CCNC1=NCCCCC1)cnc2[nH]3
Fc4ccc(NCc2nc1ccccc1n2Cc3ccccc3)cc4	ZINC000000103918	C(Nc1ccccc1)c3nc2ccccc2n3Cc4ccccc4
CNC(=O)NC(=O)Cn1cc(CN)nn1	ZINC000050224803	c1c[nH]nn1
Cn2ncc(NC(=O)c1ccccc1)c2C(N)=O	ZINC000000040636	O=C(Nc1cn[nH]c1)c2ccccc2
Cc4ccc(CN1CCCn2c1nc3n(C)c(=O)[nH]c(=O)c23)cc4	ZINC000000044024	O=c4[nH]c(=O)c3n2CCCN(Cc1ccccc1)c2nc3[nH]4
C[C@H]1C[N@]([C@@H](C)CNC(=O)[C@@H](CO)NC(N)=O)C[C@@H](C)O1	ZINC000655242652	C1COCCN1
NC[C@@H](O)COCCO	ZINC000019870773	nonring
Cn2c(NN)nc1ccccc1c2=O	ZINC000000292456	O=c1[nH]cnc2ccccc12
O=C2NC[C@@H]1CNCCN12	ZINC000025879473	O=C2NCC1CNCCN12
COc1ccc(Cl)cc1C(=O)NC(C)C	ZINC000000030533	c1ccccc1
C[N@]2CC[C@@](N)(C(=O)N1CCN(CCO)CC1)C2	ZINC000643770535	O=C(C1CCNC1)N2CCNCC2
CNC(NC1CS(=O)(=O)C1)=NN	ZINC000306649687	O=S1(=O)CCC1
COc3ccc(CN[C@@H]2CC(=O)N(c1ccccc1)C2=O)cc3	ZINC000000100392	O=C2CC(NCc1ccccc1)C(=O)N2c3ccccc3
Cc4cccc(N3C(=O)CC(N(C(=O)c1ccco1)c2cccc(C)c2)=C3O)c4	ZINC000000956450	O=C3CC(N(C(=O)c1ccco1)c2ccccc2)=CN3c4ccccc4
COc2ccc(N(C)C(=O)CC1(CC(O)=O)CCCCC1)cc2	ZINC000000217002	O=C(CC1CCCCC1)Nc2ccccc2
COC(=O)CCC(=O)Nc1nccs1	ZINC000000027608	c1cscn1
CCOC(=O)CC(=O)Nc2nc1ccc(Br)cc1s2	ZINC000000040589	c2ccc1scnc1c2
CC2(C)OC(=O)N(n1cnnc1)[C@@]2(C)O	ZINC000000225500	O=C1OCCN1n2cnnc2
NC(=N)S[C@@H]1CS(=O)(=O)C[C@@H]1O	ZINC000004336692	O=S1(=O)CCCC1
NS(=O)(=O)c2ccc(NCC(=O)N1CCNCC1)c(N(=O)=O)c2	ZINC000319698965	O=C(CNc1ccccc1)N2CCNCC2
COc1cc(C(=O)N(CC#N)CC#N)cc(OC)c1OC	ZINC000000030223	c1ccccc1
Cn1cnnc1SCC(=O)Nc2cccc3ccccc23	ZINC000000034232	O=C(CSc1nnc[nH]1)Nc2cccc3ccccc23
C[C@@H]1C[N@@](CC(C)(C)O)CCN1C(=O)CCNC(N)=O	ZINC000186902783	C1CNCCN1
COc1ccccc1C(=O)Nc2nc(C)c(C(C)=O)s2	ZINC000000035639	O=C(Nc1nccs1)c2ccccc2
Nc2n[nH]c3c(c1ccc(F)cc1)[nH][nH]n23	ZINC000000038200	c3ccc(c1[nH][nH]n2cn[nH]c12)cc3
COc3ccc(c2n\c(=C\C(C)=C/c1ccccc1)c(=O)o2)cc3OC	ZINC000000431139	O=c2oc(c1ccccc1)nc2=CC=Cc3ccccc3
CCN(CC)Cc1csc(C(N)=O)c1	ZINC000000312687	c1ccsc1
Cc2ccc(C[n+]1cccc(C(N)=O)c1)cc2	ZINC000000160601	C(c1ccccc1)[n+]2ccccc2
O=C3C(C#N)=C1CCCC[C@@H]1[C@@H](c2ccco2)C3(C#N)C#N	ZINC000000028107	O=C3CC(c1ccco1)C2CCCCC2=C3
Fc3ccc(/N=C/c2ccc(OC(=O)c1cccs1)cc2)cc3	ZINC000000064518	O=C(Oc2ccc(C=Nc1ccccc1)cc2)c3cccs3
COc2ccc(NC(=O)[C@@H]1CSC(C)(C)N1C=O)cc2	ZINC000000047643	O=C(Nc1ccccc1)C2CSCN2
NC2=NC(=O)C1(CCNCC1)N2	ZINC000042384248	O=C1N=CNC12CCNCC2
O=C(Oc1ccc3c(c1)oc(=O)c2ccccc23)\C=C\c4ccccc4	ZINC000000146173	O=C(Oc1ccc3c(c1)oc(=O)c2ccccc23)C=Cc4ccccc4
CN(CC(=O)NC[C@@H]1C[C@H](F)CN1)C(C)=O	ZINC000648140792	C1CCNC1
N[C@H]1COCCN1S(N)(=O)=O	ZINC000167499644	C1COCCN1
CCOC(=O)c3ccc2ncc(C(=O)c1ccccc1)c(O)c2c3	ZINC000000248705	O=C(c1ccccc1)c3cnc2ccccc2c3
CN1CCN(NC(N)=NN)CC1	ZINC000148136952	C1CNCCN1
CNS(=O)(=O)NCC(=O)NC[C@H]1C[C@@H](N(C)C)C1	ZINC000655245807	C1CCC1
Cn2c([n+]1ccccc1)c(\C=N\NC(N)=S)sc2=O	ZINC000000206759	O=c2[nH]c([n+]1ccccc1)cs2
CNC[C@@H](O)CO	ZINC000004283843	nonring
OCC(CO)NCC(=O)NCc1cccc(C#N)c1	ZINC000577646730	c1ccccc1
OCCN(CCO)C[C@@H](O)C23CC1CC(CC(C1)C2)C3	ZINC000000135319	C1C2CC3CC1CC(C2)C3
C[C@]45CC[C@H]2[C@H](CCc3cc(OC(=O)c1ccccc1)ccc23)[C@H]4CC[C@@H]5O	ZINC000000622255	O=C(Oc4ccc3C2CCC1CCCC1C2CCc3c4)c5ccccc5
O=C(Cn2cnc1ccccc1c2=O)c3ccccc3N(=O)=O	ZINC000000042188	O=C(Cn2cnc1ccccc1c2=O)c3ccccc3
COC(=O)[C@H]2CCc3sc(NC(=O)COc1ccccc1)c(C(=O)OC)c23	ZINC000000622257	O=C(COc1ccccc1)Nc3cc2CCCc2s3
N[C@@H]1NC[C@H](C#N)[C@@H](N)N1	ZINC000019327154	C1CNCNC1
Cc3c(Cc1ccccc1)sc(/N=C/c2ccc(Cl)cc2)c3C(N)=O	ZINC000000671964	C(c1ccccc1)c3ccc(N=Cc2ccccc2)s3
COc3ccc(C(=O)COc2ccc1c(C)cc(=O)oc1c2)cc3	ZINC000000049564	O=C(COc2ccc1ccc(=O)oc1c2)c3ccccc3
O[C@@H]3CC[N@@](Cc1ccccc1CNC(=O)C2=C[C@@H](O)[C@@H](O)[C@H](O)C2)C3	ZINC000646956535	O=C(NCc1ccccc1CN2CCCC2)C3=CCCCC3
C[C@H](N1CCC[C@@H](C(=O)NCCN)C1)C(=O)NC(N)=O	ZINC000221175372	C1CCNCC1
CC2CCN(CN1C(=O)CCC1=O)CC2	ZINC000000298732	O=C1CCC(=O)N1CN2CCCCC2
CC(C)N(C(C)C)C(=O)c3ccc(c2nc1ccccc1s2)cc3	ZINC000000049561	c3ccc(c2nc1ccccc1s2)cc3
Nc3ncc(Cc2ccc1OCOc1c2)c(N)n3	ZINC000000010465	C3Oc2ccc(Cc1cncnc1)cc2O3
COc2cc(Cc1cnc(N)nc1N)ccc2OCc3ccccc3	ZINC000000010466	C(Oc2ccc(Cc1cncnc1)cc2)c3ccccc3
COc4ccc(c3c2COc1ccccc1c2[nH]c(=O)c3C#N)cc4	ZINC000000383356	O=c4cc(c1ccccc1)c3COc2ccccc2c3[nH]4
NC(=O)C2CN([C@@H]1CNC[C@@H]1O)C2	ZINC000307379007	C2CN(C1CCNC1)C2
COc3ccc(c2nc(C(=O)Nc1nn[nH]n1)cs2)cc3	ZINC000000002384	O=C(Nc1nn[nH]n1)c3csc(c2ccccc2)n3
COC(=O)c3nn2cc(c1n[nH]cc1N(=O)=O)cnc2c3Cl	ZINC000000032049	c3cc2ncc(c1cc[nH]n1)cn2n3
CCOC(=O)c3sc2nc(C)nc(N1CCCC[C@H]1CC)c2c3C	ZINC000000109455	C3CCN(c1ncnc2sccc12)CC3
CNC(=O)NC(=O)[C@@H](C)NC[C@@H](C)O	ZINC000035101827	nonring
CC(C)N2C[C@@H](NC(=O)C(=O)NC1CNC1)CC2=O	ZINC000562827846	O=C2CC(NC(=O)C(=O)NC1CNC1)CN2
N[C@@H](CS(N)(=O)=O)C(N)=O	ZINC000075555109	nonring
NC(=O)CN[C@@H]1CNOC1	ZINC000575570836	C1CNOC1
COC(=O)[C@@H]1CS[C@H](C(=O)OC)N1C(=O)Nc2ccccc2	ZINC000000041502	O=C(Nc1ccccc1)N2CCSC2
CN(C)C[C@@](C)(O)CNC(=O)[C@@H]1CCCN(S(N)(=O)=O)C1	ZINC000646938015	C1CCNCC1
COC(=O)[C@@H](NS(=O)(=O)c1ccccc1)C(C)C	ZINC000000049985	c1ccccc1
CC(C)NC(=O)N[C@@]2(C(F)(F)F)Oc1ccc(Cl)cc1O2	ZINC000000045421	C2Oc1ccccc1O2
CC(C)C[C@@H](N)C(=O)NO	ZINC000000403009	nonring
N=C2N[C@@H]1CS(=O)(=O)C[C@@H]1S2	ZINC000009356844	N=C2NC1CS(=O)(=O)CC1S2
NCC(=O)NCC(=O)Nc1ncccc1O	ZINC000125057341	c1ccncc1
CCOC(=O)C1=C(CN(CC)CC)N(C)C(=O)N[C@@H]1c2ccccc2	ZINC000000033404	O=C2NC=CC(c1ccccc1)N2
COc3ccc([C@H](O)c2nc1ccccc1n2C(C)C)cc3	ZINC000000052728	C(c1ccccc1)c3nc2ccccc2[nH]3
CCOC(=O)Cc2csc(NC(=O)COc1c(C)cccc1C)n2	ZINC000000118047	O=C(COc1ccccc1)Nc2nccs2
O=C2C[C@@H](N1CCNCC1)C(=O)N2	ZINC000036853572	O=C2CC(N1CCNCC1)C(=O)N2
O=C(CSc2nc1ccccc1s2)Nc3ccncc3	ZINC000000033408	O=C(CSc2nc1ccccc1s2)Nc3ccncc3
CNC(=O)[C@@H](C)NC(=O)[C@@H]1CCN[C@H]1C	ZINC000309614338	C1CCNC1
Clc3ccc(NC(=O)c1ccccc1c2ccccc2)nc3	ZINC000000058352	O=C(Nc1ccccn1)c2ccccc2c3ccccc3
OC3(C(=O)N2CCN([C@@H]1CCNC1)CC2)CNC3	ZINC000662781494	O=C(C1CNC1)N3CCN(C2CCNC2)CC3
Cc3cc(C)c(\C=N\c1ccccc1C(=O)Nc2ccccc2)c(C)c3	ZINC000000046515	O=C(Nc1ccccc1)c2ccccc2N=Cc3ccccc3
CS(=O)(=O)Nc1ccc(F)c([C@@H](O)CN)c1	ZINC000000005703	c1ccccc1
NC[C@@H]1CNCCO1	ZINC000001296004	C1COCCN1
Cc3ccc(O)c(Nc2c(Cl)c(=O)n(Cc1ccccc1)c2=O)c3	ZINC000000144903	O=c2cc(Nc1ccccc1)c(=O)n2Cc3ccccc3
NCCN1CCNC1=S	ZINC000001295975	S=C1NCCN1
COc2ccc(C(=O)C(C)=NOC(=O)Nc1cccc(Cl)c1)cc2	ZINC000000381331	O=C(Nc1ccccc1)ON=CC(=O)c2ccccc2
O=C(CSC1=NCCS1)Nc3sc2CCCCc2c3C#N	ZINC000000033221	O=C(CSC1=NCCS1)Nc3cc2CCCCc2s3
Cc3nc2n(c1ccccc1)ncc2c(=O)n3Cc4ccccc4	ZINC000000049186	O=c3n(Cc1ccccc1)cnc4n(c2ccccc2)ncc34
Cc2cc(C)c(NC(=O)c1ccccc1Br)c(C)c2	ZINC000000038835	O=C(Nc1ccccc1)c2ccccc2
Fc4ccc([C@@H]2OC(=O)C1(CCCCC1)C(=O)C23CCCCC3)cc4	ZINC000000089802	O=C3OC(c1ccccc1)C2(CCCCC2)C(=O)C34CCCCC4
C[C@@H]1CCc2c(C1)sc3nc(SCC(C)=C)n(CC=C)c(=O)c23	ZINC000000506960	O=c2[nH]cnc3sc1CCCCc1c23
CN2C[C@@H](NC(=O)[C@@H]1COCCN1)CC2=O	ZINC000261585825	O=C2CC(NC(=O)C1COCCN1)CN2
N[C@H]1COC[C@@H]1N	ZINC000034241163	C1CCOC1
C[C@H](Oc1ccc(Cl)cc1)c2ccnc3ncnn23	ZINC000000019929	C(Oc1ccccc1)c2ccnc3ncnn23
Cc2ccc(C)c(C(=O)COC(=O)c1nonc1N)c2	ZINC000000052434	O=C(COC(=O)c1cnon1)c2ccccc2
CCN(CC)c2ccc(\C=N\n1c(C)cc(C)c(C#N)c1=O)c(O)c2	ZINC000000038930	O=c1ccccn1N=Cc2ccccc2
CCOc2ccc(S(=O)(=O)Nc1cc(OC)c(Cl)cc1OC)cc2	ZINC000000644520	O=S(=O)(Nc1ccccc1)c2ccccc2
O[C@H]1CNC[C@H]1CNC(=O)Cn2c(=O)[nH]c(=O)c3ccccc23	ZINC000647041231	O=C(Cn1c(=O)[nH]c(=O)c2ccccc12)NCC3CCNC3
OC(=O)c2cc(Cl)cn(Cc1ccc(Cl)cc1Cl)c2=O	ZINC000000170489	O=c1ccccn1Cc2ccccc2
Cc3ccc(S(=O)(=O)N1CCC[C@@H]1C(=O)N2CCCC2)cc3	ZINC000000005148	O=C(C1CCCN1S(=O)(=O)c2ccccc2)N3CCCC3
NC(=N)N[C@@H]1NCC(=O)S1	ZINC000031648972	O=C1CNCS1
NC(=N)NCCNC(=O)Cc1n[nH]c(=O)c2ccccc12	ZINC000002904403	O=c1[nH]ncc2ccccc12
C[C@@H]1CN(CCNC(=O)CCNS(C)(=O)=O)C[C@@H](C)O1	ZINC000042475928	C1COCCN1
Cc3ccc(n2c(=O)c(Cl)c(Nc1cccc(C)c1C)c2=O)cc3	ZINC000000121632	O=c2cc(Nc1ccccc1)c(=O)n2c3ccccc3
C[C@@H](CN)NS(N)(=O)=O	ZINC000167387219	nonring
NCC(=O)NCC(=O)N[C@@H]1CN2CCC1CC2	ZINC000037623154	C1CN2CCC1CC2
Cc4cc(C)cc(NS(=O)(=O)c3ccc(n2c(=O)c1ccccc1c2=O)cc3)c4	ZINC000000674130	O=c3n(c2ccc(S(=O)(=O)Nc1ccccc1)cc2)c(=O)c4ccccc34
N[C@@H](O)[C@@H]1O[C@H](CO)[C@@H](O)[C@@H]1O	ZINC000575448081	C1CCOC1
C[C@H](O)[C@H](O)C(=O)CN	ZINC000044171335	nonring
C[C@@H](N)CC(=O)N1CCC[C@@H]1C(N)=O	ZINC000037476051	C1CCNC1
CNS(=O)(=O)NCC(=O)N[C@@H]1CCC[C@@H]1[N@]2CC[C@@H](O)C2	ZINC000644230233	C2CCC(N1CCCC1)C2
CCOC(=O)C2=C(C)N(Cc1ccccc1)C(=O)[C@@H]2CC(O)=O	ZINC000000135766	O=C1CC=CN1Cc2ccccc2
Cc4ccc(n2c1CCCCc1c(=S)nc2c3ccccc3)cc4	ZINC000000194618	S=c4nc(c1ccccc1)n(c2ccccc2)c3CCCCc34
CCOC[C@@H](O)CN2CCN(C(=O)[C@@H]1CC(=O)NC(=O)N1)CC2	ZINC000668381167	O=C2CC(C(=O)N1CCNCC1)NC(=O)N2
Nc2nnc(CCN1CCCCC1)s2	ZINC000000098442	C2CCN(CCc1nncs1)CC2
NC(=O)CCN[C@@H]1CS(=O)(=O)C[C@@H]1O	ZINC000037692855	O=S1(=O)CCCC1
C[C@@H](NC(=O)C(=O)NCCNC(=O)c1cnccn1)C2=CC[N@@](C)CC2	ZINC000557276540	O=C(NCCNC(=O)c1cnccn1)C(=O)NCC2=CCNCC2
Cc1n[nH]c(=O)n(N)c1=O	ZINC000016249017	O=c1cn[nH]c(=O)[nH]1
CC(=O)NC[C@@H]3CN(c2ccc(N1CCOCC1)c(F)c2)C(=O)O3	ZINC000000001622	O=C1OCCN1c3ccc(N2CCOCC2)cc3
CN(CC(C)(C)CN)S(N)(=O)=O	ZINC000167532080	nonring
Cc1cc(C(N)=O)oc(=O)c1	ZINC000000107456	O=c1cccco1
CCOC(=O)c2csc(COc1cc(Cl)cc(Cl)c1)n2	ZINC000000120726	C(Oc1ccccc1)c2nccs2
CCOC(CNCc1ccccc1)OCC	ZINC000000164289	c1ccccc1
COc3ccc(OC)c2C[C@@H](Nc1ccc(O)cc1)CCc23	ZINC000000009654	C2Cc1ccccc1CC2Nc3ccccc3
OC(=O)C[C@@H](NS(=O)(=O)c1cccs1)c2ccccc2	ZINC000000094306	O=S(=O)(NCc1ccccc1)c2cccs2
COC(=O)Nc1cccc(C)c1COc2cccn3c(CC#C)c(C)nc23	ZINC000000596687	C(Oc1cccn2ccnc12)c3ccccc3
COc3ccc([C@H]2N(c1ccc(C)cc1)C(=O)C(O)=C2C(C)=O)cc3	ZINC000000070765	O=C2C=CC(c1ccccc1)N2c3ccccc3
CCC1CCC(N(CCO)CCO)CC1	ZINC000000213211	C1CCCCC1
CCN(CC)c1ccc(C=NNC(N)=NN(=O)=O)cc1	ZINC000000247755	c1ccccc1
O[C@@H]1C[C@@H]3N(C1)C(=O)[C@H]2CNCCN2C3=O	ZINC000014533583	O=C3C1CCCN1C(=O)C2CNCCN23
CC(C)(C)n3c(=O)c2ccc(C(=O)Nc1nccs1)cc2c3=O	ZINC000000036787	O=C(Nc1nccs1)c3ccc2c(=O)[nH]c(=O)c2c3
C[C@H]2C[N@@](C[C@@H]1CCCO1)CC[C@H]2NC(=O)CNC(=O)CNC(C)=O	ZINC000363660888	C2CCN(CC1CCCO1)CC2
Cn2c(=O)n(C)c1nc(CO)cnc1c2=O	ZINC000000337818	O=c2[nH]c(=O)c1nccnc1[nH]2
CC(C)NC[C@@H](O)c1ccc(NS(C)(=O)=O)cc1	ZINC000000004166	c1ccccc1
C[C@@H]1CN(C(=O)CNC(=O)CN)CCO1	ZINC000037481658	C1COCCN1
CC(C)(C)c2ccc(OCc1nnc(SCC(O)=O)o1)cc2	ZINC000000418615	C(Oc1ccccc1)c2nnco2
CC(C)c2oc1cc(O)ccc1c(=O)c2c4nc3ccccc3n4C	ZINC000000045189	O=c3c(c2nc1ccccc1[nH]2)coc4ccccc34
Cc3cccc4c(C(=O)Nc1ccccc1)cc(c2ccccc2)nc34	ZINC000000045182	O=C(Nc1ccccc1)c3cc(c2ccccc2)nc4ccccc34
N[C@@H]1CO[C@H]2[C@H]1CC(=O)NC2=O	ZINC000082401147	O=C2CC1CCOC1C(=O)N2
NCC(=O)N2CC(S(=O)(=O)N1CCNCC1)C2	ZINC000648178352	O=S(=O)(C1CNC1)N2CCNCC2
COC(=O)C1=C(C)NC(=O)N(C(C)=O)[C@@H]1c2ccc(OC)c(OC)c2	ZINC000000037896	O=C2NC=CC(c1ccccc1)N2
NCC[C@@H](O)CO	ZINC000034273814	nonring
COc3cc2NC(=O)C[C@H](c1cccc(OC)c1OC)c2cc3OC	ZINC000000094949	O=C3CC(c1ccccc1)c2ccccc2N3
Cc3ccc(n1nnnc1SCc2c(F)cccc2Cl)c(C)c3	ZINC000000066291	C(Sc1nnnn1c2ccccc2)c3ccccc3
C(Oc2ccc(\C=N\n1cnnc1)cc2)c3cccc4ccccc34	ZINC000000048583	C(Oc2ccc(C=Nn1cnnc1)cc2)c3cccc4ccccc34
CN([C@H]1CNC(=NC(N)=O)NC1=O)C(=O)C[C@@H](N)CCCO	ZINC000026499021	N=C1NCCC(=O)N1
CC(C)O[C@@]2(O)C(=O)c1ccccc1C(=O)[C@]2(O)OC(C)C	ZINC000000036943	O=C1CCC(=O)c2ccccc12
Cc2sc(NC(=O)c1ccccc1C(O)=O)nc2c3ccccc3	ZINC000000105824	O=C(Nc2nc(c1ccccc1)cs2)c3ccccc3
NC[C@H](O)[C@H](O)C=C	ZINC000036447740	nonring
Fc4ccc(CSc1nnnn1c2cccc3ccccc23)cc4	ZINC000000060574	C(Sc1nnnn1c2cccc3ccccc23)c4ccccc4
C[N@@](CCNC(=O)C1(S(N)(=O)=O)CC1)C2CC2	ZINC000568014433	O=C(NCCNC1CC1)C2CC2
CC4CCN(c2nc(c1ccc(N(=O)=O)cc1)nc3ccccc23)CC4	ZINC000000072046	C4CCN(c2nc(c1ccccc1)nc3ccccc23)CC4
CCOC(=O)c1c(C)[nH]sc1=NC(=O)Oc2ccccc2	ZINC000000126360	O=C(Oc1ccccc1)N=c2cc[nH]s2
OCCn2c(SCc1ccccc1)nc3ccccc23	ZINC000000037780	C(Sc2nc1ccccc1[nH]2)c3ccccc3
NC(=O)[C@@H]1CCC[C@@H](C(N)=O)N1	ZINC000014657986	C1CCNCC1
Oc1c(Cl)cc(Cl)cc1\C=N\c2ccccc2C(=O)NCc3cccnc3	ZINC000001744051	O=C(NCc1cccnc1)c2ccccc2N=Cc3ccccc3
CCOc1ccccc1n3c(=O)[nH]c(=O)c(=Cc2ccc[nH]2)c3=O	ZINC000000092039	O=c2[nH]c(=O)c(=Cc1ccc[nH]1)c(=O)n2c3ccccc3
C[C@H](NC(=O)c2ccc(C)c(S(=O)(=O)Nc1ccc(C)cc1C)c2)c3ccccc3	ZINC000001073054	O=C(NCc1ccccc1)c3cccc(S(=O)(=O)Nc2ccccc2)c3
C[C@]3(O)CC(=O)C(=C(O)c1ccccc1)[C@@H](c2ccc(F)cc2)[C@@H]3C(=O)c4ccccc4	ZINC000000860865	O=C3CCC(C(=O)c1ccccc1)C(c2ccccc2)C3=Cc4ccccc4
Cc4ccc3CCN(c1ncnc2[nH]ccc12)c3c4	ZINC000000009930	C2Cc1ccccc1N2c3ncnc4[nH]ccc34
NS(=O)(=O)c2cc(C(O)=O)c(NCc1ccco1)cc2Cl	ZINC000000035804	C(Nc1ccccc1)c2ccco2
CN1CCC[C@H]1CNC(N)=NN	ZINC000226060247	C1CCNC1
NC[C@@H]1CNC(=O)C(=O)N1	ZINC000042920684	O=C1NCCNC1=O
Ic2ccc(/N=C/c1ccc[nH]1)cc2	ZINC000000046195	C(=Nc1ccccc1)c2ccc[nH]2
NC(=O)[C@@H]1C[C@@H](O)CN1C2CNC2	ZINC000306345180	C2CCN(C1CNC1)C2
NC(=O)[C@@H]1[C@H](O)[C@H]2CC[C@@H]1C2	ZINC000000173593	C1CC2CCC1C2
CC(=O)c2cc(Nc1cc(C)n(C)c(=N)n1)cc(C(C)=O)c2	ZINC000000006768	N=c2nc(Nc1ccccc1)cc[nH]2
NC(=N)NC(=N)Nc1cnccn1	ZINC000031687694	c1cnccn1
Clc2cc1[nH]c(=O)c(=O)[nH]c1cc2n3cccc3	ZINC000000017999	O=c3[nH]c2ccc(n1cccc1)cc2[nH]c3=O
COc3cccc(C(=O)Nc2nc1ccccc1s2)c3	ZINC000000030033	O=C(Nc2nc1ccccc1s2)c3ccccc3
CC(C)[C@@](C)(NC(=O)c1cccnc1Oc2ccc(F)cc2)C(N)=O	ZINC000000052207	O(c1ccccc1)c2ccccn2
CC1(C)[C@H]2CC=C(CN(CCO)CCO)[C@@H]1C2	ZINC000000217766	C1C=CC2CC1C2
CCC(=O)NS(=O)(=O)c1cnccc1Nc2cccc(C(F)(F)F)c2	ZINC000000537777	N(c1ccccc1)c2ccncc2
O[C@@H]2CO[C@H](c1ccc(Cl)cc1)O[C@H]2c3ccc(N(=O)=O)cc3	ZINC000000085106	C3CC(c1ccccc1)OC(c2ccccc2)O3
CC(=O)c2cc(C#N)c(SCC(=O)Nc1cccc(C)c1)nc2C	ZINC000000048901	O=C(CSc1ccccn1)Nc2ccccc2
COc1cc(SC)ccc1C(=O)Nc2cccnc2	ZINC000000039008	O=C(Nc1cccnc1)c2ccccc2
CCc3ccc(c2cn1CCSc1n2)cc3	ZINC000000027925	C3Cn2cc(c1ccccc1)nc2S3
Cc1nn(C)cc1C[N@]2C[C@H](O)[C@H](O)C2	ZINC000332695274	C2CCN(Cc1cn[nH]c1)C2
NC(=O)C[N@]2CCC[C@@H](C(=O)NCCc1c[nH]c(=O)[nH]c1=O)C2	ZINC000091755579	O=C(NCCc1c[nH]c(=O)[nH]c1=O)C2CCCNC2
CN1CC2CN(C)CC(C1)C2(N)C(N)=O	ZINC000034478268	C1NCC2CNCC1C2
COc4cc(C2N(c1ccccc1)CCN2c3ccccc3)ccc4O	ZINC000000043203	C3CN(c1ccccc1)C(c2ccccc2)N3c4ccccc4
CCOC(=O)c2cnc1c(C)cccc1c2Nc3ccc(O)cc3	ZINC000000081004	N(c1ccccc1)c2ccnc3ccccc23
OCC[N@@](CC(=O)NC(=O)NC1CC1)C2CC2	ZINC000048065425	O=C(CNC1CC1)NC(=O)NC2CC2
NN=C(N)NCCNC(N)=O	ZINC000158811417	nonring
OC(=O)[C@@](Cc1ccccc1)(Cc2ccc(O)cn2)NC(=O)c3ccccc3	ZINC000000587797	O=C(NC(Cc1ccccc1)Cc2ccccn2)c3ccccc3
N[C@H]([C@@H]1CS(=O)(=O)C[C@@H]1O)C(N)=O	ZINC000575465551	O=S1(=O)CCCC1
CC(C)(C)[C@H](NS(C)(=O)=O)C(=O)NC[C@@H]1CNC[C@@H]1O	ZINC000647038367	C1CCNC1
Clc3ccc(CNc1ncnc2ccc(Br)cc12)cc3	ZINC000000401160	C(Nc1ncnc2ccccc12)c3ccccc3
Nc2ccc(OCC(=O)N1CCOCC1)cc2	ZINC000000052111	O=C(COc1ccccc1)N2CCOCC2
Clc2ccc([C@H](CC(=O)c1ccc(Cl)s1)C(C#N)C#N)cc2	ZINC000000388888	O=C(CCc1ccccc1)c2cccs2
COc3cc(NS(=O)(=O)c1ccccc1)c2ncccc2c3	ZINC000000338306	O=S(=O)(Nc1cccc2cccnc12)c3ccccc3
ONC(=O)CS(=O)(=O)c1ccc(Cl)cc1	ZINC000000096313	c1ccccc1
Fc3ccc(NC(=O)C[C@@H]2Nc1ccccc1NC2=O)cc3	ZINC000000046779	O=C(CC2Nc1ccccc1NC2=O)Nc3ccccc3
CC(=O)N[C@@H]1C[C@H]1N	ZINC000036234699	C1CC1
CN(C)C(=O)[C@@H](N)CCS(C)(=O)=O	ZINC000019429847	nonring
Nc3nc2[nH]cc(CN[C@H]1C=C[C@@H](O)[C@@H]1O)c2c(=O)[nH]3	ZINC000006622452	O=c2[nH]cnc3[nH]cc(CNC1CCC=C1)c23
Fc1cccc(Cl)c1COc3ccc(\C=N\n2cnnc2)cc3	ZINC000000049401	C(Oc2ccc(C=Nn1cnnc1)cc2)c3ccccc3
O=C(CSc2ncnc3sc1CCCCc1c23)c4ccccc4	ZINC000000116687	O=C(CSc2ncnc3sc1CCCCc1c23)c4ccccc4
Clc3cc2nc(C(=O)NS(=O)(=O)c1ccccc1)c(=O)[nH]c2cc3Cl	ZINC000000605478	O=C(NS(=O)(=O)c1ccccc1)c3nc2ccccc2[nH]c3=O
NC(=N)NC(=N)NCc1nn[nH]n1	ZINC000215767452	c1nn[nH]n1
C[C@@H](Oc3ccc(C=c2c(=O)c1ccccc1c2=O)cc3)C(O)=O	ZINC000000119322	O=c2c(=Cc1ccccc1)c(=O)c3ccccc23
Clc3ccc(OCc2nc(c1ccccn1)no2)c(Cl)c3	ZINC000000080685	C(Oc1ccccc1)c3nc(c2ccccn2)no3
COC(=O)c1c(C)c(C)sc1NC(=O)COc2cccc(C)c2C	ZINC000000035156	O=C(COc1ccccc1)Nc2cccs2
Cc4cc(NC(=O)CSc2ncnc3sc1CCCc1c23)no4	ZINC000000038301	O=C(CSc2ncnc3sc1CCCc1c23)Nc4ccon4
NC(=O)[C@@H]1CN(CCO)CCN1	ZINC000231505091	C1CNCCN1
Clc2ccc(S(=O)(=O)N/N=C/c1ccsc1)s2	ZINC000000095950	O=S(=O)(NN=Cc1ccsc1)c2cccs2
Clc3ccc(C(=O)N2CCC(C(=O)c1ccccc1)CC2)cc3	ZINC000000110147	O=C(C2CCN(C(=O)c1ccccc1)CC2)c3ccccc3
N[C@H]1C=C[C@H](O)[C@@H]1O	ZINC000038338380	C1CC=CC1
O=C2C[C@@H](NC(=O)C1CNC1)CN2	ZINC000229091820	O=C2CC(NC(=O)C1CNC1)CN2
NC(=N)N(CCO)CCO	ZINC000034753297	nonring
O=C3C(=C/c1cccs1)\[C@H](c2ccccc2)Oc4ccccc34	ZINC000000084858	O=C3C(=Cc1cccs1)C(c2ccccc2)Oc4ccccc34
COC(=O)CNC(=O)CN(C)C	ZINC000219454667	nonring
Nc1nc(N)nc(N(CO)CO)n1	ZINC000038612163	c1ncncn1
CO[C@@H]1O[C@H](CN)C[C@H](O)[C@H]1O	ZINC000039089956	C1CCOCC1
COc2nc(NN)nc(N1CCCCC1)n2	ZINC000000109026	C2CCN(c1ncncn1)CC2
Oc3cccc4c(=CCCc1ccccc1)c2cccc(O)c2c(=O)c34	ZINC000000019539	O=c3c1ccccc1c(=CCCc2ccccc2)c4ccccc34
COC(=O)CCNC(=O)N1CCNCC1	ZINC000011866594	C1CNCCN1
CCN(CC)CC(=O)N2CCN(C(=O)[C@@H]1CC(=O)NC(=O)N1)CC2	ZINC000668233418	O=C2CC(C(=O)N1CCNCC1)NC(=O)N2
CCn2c(=S)sc3c(=O)[nH]c(c1cccs1)nc23	ZINC000000111050	O=c2[nH]c(c1cccs1)nc3[nH]c(=S)sc23
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
C[C@@]12CC=CC[C@@H]1C(=O)N(CCO)C2=O	ZINC000000376831	O=C2NC(=O)C1CC=CCC12
Cn1cnc2[nH]c(=O)n(C)c(=O)c12	ZINC000000120234	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
COc3cc(\C=N\n1nnnc1Nc2ccccc2)cc(OC)c3O	ZINC000000028003	N(c1ccccc1)c2nnnn2N=Cc3ccccc3
CC(=O)N2N=C(c1ccc(Cl)cc1Cl)OC23CCCC3	ZINC000000039268	C1CCC3(C1)NN=C(c2ccccc2)O3
NC(=N)c3ccc(N2CCN(C1CCN(CC(O)=O)CC1)CC2)cc3	ZINC000000005719	C3CC(N2CCN(c1ccccc1)CC2)CCN3
Cc1ccccc1c4nnc(c3ccc(c2ccccc2)cc3)o4	ZINC000000050136	c4ccc(c3ccc(c2nnc(c1ccccc1)o2)cc3)cc4
Cn2c(=O)oc3cc(S(=O)(=O)Nc1ccccc1F)ccc23	ZINC000000035202	O=c3[nH]c2ccc(S(=O)(=O)Nc1ccccc1)cc2o3
CNC[C@@H](O)COc1ccc(Cl)c(C)c1	ZINC000000227598	c1ccccc1
Cc3cc(C)c(SCC(=O)NCc2ccc1OCOc1c2)c(C)c3	ZINC000000152034	O=C(CSc1ccccc1)NCc3ccc2OCOc2c3
CCC(=O)Nc2nc(C)cc3c1ccccc1oc(=O)c23	ZINC000000035209	O=c2oc1ccccc1c3ccncc23
CC[C@@H](Sc2nc1ccccc1[nH]2)C(=O)Nc3nnc(C)s3	ZINC000000033301	O=C(CSc2nc1ccccc1[nH]2)Nc3nncs3
C[N+](C)(C)CCNC(=O)c2cc[n+](Cc1ccccc1)c(\C=N\O)c2	ZINC000000307025	C(c1ccccc1)[n+]2ccccc2
Cc3ccc(NC(=O)c2cc1cc(Cl)cc(Cl)c1oc2=O)cc3	ZINC000000192834	O=C(Nc1ccccc1)c3cc2ccccc2oc3=O
COc2ccc(CNC[C@@]1(O)CCOC(C)(C)C1)cc2	ZINC000000171758	C2CC(CNCc1ccccc1)CCO2
CC(C)c3nnc(SCC(=O)Nc2ccc1OCCOc1c2)n3C	ZINC000000410622	O=C(CSc1nnc[nH]1)Nc3ccc2OCCOc2c3
Cn1nc(N)c(CN)n1	ZINC000001576571	c1cn[nH]n1
OC[C@@H](O)COC(=O)c1ccccc1Nc2ccnc3cc(Cl)ccc23	ZINC000000607910	N(c1ccccc1)c2ccnc3ccccc23
CC(C)N(CNC(=O)c1cccnc1)c3c(C)n(C)n(c2ccccc2)c3=O	ZINC000000538089	O=C(NCNc2c[nH]n(c1ccccc1)c2=O)c3cccnc3
COc1cccc(OC)c1OC[C@@H](O)CN[C@@H](C)c2ccccc2	ZINC000000166988	C(CNCc1ccccc1)COc2ccccc2
NCCSc1nncc(=O)n1N	ZINC000020396650	O=c1cnnc[nH]1
C[C@@H](N)CNC(=O)c1ccnc(S(N)(=O)=O)c1	ZINC000648129059	c1ccncc1
N[C@@H](CO)C(=O)N[C@H](Cc1ccccc1)C(N)=O	ZINC000004760569	c1ccccc1
NS(=O)(=O)CN1CCNCC1	ZINC000145524086	C1CNCCN1
CN(C)C(=O)CNC(=O)[C@@H]1CNCCO1	ZINC000043707983	C1COCCN1
Fc2cc(Cl)c(C(=O)NC1CCCCCCC1)cc2F	ZINC000000046987	O=C(NC1CCCCCCC1)c2ccccc2
C[N+](C)(C)C[C@H](O)CSc1nnnn1c2ccccc2	ZINC000000402524	c2ccc(n1cnnn1)cc2
O=C(COCC(=O)NC1CCCCC1)NC2CCCCC2	ZINC000000046980	O=C(COCC(=O)NC1CCCCC1)NC2CCCCC2
Cc1ccccc1Nc3nc(c2ccc(C)c(N(=O)=O)c2)cs3	ZINC000000028955	N(c1ccccc1)c3nc(c2ccccc2)cs3
OC(=O)c4ccc(c3nc(=O)c2c1CCCCc1sc2[nH]3)cc4	ZINC000000302690	O=c3nc(c1ccccc1)[nH]c4sc2CCCCc2c34
COc2ccc(OC)c(NC(=S)NC(=O)C=Cc1cccs1)c2	ZINC000000511741	O=C(NC(=S)Nc1ccccc1)C=Cc2cccs2
CN(C)[C@H]2CN(Cc1nnn(C)n1)C[C@@H]2O	ZINC000572613630	C2CCN(Cc1nn[nH]n1)C2
COc1cc(CC[C@@H](C)N)ccc1O	ZINC000000083538	c1ccccc1
C[N@]1CCO[C@@H](C(=O)NC[C@](C)(O)CO)C1	ZINC000407986672	C1COCCN1
NC(=O)N[C@@H]1CNC[C@@H]1O	ZINC000575593825	C1CCNC1
COc1ccccc1Nc3c(Cl)c(=O)n(c2cccc(C)c2)c3=O	ZINC000000121743	O=c2cc(Nc1ccccc1)c(=O)n2c3ccccc3
CCN(CC)c2ccc(C(=O)Nc1c(C)cccc1CC)cc2	ZINC000000060744	O=C(Nc1ccccc1)c2ccccc2
CCOC(=O)C1=C(C)N(CCO)C(=O)N[C@@H]1c2ccccc2	ZINC000000037310	O=C2NC=CC(c1ccccc1)N2
NCCN1CNC(=O)NC1	ZINC000019798293	O=C1NCNCN1
COC(=O)c2cccc(CN1C[C@H](O)[C@@H](O)C1)c2CN3C[C@H](O)[C@@H](O)C3	ZINC000599531814	C3CCN(Cc1ccccc1CN2CCCC2)C3
CC[C@H](C)n3c(SCc1ccccc1F)nc2ccsc2c3=O	ZINC000000425433	O=c2[nH]c(SCc1ccccc1)nc3ccsc23
O=C(CNC(=O)[C@@H]1CCCN1)Nc3nc(N2CCNCC2)n[nH]3	ZINC000572719642	O=C(CNC(=O)C1CCCN1)Nc3nc(N2CCNCC2)n[nH]3
COc2ccc(c1cc(N)nc(N)n1)cc2	ZINC000000082261	c2ccc(c1ccncn1)cc2
CC(=O)NCC(=O)NCC(=O)NC[C@@H]1CCC[C@@H]1N2CCOCC2	ZINC000370762575	C2CCC(N1CCOCC1)C2
CS(=O)(=O)NC2CCN(Cc1ccccc1)CC2	ZINC000000029517	C2CCN(Cc1ccccc1)CC2
N=C2N[C@@H](Cc1cscn1)CS2	ZINC000000027429	N=C2NC(Cc1cscn1)CS2
NC(=N)N1CCC(C(N)=O)CC1	ZINC000010153166	C1CCNCC1
O=S(=O)(Nc2ccc1OCOc1c2)c4ccc3ccccc3c4	ZINC000000341637	O=S(=O)(Nc2ccc1OCOc1c2)c4ccc3ccccc3c4
Oc1ccc(N(=O)=O)cc1[C@@H](C#Cc2ccccc2)N3CCOCC3	ZINC000000174211	C3CN(C(C#Cc1ccccc1)c2ccccc2)CCO3
O=C(c1cccs1)c3cn(Cc2ccccc2C#N)c4ccccc34	ZINC000000619923	O=C(c1cccs1)c3cn(Cc2ccccc2)c4ccccc34
CCN(CC)C[C@@H](O)CNC1=NS(=O)(=O)c2ccccc12	ZINC000000068169	O=S2(=O)N=Cc1ccccc12
O=C(Cn2nc(c1ccccc1)ccc2=O)NCCN3CCCC3	ZINC000000219351	O=C(Cn2nc(c1ccccc1)ccc2=O)NCCN3CCCC3
OCCN(CCO)Cc1ccc(Cl)cc1	ZINC000000280310	c1ccccc1
NC2=NC[C@@H](CN1CCNCC1)O2	ZINC000039115045	C2CN(CC1CN=CO1)CCN2
CN1CCN(C(=O)CN)CC1	ZINC000004240492	C1CNCCN1
Clc3ccc(/N=C/c2ccc(OC(=O)c1ccccc1)cc2)cc3	ZINC000000061694	O=C(Oc2ccc(C=Nc1ccccc1)cc2)c3ccccc3
N[C@@H](CCO)C(N)=O	ZINC000005828755	nonring
CCOC(=O)c3c(N)sc2C(=O)[C@@H](Sc1ccccc1)CCc23	ZINC000000126502	O=C2C(Sc1ccccc1)CCc3ccsc23
NC(=O)CSc2nnc(Cc1ccccc1)n2c3ccccc3	ZINC000000043908	C(c1ccccc1)c2nncn2c3ccccc3
N[C@H](Cc1ccncn1)c2ccccc2	ZINC000000015863	C(Cc1ccncn1)c2ccccc2
Clc2ccc(C(=O)NC(=S)NCc1ccccc1)c(Cl)c2	ZINC000000067502	O=C(NC(=S)NCc1ccccc1)c2ccccc2
O[C@@H](CNCc1ccco1)COc2ccccc2	ZINC000000296570	C(CNCc1ccco1)COc2ccccc2
Nc2nc(=O)c1nc(=O)[nH]c1n2	ZINC000005116778	O=c2nc1c(=O)ncnc1[nH]2
Cc3nc(Nc2nc1ccccc1s2)ncc3C(=O)Nc4ccc(F)cc4	ZINC000001264823	O=C(Nc1ccccc1)c4cnc(Nc3nc2ccccc2s3)nc4
COc3cc2CC[C@@H](NC(C)=O)c1cc(=O)c(OC)ccc1c2c(OC)c3OC	ZINC000000607790	O=c3cccc2c(CCCc1ccccc12)c3
Nc2sc1CCCCc1c2C(=O)NCCc3ccccc3	ZINC000000036793	O=C(NCCc1ccccc1)c3csc2CCCCc23
Clc3cccc(N2CCN(C(=O)c1ccc(N(=O)=O)o1)CC2)c3	ZINC000000047039	O=C(N2CCN(c1ccccc1)CC2)c3ccco3
O=C(N(Cc1ccccc1)c2ccccn2)c3ccccc3N(=O)=O	ZINC000000047033	O=C(N(Cc1ccccc1)c2ccccn2)c3ccccc3
Cc1cc(N(=O)=O)ccc1c3ccc(C=c2[nH]c(=S)[nH]c2=O)o3	ZINC000000047031	O=c1[nH]c(=S)[nH]c1=Cc3ccc(c2ccccc2)o3
NCC(=O)NCC(=O)Nc1cccc(CO)c1	ZINC000037628859	c1ccccc1
C[C@@H](N)C(=O)N[C@H](C)C(=O)N(C)C	ZINC000036135907	nonring
OC(=O)c4ccc3c(=O)n(c2ncc(c1ccccc1)s2)c(=O)c3c4	ZINC000000509344	O=c3n(c2ncc(c1ccccc1)s2)c(=O)c4ccccc34
CC(C)(C)NC(=O)CN(CCN)C[C@@H](O)CO	ZINC000662288094	nonring
CCOc3ccc2nc(SCC(=O)c1ccc(O)cc1)sc2c3	ZINC000000054386	O=C(CSc2nc1ccccc1s2)c3ccccc3
C[N@@](CCN1C(=O)CNC1=O)CC2(CO)CC2	ZINC000186801920	O=C1CNC(=O)N1CCNCC2CC2
C[C@H]1N[C@@](CN)(CO)[C@@H](O)[C@@H](O)[C@@H]1O	ZINC000027074028	C1CCNCC1
CNS(=O)(=O)CC(=O)N1C[C@@H]2C[C@H]1CN2	ZINC000638918710	C1NC2CNC1C2
Nc2n[nH]c(C1(O)CNC1)n2	ZINC000575563986	C1NCC1c2ncn[nH]2
C[C@@H](N)[C@@H]1CCN(S(N)(=O)=O)C1	ZINC000167540642	C1CCNC1
CCOC(=O)C[C@@H](O)C[N@]1C[C@H](O)[C@H](O)C1	ZINC000233999816	C1CCNC1
C[C@@H]2CN(C(=O)C(=O)NCCC[N@]1CCC[C@@H](C(N)=O)C1)C[C@@H](CO)O2	ZINC000583922875	O=C(NCCCN1CCCCC1)C(=O)N2CCOCC2
COc2ccc(O)c(C=NNC1=NC(=O)C(C)S1)c2	ZINC000000048626	O=C2CSC(NN=Cc1ccccc1)=N2
C[C@H](N)C[C@@H](C)NC(=O)C(=O)N2CCN([C@@H](C)C(=O)NC1CC1)CC2	ZINC000583934467	O=C(CN1CCNCC1)NC2CC2
O=C(NCc1ccco1)c2ccccc2NS(=O)(=O)c3cccs3	ZINC000000687775	O=C(NCc1ccco1)c2ccccc2NS(=O)(=O)c3cccs3
O=C(NC1CCCCC1)c2ccccc2NS(=O)(=O)c3cccs3	ZINC000000687774	O=C(NC1CCCCC1)c2ccccc2NS(=O)(=O)c3cccs3
CN(Cc1ccccc1)C(=O)COc2cc(C)c(Cl)c(C)c2	ZINC000000063699	O=C(COc1ccccc1)NCc2ccccc2
CC3(C)Oc1ccc(C#N)cc1[C@H](OC2=CC(=O)CC2)[C@H]3O	ZINC000000004023	O=C3CCC(OC1CCOc2ccccc12)=C3
Nc1ncnn1C2=NCCN2	ZINC000032191439	C2CN=C(n1cncn1)N2
CC1CCN(C[C@@H](O)CNC(=O)C(=O)NC[C@@H](C)S(N)(=O)=O)CC1	ZINC000557905772	C1CCNCC1
Clc3ccc(C(=O)ON=C(c1cccs1)c2cccs2)cc3	ZINC000000133340	O=C(ON=C(c1cccs1)c2cccs2)c3ccccc3
CC(C)(NCC(=O)NC(N)=O)C#C	ZINC000069681498	nonring
Cc1c(Cl)cccc1NS(=O)(=O)c4ccc3[nH]c(c2ccccc2)nc3c4	ZINC000002468011	O=S(=O)(Nc1ccccc1)c4ccc3[nH]c(c2ccccc2)nc3c4
CN(CC(=O)Nc1ccc(S(N)(=O)=O)cc1)C(N)=N	ZINC000013800556	c1ccccc1
N[C@H]1CNC(=O)[C@H]1N	ZINC000075518914	O=C1CCCN1
COc2ccc(CN[C@@H](CO)c1ccccc1)c(OC)c2OC	ZINC000000128381	C(NCc1ccccc1)c2ccccc2
O=C2C[C@@H](C(=O)NCC(=O)N1CCNCC1)CN2	ZINC000123061614	O=C2CC(C(=O)NCC(=O)N1CCNCC1)CN2
Cc2cc[n+](Cc1cnc(C)nc1N)cc2	ZINC000000251478	C(c1cncnc1)[n+]2ccccc2
NC(=O)c1ccccc1NC(=O)c2cc(Cl)ccc2Cl	ZINC000000030333	O=C(Nc1ccccc1)c2ccccc2
NC(=O)c1ccccc1NC(=O)c2cccc(Br)c2	ZINC000000030332	O=C(Nc1ccccc1)c2ccccc2
COc1ccccc1OC[C@@H]2CNC(=O)O2	ZINC000000000452	O=C2NCC(COc1ccccc1)O2
CN(CCN)CC(=O)NC(N)=O	ZINC000041055600	nonring
OC(=O)c3ccc(COc2ccc(\C=c1\[nH]c(=O)[nH]c1=O)cc2)cc3	ZINC000000073257	O=c3[nH]c(=O)c(=Cc2ccc(OCc1ccccc1)cc2)[nH]3
NS(=O)(=O)CCN[C@@H]1CC(=O)NC1=O	ZINC000102669824	O=C1CCC(=O)N1
NC(=O)Cc2cccc(C(=O)c1ccc(Cl)cc1)c2N	ZINC000000004623	O=C(c1ccccc1)c2ccccc2
CCN(C(C)=O)c2ccc(Oc1nc(OC)cc(OC)n1)cc2	ZINC000000042875	O(c1ccccc1)c2ncccn2
NC(=O)c2c(N)sc1CCCCc12	ZINC000000035817	C2CCc1sccc1C2
CC3(C)CC(=O)c2cnc(NC(=O)CCc1ccccc1)nc2C3	ZINC000000048939	O=C(CCc1ccccc1)Nc3ncc2C(=O)CCCc2n3
CCOC(=O)c2c(C)n(CC)c3ccc(OC(=O)c1ccco1)cc23	ZINC000000103759	O=C(Oc2ccc1[nH]ccc1c2)c3ccco3
C[N@]1CC[C@@](O)(CNC(=O)NCCNS(C)(=O)=O)C1	ZINC000358659343	C1CCNC1
NC(=N)NCCC[C@@H]2NC(=O)[C@H](Cc1ccc(O)cc1)NC2=O	ZINC000001583498	O=C2CNC(=O)C(Cc1ccccc1)N2
COc3ccc2NS(=O)(=O)c1ccc(Cl)cc1c2c3	ZINC000000039127	O=S3(=O)Nc1ccccc1c2ccccc23
N=C(NCCN1CCNC(=O)C1)N2CCOCC2	ZINC000262152748	N=C(NCCN1CCNC(=O)C1)N2CCOCC2
O=C(Cn1cc(N(=O)=O)cn1)Nc2ccccc2C#N	ZINC000000037045	O=C(Cn1cccn1)Nc2ccccc2
Cc1ccccc1N4CCN(CCc3nnc2CCCCn23)CC4	ZINC000000001246	C1CCn2c(C1)nnc2CCN4CCN(c3ccccc3)CC4
C[C@@H](CCN(C)C)NC(=O)NC(C)(CO)CO	ZINC000517748222	nonring
CC[C@@H]1CCCCN1C(=O)c3cc(c2ccc(C)o2)nc4ccccc34	ZINC000000483293	O=C(N1CCCCC1)c3cc(c2ccco2)nc4ccccc34
CN(CCN)S(=O)(=O)c1ncc[nH]1	ZINC000388117600	c1c[nH]cn1
CC(=O)Nc2ccc(OCC[n+]1cccc(C(N)=O)c1)cc2	ZINC000000297622	C(C[n+]1ccccc1)Oc2ccccc2
CC(=O)NCn3cc(c2ccc(c1cccs1)cc2)c(=O)o3	ZINC000000025513	O=c1o[nH]cc1c3ccc(c2cccs2)cc3
OC(=O)c3cccc(Nc2c(Cl)c(=O)n(C1CCCCC1)c2=O)c3	ZINC000000122077	O=c2cc(Nc1ccccc1)c(=O)n2C3CCCCC3
O=C(NC[C@@H]1COCCO1)C(=O)N2CCNCC2	ZINC000038063253	O=C(NCC1COCCO1)C(=O)N2CCNCC2
CC[N@]1C[C@@H](C)[C@H](NC(=O)CNC(=O)CNC(C)=O)C1	ZINC000674827573	C1CCNC1
NC2(C(=O)N1CCN(S(N)(=O)=O)CC1)CC2	ZINC000083835119	O=C(C1CC1)N2CCNCC2
C[C@@H](NC(=O)c1cccs1)c2ccccc2	ZINC000000029365	O=C(NCc1ccccc1)c2cccs2
CCOC(=O)[C@H](N)C(=O)NC[C@H]1C[N@@]2CCCN1CC2	ZINC000394391849	C1CN2CCN(C1)CC2
COC(=O)CCNC(=O)[C@@H]1CCNC1	ZINC000062116356	C1CCNC1
CN(C)S(=O)(=O)CC[N@]1C[C@H](O)[C@H](O)C1	ZINC000308807737	C1CCNC1
CC(C)[C@H]([C@@H](C)N)C(=O)NCCS(N)(=O)=O	ZINC000399704020	nonring
C[C@@H](CN)[C@@H](CN)C(O)=O	ZINC000013743935	nonring
CN1CCN(CC(\N)=N\O)CC1	ZINC000019439526	C1CNCCN1
O=C2CN(C(=O)C(=O)N[C@@H]1CCNC1)CCN2	ZINC000627507596	O=C2CN(C(=O)C(=O)NC1CCNC1)CCN2
O=C1C[C@@H](NCC#C)C(=O)N1	ZINC000102669592	O=C1CCC(=O)N1
Cc2cccc(NC(=O)Cc1cccs1)n2	ZINC000000030808	O=C(Cc1cccs1)Nc2ccccn2
CSc2nnc(c1cc[n+](C)cc1)n2CCO	ZINC000000353156	c2cc(c1nnc[nH]1)ccn2
CN(C)CCNC(=O)c1cccc(Cl)c1	ZINC000000213479	c1ccccc1
CN(C)CCNC(=O)c1ccc(F)cc1	ZINC000000213474	c1ccccc1
O[C@H]2C[N@@](CC(=O)N1CCOCC1)C[C@H]2O	ZINC000086331618	O=C(CN1CCCC1)N2CCOCC2
CN(C)CCNC(=O)Cc1ccccc1	ZINC000000451723	c1ccccc1
NNC(=S)Nc2ccc1OCOc1c2	ZINC000000097147	C2Oc1ccccc1O2
Cc2nc1sccn1c2c4csc(Nc3ccccn3)n4	ZINC000000034767	N(c1ccccn1)c4nc(c2cnc3sccn23)cs4
Nc2nc1ccccc1n2CCN3CCOCC3	ZINC000000186858	C3CN(CCn1cnc2ccccc12)CCO3
C[C@@H]2CN(CCCNC(=O)NCC(=O)N1CCNCC1)C[C@@H](C)O2	ZINC000583920591	O=C(NCCCN1CCOCC1)NCC(=O)N2CCNCC2
CCOc2cc(S(=O)(=O)Nc1ccc(Cl)cn1)ccc2F	ZINC000000384746	O=S(=O)(Nc1ccccn1)c2ccccc2
COC(=O)[C@@H]2[C@@H](c1ccc(Cl)cc1)C(C#N)=C(SC)NC2=O	ZINC000000080962	O=C2CC(c1ccccc1)C=CN2
CCOC(=O)c2[nH]c(C)c(CNCc1ccco1)c2C	ZINC000000034369	C(NCc1ccco1)c2cc[nH]c2
NC(=O)C1(C(N)=O)O[C@@H]1c2ccccc2	ZINC000000492321	C1OC1c2ccccc2
NS(=O)(=O)c2cccc(S(=O)(=O)NCCN1CCC(O)CC1)c2	ZINC000321415122	O=S(=O)(NCCN1CCCCC1)c2ccccc2
COc1ccc(S(N)(=O)=O)cc1C(=O)NC2CCN(C)CC2	ZINC000000347658	O=C(NC1CCNCC1)c2ccccc2
COc3ccc(n2c(=S)[nH]c(=O)c(=Cc1ccc(OC)c(OC)c1)c2=O)cc3	ZINC000000849715	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc3ccccc3
Fc3ccc(NCn1nnc2ccccc12)c(F)c3F	ZINC000000031589	C(Nc1ccccc1)n2nnc3ccccc23
C[C@@H](N)CNC(=O)CN1C(=O)NC(C)(C)C1=O	ZINC000648128915	O=C1CNC(=O)N1
Cn3c(SCc2ccc1OCOc1c2)nnc3c4ccccc4	ZINC000000060966	C4Oc3ccc(CSc2nnc(c1ccccc1)[nH]2)cc3O4
CO[C@H](C)[C@](O)(C(C)C)C(=O)OCC2=CC[N@]1CC[C@@H](O)[C@H]12	ZINC000000338200	C2CC1C=CCN1C2
CN(N)c3nc(N1CCCC1)nc(N2CCCC2)n3	ZINC000000040832	C3CCN(c2ncnc(N1CCCC1)n2)C3
O=C(NCCN1CCNCC1)c3ccc2c(=O)[nH]c(=O)c2c3	ZINC000517739699	O=C(NCCN1CCNCC1)c3ccc2c(=O)[nH]c(=O)c2c3
CN2CCN(CCNNCC[N@@]1CCC[C@@H](O)C1)CC2	ZINC000019167080	C2CCN(CCNNCCN1CCNCC1)CC2
OCCN[C@@H]1CC(=O)NC1=O	ZINC000105012523	O=C1CCC(=O)N1
O[C@H]1[C@@H]2CNC[C@@]1(O)OC2=O	ZINC000039060354	O=C1OC2CNCC1C2
CCc3cc2c(=O)n(CC(=O)Nc1ccc(Cl)cc1)cnc2s3	ZINC000000148866	O=C(Cn2cnc1sccc1c2=O)Nc3ccccc3
CNC(=O)CN	ZINC000002526304	nonring
NC[C@H]2CNc1nc(N)[nH]c(=O)c1N2	ZINC000013474448	O=c2[nH]cnc1NCCNc12
Fc4cccc(Nc3cc(c1ccccc1)nc(c2ccccc2)n3)c4	ZINC000000348361	N(c1ccccc1)c4cc(c2ccccc2)nc(c3ccccc3)n4
FC(F)(F)c2cccc(NC(=O)\C=C\c1ccc(Cl)cc1)c2	ZINC000000063999	O=C(Nc1ccccc1)C=Cc2ccccc2
CCOC(=O)C2=C(NN(C)c1ccccc1)C(=O)N(C)C2	ZINC000000042092	O=C1NCC=C1NNc2ccccc2
CN(C)c1ccccc1C[S@@](=O)c2nccn2c3ncccc3C	ZINC000000003722	O=S(Cc1ccccc1)c2nccn2c3ccccn3
C[C@@H](CN1CCOCC1)NC(=O)CN	ZINC000037008663	C1COCCN1
OC(=O)c2cc(NS(=O)(=O)c1ccc(F)cc1)ccc2O	ZINC000000073719	O=S(=O)(Nc1ccccc1)c2ccccc2
O=c2[nH]c1ccccc1n2C4CCN(CCOc3ccccc3)CC4	ZINC000000001873	O=c2[nH]c1ccccc1n2C4CCN(CCOc3ccccc3)CC4
OC(=O)c3ccc(S(=O)(=O)N(Cc1ccc(F)cc1)C2CCCCC2)cc3	ZINC000000924353	O=S(=O)(N(Cc1ccccc1)C2CCCCC2)c3ccccc3
Cc2ccc(C(=O)C=CNc1ccc(Cl)c(C(F)(F)F)c1)cc2	ZINC000000302266	O=C(C=CNc1ccccc1)c2ccccc2
COc3ccc(C2=NN(C(C)=O)C1(CCCC1)O2)cc3OC	ZINC000000039270	C1CCC3(C1)NN=C(c2ccccc2)O3
Fc4ccc(c2c(c1ccncc1)[nH]c3cccnc23)cc4	ZINC000000023731	c4ccc(c2c(c1ccncc1)[nH]c3cccnc23)cc4
Nn3c(COc1ccc(Cl)cc1)nc2ccccc2c3=O	ZINC000000032880	O=c2[nH]c(COc1ccccc1)nc3ccccc23
CNS(=O)(=O)CC(=O)NCC(C)(C)CN(C)C	ZINC000332450551	nonring
NC(=N)NCCn1cnc2c(N)ncnc12	ZINC000028007682	c2ncc1nc[nH]c1n2
COc1ccc(C)cc1Nc3c(Cl)c(=O)n(C2CCCCC2)c3=O	ZINC000000144921	O=c2cc(Nc1ccccc1)c(=O)n2C3CCCCC3
CC(C)(CNC(=O)C(=O)NC1CCN(CCO)CC1)N2CCOCC2	ZINC000670537342	O=C(NCCN1CCOCC1)C(=O)NC2CCNCC2
COc1ccc(C(C)(C)C)cc1S(=O)(=O)Nc2ccc(Br)cc2C	ZINC000001063537	O=S(=O)(Nc1ccccc1)c2ccccc2
CN[C@@H]([C@@H](C)O)C(N)=O	ZINC000142961373	nonring
CNCC(=O)NCC(=O)NC(C)(C)C	ZINC000035661192	nonring
O=C(CSCc1ccccc1)Nc2c[nH]c(=O)[nH]c2=O	ZINC000000070138	O=C(CSCc1ccccc1)Nc2c[nH]c(=O)[nH]c2=O
NCCOc1nonc1N	ZINC000002026502	c1cnon1
CCc1ccccc1NC(=O)c2ccc(OC(C)=O)cc2	ZINC000000049690	O=C(Nc1ccccc1)c2ccccc2
Clc3cc(Cl)cc(NC(=O)c2csc1CCCCCc12)c3	ZINC000000254316	O=C(Nc1ccccc1)c3csc2CCCCCc23
CNC(=O)C[C@@]2(O)CCCN(C(=O)C(=O)N(C)CC[N@@](C)C1CC1)C2	ZINC000644917090	O=C(NCCNC1CC1)C(=O)N2CCCCC2
CC(=O)NCCN[C@@H]1COC[C@@H]1O	ZINC000037891482	C1CCOC1
CSc2c(c1ccccc1)c(N)nn2S(=O)(=O)c3ccccc3	ZINC000000069209	O=S(=O)(c1ccccc1)n3cc(c2ccccc2)cn3
COC(=O)c1ccccc1N[C@H]2CC3=C(CC2(C)C)C(C)(C)CCC3	ZINC000000301363	C1CCC3=C(C1)CCC(Nc2ccccc2)C3
CC(C)c2ccc(CNC(=O)CSc1nnc(N)s1)cc2	ZINC000000036148	O=C(CSc1nncs1)NCc2ccccc2
Cc1ccccc1n3c(=O)c(Cl)c(c2ccc(Cl)cc2)c3=O	ZINC000000064077	O=c2cc(c1ccccc1)c(=O)n2c3ccccc3
C[C@H]1[C@@H](CO)CC[N@]1CC(N)=O	ZINC000215008406	C1CCNC1
Oc2ccc(\C=C\c1ccc(O)c(O)c1)cc2	ZINC000000014989	C(=Cc1ccccc1)c2ccccc2
NN1C(N=N)NCC1=O	ZINC000001895876	O=C1CNCN1
Nc2cc(N)nc(SCC(=O)NC1CCCC1)n2	ZINC000000410873	O=C(CSc1ncccn1)NC2CCCC2
NC(=O)c2noc(C1(O)CNC1)n2	ZINC000575556018	C1NCC1c2ncno2
C2CO[C@H](CNCc1ccco1)C2	ZINC000000265972	C2COC(CNCc1ccco1)C2
Cc1ccc(N(=O)=O)cc1NC(=O)Nc2ccc(Cl)c(Cl)c2	ZINC000000149954	O=C(Nc1ccccc1)Nc2ccccc2
OC(=O)c2ccc1ccccc1c2OCC(=O)Nc3cc(Cl)cc(Cl)c3	ZINC000013086038	O=C(COc1cccc2ccccc12)Nc3ccccc3
CC(=O)c3c(C)n(CCc1c[nH]c2ccccc12)c(C)c3C(C)=O	ZINC000000033687	C(Cn1cccc1)c2c[nH]c3ccccc23
NC1=NC(=O)CN1CCNCCN2CC(=O)NC2=N	ZINC000038647667	N=C1NC(=O)CN1CCNCCN2CC(=O)N=C2
OC3(C(=O)N1C[C@@H]2C[C@H]1CN2)CNC3	ZINC000638916704	O=C(C1CNC1)N2CC3CC2CN3
CN(C)[C@H]1CN(C(=O)C(N)=O)C[C@@H]1O	ZINC000635949025	C1CCNC1
NN=C(N)NCc1ncon1	ZINC000231818839	c1ncon1
O=C(Cn2cc(C(=O)c1ccco1)c3ccccc23)NCc4ccco4	ZINC000000560614	O=C(Cn2cc(C(=O)c1ccco1)c3ccccc23)NCc4ccco4
NS(=O)(=O)N1CCN[C@@H](CO)C1	ZINC000616654224	C1CNCCN1
NS(=O)(=O)N2CC[C@@H]1OCCN[C@H]1C2	ZINC000404257225	C2COC1CCNCC1N2
COc3ccc(c2c(C)nn(c1ccccc1)c2N)cc3OC	ZINC000000045335	c3ccc(c2cnn(c1ccccc1)c2)cc3
OCC(CO)(CO)NCc1ccccc1	ZINC000005736865	c1ccccc1
OCCN3CCN(C2CCN(Cc1ccc(N(=O)=O)cc1)CC2)CC3	ZINC000000316678	C3CN(C2CCN(Cc1ccccc1)CC2)CCN3
CN(C)CC[C@@](C)(O)Cc1ccccc1	ZINC000000034810	c1ccccc1
Clc4ccc(c3ccc(c2nc1ccccc1o2)o3)cc4	ZINC000000034814	c4ccc(c3ccc(c2nc1ccccc1o2)o3)cc4
OC[C@H]3N[C@@H](c1c[nH]c2c(=O)[nH]cnc12)[C@H](O)[C@@H]3O	ZINC000013492899	O=c2[nH]cnc3c(C1CCCN1)c[nH]c23
CCS(=O)(=O)N[C@H](C)C(=O)N1C[C@@H](C)[N@@](CCO)C[C@@H]1C	ZINC000616340817	C1CNCCN1
Clc1ccccc1C(=O)NCc2cccnc2	ZINC000000029566	O=C(NCc1cccnc1)c2ccccc2
Cc4ccc3sc(c2ccc(/N=C/c1ccccc1O)cc2)nc3c4	ZINC000000058444	C(=Nc3ccc(c2nc1ccccc1s2)cc3)c4ccccc4
CN(C)CCn2ccc(=NC(=O)C(=O)NCCNc1cnccn1)[nH]2	ZINC000533462397	O=C(NCCNc1cnccn1)C(=O)N=c2cc[nH][nH]2
CCOc2ccc(c1cnc(N)nc1N)cc2	ZINC000000374791	c2ccc(c1cncnc1)cc2
Nc3nnc(SCC(=O)c1cccc2ccccc12)s3	ZINC000000036097	O=C(CSc1nncs1)c2cccc3ccccc23
CC(=N)NC(C(N)=O)C(N)=O	ZINC000575463307	nonring
CC(=O)Nc1ccccc1OC[C@@H](O)CN2CCC(C(N)=O)CC2	ZINC000000147011	C2CCN(CCCOc1ccccc1)CC2
CCOC(=O)c3nc2cc1C(C)=C(C)[C@H](C)n1c(CC(C)C)c2c3C	ZINC000000053277	C2C=Cc3cc1nccc1cn23
Cc5nc4sc2c(nnn3c1ccccc1nc23)c4c(C)c5Cl	ZINC000000054556	c1ccc4c(c1)nc5c3sc2ncccc2c3nnn45
Cc2cc(NC(=O)\C=C\c1ccco1)ccc2NC(=O)c3ccccc3	ZINC000000277340	O=C(Nc2ccc(NC(=O)c1ccccc1)cc2)C=Cc3ccco3
Cc3cc(C)n(CC(=O)NCc1n[nH]c(=O)c2ccccc12)n3	ZINC000000053279	O=C(Cn1cccn1)NCc2n[nH]c(=O)c3ccccc23
NC(=N)N2CCN(C[C@@H](O)COc1ccccc1)CC2	ZINC000000323296	C(COc1ccccc1)CN2CCNCC2
O=C(CNS(=O)(=O)c1cccs1)Nc3nc(N2CCNCC2)n[nH]3	ZINC000583933514	O=C(CNS(=O)(=O)c1cccs1)Nc3nc(N2CCNCC2)n[nH]3
Cc3cc(C)n(c2ccc(SCc1ccc(Cl)cc1)nn2)n3	ZINC000000091435	C(Sc2ccc(n1cccn1)nn2)c3ccccc3
C2CN=C(CNc1ccccc1)N2	ZINC000000001918	C2CN=C(CNc1ccccc1)N2
COc3ccc2[C@@H](Nc1cc(N(=O)=O)ccc1F)OC(=O)c2c3OC	ZINC000000551679	O=C2OC(Nc1ccccc1)c3ccccc23
CCC[N@@](CCO)Cc1ccc(N(=O)=O)cc1	ZINC000000215708	c1ccccc1
NCC(=O)NCC(=O)N1CCN(CC#C)CC1	ZINC000037822835	C1CNCCN1
CCc3nsc([C@H]1CN2CCC1CC2)n3	ZINC000000004100	C1CN3CCC1C(c2ncns2)C3
CCN(CC)C(=O)c1ccc[n+](CCC(N)=O)c1	ZINC000000393587	c1ccncc1
NC(=N)C(=N)NCC(O)=O	ZINC000028243441	nonring
NC(=O)CSc3nc(C1CC1)cc(c2ccco2)c3C#N	ZINC000000034963	C1CC1c3cc(c2ccco2)ccn3
COC(=O)c2sc1cc(N(=O)=O)cc(SCC(C)C)c1c2N	ZINC000000036892	c2ccc1sccc1c2
CC(C)(O)[C@](C)(O)c1ccc(Cl)cc1	ZINC000000000603	c1ccccc1
COc2ccc(CCNC(=O)c1cccc(Cl)c1)cc2OC	ZINC000000037540	O=C(NCCc1ccccc1)c2ccccc2
COc1ccccc1C(=O)Nc4ccc3oc(c2cccnc2)nc3c4	ZINC000000192373	O=C(Nc3ccc2oc(c1cccnc1)nc2c3)c4ccccc4
CC(C)COC(=O)N=c2[nH]nc(c1ccc(Cl)cc1Cl)s2	ZINC000000322739	N=c2[nH]nc(c1ccccc1)s2
COc3ccc(N2C(=O)C[C@@H](Nc1ccc(CCO)cc1)C2=O)cc3	ZINC000000077382	O=C2CC(Nc1ccccc1)C(=O)N2c3ccccc3
CC(C)N(Cc1ccccc1)C(=O)Cn3c(=O)c2ccccc2c3=O	ZINC000000030497	O=C(Cn2c(=O)c1ccccc1c2=O)NCc3ccccc3
COc2ccc(OC)c(C[N@@](C)C1CCN(C)CC1)c2	ZINC000000199823	C2CC(NCc1ccccc1)CCN2
Cc3ccc(NC(=O)c2oc1cc(C)c(C)cc1c2C)cc3N(=O)=O	ZINC000000617053	O=C(Nc1ccccc1)c3cc2ccccc2o3
CC(=O)N[C@@H]1CCN(C(N)=NN)C1	ZINC000160276847	C1CCNC1
CN(C)N=C1NCC(O)CN1	ZINC000575453063	N=C1NCCCN1
CN(C)CC(=O)N1CCNCC1	ZINC000019685367	C1CNCCN1
CC[C@@H](C)[C@@H](NC(=O)[C@@H](C)NC(=O)CN)C(N)=O	ZINC000004992606	nonring
O[C@@H]3C=C5CCN4Cc2cc1OCOc1cc2[C@H]([C@H]3O)[C@@H]45	ZINC000000000024	C5Oc4cc3CN1CCC2=CCCC(C12)c3cc4O5
CCn2c(N)c(C(=O)CN1CC[N@@](C[C@@H](C)O)[C@@H](C)C1)c(=O)[nH]c2=O	ZINC000533411320	O=C(CN1CCNCC1)c2c[nH]c(=O)[nH]c2=O
CN3C(=O)C[C@H](N2CCN(C(=O)CN1CCCC1)CC2)C3=O	ZINC000000036436	O=C3CC(N2CCN(C(=O)CN1CCCC1)CC2)C(=O)N3
NC(=O)c2ccc[n+](C[C@@H](O)COc1ccccc1)c2	ZINC000000297628	C(COc1ccccc1)C[n+]2ccccc2
COc2cccc(C(=O)Nc1nc[nH]n1)c2	ZINC000000037945	O=C(Nc1nc[nH]n1)c2ccccc2
O=C(NCCCN1CCOCC1)NCCn2cnc(C#N)n2	ZINC000558345727	O=C(NCCCN1CCOCC1)NCCn2cncn2
NC(=O)CC1(N)CS(=O)(=O)C1	ZINC000148842032	O=S1(=O)CCC1
CC(=O)NS(=O)(=O)c2ccc(NC(=O)Nc1ccc(Cl)c(Cl)c1)cc2	ZINC000000639011	O=C(Nc1ccccc1)Nc2ccccc2
Cc1cc(C)c(S(N)(=O)=O)c(Cl)n1	ZINC000000051733	c1ccncc1
NNCC(=O)N1CCNCC1	ZINC000222911495	C1CNCCN1
COc1ccc(Cl)cc1NC(=O)[C@@H](C)Oc2ccccc2	ZINC000000030654	O=C(COc1ccccc1)Nc2ccccc2
O=S(=O)(N(C1CCNCC1)C2CC2)c3ccccc3	ZINC000000154345	O=S(=O)(N(C1CCNCC1)C2CC2)c3ccccc3
CC[C@@H](C)C(=O)N2CCN(c1ccccc1)CC2	ZINC000000030417	C2CN(c1ccccc1)CCN2
Fc3ccc(CSc1ncnc2[nH]cnc12)c4ccccc34	ZINC000000031876	C(Sc1ncnc2[nH]cnc12)c3cccc4ccccc34
C[C@H](CN)N1C[C@@H](O)[C@H](O)C1	ZINC000300059467	C1CCNC1
CC(=O)c3ccc(N=c2oc1cc(O)ccc1cc2C(N)=O)cc3	ZINC000000178957	N(c1ccccc1)=c3ccc2ccccc2o3
NC[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1N2CCOCC2	ZINC000020464847	C2CC(N1CCOCC1)CO2
C[C@@H](N([C@@H](C)c1ccccc1)C(=O)c2ccccc2C(O)=O)c3ccccc3	ZINC000000641888	O=C(N(Cc1ccccc1)Cc2ccccc2)c3ccccc3
COc1ccc(C(=O)NCCN(C)C)cc1OC	ZINC000000432966	c1ccccc1
O=c2oc(NCc1ccccc1)nc3ccccc23	ZINC000000006983	O=c2oc(NCc1ccccc1)nc3ccccc23
N[C@@H](Cn1ccnc1C#N)C(N)=O	ZINC000127855816	c1c[nH]cn1
Nc3c(C#N)c(c1ccccc1Cl)c(C#N)c4nc2ccccc2n34	ZINC000000060425	c4ccc(c1ccn3c(c1)nc2ccccc23)cc4
CNC(=O)CNC1=NC[C@@H](O)CN1	ZINC000575499078	C1CNC=NC1
COc2cc(OC)cc(Oc1nc(C)c(Cl)c(C)c1C(N)=O)c2	ZINC000000029011	O(c1ccccc1)c2ccccn2
Nc4nc(CSc2nc1ccccc1[nH]2)nc(N3CCOCC3)n4	ZINC000000033458	C4CN(c3ncnc(CSc2nc1ccccc1[nH]2)n3)CCO4
CNS(=O)(=O)c2cccc(NC(=O)CNC(=O)[C@@]1(N)CC[N@@](C)C1)c2	ZINC000643677658	O=C(CNC(=O)C1CCNC1)Nc2ccccc2
CC(=O)N[C@@H]1CN[C@@H](CO)[C@@H]1O	ZINC000077269674	C1CCNC1
COc2ccc(CCNC(=O)CN1CCC(C)CC1)cc2OC	ZINC000000038258	O=C(CN1CCCCC1)NCCc2ccccc2
NN=C(N)N[C@@]1(CO)CCOC1	ZINC000306606565	C1CCOC1
CN1CCN(C[C@@](C)(N)C(N)=O)CC1	ZINC000045227254	C1CNCCN1
O=C(NCCn1ncnn1)[C@@H]3[C@H]2CNC[C@H]23	ZINC000648156903	O=C(NCCn1ncnn1)C3C2CNCC23
CC(CO)(CO)NC(=O)NCCCN1CCOCC1	ZINC000518511848	C1COCCN1
COc3ccc(C(=O)CSc2nc1c(C)cccc1cc2C#N)cc3	ZINC000000421676	O=C(CSc2ccc1ccccc1n2)c3ccccc3
Cc4ccc(c3cc(C(=O)NCCc1ccccc1)c2ccccc2n3)s4	ZINC000000668508	O=C(NCCc1ccccc1)c3cc(c2cccs2)nc4ccccc34
CN(C)CCCN1CNC(=S)NC1	ZINC000000180366	S=C1NCNCN1
Nc2nc(N)nc(NC[C@@H]1C[C@H](O)C1)n2	ZINC000624667312	C2CC(CNc1ncncn1)C2
O=S4(=O)C=C(Sc2nc1ccccc1s2)c3ccccc34	ZINC000000081590	O=S4(=O)C=C(Sc2nc1ccccc1s2)c3ccccc34
NS(=O)(=O)CCNC(=O)C(=O)N1CCNCC1	ZINC000036746182	C1CNCCN1
CC(C)(C)OC(=O)N1C[C@@H](O)C[C@@H]1C(=O)OCC(=O)c2ccccc2	ZINC000000052134	O=C(COC(=O)C1CCCN1)c2ccccc2
C[C@H]1N(C(=O)[C@@H](N)CCN(C)C)CCNC1=O	ZINC000653082565	O=C1CNCCN1
Cn1nnc(CN)c1CN	ZINC000019051629	c1c[nH]nn1
C[C@@H]2C[N@@](CC(=O)N1CCNC(=O)C1)C[C@H]2C(N)=O	ZINC000285699904	O=C2CN(C(=O)CN1CCCC1)CCN2
Cn1nnnc1[C@@H](CN)CO	ZINC000063065425	c1nnn[nH]1
O=N(=O)c3cccc(\C=N\C2=NN(c1ccccc1)CC2)c3	ZINC000000042641	C2CC(N=Cc1ccccc1)=NN2c3ccccc3
CCN(CC)c2ccc(C=C1C(=O)OC(C)(C(C)(C)C)OC1=O)cc2	ZINC000000200180	O=C1OCOC(=O)C1=Cc2ccccc2
COc2ccc(O[C@@H](C)C(=O)Nc1ccc(C(O)=O)cc1)cc2	ZINC000000119639	O=C(COc1ccccc1)Nc2ccccc2
COc2ccc(CCNC(=S)Nc1c(C)nn(C)c1C)cc2OC	ZINC000000609999	S=C(NCCc1ccccc1)Nc2cn[nH]c2
OC[C@@H]2CN(C1CNC1)CC(=O)N2	ZINC000307195765	O=C2CN(C1CNC1)CCN2
NC(=O)CNC(=O)C(=O)N1CCNCC1	ZINC000036904439	C1CNCCN1
CC(=O)Nc3cccc(c2cc(=O)c1ccccc1o2)c3O	ZINC000000034370	O=c2cc(c1ccccc1)oc3ccccc23
CNS(=O)(=O)CCNC(=O)N(C)CCN(C)C	ZINC000332453160	nonring
O=C(C=C3NC[C@H]1N(CCc2ccccc12)C3=O)c4ccccc4	ZINC000000034484	O=C(C=C3NCC1N(CCc2ccccc12)C3=O)c4ccccc4
CC[C@H](C)[C@H](N)C(=O)Nc1ccncc1	ZINC000000025491	c1ccncc1
O=C(Nc3nc(c2ccc(Oc1ccccc1)cc2)cs3)C4CC4	ZINC000000180477	O=C(Nc3nc(c2ccc(Oc1ccccc1)cc2)cs3)C4CC4
COc4cc3[nH]c2c(=O)n(CCc1ccccc1)cnc2c3cc4OC	ZINC000000487671	O=c3n(CCc1ccccc1)cnc4c2ccccc2[nH]c34
CC2CCN(C(=O)COc1ccc(Br)cc1)CC2	ZINC000000041537	O=C(COc1ccccc1)N2CCCCC2
CN1CCN(C(=O)CCNC(=O)NC(CO)CO)CC1	ZINC000340928500	C1CNCCN1
CN2C[C@@H](CNc1nc(N)nc(N)n1)CC2=O	ZINC000624399976	O=C2CC(CNc1ncncn1)CN2
Cc1ccc(F)cc1NC(=O)CSc2nnnn2C	ZINC000000031456	O=C(CSc1nnn[nH]1)Nc2ccccc2
C[C@@H]1C[N@@](CCO)[C@H](C)CN1C(=O)[C@@H]2CCCN(S(N)(=O)=O)C2	ZINC000616342245	O=C(C1CCCNC1)N2CCNCC2
COC(=O)c3cccc(NC(=O)CSc2nc1ccccc1[nH]2)c3	ZINC000000080642	O=C(CSc2nc1ccccc1[nH]2)Nc3ccccc3
N[C@@H]1[C@H](COC(N)=O)NC1=O	ZINC000039060342	O=C1CCN1
NS(=O)(=O)c2cc(C(=O)NC[C@@H]1C[C@H](F)CN1)ccn2	ZINC000648140857	O=C(NCC1CCCN1)c2ccncc2
Cc2nc(c1n[nH]c(C)n1)n[nH]2	ZINC000000121187	c2nc(c1nc[nH]n1)n[nH]2
COc1cc(CC=C)ccc1Oc2ncnc3sc(C)c(C)c23	ZINC000000087619	O(c1ccccc1)c2ncnc3sccc23
N[C@H](CC(N)=O)C(=O)N1CCNCC1	ZINC000037482114	C1CNCCN1
O=S(=O)(N(CC#N)CC#N)c1ccccc1	ZINC000000029390	c1ccccc1
COc3ccc(c2nc(c1ccc(Br)cc1)cs2)cc3	ZINC000000172045	c3ccc(c2csc(c1ccccc1)n2)cc3
NCCNC(=O)Cn1cncn1	ZINC000037902445	c1nc[nH]n1
NNc1ccc(N(CCO)CCO)nn1	ZINC000000001866	c1ccnnc1
O=C(NN=c2cc[nH]c(Cc1ccccc1)n2)c3cccc(N(=O)=O)c3	ZINC000000054808	O=C(NN=c2cc[nH]c(Cc1ccccc1)n2)c3ccccc3
Fc4ccc3O[C@@H](c2ccc1OCCCOc1c2)CC(=O)c3c4	ZINC000000064412	O=C3CC(c2ccc1OCCCOc1c2)Oc4ccccc34
C2CC(Cc1c[nH]cn1)CCN2	ZINC000000005777	C2CC(Cc1c[nH]cn1)CCN2
NC(=S)NN1CCNCC1	ZINC000016124469	C1CNCCN1
O[C@H]1[C@@H](O)[C@@H](O)[C@@]2(O)CC[C@@H]1N2	ZINC000012153281	C1CC2CCC(C1)N2
C3CN(c2nnn(CC1CC1)n2)CCO3	ZINC000000090438	C3CN(c2nnn(CC1CC1)n2)CCO3
O=C(Cc1ccncc1)N3CCC(C(=O)c2ccccc2)CC3	ZINC000000017730	O=C(Cc1ccncc1)N3CCC(C(=O)c2ccccc2)CC3
FC(F)Sc3ccc(NC(=O)[C@@H]2COc1ccccc1O2)cc3	ZINC000000302528	O=C(Nc1ccccc1)C3COc2ccccc2O3
CC[C@@H](C)NC(=O)CN1C[C@H](O)[C@@H](O)C1	ZINC000233850293	C1CCNC1
C2CN=C(C1=NCCN1)N2	ZINC000000349622	C2CN=C(C1=NCCN1)N2
CC(C)C[N@]2CCO[C@@H](CNC(=O)C(=O)N[C@@H]1CCNC1=O)C2	ZINC000668388707	O=C1NCCC1NC(=O)C(=O)NCC2CNCCO2
Cc2cccc(NC(=O)Nc1cccnc1)c2	ZINC000000018754	O=C(Nc1ccccc1)Nc2cccnc2
NC(=N)NC(=N)Nc1nc[nH]n1	ZINC000001714291	c1nc[nH]n1
O=C3C[C@@H](C(=O)Nc2ccc1ccccc1c2)CN3C4CCCCC4	ZINC000000038105	O=C3CC(C(=O)Nc2ccc1ccccc1c2)CN3C4CCCCC4
COc2cccc(C(=O)Nc1sc(C)cc1C(O)=O)c2N	ZINC000000002516	O=C(Nc1cccs1)c2ccccc2
CCOC(=O)c2c(Cl)c1cccc(C(F)(F)F)c1nc2SC	ZINC000000161525	c2ccc1ncccc1c2
COc3cccc(NS(=O)(=O)c2ccc1ccccc1c2)c3	ZINC000000326730	O=S(=O)(Nc1ccccc1)c3ccc2ccccc2c3
CCC[N@@](CCO)Cc1ccc(N(C)C)cc1	ZINC000000277751	c1ccccc1
COC(=O)C(O)(O)CN	ZINC000086864961	nonring
Nc1ccccc1SC[C@@H](O)COc2cccc(C(F)(F)F)c2	ZINC000000160154	C(COc1ccccc1)CSc2ccccc2
NCCNC(=O)c1nc(N)n[nH]1	ZINC000008733298	c1nc[nH]n1
NCC(=O)N1CC(O)C1	ZINC000227269798	C1CNC1
CCN(CC)C[C@@H](O)COc1cc(C(F)(F)F)ccn1	ZINC000000117271	c1ccncc1
C[C@@H](O)CNC(=O)[C@H](N)CO	ZINC000083339738	nonring
N[C@@H]3CCN(C(=O)C2(n1cnnn1)CC2)C3	ZINC000662393437	O=C(N1CCCC1)C3(n2cnnn2)CC3
COc1cccc(OC)c1C(=O)OCC(=O)c2ccc(Cl)cc2	ZINC000000072874	O=C(COC(=O)c1ccccc1)c2ccccc2
CN(CCO)C[C@@H](O)CN	ZINC000072209954	nonring
O[C@H]2CN(CC1CNC1)C[C@H]2O	ZINC000575559768	C2CCN(CC1CNC1)C2
Cc4cc3c(=O)n(Cc2cccc(Oc1ccccc1)c2)cnc3s4	ZINC000000151055	O=c3n(Cc2cccc(Oc1ccccc1)c2)cnc4sccc34
CC[C@H](C)Oc2ccc(C(=O)NC(=S)Nc1cccc(F)c1)cc2	ZINC000000570293	O=C(NC(=S)Nc1ccccc1)c2ccccc2
Cc2cnc1nc(N)[nH]c(=O)c1n2	ZINC000000403052	O=c1[nH]cnc2nccnc12
COc2ccc1[nH]cc(CCN)c1c2	ZINC000000057163	c2ccc1[nH]ccc1c2
CC(C)c2nnc(SCC(=O)Nc1sc(C)c(C)c1C#N)n2C	ZINC000000410466	O=C(CSc1nnc[nH]1)Nc2cccs2
C[N+](C)(C)C[C@@H]1CCC[C@@H]1O	ZINC000000027628	C1CCCC1
OC(=O)CSCC(=O)Nc1ccc(Br)cc1	ZINC000000100867	c1ccccc1
C1NCC2CNCC1O2	ZINC000001701348	C1NCC2CNCC1O2
COc2cc(\C=C1/CCCC1=O)ccc2OCc3ccccc3	ZINC000000034801	O=C1CCCC1=Cc3ccc(OCc2ccccc2)cc3
C[n+]2cc(C(=O)NCC[N+](C)(C)Cc1ccccc1)ccc2\C=N\O	ZINC000000174443	O=C(NCCNCc1ccccc1)c2cccnc2
COc3ccc([C@@H]1SCCN1C(=O)c2ccc(N(=O)=O)cc2)cc3	ZINC000000068890	O=C(N1CCSC1c2ccccc2)c3ccccc3
Oc3cc(c1ccccc1)n(c2ccccc2)c(=O)c3S(=O)(=O)c4ccc(Cl)cc4	ZINC000000704386	O=c3c(S(=O)(=O)c1ccccc1)ccc(c2ccccc2)n3c4ccccc4
COc1ccc(Br)cc1C2Nc3cccc4cccc(N2)c34	ZINC000000624821	N2C(c1ccccc1)Nc3cccc4cccc2c34
Brc2ccc(NS(=O)(=O)c1ccccc1)nc2	ZINC000000036083	O=S(=O)(Nc1ccccn1)c2ccccc2
CCCC(=O)C2c1cccc(O)c1C(=O)c3c(O)cccc23	ZINC000000001077	O=C2c1ccccc1Cc3ccccc23
CCOc1ccccc1[C@@H]2NC(=O)NC(C)=C2C(=O)OCC(C)C	ZINC000000044542	O=C2NC=CC(c1ccccc1)N2
CN1CCN(NCC(N)=O)CC1	ZINC000215070957	C1CNCCN1
Clc2cc(N(=O)=O)c(Sc1ccccn1)cc2n3cccc3	ZINC000000083685	S(c2cccc(n1cccc1)c2)c3ccccn3
CNC[C@@H](O)CN2CCN(c1ccccc1OC)CC2	ZINC000000227553	C2CN(c1ccccc1)CCN2
NC(=O)c2ccc[n+](Cc1cccc(C#N)c1)c2	ZINC000000164252	C(c1ccccc1)[n+]2ccccc2
CN3C[C@@]2(C)c1ccccc1N(C)[C@@]2(O)C3=O	ZINC000000041036	O=C1NCC2C1Nc3ccccc23
NC[C@H](O)COc1ccccc1CC=C	ZINC000000235991	c1ccccc1
COC[C@H](C)N[C@@H]1CCCC[C@H]1OC	ZINC000000183529	C1CCCCC1
CN(C)CCCNC(=O)CSc1nncn1N	ZINC000005581309	c1nnc[nH]1
Brc3ccc(OCc2nc(c1ccncc1)no2)cc3	ZINC000000078774	C(Oc1ccccc1)c3nc(c2ccncc2)no3
CC[N@@](C)C[C@@H](O)CN1CC(NC(=O)NC)C1	ZINC000521369754	C1CNC1
Clc1ccccc1NCn3c(=O)c2ccc(N(=O)=O)cc2c3=O	ZINC000000059908	O=c2n(CNc1ccccc1)c(=O)c3ccccc23
CN(C)CC(=O)NCCNS(=O)(=O)N(C)C	ZINC000332455351	nonring
Cn2c[n+](C[C@@H](O)COC[C@H]1CCC=CC1)c3ccccc23	ZINC000000098638	C(COCC1CCC=CC1)C[n+]2c[nH]c3ccccc23
OC(Nc1ccc(Cl)cc1)=NS(=O)(=O)c2csc3ccccc23	ZINC000000606265	O=S(=O)(N=CNc1ccccc1)c2csc3ccccc23
CN(C)CCn2cnc3n(Cc1ccccc1)c(=O)[nH]c(=O)c23	ZINC000000485621	O=c2[nH]c(=O)c1[nH]cnc1n2Cc3ccccc3
C[C@@H]1COCCN1C(=O)C(=O)NCCN	ZINC000035773387	C1COCCN1
NCCNOCC(N)=O	ZINC000307158476	nonring
CN2C[C@@H](NC1CNC1)C(=O)N2	ZINC000307164614	O=C1NNCC1NC2CNC2
CCN1CCC(=O)NC1=O	ZINC000000402094	O=C1CCNC(=O)N1
CN(C)CC(=O)Nc1ccccc1C	ZINC000000393023	c1ccccc1
Cc3cc(C(=O)Oc1cccc2cccnc12)ccc3N(=O)=O	ZINC000000063217	O=C(Oc1cccc2cccnc12)c3ccccc3
NC(=O)CC[n+]1ccccc1	ZINC000000393591	c1ccncc1
C3CN=C(Nc2ccc1nccnc1c2)N3	ZINC000000014042	C3CN=C(Nc2ccc1nccnc1c2)N3
O=c2nncc(N1CCNCC1)[nH]2	ZINC000020394121	O=c2nncc(N1CCNCC1)[nH]2
COc3ccc(CCn2c1CCCc1c(=S)[nH]c2=O)cc3OC	ZINC000000033671	O=c2[nH]c(=S)c1CCCc1n2CCc3ccccc3
Fc4ccc(c2nnc3sc(c1ccc(N(=O)=O)cc1)nn23)cc4	ZINC000000048480	c4ccc(c3nn2c(c1ccccc1)nnc2s3)cc4
CC(C)(C)[C@H](NC(=O)CN)C(N)=O	ZINC000308508342	nonring
OC(=C(C(=O)Nc1ccccc1)S(=O)(=O)c2ccccc2)c3ccccc3	ZINC000000640412	O=C(Nc1ccccc1)C(=Cc2ccccc2)S(=O)(=O)c3ccccc3
CCSC(=O)c1cccc(C(=O)SCC)c1	ZINC000000001324	c1ccccc1
CCc3c(C)n2cc(C(=O)c1ccccc1)nc2nc3OC	ZINC000000001325	O=C(c1ccccc1)c3cn2cccnc2n3
CCC(=O)c1c(O)cc(O)cc1O	ZINC000000001454	c1ccccc1
Cc1nn(CC(N)=O)c(=O)c2ccccc12	ZINC000000209987	O=c1[nH]ncc2ccccc12
Cc2[nH]n(Cc1ccccc1)c(=O)c2[C@H](C(C#N)C#N)c3ccncc3	ZINC000000271761	O=c2c(Cc1ccncc1)c[nH]n2Cc3ccccc3
CC(C)(C)NC[C@@H](O)COc1ccccc1OC[C@@H]2CCCO2	ZINC000000000101	C2COC(COc1ccccc1)C2
CC(C)(C)NC[C@@H](O)COc1ccccc1C#N	ZINC000000000104	c1ccccc1
Cc1cccc(C)c1NC(=O)c2ccccc2NC(=O)c3ccncc3	ZINC000000127534	O=C(Nc1ccccc1C(=O)Nc2ccccc2)c3ccncc3
COc1ccccc1CC(=O)Nc2cc(Cl)ccc2C	ZINC000000030315	O=C(Cc1ccccc1)Nc2ccccc2
CC(C)CNc2nc(c1ccc(N(=O)=O)cc1)nc3ccccc23	ZINC000000072015	c3ccc(c2ncc1ccccc1n2)cc3
OCc1nnn2CCNCc12	ZINC000024565392	C2Cn1nncc1CN2
COc3ccc(n2c(=O)c(Cl)c(Nc1ccccc1O)c2=O)cc3	ZINC000000107276	O=c2cc(Nc1ccccc1)c(=O)n2c3ccccc3
NC[C@@H](O)Cn1cccnc1=O	ZINC000022173360	O=c1nccc[nH]1
N[C@@H]2CCN(C(=O)C1(O)CNC1)C2	ZINC000662394025	O=C(C1CNC1)N2CCCC2
CC(C)Sc2nc1n(C)c(=O)[nH]c(=O)c1n2Cc3ccc(C)cc3	ZINC000000044050	O=c3[nH]c(=O)c2n(Cc1ccccc1)cnc2[nH]3
COc3ccc([C@@H]2C=C(c1ccccc1)NC(=O)[C@@H]2C#N)cc3	ZINC000000031842	O=C3CC(c1ccccc1)C=C(c2ccccc2)N3
N[C@@H]1CCN(O)C1=O	ZINC000003791818	O=C1CCCN1
CCCn3c(=S)[nH]c2cc(C(=O)N1CCC[C@@H](C)C1)ccc2c3=O	ZINC000000425386	O=C(N1CCCCC1)c3ccc2c(=O)[nH]c(=S)[nH]c2c3
CNC(=O)CCCc1cccc2OCCSc12	ZINC000000007449	C2CSc1ccccc1O2
COc3cc2CCN(Cc1ccc(C(O)=O)cc1)Cc2cc3OC	ZINC000000201020	C2Cc1ccccc1CN2Cc3ccccc3
CCNC(=O)NC(=O)CN1CCO[C@H](CN(C)CC(N)=O)C1	ZINC000370230818	C1COCCN1
Cc3nc1c(CCc2c1non2=O)n3O	ZINC000000291856	O=n1onc3c1CCc2[nH]cnc23
NCC(=O)NCc1c[nH]nn1	ZINC000162289421	c1c[nH]nn1
N[C@@H](CN1CCOCC1)C(N)=O	ZINC000045375459	C1COCCN1
Brc3ccc(C(=O)c2conc(c1ccco1)[nH]2)cc3	ZINC000000045554	O=C(c1ccccc1)c3conc(c2ccco2)[nH]3
NCCN1CCN(N(O)N=O)CC1	ZINC000039115380	C1CNCCN1
CCNC(=O)CNC1CCS(=O)(=O)CC1	ZINC000037117145	O=S1(=O)CCCCC1
Cc3ccc(NC(=O)C[C@H]2Nc1cc(C)c(C)cc1NC2=O)c(C)c3	ZINC000000103170	O=C(CC2Nc1ccccc1NC2=O)Nc3ccccc3
COc2ccc(/C=C/C(=O)Nc1ccccc1C(N)=O)cc2OC	ZINC000000006865	O=C(Nc1ccccc1)C=Cc2ccccc2
C[N@@](CC(=O)NC(N)=O)CC1(CO)CC1	ZINC000186782384	C1CC1
CCc3cc2c(SCC(=O)c1ccc(Cl)cc1)ncnc2s3	ZINC000000072469	O=C(CSc1ncnc2sccc12)c3ccccc3
C[C@@H](S[C@H]2Cc1cc(Cl)ccc1Sc3ccccc23)C(N)=O	ZINC000000346651	C2Cc1ccccc1Sc3ccccc23
COC(=O)c2sc(c1ccc(C(C)(C)C)cc1)cc2NC(C)=O	ZINC000000116981	c2ccc(c1cccs1)cc2
CC(C)(C)N(CCO)CCO	ZINC000000396185	nonring
CN3CCC(N(C)[C@@H]2CC(=O)N(c1ccccc1)C2=O)CC3	ZINC000000077141	O=C2CC(NC1CCNCC1)C(=O)N2c3ccccc3
NC[C@H](O)CN2C(=O)[C@H]1C[C@H]1C2=O	ZINC000223559342	O=C2NC(=O)C1CC12
OC[C@@H](O)[C@H]2[C@H](O)[C@@H](O)[C@@H]1CCC[N@]12	ZINC000028651876	C2CC1CCCN1C2
COc1ccc(C=O)cc1Cn2nc(C)c(N(=O)=O)c2C	ZINC000000035780	C(c1ccccc1)n2cccn2
CCNC(N[C@@H]1CCN(C)C1)=NN	ZINC000165228892	C1CCNC1
Cc4ccc(n2nc1CSCc1c2NC(=O)c3cccc(C)c3)cc4	ZINC000000190301	O=C(Nc2c1CSCc1nn2c3ccccc3)c4ccccc4
C[C@H](CO)Nc1nc(N)nc(N)n1	ZINC000142779506	c1ncncn1
CC[C@H](N)[C@@H]1CCCCNC1=O	ZINC000000199212	O=C1CCCCCN1
OC(=O)CSc2nc1ccccc1c(=O)n2c3ccccc3	ZINC000000031995	O=c2n(c1ccccc1)cnc3ccccc23
COc3c(O)ccc([C@@H]2NC(=O)c1c(C)c(C)sc1N2)c3N(=O)=O	ZINC000000043412	O=C2NC(c1ccccc1)Nc3sccc23
Clc3ccc(NC(=S)N1CCS[C@@H]1c2cccs2)cc3	ZINC000000269232	S=C(Nc1ccccc1)N2CCSC2c3cccs3
Cc1cc(C)n(N)c(=O)c1	ZINC000000086953	O=c1cccc[nH]1
CCCc1cc(C(=O)OCC)c(NC(=O)CCCC(O)=O)s1	ZINC000000028443	c1ccsc1
CN1CCOCCOCCN(C)C1=O	ZINC000000275665	O=C1NCCOCCOCCN1
CC(=O)Nc1nonc1N2CCCC2=O	ZINC000000042419	O=C1CCCN1c2cnon2
OCCN(CCO)C(=O)c2cccc3c(=O)c1ccccc1c23	ZINC000000163598	O=c2c1ccccc1c3ccccc23
COc1ccc(Cl)cc1C(=O)Nc2ccc(Br)cn2	ZINC000000235464	O=C(Nc1ccccn1)c2ccccc2
CN(C)C(=O)NCC[N@@](C)CC(=O)NC(N)=O	ZINC000332482604	nonring
CCN1[C@@H](O)[C@H](O)N(CC)C1=O	ZINC000000190124	O=C1NCCN1
COC(=O)c1sccc1NC(=O)CC(C)(C)CC(O)=O	ZINC000000117905	c1ccsc1
CNC(=O)[C@@H](C)NS(=O)(=O)CCN1CCCC1	ZINC000530483191	C1CCNC1
COC(=O)C1=C(C)NC(=O)N[C@@H]1c3cc(Cl)cc2COCOc23	ZINC000000032688	O=C3NC=CC(c2cccc1COCOc12)N3
CN(C)CCNC(=O)c2ccc(S(=O)(=O)N1CCCCC1)cc2	ZINC000000306410	O=S(=O)(N1CCCCC1)c2ccccc2
C[C@@H]1C[N@@](CCO)[C@H](C)CN1C(=O)c2cnn(C[C@@H](O)CO)c2	ZINC000616341729	O=C(N1CCNCC1)c2cn[nH]c2
N#Cc1ccccc1/N=C/c3ccc(\C=N\c2ccccc2C#N)cc3	ZINC000000065667	C(=Nc1ccccc1)c3ccc(C=Nc2ccccc2)cc3
Cc1nnsc1C(=O)N[C@@H]2CCCCNC2=O	ZINC000000153533	O=C1NCCCCC1NC(=O)c2cnns2
ON=c1c(=O)[nH]c(=N)[nH]c1=O	ZINC000008619223	N=c1[nH]c(=O)c(=N)c(=O)[nH]1
Cn1cc(C=O)cn1	ZINC000000109495	c1cn[nH]c1
Brc2cc(\C=N\c1ccccc1)sc2Br	ZINC000000369287	C(=Nc1ccccc1)c2cccs2
CC(C)NC(=O)C[N@@](C)CCC(=O)NC(N)=O	ZINC000011438778	nonring
NC(N)=NN[C@@H]1O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]1O	ZINC000059607050	C1CCOCC1
N[C@@H]1COC[C@@H]1n2cc(CO)nn2	ZINC000307216245	C2CC(n1ccnn1)CO2
CC3(C)C=C(n1ccccc1=O)c2cc(N(=O)=O)ccc23	ZINC000000010426	O=c1ccccn1C2=CCc3ccccc23
C=CCN(CC=C)S(=O)(=O)Cc1ccccc1	ZINC000000029819	c1ccccc1
Fc1cccc(Cl)c1Cn4nnc(c3ccc2OCOc2c3)n4	ZINC000000053548	C4Oc3ccc(c2nnn(Cc1ccccc1)n2)cc3O4
Brc3ccc(C(=O)Nn2cnc1ccccc1c2=O)o3	ZINC000000102827	O=C(Nn2cnc1ccccc1c2=O)c3ccco3
Cc1ccccc1N2CC(=O)N(N)CC2=O	ZINC000000383392	O=C2CN(c1ccccc1)C(=O)CN2
C\C(=N\NC(N)=S)c1ccc(N)cc1	ZINC000000047573	c1ccccc1
Brc3ccc(NCCC(=O)c2ccc1OCOc1c2)cc3	ZINC000000039212	O=C(CCNc1ccccc1)c3ccc2OCOc2c3
C[C@H](CN)NC(=O)C1(O)CNC1	ZINC000662765649	C1CNC1
CN(C)C(=NN)N(C)C	ZINC000004775232	nonring
Cc3ccc2nc(NC(=O)c1ccc(Cl)cc1N(=O)=O)sc2c3	ZINC000000068312	O=C(Nc2nc1ccccc1s2)c3ccccc3
NC(=N)NCCc1ccc(S(N)(=O)=O)cc1	ZINC000006850819	c1ccccc1
Oc3cccc(Nc2nc(c1ccc(Br)cc1)cs2)c3	ZINC000000446562	N(c1ccccc1)c3nc(c2ccccc2)cs3
CC(C)NC(=O)n1cc(F)c(=O)[nH]c1=O	ZINC000000046551	O=c1cc[nH]c(=O)[nH]1
NN=C(N)CC(N)=NN	ZINC000004203861	nonring
NC[C@@H](N)CO	ZINC000022590238	nonring
O=C(CCN1C(=O)CCC1=O)OC[C@H]2CCC[N@]3CCCC[C@@H]23	ZINC000000035433	O=C(CCN1C(=O)CCC1=O)OCC2CCCN3CCCCC23
O[C@@H]1COC[C@@H]1NCCN2CCOCC2	ZINC000037880941	C(CN1CCOCC1)NC2CCOC2
C(Nc3cccc(c2nc1ccccc1s2)c3)c4cccnc4	ZINC000000078099	C(Nc3cccc(c2nc1ccccc1s2)c3)c4cccnc4
CN(CC(N)=O)C(N)=N	ZINC000039077787	nonring
NC[C@@H](O)CN1CCCS1(=O)=O	ZINC000036809233	O=S1(=O)CCCN1
O=C1CCCc2c1non2=O	ZINC000000039503	O=C1CCCc2c1non2=O
NC[C@@H](O)COCc1ccco1	ZINC000000249239	c1ccoc1
Cc1nn(C)c(CO)c1N(=O)=O	ZINC000000120371	c1cn[nH]c1
CN[C@@H]([C@@H](O)CO)[C@@H](O)C=O	ZINC000118361409	nonring
CN3CCN([C@@H]1[C@@H](O)[C@H](NC(=O)NCC=C)[C@H]2CO[C@@H]1O2)CC3	ZINC000022922198	C3CN(C1CCC2COC1O2)CCN3
NCP(=O)(CN)CN	ZINC000001871645	nonring
ON1CC[C@]3(O)[C@@H]1CCc2nonc23	ZINC000000497841	C3CC1C(CCc2nonc12)N3
NC(=N)CCCc1c[nH]cn1	ZINC000000004903	c1c[nH]cn1
NC(=O)[C@H]1C[C@@H](C(N)=O)N1	ZINC000029326571	C1CNC1
Nc4ccc(Oc3ccc2c(=O)n(c1cccc(N)c1)c(=O)c2c3)cc4	ZINC000000050397	O=c3n(c1ccccc1)c(=O)c4cc(Oc2ccccc2)ccc34
NC(=O)c2ncn(CC(=O)NCC[N@]1CCC=CC1)n2	ZINC000651952994	O=C(Cn1cncn1)NCCN2CCC=CC2
Cc3ccc(C)c(C(=O)c1ccccc1NC(=O)c2ccccn2)c3	ZINC000000050395	O=C(Nc1ccccc1C(=O)c2ccccc2)c3ccccn3
Oc3cccc(Nc2ccc(Nc1cccc(O)c1)nn2)c3	ZINC000000009278	N(c1ccccc1)c3ccc(Nc2ccccc2)nn3
CCCc2nc(S(=O)(=O)c1ccc(C)cc1)c(NC)o2	ZINC000000035955	O=S(=O)(c1ccccc1)c2cocn2
C[C@H]2C[C@@H](C)CN(S(=O)(=O)c1ccc(Cl)c(C(O)=O)c1)C2	ZINC000000002163	O=S(=O)(N1CCCCC1)c2ccccc2
COCC(=O)NC[C@H]1O[C@@H](CO)[C@@H](O)[C@H]1N2CCCCC2	ZINC000020465681	C2CCN(C1CCOC1)CC2
NC(=O)c2[nH]c1ccc(Cl)cc1c2S(=O)(=O)c3ccccc3	ZINC000000005691	O=S(=O)(c1ccccc1)c2c[nH]c3ccccc23
NS(=O)(=O)[C@@H]1CNCCN1	ZINC000616650862	C1CNCCN1
CN(C)CCNc1cn[nH]c(=O)c1Cl	ZINC000000126687	O=c1cccn[nH]1
CCc3ccc(C(=O)C=CSc2nc1ccc(C)cc1[nH]2)cc3	ZINC000000068550	O=C(C=CSc2nc1ccccc1[nH]2)c3ccccc3
CC[C@@H](Nc1nc(N)nc(N)n1)C(N)=O	ZINC000624234564	c1ncncn1
Fc3cccc4c(N2CCc1ccccc1C2)ccnc34	ZINC000000026876	C2Cc1ccccc1CN2c3ccnc4ccccc34
Nc2nnc(C1(O)CNC1)n2N	ZINC000575563603	C1NCC1c2nnc[nH]2
NC(=N)[C@@H]1CN(S(N)(=O)=O)CCO1	ZINC000167587000	C1COCCN1
Cc5ccc4n3CCN(C(=O)c1ccco1)[C@@H]2CCCc(c23)c4c5	ZINC000000105648	O=C(N1CCn3c2C1CCCc2c4ccccc34)c5ccco5
OCCN(CCO)Cc1ccccc1F	ZINC000000279749	c1ccccc1
NS(=O)(=O)c3cc2C(=O)N(C1CCCCC1)Cc2cc3Cl	ZINC000000001199	O=C2N(C1CCCCC1)Cc3ccccc23
Cc2ccc(OC[C@H]1CCCN1)cn2	ZINC000000018380	C2CNC(COc1cccnc1)C2
Oc1ccc(Br)cc1\C=N\Cc2csc3ccccc23	ZINC000000069403	C(N=Cc1ccccc1)c2csc3ccccc23
O=C(NC1CC1)c3cc(c2ccccc2)nc4ccccc34	ZINC000000035364	O=C(NC1CC1)c3cc(c2ccccc2)nc4ccccc34
Cc2ccc(NC(=O)c1cccc(N(=O)=O)c1C)c(Br)c2	ZINC000000068134	O=C(Nc1ccccc1)c2ccccc2
COC(=O)[C@@H](C)N(C)C(=O)CNC(=O)CN	ZINC000592272825	nonring
COc1ccc(C(C)C)cc1S(=O)(=O)Nc2ccc(NC(C)=O)cc2	ZINC000001067249	O=S(=O)(Nc1ccccc1)c2ccccc2
CC(C)(N)C(=O)NCCS(N)(=O)=O	ZINC000040920771	nonring
Cc3ccc(NC(=O)CCCn2c(=O)c1ccccc1c2=O)cc3	ZINC000000050998	O=C(CCCn2c(=O)c1ccccc1c2=O)Nc3ccccc3
CSc3[nH]c(c1ccccc1)nc4nc(c2ccccc2)cc(=O)c34	ZINC000000050242	O=c3cc(c1ccccc1)nc4nc(c2ccccc2)[nH]cc34
CN1CCNC[C@@H]1CNS(C)(=O)=O	ZINC000211601810	C1CNCCN1
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[C@H](O)[C@@H](O)[C@H](O)C(=O)CO	ZINC000039284030	nonring
Nc2ccn(CCN1[C@@H](CO)SCC1=O)c(=O)n2	ZINC000000022751	O=C1CSCN1CCn2cccnc2=O
COc1cc(CCN)cc2OCOc12	ZINC000000393470	C2Oc1ccccc1O2
CN(CCO)S(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000000029138	c1ccccc1
Brc3ccc2OCc1noc(=O)n1c2c3	ZINC000000007253	O=c3onc2COc1ccccc1n23
CN(C)CCOC(=O)c1ccc(Cl)c(N)c1	ZINC000000001202	c1ccccc1
NC(=N)NCCc1nn[nH]n1	ZINC000028239903	c1nn[nH]n1
O=N(=O)c1ccccc1S(=O)(=O)NCc2ccco2	ZINC000000040319	O=S(=O)(NCc1ccco1)c2ccccc2
COc2cc([C@@H](C#N)N1N=C(C)CC1(C)C)ccc2O	ZINC000000034908	C2CN(Cc1ccccc1)N=C2
COc3c(C)cnc(CSc2nc1c(C)ccnc1[nH]2)c3C	ZINC000000014070	C(Sc2nc1cccnc1[nH]2)c3ccccn3
C[C@@](O)(CNC(=O)CNC(=O)c1ccc(O)cc1)CN2CCOCC2	ZINC000530648343	O=C(CNC(=O)c1ccccc1)NCCCN2CCOCC2
NC(=O)[C@@H]1CC[N@]1CCO	ZINC000039064493	C1CNC1
COCn1nccc1S(=O)(=O)NC[C@@]2(O)CC[N@@](C)C2	ZINC000530485375	O=S(=O)(NCC1CCNC1)c2ccn[nH]2
Clc3ccc2N1C=CC(=O)C[C@@H]1CCc2c3	ZINC000000022623	O=C3CC2CCc1ccccc1N2C=C3
COc2cc(C(=O)N[C@@H]1C[C@H](C)CC(C)(C)C1)cc(OC)c2OC	ZINC000000035987	O=C(NC1CCCCC1)c2ccccc2
CNS(=O)(=O)CCC[N@]1CC[C@H](NS(C)(=O)=O)C1	ZINC000407947877	C1CCNC1
CCc3ccnc(NC(=O)Nc2ccc(OCc1ccccc1)cc2)c3	ZINC000000148384	O=C(Nc2ccc(OCc1ccccc1)cc2)Nc3ccccn3
N[C@@H]1CCO[C@@H]1C(=O)N2CC(O)C2	ZINC000575577778	O=C(C1CCCO1)N2CCC2
Oc1ccc(Cl)cc1NC=c2c(=O)[nH]c(=S)[nH]c2=O	ZINC000000059283	O=c1[nH]c(=S)[nH]c(=O)c1=CNc2ccccc2
NCCN1CCNS1(=O)=O	ZINC000082655497	O=S1(=O)NCCN1
CNC(=O)CNS(=O)(=O)N1CCNCC1	ZINC000037225087	C1CNCCN1
CCN(CC)CCNc1[nH]c(=O)nnc1C	ZINC000000138524	O=c1nncc[nH]1
COc2ccc(C(=O)N1CCCC1=O)cc2	ZINC000000015951	O=C1CCCN1C(=O)c2ccccc2
O=c2[nH]cc(S(=O)(=O)NC1CNC1)c(=O)[nH]2	ZINC000085256424	O=c2[nH]cc(S(=O)(=O)NC1CNC1)c(=O)[nH]2
CC(=O)NC2(O)C(=O)c1ccccc1C2=O	ZINC000000040260	O=C1CC(=O)c2ccccc12
C[C@@H]2CN(C[C@H](O)C[N@]1CC[C@@](O)(C(N)=O)C1)C[C@@H](C)O2	ZINC000348205639	C2CCN(CCCN1CCOCC1)C2
CNCCNC(=O)C(=O)N1CCN(C)C(=O)C1	ZINC000519414043	O=C1CNCCN1
CC(C)(C)C(=O)NC(=O)Nc1cc(C(F)(F)F)ccc1Cl	ZINC000000076032	c1ccccc1
COC(=O)N1CCN(C(=O)CNC(=O)CN)CC1	ZINC000038101774	C1CNCCN1
NC(=O)NC(=O)CNC[C@@H]1CCOC1	ZINC000038094083	C1CCOC1
CCN(CC)CCNC(=O)C(=O)N[C@@H]1CCNC1=O	ZINC000668328094	O=C1CCCN1
CSc1nc(NC(C)=O)n(C(C)=O)n1	ZINC000000034200	c1nc[nH]n1
O=C(CSc2nc1ccccc1[nH]2)Nc4nc3ccccc3s4	ZINC000000051752	O=C(CSc2nc1ccccc1[nH]2)Nc4nc3ccccc3s4
Cc3ccc(C)c(NC(=O)CSc2nnc(c1ccccc1)o2)c3	ZINC000000107241	O=C(CSc2nnc(c1ccccc1)o2)Nc3ccccc3
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c2cc(O)cc(O)c2	ZINC000000057321	C(Cc1ccccc1)NCCc2ccccc2
CC[C@H](C)[N@@](CCO)CC(=O)NC(N)=O	ZINC000308835920	nonring
CCOc1ccccc1N3[C@@H](c2ccc(Cl)cc2)SCC3=O	ZINC000000031856	O=C2CSC(c1ccccc1)N2c3ccccc3
O=C(CSc2nc1ccccc1o2)Nc4nc3ccccc3s4	ZINC000000051638	O=C(CSc2nc1ccccc1o2)Nc4nc3ccccc3s4
O=C(CN1CCCC1=O)NC2CNC2	ZINC000085255998	O=C(CN1CCCC1=O)NC2CNC2
CN3CC[C@@](O)(c1ccc(F)cc1)[C@H](C(=O)c2ccc(F)cc2)C3	ZINC000000000310	O=C(C1CNCCC1c2ccccc2)c3ccccc3
C[N@]1CCNC[C@@H](C(N)=O)C1	ZINC000072344418	C1CNCCNC1
NC(=N)C1(NS(N)(=O)=O)CC1	ZINC000575471124	C1CC1
NCc1cn(C[C@@H](O)CO)nn1	ZINC000062314437	c1c[nH]nn1
CN(C)C(=O)CCNC(=O)[C@@H]1C[C@@H](O)CN1	ZINC000037751339	C1CCNC1
NC(=N)[C@@H](O)c2ccc1OCOc1c2	ZINC000000000559	C2Oc1ccccc1O2
Fc4ccc(c3nc(c2ccc(NC(=O)c1ccco1)cc2)no3)cc4	ZINC000000037073	O=C(Nc3ccc(c2noc(c1ccccc1)n2)cc3)c4ccco4
Cc3cccc(S(=O)(=O)N1CCS[C@@H]1c2ccccc2)c3	ZINC000000060442	O=S(=O)(N1CCSC1c2ccccc2)c3ccccc3
Cc3ccc(\C=C(/C#N)C(=O)N2CCc1ccccc1C2)o3	ZINC000000029036	O=C(C=Cc1ccco1)N3CCc2ccccc2C3
O[C@@H]2NC(=O)N(c1ccccc1)[C@@H]2O	ZINC000000491459	O=C1NCCN1c2ccccc2
COc3ccc(NC(=O)n2ccc(C(=O)N1CCOCC1)n2)cc3	ZINC000000028523	O=C(Nc1ccccc1)n3ccc(C(=O)N2CCOCC2)n3
OCCN2CCN(C(=O)CNC(=O)c1ccco1)CC2	ZINC000035107162	O=C(CNC(=O)c1ccco1)N2CCNCC2
COc2ccc(C(=O)N1CCC(C)CC1)cc2	ZINC000000029152	O=C(N1CCCCC1)c2ccccc2
CN(C[C@@H](O)CN)[C@@H]1CCS(=O)(=O)C1	ZINC000019685126	O=S1(=O)CCCC1
COC(=O)c1ccc(C(=O)OC)c(NC(=O)C(C)C)c1	ZINC000000029790	c1ccccc1
Cc3nc2cc(NC(=O)c1cccc(C(F)(F)F)c1)ccc2s3	ZINC000000567724	O=C(Nc2ccc1scnc1c2)c3ccccc3
CN(C)CCOCCNC(=O)C(=O)N2CCO[C@H](c1n[nH]c(C)n1)C2	ZINC000583940964	C2COC(c1nc[nH]n1)CN2
C[C@@](N)(CO)c1nnc(N)n1N	ZINC000306356965	c1nnc[nH]1
OC(=O)c4ccc3c(=O)n(CCCc2nc1ccccc1[nH]2)c(=O)c3c4	ZINC000000197916	O=c3n(CCCc2nc1ccccc1[nH]2)c(=O)c4ccccc34
OC2CCN(C[C@@H](O)COc1ccc(Cl)c(Cl)c1)CC2	ZINC000000066354	C2CCN(CCCOc1ccccc1)CC2
C[C@H](N)C(=O)N1CC[C@@](O)(C(N)=O)C1	ZINC000306711005	C1CCNC1
CC(=O)NCC(=O)N1CCC[C@@H]1C(=O)N[C@@H]3[C@H]2CNC[C@H]23	ZINC000648140509	O=C(NC2C1CNCC12)C3CCCN3
CCOc3cc(\C=N\c2sc1CCCCc1c2C#N)ccc3O	ZINC000000047317	C3CCc2sc(N=Cc1ccccc1)cc2C3
CC3(C)O[C@H]2O[C@H]([C@@H](O)CO)[C@H](OCc1ccccc1)[C@H]2O3	ZINC000000042934	C3OC2OCC(OCc1ccccc1)C2O3
FC(F)(F)c2ccnc(N1CCCNCC1)n2	ZINC000000066276	C2CNCCN(c1ncccn1)C2
C[C@@]14CCCN1c3cc2[nH]c(=O)cc(C(F)(F)F)c2cc3CC4	ZINC000000007303	O=c4ccc3cc2CCC1CCCN1c2cc3[nH]4
O=c3n(CC[C@H](Cc1ccccc1)c2ccco2)c(=O)c4ccccc34	ZINC000000489417	O=c3n(CCC(Cc1ccccc1)c2ccco2)c(=O)c4ccccc34
N[C@H]1C[C@@H]1NC(=O)[C@@H]2CCC(=O)N2	ZINC000036234011	O=C2CCC(C(=O)NC1CC1)N2
OCCN(CCO)Cc1c[nH]c(=O)[nH]c1=O	ZINC000001682039	O=c1cc[nH]c(=O)[nH]1
Cc2cc(\C=c1/c(=O)[nH]c(=S)n(CC=C)c1=O)c(C)n2c4sc3CCCCc3c4C#N	ZINC000000635649	O=c1[nH]c(=S)[nH]c(=O)c1=Cc4ccn(c3cc2CCCCc2s3)c4
CC(=O)Nc3ccc(NC(=O)Cc1cccc2ccccc12)cc3	ZINC000000072433	O=C(Cc1cccc2ccccc12)Nc3ccccc3
Brc3cncc(C(=O)Nc2ccc1OCOc1c2)c3	ZINC000000037927	O=C(Nc2ccc1OCOc1c2)c3cccnc3
CCc1cccc(CC)c1NC(=O)NCC3(c2ccccc2)CC3	ZINC000000025239	O=C(NCC2(c1ccccc1)CC2)Nc3ccccc3
S=c3[nH]c(c2ccc(Oc1ccccc1)cc2)cn3c4ccccc4	ZINC000000424448	S=c3[nH]c(c2ccc(Oc1ccccc1)cc2)cn3c4ccccc4
COc2ccc(OC(=O)c1ccc(Br)cc1)c(C(C)=O)c2	ZINC000000262430	O=C(Oc1ccccc1)c2ccccc2
CC(C)[C@H]2[C@@H](c1ccc(Cl)cc1Cl)OC(=O)C(C)(C)C2=O	ZINC000000086833	O=C2CC(c1ccccc1)OC(=O)C2
COc4ccc(c2nc1ccccc1nc2c3ccccc3)cc4OC	ZINC000000387558	c4ccc(c2nc1ccccc1nc2c3ccccc3)cc4
Nc2ncn(C(=O)c1ccco1)n2	ZINC000000047402	O=C(c1ccco1)n2cncn2
CN(C)C(=O)Cn1ccnc1	ZINC000000492312	c1c[nH]cn1
O=C(COc1ccccc1)NCCN2CCCC2	ZINC000000383099	O=C(COc1ccccc1)NCCN2CCCC2
COc1cc(N(=O)=O)cc2c(CCN)c(C(O)=O)[nH]c12	ZINC000000077284	c2ccc1[nH]ccc1c2
Cn3c1ccccc1c4cc([C@@H]2N[C@@H](C(O)=O)CS2)ccc34	ZINC000000205071	C4CSC(c3ccc2[nH]c1ccccc1c2c3)N4
C[C@H](NS(N)(=O)=O)[C@@H]1CCCNC1	ZINC000167469389	C1CCNCC1
CO[C@@H]1O[C@@H](C)[C@@H](O)[C@@H](N)[C@H]1O	ZINC000034589288	C1CCOCC1
Cn1nnnc1CNC(N)=NN	ZINC000306561290	c1nnn[nH]1
CCOC(=O)Cc2csc(NC(=O)[C@@H]1CCCC[C@@H]1C(O)=O)n2	ZINC000000205096	O=C(Nc1nccs1)C2CCCCC2
COC(=O)C1=C(C)NC(=O)N[C@@H]1c2ccccc2SC(F)F	ZINC000000003681	O=C2NC=CC(c1ccccc1)N2
COc1ccccc1c3nnc(SCc2ccccc2Cl)n3C	ZINC000000422418	C(Sc2nnc(c1ccccc1)[nH]2)c3ccccc3
O=C(Nc1ccc2[nH]c(=O)c3cccc1c23)C5C4CC6CC(C4)CC5C6	ZINC000000127479	O=C(Nc1ccc2[nH]c(=O)c3cccc1c23)C5C4CC6CC(C4)CC5C6
CNC(=O)NC(=O)[C@@H](C)NCCNS(C)(=O)=O	ZINC000035207944	nonring
CNCC(=O)N1CCC(C(=O)NC)CC1	ZINC000036136423	C1CCNCC1
C[C@@H](O)C[N+](=O)Cc1ccccc1	ZINC000000126541	c1ccccc1
CCS(=O)(=O)N2CCC(C(=O)NCC[N@]1CCCC[C@@H]1C)CC2	ZINC000000262546	O=C(NCCN1CCCCC1)C2CCNCC2
CCOC(=O)c1ccccc1NC(=O)C(C)C	ZINC000000029806	c1ccccc1
O=C(Nc3nc(c1ccccc1)c(c2ccccc2)s3)c4ccco4	ZINC000000066468	O=C(Nc3nc(c1ccccc1)c(c2ccccc2)s3)c4ccco4
Oc1cccc2c(=O)[nH]c(=O)oc12	ZINC000000003754	O=c2[nH]c(=O)c1ccccc1o2
NC(=O)CNCC(=O)N1CCOCC1	ZINC000020056916	C1COCCN1
NC(N)N=NC=CN=NC(N)=N	ZINC000008614676	nonring
CCOC(=O)c2[nH]c1ccc(C)cc1c2NC(=O)CN(C)C	ZINC000000117603	c2ccc1[nH]ccc1c2
N#Cc4ccc(C2N(c1ccccc1)CCN2c3ccccc3)cc4	ZINC000000095863	C3CN(c1ccccc1)C(c2ccccc2)N3c4ccccc4
O=C(NCCn1cccn1)[C@H]2CNCCO2	ZINC000043801366	O=C(NCCn1cccn1)C2CNCCO2
CNC(=O)CS(=O)(=O)CCN	ZINC000058249919	nonring
Cn2c[n+](C[C@@H](O)COC1CCCCC1)c3ccccc23	ZINC000000110076	C3CCC(OCCC[n+]1c[nH]c2ccccc12)CC3
CCCC(=O)C3=C(Nc2ccc1ccccc1c2)CC(C)(C)CC3=O	ZINC000000340906	O=C3CCCC(Nc2ccc1ccccc1c2)=C3
CN(CC[C@@H](N)CC(=O)N[C@H]2C=C[C@H](n1ccc(N)nc1=O)O[C@@H]2C(O)=O)C(N)=N	ZINC000001612188	O=c1ncccn1C2OCCC=C2
Cc2[nH]c1ccccc1c2C(=O)CSc3nnnn3c4ccccc4	ZINC000000125788	O=C(CSc1nnnn1c2ccccc2)c3c[nH]c4ccccc34
COc2ccc(NC(=O)CN(c1cc(C)ccc1OC)S(C)(=O)=O)cc2Cl	ZINC000000622157	O=C(CNc1ccccc1)Nc2ccccc2
CNS(=O)(=O)c3ccc(NC(=O)N2CC([N@]1CC[C@@H](O)C1)C2)nc3	ZINC000650136280	O=C(Nc1ccccn1)N3CC(N2CCCC2)C3
CCCC(=O)Nc1ccc(OC[C@@H](O)CNC(C)C)c(C(C)=O)c1	ZINC000000156792	c1ccccc1
NCCS(=O)(=O)NC1CC1	ZINC000011584547	C1CC1
COc2ccc(NC(=O)c1sc(N)c(C(=O)OC(C)C)c1C)cc2	ZINC000000204309	O=C(Nc1ccccc1)c2cccs2
OC(=O)C3CCC(n2c(=O)c1cc(Cl)c(Cl)cc1c2=O)CC3	ZINC000000194178	O=c2n(C1CCCCC1)c(=O)c3ccccc23
CC(C)CCSc3nc(N)c2c1CC(C)(C)OCc1sc2n3	ZINC000000102961	C1Cc2c(CO1)sc3ncncc23
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
Nc1nc(=O)c(=N)c(=N)[nH]1	ZINC000005412987	N=c1[nH]cnc(=O)c1=N
CN(C)C[C@@H](O)COc1ccccc1CCc2ccccc2	ZINC000000013099	C(Cc1ccccc1)c2ccccc2
N[C@@H](Cn1cncn1)C(N)=O	ZINC000045435671	c1nc[nH]n1
NC[C@@H](O)[C@@H](O)CO	ZINC000033610361	nonring
N[C@@H]1[C@@H](O)[C@@H](O)[C@@H](O)[C@@]1(O)CO	ZINC000013904530	C1CCCC1
CC(=O)NN3[C@@H](c1ccccc1O)Nc2ccccc2C3=O	ZINC000000032163	O=C2NC(c1ccccc1)Nc3ccccc23
CC(C)(C)c2ccc(C(=O)OCc1cc(Cl)nc(Cl)c1)cc2	ZINC000000165975	O=C(OCc1ccncc1)c2ccccc2
O=C(CSC(=S)NNc1ccccc1)c2cccc(N(=O)=O)c2	ZINC000000093223	O=C(CSC(=S)NNc1ccccc1)c2ccccc2
Cn1nc(N)[n+](C)n1	ZINC000002541238	c1nn[nH]n1
Nc2nc(N)nc(N1CCOCC1)n2	ZINC000001603965	C2CN(c1ncncn1)CCO2
CN2C[C@@H](NC(=O)C(=O)N[C@H]1CCNC1)CC2=O	ZINC000568534885	O=C2CC(NC(=O)C(=O)NC1CCNC1)CN2
NC[C@@H]1COCCN(S(N)(=O)=O)C1	ZINC000616664326	C1CNCCOC1
O[C@H](CSc2nc1ccccc1[nH]2)c3ccc(Cl)c(Cl)c3	ZINC000000389393	C(Cc1ccccc1)Sc3nc2ccccc2[nH]3
CO[C@@H]1[C@@H](N)[C@@H](O)[C@@H](O)[C@H]1O	ZINC000025999184	C1CCCC1
C[C@@H](CN)N1CCN(CCO)CC1	ZINC000019794319	C1CNCCN1
COc1ccc(OC)c([C@@H](O)CNC(=O)CN)c1	ZINC000000403079	c1ccccc1
Cc2ncc(Cn1c(C)c(CCO)sc1=O)c(N)n2	ZINC000000002152	O=c1sccn1Cc2cncnc2
Cn1nccc1S(=O)(=O)NCCN2CCC(O)CC2	ZINC000321290974	O=S(=O)(NCCN1CCCCC1)c2ccn[nH]2
CC(C)(N)CNC(=O)CN1CCNCC1=O	ZINC000236603493	O=C1CNCCN1
COc2ccc(S(=O)(=O)Nc1ccccc1C(=O)NC(C)(C)C)cc2OC	ZINC000000645849	O=S(=O)(Nc1ccccc1)c2ccccc2
CN(C)CCNC(=O)Cn2nc(c1ccc(C)cc1)ccc2=O	ZINC000000220025	O=c2ccc(c1ccccc1)n[nH]2
C(Nn1cnnc1)n2nnc3ccccc23	ZINC000000408266	C(Nn1cnnc1)n2nnc3ccccc23
CN2CC[C@@](N)(C(=O)N[C@H]1CN(C)C(=O)C1)C2	ZINC000643666666	O=C2CC(NC(=O)C1CCNC1)CN2
CCN(CCO)C(=O)[C@@H]1C[C@@H](O)CN1	ZINC000037809377	C1CCNC1
OC2(C(=O)N1CCNCC1)CNC2	ZINC000662392093	O=C(C1CNC1)N2CCNCC2
CCN2C=C(C(=O)OC)C(c1ccccc1Cl)C(C(=O)OC)=C2	ZINC000000036516	N2C=CC(c1ccccc1)C=C2
O=C(CSc2nc(c1ccncc1)ccc2C#N)NC3CC3	ZINC000000033166	O=C(CSc2cccc(c1ccncc1)n2)NC3CC3
C[C@@H](O)C(=O)NCCN	ZINC000039068581	nonring
COc2ccc(NC(=O)CCN1CCC(C(N)=O)CC1)c(OC)c2	ZINC000000256858	O=C(CCN1CCCCC1)Nc2ccccc2
COCC[N@]1CCC[C@H]1CNC(=O)N[C@H]2CCNC2=O	ZINC000660700789	O=C(NCC1CCCN1)NC2CCNC2=O
CNC(=O)NC[C@@](C)(O)CN(C)C	ZINC000228631671	nonring
Cc1ccccc1NS(=O)(=O)c4cccc(c3nnc(c2ccccc2)o3)c4	ZINC000000707852	O=S(=O)(Nc1ccccc1)c4cccc(c3nnc(c2ccccc2)o3)c4
COC(=O)[C@H]1C[C@@H]1C(=O)NCCC[N@]2CCC[C@H]2C(N)=O	ZINC000600234347	O=C(NCCCN1CCCC1)C2CC2
CC[N@@](C)C[C@@H](O)CN1CCn2c(C1)n[nH]c2=O	ZINC000516781811	O=c2[nH]nc1CNCCn12
OCCn3c(=O)c2ccc(Oc1ccc(N(=O)=O)cc1)cc2c3=O	ZINC000000059324	O=c2[nH]c(=O)c3cc(Oc1ccccc1)ccc23
CC(C)[C@@H](NS(C)(=O)=O)C(=O)NCCN(C)C	ZINC000332449004	nonring
C[N@]1CC[C@@H](CNCC(=O)NC(N)=O)C1	ZINC000037485093	C1CCNC1
Clc1ccccc1C(=O)O/N=C(/c2ccccc2)c3ccncc3	ZINC000000208786	O=C(ON=C(c1ccccc1)c2ccncc2)c3ccccc3
O=C(CCn1c(=O)oc2ccccc12)NCCN3CCCCC3	ZINC000000128540	O=C(CCn1c(=O)oc2ccccc12)NCCN3CCCCC3
NC(=O)CC(=O)N1CCNCC1	ZINC000082633681	C1CNCCN1
C[C@@H](N)CNC(=O)c1ccc(S(N)(=O)=O)cn1	ZINC000648129417	c1ccncc1
OC(=O)CCn2cnc(c1ccccc1)c2c3ccccc3	ZINC000000086855	c3ccc(c1nc[nH]c1c2ccccc2)cc3
CC(C)COC(=O)c1ccccc1n3c(=O)c2ccccc2c3=O	ZINC000000033010	O=c2n(c1ccccc1)c(=O)c3ccccc23
OC(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc3ccc2OCCOc2c3	ZINC000000113631	O=C(Nc2ccc1OCCOc1c2)C3CCCCC3
C[C@@H]2CNC[C@H](C(=O)N=c1nc[nH]n1C)O2	ZINC000662502206	O=C(N=c1nc[nH][nH]1)C2CNCCO2
N[C@]1(O)NC(=N)NC=C1	ZINC000100292834	N=C1NCC=CN1
CC(C)[C@H](N(C)C)C(=O)NCCNS(C)(=O)=O	ZINC000332507567	nonring
COc3ccc(\C=c1\c(=O)[nH]c2ccccc12)cc3O[C@@H]4C[C@H]5CC[C@@H]4C5	ZINC000000600524	O=c2[nH]c1ccccc1c2=Cc5cccc(OC3CC4CCC3C4)c5
CO[C@H]1CNC[C@H]1NC(N)=O	ZINC000036263343	C1CCNC1
COc2cc(Br)c1CCC(=O)c1c2OC	ZINC000000008028	O=C1CCc2ccccc12
CN(C)CC(C)(C)CNC(=O)CNC(N)=O	ZINC000332508794	nonring
Cn1cccc1C(=O)[C@H](C#N)C(=O)Nc2ccccc2	ZINC000000004247	O=C(CC(=O)c1ccc[nH]1)Nc2ccccc2
COc3cc2ncnc(Nc1cc(Cl)c(Cl)cc1F)c2cc3OC	ZINC000000589460	N(c1ccccc1)c2ncnc3ccccc23
CC(=O)Oc4ccc3occ(C(=O)c2cc1ccccc1o2)c3c4	ZINC000000036624	O=C(c2cc1ccccc1o2)c3coc4ccccc34
Cc4ccc3nc(c1ccccc1)cc(C(=O)N2CCCCC2)c3c4	ZINC000000045159	O=C(N1CCCCC1)c3cc(c2ccccc2)nc4ccccc34
O[C@H](CN1CCCCC1)Cn2ccnc2N(=O)=O	ZINC000000000630	C2CCN(CCCn1ccnc1)CC2
COc2ccc(CNC1CCN(C)CC1)c(OC)c2	ZINC000000182698	C2CC(NCc1ccccc1)CCN2
COc3ccc(NC(=O)C(=C/c2ccc1OCOc1c2)/C#N)cc3	ZINC000000048011	O=C(Nc1ccccc1)C=Cc3ccc2OCOc2c3
COc4ccc(c2nc1ccccc1n2CCc3ccccc3)cc4	ZINC000000104784	C(Cn2c(c1ccccc1)nc3ccccc23)c4ccccc4
COc3cc(c2oc(c1ccc(O)c(OC)c1)c(C)c2C)ccc3O	ZINC000000019047	c3ccc(c2ccc(c1ccccc1)o2)cc3
COc3ccc(S(=O)(=O)Nc1cccc2cc(C(O)=O)[nH]c12)cc3	ZINC000000154319	O=S(=O)(Nc1cccc2cc[nH]c12)c3ccccc3
O=C(COc1ccccc1)NC(=S)N2CCCc3ccccc23	ZINC000000048466	O=C(COc1ccccc1)NC(=S)N2CCCc3ccccc23
CC[C@@H]2C(=O)O[C@H](c1ccc(Cl)cc1)C(C)(C)C2=O	ZINC000000036841	O=C2CC(c1ccccc1)OC(=O)C2
O[C@@H]2CN(C1CNC1)C[C@H]2O	ZINC000236524841	C2CCN(C1CNC1)C2
NC(=N)C(N)=O	ZINC000020230839	nonring
CC(=O)N1CCN(CC(N)=O)C[C@@H](C(N)=O)C1	ZINC000257230001	C1CNCCNC1
COCC(=O)N2CCO[C@@H]1CNC[C@H]12	ZINC000306272982	C2COC1CNCC1N2
N/C(=N\O)N1C[C@H](O)[C@H](CO)C1	ZINC000306472737	C1CCNC1
N[C@@H]1C[C@@H](C(N)=O)N(C=O)C1	ZINC000039063049	C1CCNC1
O=C2C[C@H](NCCN1CCOCC1)C(=O)N2	ZINC000102669314	O=C2CC(NCCN1CCOCC1)C(=O)N2
O[C@@]13NC(=O)N(CC=C)[C@]1(O)c2ccccc2C3=O	ZINC000000052881	O=C1NC3C(N1)c2ccccc2C3=O
Clc3ccc2oc(C(=O)c1ccc(Cl)c(Cl)c1)cc2c3	ZINC000000150598	O=C(c1ccccc1)c3cc2ccccc2o3
ClC(Cl)(Cl)[C@@H](NC(=O)c1ccccc1)Nc2ncccn2	ZINC000000158331	O=C(NCNc1ncccn1)c2ccccc2
NC[C@@]1(O)CCNC1	ZINC000034321166	C1CCNC1
CCOC(=O)C1=C(C)NC3=C([C@H]1c2cc(C)sc2C)C(=O)CCC3	ZINC000000122315	O=C1CCCC3=C1C(c2ccsc2)C=CN3
COc4ccc(N1C(=O)CS[C@@]13C(=O)Nc2ccc(C)cc23)cc4	ZINC000000046889	O=C1CSC4(N1c2ccccc2)C(=O)Nc3ccccc34
Fc4ccc(C(=O)n1nccc1c3csc(c2ccccc2)n3)cc4	ZINC000000122588	O=C(c1ccccc1)n2nccc2c4csc(c3ccccc3)n4
COC(=O)CSc2nc1ccccc1c(=O)n2CC=C	ZINC000000028519	O=c1[nH]cnc2ccccc12
Clc4ccc(Nc2nnc(Cc1ccncc1)c3ccccc23)cc4	ZINC000000007460	C(c1ccncc1)c3nnc(Nc2ccccc2)c4ccccc34
N[C@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(O)=O	ZINC000001575285	C1CCNC1
CCNC(=O)CNC(=O)CN	ZINC000035138329	nonring
CC(CO)(CO)NC(N)=N	ZINC000129265653	nonring
COc1ccccc1NC(=O)CSc2nc(N)cc(N)n2	ZINC000000379437	O=C(CSc1ncccn1)Nc2ccccc2
CC3=C(C(N)=O)[C@@H](c1ccccn1)n2nc[nH]c2=N3	ZINC000000071248	C3=CC(c1ccccn1)n2nc[nH]c2=N3
CCOC(=O)C1=C(C)OC(N)=C(C#N)[C@H]1c2ccc(F)cc2	ZINC000000043655	O2C=CC(c1ccccc1)C=C2
CC(=O)Nc2ccc(C(=O)NC1=NCCS1)cc2	ZINC000000030064	O=C(NC1=NCCS1)c2ccccc2
OC(=O)C[C@@H](CC(=O)Nc1cc(Cl)cc(Cl)c1)c2ccc(Cl)cc2Cl	ZINC000001045927	O=C(CCc1ccccc1)Nc2ccccc2
C[N@@](CCO)C[C@@H](O)CC1(O)CCC1	ZINC000625084557	C1CCC1
C[C@H](Sc1nnc(C)n1C2CCCCC2)C(=O)NCc3ccco3	ZINC000000560527	O=C(CSc1nncn1C2CCCCC2)NCc3ccco3
OC[C@H]2CN(C(=O)C1(O)CNC1)CCO2	ZINC000662590697	O=C(C1CNC1)N2CCOCC2
Oc3c([C@H](N1CCCC1)c2ccc(Cl)cc2)ccc4cccnc34	ZINC000000038269	C4CCN(C(c1ccccc1)c3ccc2cccnc2c3)C4
O[C@@H]1CS(=O)(=O)C[C@@H]1N2CCCC2	ZINC000004226045	O=S2(=O)CCC(N1CCCC1)C2
CCOC(=O)Cc2csc(NC(=O)Cc1ccccc1N(=O)=O)n2	ZINC000000457007	O=C(Cc1ccccc1)Nc2nccs2
NC[C@@H](O)c1cccc(O)c1	ZINC000000119283	c1ccccc1
CNC(NC(N)=N)=CN(=O)=O	ZINC000012949817	nonring
CCn2c(SCC(=O)NCc1ccco1)nnc2c3cccs3	ZINC000000356583	O=C(CSc2nnc(c1cccs1)[nH]2)NCc3ccco3
COc2ccc(NC(=O)Cc1cccs1)c(OC)c2	ZINC000000030448	O=C(Cc1cccs1)Nc2ccccc2
Oc2nc1cc(Cl)ccc1c(O)c2C(=O)c3cccs3	ZINC000000020182	O=C(c2cnc1ccccc1c2)c3cccs3
CN2C[C@@H](NC(=O)[C@@H]1C[N@@](C)CCO1)C(=O)N2	ZINC000562183206	O=C1NNCC1NC(=O)C2CNCCO2
CC(=O)N1CCN(C(N)=N)CC1	ZINC000002599496	C1CNCCN1
Cc3cc1oc(=O)c(C)c(C)c1c4occ(c2ccc(Cl)cc2)c34	ZINC000000095485	O=c4ccc3c(ccc2c(c1ccccc1)coc23)o4
CC(=O)c2cccc(NS(=O)(=O)c1ccc(N(=O)=O)cc1)c2	ZINC000000180198	O=S(=O)(Nc1ccccc1)c2ccccc2
O=C(Nc1nccs1)c3cn(c2ccccc2)nc3c4ccccc4	ZINC000000453684	O=C(Nc1nccs1)c3cn(c2ccccc2)nc3c4ccccc4
Cc3sc2[nH]c(SCC(=O)NC1CCCCC1)nc(=O)c2c3C	ZINC000000076233	O=C(CSc2nc(=O)c1ccsc1[nH]2)NC3CCCCC3
CC(C)OC[C@@H](O)C[N@]1CC[C@H](S(N)(=O)=O)C1	ZINC000330364075	C1CCNC1
NCCNS(=O)(=O)c1cccc(S(N)(=O)=O)c1	ZINC000036286502	c1ccccc1
NCC(=O)Nc1nn[nH]n1	ZINC000060120066	c1nn[nH]n1
CCc3c(C)[nH]c2nnc(c1ccccc1OC)n2c3=O	ZINC000000034728	O=c2cc[nH]c3nnc(c1ccccc1)n23
CN3C(=O)N(c1ccccc1)C2(CCNCC2)C3=O	ZINC000000016722	O=C2NC(=O)C1(CCNCC1)N2c3ccccc3
NC(=O)CON=C1NCCN1	ZINC000165730587	N=C1NCCN1
C[C@@H](CN1CCCCC1)NC(=O)C(=O)NCC(=O)N2CCNCC2	ZINC000642733453	O=C(CNC(=O)C(=O)NCCN1CCCCC1)N2CCNCC2
Cc2cc(=O)oc3cc(OC(=O)c1ccc(F)cc1)ccc23	ZINC000000034722	O=C(Oc2ccc1ccc(=O)oc1c2)c3ccccc3
Oc2c(C(=O)Nc1ccc(Br)cn1)cnc3ccccc23	ZINC000000043506	O=C(Nc1ccccn1)c3cnc2ccccc2c3
Nc2n(CCO)c1ccccc1[n+]2N	ZINC000000274868	c2ccc1[nH]cnc1c2
O=S(=O)(Nc2ccc(c1cnco1)cc2)c3ccccc3	ZINC000000143536	O=S(=O)(Nc2ccc(c1cnco1)cc2)c3ccccc3
NC(=O)C[C@@]2(O)CCCN(CC#CC[N@]1CCC[C@@](O)(CC(N)=O)C1)C2	ZINC000643807293	C2CCN(CC#CCN1CCCCC1)CC2
C[C@@H](C1CC1)N(CC(=O)NC(N)=O)CC(=O)NC(N)=O	ZINC000047550829	C1CC1
CCOC(=O)c2cnc1ccc(OCC)cc1c2NCCN(C)C	ZINC000000071821	c2ccc1ncccc1c2
CCCC2=C(C(=O)OCC)[C@@H](c1ccc(O)c(OCC)c1)NC(=O)N2	ZINC000000618666	O=C2NC=CC(c1ccccc1)N2
C[C@@H](O)CN(C[C@@H](C)O)Cc1ccccc1Cl	ZINC000000214572	c1ccccc1
C[C@@H]2CN[C@@H](C(=O)N[C@@H]1CCCNC1=O)CN2	ZINC000062815486	O=C1NCCCC1NC(=O)C2CNCCN2
Clc3ccc(N2C(=O)CN(c1ccccc1)C2=S)cc3	ZINC000000047558	O=C2CN(c1ccccc1)C(=S)N2c3ccccc3
O=C3CN(C(=O)CN2C[C@@H]1CNC[C@H]1C2)CCN3	ZINC000359311001	O=C3CN(C(=O)CN2CC1CNCC1C2)CCN3
Cn1nnnc1NCC2(O)CNC2	ZINC000300716722	C1NCC1CNc2nnn[nH]2
N[C@@H]1CCCN(C[C@H](N)C(N)=O)C1	ZINC000127894188	C1CCNCC1
CN[C@@H](CNC(N)=N)C(O)=O	ZINC000028236146	nonring
CCC(C)(C)NC2=NS(=O)(=O)c1sc(Cl)cc1N2	ZINC000000025913	O=S2(=O)N=CNc1ccsc12
CCN1C2C(NC1=O)NC(=O)N2CC	ZINC000000289613	O=C2NC1NC(=O)NC1N2
COc1ccc(N(=O)=O)cc1NC(=O)CCN2CCN(C)CC2	ZINC000000119867	O=C(CCN1CCNCC1)Nc2ccccc2
N[C@@H](CN1C(=O)CCC1=O)C(N)=O	ZINC000045460987	O=C1CCC(=O)N1
CN2[C@@H](N(O)C(=O)Nc1ccccc1)C(C)(C)SC2=S	ZINC000000363874	O=C(NC1CSC(=S)N1)Nc2ccccc2
COc3ccc2cc([C@@H](C)C(=O)Nc1ccccc1C)ccc2c3	ZINC000000103446	O=C(Cc2ccc1ccccc1c2)Nc3ccccc3
CS(=O)(=O)CCNC(N)=N	ZINC000052019199	nonring
CNS(=O)(=O)CC(=O)NCC[N@@](C)C(C)C	ZINC000332514244	nonring
Nc2cc(N)nc(SCC(=O)N1CCOCC1)n2	ZINC000000418002	O=C(CSc1ncccn1)N2CCOCC2
NCCNC(=O)c1c[nH]c(=O)[nH]1	ZINC000037902414	O=c1[nH]cc[nH]1
COC[C@@H](C)NC(=O)Cc1ccc(Br)cc1	ZINC000000031716	c1ccccc1
CC(=O)N[C@@H]1[C@@H](N)C=C(C(O)=O)O[C@H]1[C@H](O)[C@H](O)CN	ZINC000005884077	C1COC=CC1
CCN(C(=O)c1cc(C(=O)OC)cc(N(=O)=O)c1)c2ccccc2	ZINC000000060855	O=C(Nc1ccccc1)c2ccccc2
Cc2nc(C)c(Cl)c(NS(=O)(=O)c1ccc(N)cc1)n2	ZINC000000002090	O=S(=O)(Nc1ccncn1)c2ccccc2
CCNC(=O)N[C@H]1[C@H](O)[C@@H](N(C)CCN(C)C)[C@@H]2OC[C@H]1O2	ZINC000022922224	C1CC2COC(C1)O2
CCOC(=O)c2cccc(NC(=O)CCc1ccccc1)c2	ZINC000000031718	O=C(CCc1ccccc1)Nc2ccccc2
O=C1CCC(=O)N1CC(=O)N2CCNCC2	ZINC000019432529	O=C1CCC(=O)N1CC(=O)N2CCNCC2
CN(C)CCN2C[C@@H](C(=O)N[C@@H]1CCNC(=O)CC1)CC2=O	ZINC000616359025	O=C2CCC(NC(=O)C1CNC(=O)C1)CCN2
CS(=O)(=O)N2CC[C@@H](NC(=O)NC[C@@H](N)C1CC1)C2	ZINC000583939548	O=C(NCCC1CC1)NC2CCNC2
CNC(=O)[C@@H]2CN(C(=O)C(=O)NC[C@@H](O)CN(C)C)c1ccccc1O2	ZINC000616327554	C2COc1ccccc1N2
CN(C)CCNC(=O)Cn2cnc1sc(C)c(C)c1c2=O	ZINC000000109567	O=c1[nH]cnc2sccc12
CNC(=O)C[N@@](C)CCCS(=O)(=O)NC	ZINC000332439223	nonring
Cc1oc(C(C)(C)C)cc1C(=O)N[C@H](Cc2ccccc2)C(O)=O	ZINC000000330904	O=C(NCCc1ccccc1)c2ccoc2
C[C@@]1(NCCO)CCS(=O)(=O)C1	ZINC000003098912	O=S1(=O)CCCC1
C[C@@H](N)C(=O)N[C@@H](C)C(=O)N1CCC[C@H]1C(=O)NCC(N)=O	ZINC000040392939	C1CCNC1
Cc1nc(N)c(CN(CCO)CCO)c(=O)[nH]1	ZINC000005530332	O=c1ccnc[nH]1
O=C(CSc2nc1ccccc1c(=O)[nH]2)c4cc3ccccc3o4	ZINC000000070064	O=C(CSc2nc1ccccc1c(=O)[nH]2)c4cc3ccccc3o4
CCOC(=O)c1c(NC(C)=O)sc2c(O)cccc12	ZINC000000033484	c2ccc1sccc1c2
Cc3cc(c1csc(=S)n1Nc2ccccc2)ccc3Cl	ZINC000000093230	S=c2scc(c1ccccc1)n2Nc3ccccc3
CNS(=O)(=O)CC(=O)N[C@@H]1CNCC[C@@H]1C	ZINC000186878400	C1CCNCC1
CCOC(=O)c1c(C)c(C)sc1NC(N)=O	ZINC000000033483	c1ccsc1
CC(=O)n2ccc(C(=O)Nc1nccs1)n2	ZINC000000032374	O=C(Nc1nccs1)c2cc[nH]n2
O[C@H](COC[C@@H]1CCCO1)CN3CC(N2CCNC2=O)C3	ZINC000660688977	O=C1NCCN1C3CN(CCCOCC2CCCO2)C3
Cc2ccc(NC(=O)N[C@@H](Cc1ccccc1)C(O)=O)cc2Cl	ZINC000000536727	O=C(NCCc1ccccc1)Nc2ccccc2
CC[C@@](C)(NS(=O)(=O)c1c(C)ccc2nsnc12)C#C	ZINC000000033712	c2ccc1nsnc1c2
Cc2cnc1n(C)c(=O)n(C)c(=O)c1n2	ZINC000000332373	O=c2[nH]c(=O)c1nccnc1[nH]2
COc2cc(NC(=O)c1c(F)cccc1F)nc(OC)n2	ZINC000000052691	O=C(Nc1ccncn1)c2ccccc2
N[C@@H](C=O)[C@@H](O)C=O	ZINC000034874692	nonring
OCCn2nnc(c1ccccc1)n2	ZINC000000340445	c2ccc(c1nn[nH]n1)cc2
OCCN(CO)CCO	ZINC000001590821	nonring
N[C@@H](CO)c1nc(N)n[nH]1	ZINC000041050701	c1nc[nH]n1
O=C(CNC(=O)C1CNC1)N2CCOCC2	ZINC000261532996	O=C(CNC(=O)C1CNC1)N2CCOCC2
CC(C)c3ccc(N2C(=O)C[C@@H](Sc1ccccc1N)C2=O)cc3	ZINC000000097259	O=C2CC(Sc1ccccc1)C(=O)N2c3ccccc3
COC(=O)C1=CN(C)C=C(C(=O)OC)C1c2ccc(OC)cc2OC	ZINC000000028989	N2C=CC(c1ccccc1)C=C2
CN([C@@H](CN)C1CC1)S(N)(=O)=O	ZINC000167542148	C1CC1
Cn1cc(CN)c(=O)n(C)c1=O	ZINC000020083482	O=c1cc[nH]c(=O)[nH]1
CC(C)Nc1nc(NC(C)C)nc(N(C)C(N)=O)n1	ZINC000000027676	c1ncncn1
CCC(=O)Nc1cc(NC(=O)CC)cc(N(=O)=O)c1	ZINC000000027674	c1ccccc1
OC[C@H](O)Cn3cnc2sc1CCCCc1c2c3=O	ZINC000000151080	O=c2[nH]cnc3sc1CCCCc1c23
C[N@@](CCNC(=O)C(=O)Nc2ccc(N1CCNC(=O)C1)nc2)C3CC3	ZINC000605243488	O=C3CN(c2ccc(NC(=O)C(=O)NCCNC1CC1)cn2)CCN3
CCn3c(\C=N\c2nc1cc(C)c(C)cc1n2CC)nc4ccccc34	ZINC000000349473	C(=Nc2nc1ccccc1[nH]2)c4nc3ccccc3[nH]4
COc3ccc([C@@H]2NC(=O)c1ccccc1O2)cc3OC	ZINC000000033151	O=C2NC(c1ccccc1)Oc3ccccc23
COC(=O)c2ccc(NC(=O)CSc1nnc(C(C)C)n1C)cc2	ZINC000000410903	O=C(CSc1nnc[nH]1)Nc2ccccc2
COc3cccc(NC(=O)c1ccccc1CCc2ccccc2)c3	ZINC000000129848	O=C(Nc1ccccc1)c2ccccc2CCc3ccccc3
CSc1nc(N)cc(N(C)C)n1	ZINC000000330563	c1cncnc1
CNc1nc(O)cc(=O)[nH]1	ZINC000000330490	O=c1ccnc[nH]1
O=C(Nc1ccncc1)[C@@H](C#N)C(=O)C2CC2	ZINC000000018830	O=C(CC(=O)C1CC1)Nc2ccncc2
NC(=O)CNC1CCN(CC#C)CC1	ZINC000037183944	C1CCNCC1
Cc3cccc(Nc2nc(Cl)nc(Nc1cccc(C)c1)n2)c3	ZINC000000069423	N(c1ccccc1)c3ncnc(Nc2ccccc2)n3
COc2cc(c1ccccn1)nc(\C=N\O)c2SC	ZINC000000005789	c2ccc(c1ccccn1)nc2
Cn2c(N)c(C(=O)NCc1ccccc1)sc2=S	ZINC000000033629	O=C(NCc1ccccc1)c2c[nH]c(=S)s2
Cc3ccc(NC(=S)[C@@H](C#N)c2nc1cccnc1n2C)cc3	ZINC000000026616	S=C(Cc2nc1cccnc1[nH]2)Nc3ccccc3
Nn2c(SCC(=O)Nc1ccc(F)cc1)nnc2C3CCCCC3	ZINC000000527422	O=C(CSc2nnc(C1CCCCC1)[nH]2)Nc3ccccc3
NC(=O)[C@@H]1CCN1	ZINC000013375223	C1CNC1
CCc1cccc(C)c1NC(=O)COc2ccccc2C(C)(C)C	ZINC000000133603	O=C(COc1ccccc1)Nc2ccccc2
CCc2ccc(OCC(=O)Nc1ccc(Br)c(C)n1)cc2	ZINC000000515013	O=C(COc1ccccc1)Nc2ccccn2
Cc1cc(N(=O)=O)nn1CC(=O)Nc2ccc(Br)cn2	ZINC000000033027	O=C(Cn1cccn1)Nc2ccccn2
OC1(O)CCNCC1	ZINC000000155142	C1CCNCC1
C[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(=O)N2CC(=O)NCC2=O	ZINC000004760649	O=C(CCc1ccccc1)NCC(=O)N2CC(=O)NCC2=O
O=S(=O)(Nc3ccc(c2cn1cccnc1n2)cc3)c4ccccc4	ZINC000000629694	O=S(=O)(Nc3ccc(c2cn1cccnc1n2)cc3)c4ccccc4
COc3ccc(NC(=O)Cc1cccc2ccccc12)c4ccccc34	ZINC000000231496	O=C(Cc1cccc2ccccc12)Nc3cccc4ccccc34
NC(=N)N[C@@H]1NC(=O)NC1=O	ZINC000016887597	O=C1CNC(=O)N1
CC(C)(C)c3cc(C(C)(C)C)n(c2ccc(n1cccc1)cc2)n3	ZINC000000112240	c3ccn(c2ccc(n1cccn1)cc2)c3
CS(=O)(=O)Nc1ccccc1N=C(c2ccccc2)c3ccccc3	ZINC000000624495	N(=C(c1ccccc1)c2ccccc2)c3ccccc3
CC(C)ON=C(N)NC(N)=N	ZINC000005456240	nonring
N[C@@H]1[C@@H](O)[C@@H](CO)[C@@H](CO)O[C@H]1CO	ZINC000005282313	C1CCOCC1
COC(=O)c1c[nH]c(=O)[nH]c1=O	ZINC000001608199	O=c1cc[nH]c(=O)[nH]1
Nc2nc(N)nc(NCC1COC1)n2	ZINC000624688842	C(Nc1ncncn1)C2COC2
NCC(=O)NCC(=O)NO	ZINC000040873910	nonring
CC(C)CN(CC(=O)NC(N)=O)CC(=O)NC(N)=O	ZINC000047550125	nonring
COc3ccc(CCC(=O)c2ccc1OCCOc1c2)cc3	ZINC000000044420	O=C(CCc1ccccc1)c3ccc2OCCOc2c3
Brc2ccc(/N=C/c1ccc(N(=O)=O)cc1)cc2	ZINC000000060041	C(=Nc1ccccc1)c2ccccc2
O=C2Oc1ccccc1[C@@]2(Cc3ccc(N(=O)=O)cc3)c4ccccc4	ZINC000000116093	O=C2Oc1ccccc1C2(Cc3ccccc3)c4ccccc4
OC[C@@H]3CCC[N@]([C@@H]2CC(=O)N(c1ccccc1)C2=O)C3	ZINC000000076588	O=C2CC(N1CCCCC1)C(=O)N2c3ccccc3
O=C(N[C@@H](Sc1ccncn1)C(=O)c2ccccc2)c3ccccc3	ZINC000000251540	O=C(NC(Sc1ccncn1)C(=O)c2ccccc2)c3ccccc3
COc1ccc(CNC[C@@H](C)O)cc1OC	ZINC000000268966	c1ccccc1
NN=C(N)N1CCNCC1	ZINC000039079123	C1CNCCN1
CCc2c(C)sc(NC(=O)c1cc(OC)cc(OC)c1)c2C(N)=O	ZINC000000433673	O=C(Nc1cccs1)c2ccccc2
CCNC(=O)CNc1nc(N)nc(N)n1	ZINC000623808414	c1ncncn1
Brc3ccc([C@@H]2O[C@H](c1ccccc1)C(=O)O2)cc3	ZINC000000064902	O=C2OC(c1ccccc1)OC2c3ccccc3
Cc1ccc(Cl)cc1NC(=O)[C@@H]2CC=CC[C@@H]2C(O)=O	ZINC000000098355	O=C(Nc1ccccc1)C2CCC=CC2
NC(=N)NC[C@@H](O)C(N)=O	ZINC000228668429	nonring
COCc2cc(C)nc3sc(C(O)=O)c(n1cccc1)c23	ZINC000000054557	c3ccn(c1csc2ncccc12)c3
C[C@@H](N1C[C@H](O)[C@@H](O)C1)C(=O)NCC=C	ZINC000235198053	C1CCNC1
CCOC(=O)c1c(C)c(C)sc1NC(=O)CCOc2ccccc2	ZINC000000067487	O=C(CCOc1ccccc1)Nc2cccs2
CN(CC(=O)NCCC(=O)Nc1nnc(S(N)(=O)=O)s1)C(N)=N	ZINC000013800588	c1nncs1
NC(=O)[C@@H]1CCCN1C(=O)N2CCNCC2	ZINC000020294610	O=C(N1CCCC1)N2CCNCC2
CCc3ccc(N2C[C@@H](C(=O)Nc1ccccc1)CC2=O)cc3	ZINC000000044762	O=C2CC(C(=O)Nc1ccccc1)CN2c3ccccc3
COc4ccc3oc([C@@H](O)c1c(C)oc2ccc(OC)cc12)cc3c4	ZINC000000195561	C(c2cc1ccccc1o2)c3coc4ccccc34
CN2CCN([C@H]1CNC[C@@H]1O)CC2	ZINC000021953399	C2CC(N1CCNCC1)CN2
NCc1cn(C(CO)CO)c(=O)[nH]c1=O	ZINC000409438584	O=c1cc[nH]c(=O)[nH]1
CN(N)C(=N)NCc1ccccc1	ZINC000000011148	c1ccccc1
Cn1nnnc1NCC(=O)N2CCNCC2	ZINC000062939373	O=C(CNc1nnn[nH]1)N2CCNCC2
CC(C)[C@H](NC(=O)c1ccccc1)c2n[nH]c(=S)n2CC=C	ZINC000000366580	O=C(NCc1n[nH]c(=S)[nH]1)c2ccccc2
CC(=O)NCCNC(=O)[C@@H]1CCCNC1	ZINC000036746481	C1CCNCC1
NC(=O)CN(CC#C)C1CCNCC1	ZINC000037470330	C1CCNCC1
NCCNC(=O)C(=O)NC1CC1	ZINC000037242750	C1CC1
C[C@@H]2C[C@H](OC(=O)c1ccccc1O)CC(C)(C)C2	ZINC000000000370	O=C(OC1CCCCC1)c2ccccc2
NNc2nc(N)nc(c1cccnc1)n2	ZINC000000163109	c2cncc(c1ncncn1)c2
CN([C@@H]1CNC[C@H]1O)C(N)=O	ZINC000036263797	C1CCNC1
NC(=O)n2c1ccccc1ccc3ccccc23	ZINC000000004785	c3ccc2[nH]c1ccccc1ccc2c3
CC2(C(=O)NCCn1ncnn1)CNC2	ZINC000399464286	O=C(NCCn1ncnn1)C2CNC2
C[C@H](Sc2nc1ccccc1c(=O)n2c3ccccc3)C#N	ZINC000000045741	O=c2n(c1ccccc1)cnc3ccccc23
CC2=CC(C)(C)N(S(=O)(=O)c1ccc(C)cc1)c3ccccc23	ZINC000000055081	O=S(=O)(N1CC=Cc2ccccc12)c3ccccc3
COc2ccc(CCC(=O)Nc1cc(C)c(O)c(C)c1)cc2	ZINC000000007070	O=C(CCc1ccccc1)Nc2ccccc2
O=C(Nn2c(=S)[nH]c1ccccc1c2=O)c3cccc(N(=O)=O)c3	ZINC000000037014	O=C(Nn2c(=S)[nH]c1ccccc1c2=O)c3ccccc3
N[C@@H]1CNC(=O)NC1=O	ZINC000071253474	O=C1CCNC(=O)N1
O=N(=O)c4cccc(Cc3cn2c(c1ccccc1)cnc2s3)c4	ZINC000000063481	C(c1ccccc1)c4cn3c(c2ccccc2)cnc3s4
CCSc3ccc(NC(=O)c2ccc1ccccc1c2OC)cc3	ZINC000000472099	O=C(Nc1ccccc1)c3ccc2ccccc2c3
Cc2nn(C(=O)c1ccc(Cl)cc1)c(C)c2Sc3ncccn3	ZINC000000123562	O=C(c1ccccc1)n3cc(Sc2ncccn2)cn3
CCn1c(=O)cc(N)n(C)c1=O	ZINC000000399838	O=c1cc[nH]c(=O)[nH]1
NS(=O)(=O)NCCN1CCNCC1	ZINC000162323559	C1CNCCN1
O=C(COC(=O)c2ccc(NC(=O)c1ccco1)cc2)c3ccccc3	ZINC000000482288	O=C(COC(=O)c2ccc(NC(=O)c1ccco1)cc2)c3ccccc3
CC(C)(C)c3cc(c1cccs1)cc(c2cccs2)c3	ZINC000000062758	c3csc(c2cccc(c1cccs1)c2)c3
O=C(CSc1nc[nH]n1)NCc2n[nH]c(=O)c3ccccc23	ZINC000000034288	O=C(CSc1nc[nH]n1)NCc2n[nH]c(=O)c3ccccc23
Cn1cc(S(=O)(=O)NCCN)cn1	ZINC000036286467	c1cn[nH]c1
O=c2[nH]c(c1ccco1)cn3ccnc23	ZINC000000020089	O=c2[nH]c(c1ccco1)cn3ccnc23
N[C@@H](CCCNC(N)=N)C(=O)NCC(O)=O	ZINC000002545093	nonring
O=C(CN1CCNCC1)N[C@@H]2CCS(=O)(=O)C2	ZINC000019976633	O=C(CN1CCNCC1)NC2CCS(=O)(=O)C2
NCCNC(=O)C(=O)Nc1cn[nH]c1	ZINC000035763461	c1cn[nH]c1
C[C@H](N1C[C@H](O)[C@@H](O)C1)C(=O)NCCc2ccc(S(N)(=O)=O)cc2	ZINC000625712651	O=C(CN1CCCC1)NCCc2ccccc2
CC(C)NS(=O)(=O)CCNC(=O)[C@@H]1CNC[C@H]1c2cnn(C)c2	ZINC000653081350	C2CC(c1cn[nH]c1)CN2
OC[C@H]1CNCCN1	ZINC000026898369	C1CNCCN1
COc1ccc(Cl)cc1NC(=O)COc3ccc2CCCCc2c3	ZINC000000565859	O=C(COc2ccc1CCCCc1c2)Nc3ccccc3
NC(=O)CCN1C[C@@H](O)[C@H](O)C1	ZINC000236176043	C1CCNC1
C[C@H]1CC3=C(C[C@@H]1COC(=O)Nc2ccccc2)C(C)(C)CCC3	ZINC000000210881	O=C(Nc1ccccc1)OCC3CCC2=C(CCCC2)C3
CC(C)NS(=O)(=O)CCNC(=O)[C@]12CNC[C@H]1COC2	ZINC000653081514	C1NCC2COCC12
CN(O)C(=O)CCc3ccc2Cc1cccc(O)c1C(=O)c2c3O	ZINC000000006784	O=C2c1ccccc1Cc3ccccc23
O[C@H]1CNC[C@H]1N2C(=O)CNC2=O	ZINC000575474290	O=C1CNC(=O)N1C2CCNC2
Cc3ccc2cc(C)c(SCC(=O)Nc1ccc(F)cc1)nc2c3	ZINC000000421038	O=C(CSc2ccc1ccccc1n2)Nc3ccccc3
FC(F)(F)c3cccc(NC(=O)CN1CCc2ccccc12)c3	ZINC000000043123	O=C(CN1CCc2ccccc12)Nc3ccccc3
CN(C)C(=O)NCC[N@@](C)CCNS(C)(=O)=O	ZINC000332514102	nonring
O=C(NC1CCNCC1)c2c[nH]c(=O)[nH]2	ZINC000037116548	O=C(NC1CCNCC1)c2c[nH]c(=O)[nH]2
CC(C)(CC(O)=O)CC(=O)Nc1ccccc1Oc2ccccc2	ZINC000000152874	O(c1ccccc1)c2ccccc2
O=C1NCc4c1cc3ccc2OCOc2c3c4c6ccc5OCOc5c6	ZINC000000007322	O=C1NCc4c1cc3ccc2OCOc2c3c4c6ccc5OCOc5c6
CNC(=O)CN1CCNCC1	ZINC000019803722	C1CNCCN1
OC(=O)CC3(CC(=O)N2CCC(n1cccc1)CC2)CCCC3	ZINC000000118256	O=C(CC1CCCC1)N3CCC(n2cccc2)CC3
CNC(=O)Cn3[nH]c(=NC(=O)N2CC([N@]1CC[C@@H](O)C1)C2)cc3C	ZINC000650108299	O=C(N=c1cc[nH][nH]1)N3CC(N2CCCC2)C3
Nc2nc(Nc1cccc(C(F)(F)F)c1)nc(C(F)(F)F)n2	ZINC000000061080	N(c1ccccc1)c2ncncn2
Cc1cc(=O)oc4c1ccc3o\c(=C/c2ccc(Cl)cc2)c(=O)c34	ZINC000000034737	O=c4ccc3ccc2oc(=Cc1ccccc1)c(=O)c2c3o4
NC[C@H](N)C(N)=O	ZINC000034155865	nonring
OC(=O)[C@@H](Oc3ccc2c1CCCc1c(=O)oc2c3)c4ccccc4	ZINC000000091033	O=c4oc2cc(OCc1ccccc1)ccc2c3CCCc34
CCOC(=O)c2c(NC(=O)c1ccco1)scc2c3ccccc3	ZINC000000044235	O=C(Nc2cc(c1ccccc1)cs2)c3ccco3
CN(CCN)C(=O)[C@@H]1CNCCO1	ZINC000647088687	C1COCCN1
N[C@H]1C[C@@H](CO)OC1=O	ZINC000038265718	O=C1CCCO1
CN(C)CCNC(N)=NN(=O)=O	ZINC000001742059	nonring
Cc3cc(N2CCN(C(=O)c1ccccc1)CC2)ncn3	ZINC000000013143	O=C(N2CCN(c1ccncn1)CC2)c3ccccc3
Cc3nccc(N2CCN(C(=O)c1cccnc1)CC2)n3	ZINC000000013142	O=C(N2CCN(c1ccncn1)CC2)c3cccnc3
CN(CCN)S(C)(=O)=O	ZINC000020182975	nonring
Cc1ccc(C(=O)NCCNC(=O)CNC(=O)CN)cc1	ZINC000037902972	c1ccccc1
C[C@@H](NC(=O)[C@@](C)(N)C1CC1)C(N)=O	ZINC000037479017	C1CC1
NC[C@H](N)C(=O)NCC(N)=O	ZINC000036519955	nonring
OCCN1CCOCCOCCN(CCO)CCN(CCO)CC1	ZINC000019228135	C1CNCCOCCOCCNCCN1
C[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCN	ZINC000029132560	C1CCNCC1
C[C@@]1(NC(=O)CN)CCS(=O)(=O)C1	ZINC000035018150	O=S1(=O)CCCC1
N[C@@H]1C[C@@H](N)[C@@H](O)C(O)[C@@H]1O	ZINC000005125111	C1CCCCC1
Cc4cc3ncn(C[C@@H](O)COc1cccc2ccccc12)c3cc4C	ZINC000000243051	C(COc1cccc2ccccc12)Cn3cnc4ccccc34
N=C(NCCN1C(=O)CNC1=O)N2CCOCC2	ZINC000262549535	N=C(NCCN1C(=O)CNC1=O)N2CCOCC2
Cc2sc(NC(=O)[C@@H]1CC=CC[C@@H]1C(O)=O)nc2c3ccccc3	ZINC000000204925	O=C(Nc2nc(c1ccccc1)cs2)C3CCC=CC3
O=C(NC[C@@H]1CNCCO1)c3nc2NCCCn2n3	ZINC000643801273	O=C(NCC1CNCCO1)c3nc2NCCCn2n3
CN2C[C@@H]1C=NN[C@@]1(C(N)=O)C2=O	ZINC000238346681	O=C2NCC1C=NNC12
CCOC(=O)[C@@H]2CCC[N@@](C1CCN(C)CC1)C2	ZINC000000248228	C2CCN(C1CCNCC1)CC2
OC2CCN(CCNS(=O)(=O)c1c[nH]cn1)CC2	ZINC000321272954	O=S(=O)(NCCN1CCCCC1)c2c[nH]cn2
NC(=N)NC(=N)NCCS(O)(=O)=O	ZINC000031792617	nonring
O[C@@H](COc1ccc(N(=O)=O)cc1)Cn3c(=O)c2ccccc2c3=O	ZINC000000033561	O=c2n(CCCOc1ccccc1)c(=O)c3ccccc23
Cc2c(C[N@]1C[C@H](O)[C@H](O)C1)cnn2C	ZINC000332689825	C2CCN(Cc1cn[nH]c1)C2
CNC1(C(N)=O)CNC1	ZINC000078677351	C1CNC1
C[C@@H](O)C[N@]1C[C@H](O)[C@H](O)C1	ZINC000086331379	C1CCNC1
Nc4ccc(C2N=NC(=S)Cc3cc1OCOc1cc23)cc4	ZINC000000024167	S=C4Cc2cc1OCOc1cc2C(c3ccccc3)N=N4
C[C@]1(O)[C@@H](O)COC1=O	ZINC000013459856	O=C1CCCO1
OC[C@@H]1COCCN1	ZINC000004202897	C1COCCN1
CN3CCN(C(=O)c1ccccc1NC(=O)Cc2ccccc2)CC3	ZINC000000035391	O=C(Cc1ccccc1)Nc2ccccc2C(=O)N3CCNCC3
Clc3ccc(COc2ccc(C=c1[nH]c(=S)[nH]c1=O)cc2)cc3	ZINC000000194150	O=c1[nH]c(=S)[nH]c1=Cc3ccc(OCc2ccccc2)cc3
CNS(=O)(=O)NCCC[N@]1CCC[C@H]1C(N)=O	ZINC000625378585	C1CCNC1
COc2ccc(\C=N\c1cc(Cl)cc(Cl)c1)c3ccccc23	ZINC000000065330	C(=Nc1ccccc1)c2cccc3ccccc23
NC[C@@H]1CN(CC(N)=O)C(=O)O1	ZINC000098103196	O=C1NCCO1
CN1C2CC(N(C)C1=O)N(C)C(=O)N2C	ZINC000000210673	O=C1NC2CC(N1)NC(=O)N2
NC(=N)N1C[C@H]2[C@H](C1)C(=O)NC2=O	ZINC000307618249	O=C2NC(=O)C1CNCC12
NC(=O)C[C@H]1C[C@H](O)CN1	ZINC000034621670	C1CCNC1
COc2ccc(NC(=O)CC1(CC(O)=O)CCCCC1)cc2OC	ZINC000000070058	O=C(CC1CCCCC1)Nc2ccccc2
CCOc3ccnc(N2CCN(C(=O)c1cccs1)CC2)n3	ZINC000000017603	O=C(N2CCN(c1ncccn1)CC2)c3cccs3
NC(=O)C[n+]1ccccn1	ZINC000003130261	c1ccnnc1
O=S(=O)(Nc3ccc(c2cn1ccsc1n2)cc3)c4ccc6cccc5CCc4c56	ZINC000000629260	O=S(=O)(Nc3ccc(c2cn1ccsc1n2)cc3)c4ccc6cccc5CCc4c56
OCCN(CCO)Cc1ccc(F)c(Br)c1	ZINC000000227423	c1ccccc1
CN(C)CCN1CCc2ccccc12	ZINC000000185131	C2Cc1ccccc1N2
N=C3C(C#N)=C1CCCCC1[C@@H](c2ccccc2)C3(C#N)C#N	ZINC000000028082	N=C3CC(c1ccccc1)C2CCCCC2=C3
COc3ccc(c1cscc1c2ccc(S(C)(=O)=O)cc2)cc3	ZINC000000018712	c3ccc(c1cscc1c2ccccc2)cc3
O=C(CN1CCNCC1)NCC(=O)NC2CC2	ZINC000036782732	O=C(CN1CCNCC1)NCC(=O)NC2CC2
O=c2[nH]c(=O)c(=CN1CCNCC1)c(=O)[nH]2	ZINC000027232424	O=c2[nH]c(=O)c(=CN1CCNCC1)c(=O)[nH]2
NCC(=O)N1CCC2(CC1)NC(=O)NC2=O	ZINC000037818271	O=C2NC(=O)C1(CCNCC1)N2
CCOc3nc(NC1CCCC1)nc(Nc2ccc(Cl)cc2)n3	ZINC000000053130	C3CCC(Nc2ncnc(Nc1ccccc1)n2)C3
Brc3cccc(c2csc(Nc1cccnc1)n2)c3	ZINC000000108853	N(c1cccnc1)c3nc(c2ccccc2)cs3
Cc2cccc(NC(=O)[C@H]1SC(=N)NC(O)=C1)c2	ZINC000000190871	N=C2NC=CC(C(=O)Nc1ccccc1)S2
O=S(=O)(N[C@H]1CCN(C#N)C1)c2ccccc2	ZINC000000008873	O=S(=O)(NC1CCNC1)c2ccccc2
O=C(NCCN1CCNCC1)C#C	ZINC000036278461	C1CNCCN1
O=C(CN2N=C(c1ccccc1)CCC2=O)NCCN3CCCC3	ZINC000000219594	O=C(CN2N=C(c1ccccc1)CCC2=O)NCCN3CCCC3
O[C@H]1CNC[C@H]1CNC(=O)[C@@H]2CCCN2c3ncccn3	ZINC000648132985	O=C(NCC1CCNC1)C2CCCN2c3ncccn3
Cl\C(=C/c1ccccc1)C(=O)Nc2ccc(Cl)c(Cl)c2	ZINC000000054690	O=C(Nc1ccccc1)C=Cc2ccccc2
Cc2cc(C)n(/N=C/c1cc(Cl)cc(Cl)c1O)c(=O)c2	ZINC000000054691	O=c1ccccn1N=Cc2ccccc2
C[C@@H]3Nc2ccc(c1csc(C#N)c1)cc2C(C)(C)O3	ZINC000000009203	C3Nc2ccc(c1ccsc1)cc2CO3
C[C@@H]1C[N@@](CCO)[C@H](C)CN1C(=O)CNS(=O)(=O)N(C)C	ZINC000616340997	C1CNCCN1
N[C@H](C(=O)N2[C@@H](C#N)C[C@@H]1C[C@@H]12)C3(CO)CCC3	ZINC000000027201	O=C(CC1CCC1)N3CCC2CC23
C[N+](C)(C)Cc1ncccc1O	ZINC000000159649	c1ccncc1
COc1ccccc1[C@@H]2NC(=O)NC(C)=C2C(=O)OC3CCCC3	ZINC000000044506	O=C3NC=C(C(=O)OC1CCCC1)C(c2ccccc2)N3
COc2ccc(CNC[C@@H](O)CSc1ccc(OC)cc1)cc2	ZINC000000108910	C(CNCc1ccccc1)CSc2ccccc2
CN(C)CCNC(=O)[C@H]1CCCN(S(C)(=O)=O)C1	ZINC000000219447	C1CCNCC1
NC(=O)CN[C@@H]1COC[C@@H]1O	ZINC000037883187	C1CCOC1
CNS(=O)(=O)c2ccc(C(=O)NCC(=O)N1CCNCC1)cn2	ZINC000583933766	O=C(CNC(=O)c1cccnc1)N2CCNCC2
Cc3ccc(NC(=O)Cn2nnc(c1ccccc1)n2)c(C)c3	ZINC000000034932	O=C(Cn2nnc(c1ccccc1)n2)Nc3ccccc3
Clc4ccc(c3noc([C@H]2CCc1ccccc1O2)n3)cc4	ZINC000000082358	C2Cc1ccccc1OC2c4nc(c3ccccc3)no4
C[C@]34CC[C@@H]1[C@@H](CCc2cc(O)ccc12)[C@H]3CCC45OCCO5	ZINC000000033030	C5COC4(CCC3C2CCc1ccccc1C2CCC34)O5
CCN(CC)CCn1c(=N)n(CCO)c2ccccc12	ZINC000000305750	N=c2[nH]c1ccccc1[nH]2
CC4=NN=C(c1ccc(N)cc1)c3cc2OCOc2cc3C4	ZINC000000004264	C4Oc3cc2CC=NN=C(c1ccccc1)c2cc3O4
CNc2ncnc3cc(C1=NNC(=O)C[C@@H]1C)ccc23	ZINC000000004260	O=C3CCC(c2ccc1cncnc1c2)=NN3
CC(C)NC(=N)CCn1cnc2n(C)c(=O)n(C)c(=O)c12	ZINC000000054273	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
CN(C)c1ccc(\C=N\NC(N)=S)cc1C#N	ZINC000000112415	c1ccccc1
CC(=O)c3cccc(NC(=O)c2ccc(c1ccccc1Cl)o2)c3	ZINC000000620638	O=C(Nc1ccccc1)c3ccc(c2ccccc2)o3
C[C@@]4(c2ccc(OCc1ccccc1)cc2)Cc3ccccc3C(=O)O4	ZINC000000399001	O=C3OC(c2ccc(OCc1ccccc1)cc2)Cc4ccccc34
CNC(=O)CNC(=O)[C@@H]1CCN1	ZINC000307503820	C1CNC1
COc2ccc(C(=O)Nc1c(Cl)cncc1Cl)c3[nH]c(C(C)C)nc23	ZINC000000578683	O=C(Nc1ccncc1)c2cccc3nc[nH]c23
C[C@@H](O)CN2CC(N1CCNC1=O)C2	ZINC000660684657	O=C1NCCN1C2CNC2
Fc3ccc(c2nc1c(Cl)cc(Cl)cc1c(=O)o2)cc3	ZINC000000041108	O=c2oc(c1ccccc1)nc3ccccc23
CC[C@@H](O)CN2CCN(C(=O)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1)CC2	ZINC000668377161	O=C(N1CCNCC1)C2=CCCCC2
N[C@H]2CCN(c1ccc(Cl)nc1)C2	ZINC000000026489	C2CCN(c1cccnc1)C2
Oc1ccccc1\C=N\n4c(c2ccccc2)nc3ccccc3c4=O	ZINC000000049119	O=c3n(N=Cc1ccccc1)c(c2ccccc2)nc4ccccc34
COc2ccc1cc([C@@H](C)CO)ccc1c2	ZINC000000001784	c2ccc1ccccc1c2
CCOC(=O)C[C@@H](N)c1ccc(O)cc1	ZINC000000372193	c1ccccc1
Oc1ccccc1\C=N\c2cc(C(F)(F)F)ccc2N3CCCC3	ZINC000000063768	C3CCN(c1ccccc1N=Cc2ccccc2)C3
FC(F)(F)c2cc(N[C@@H](C#N)c1ccccc1)cc(C(F)(F)F)c2	ZINC000000102314	C(Nc1ccccc1)c2ccccc2
COc2cccc(NC(=O)CCN1CCCC1)c2	ZINC000000176484	O=C(CCN1CCCC1)Nc2ccccc2
COc2cc(O)c(C(=O)Cc1ccc(Cl)cc1)c(OC)c2	ZINC000000058160	O=C(Cc1ccccc1)c2ccccc2
Cc2onc(c1ccccc1)c2c4csc(COc3ccccc3)n4	ZINC000000123998	C(Oc1ccccc1)c4nc(c2conc2c3ccccc3)cs4
Cn1[nH]c(CNC(N)=NN)cc1=O	ZINC000307362378	O=c1cc[nH][nH]1
O=C3C(=C/c1c[nH]c2ccccc12)/CC/C3=C/c4c[nH]c5ccccc45	ZINC000000114716	O=C3C(=Cc1c[nH]c2ccccc12)CCC3=Cc4c[nH]c5ccccc45
Brc2ccc(NC(=O)c1ccccc1N(=O)=O)nc2	ZINC000000043536	O=C(Nc1ccccn1)c2ccccc2
CN2CC[C@@H](NC(=O)C1(O)CNC1)C2=O	ZINC000662589698	O=C1NCCC1NC(=O)C2CNC2
O=C1CCCN1c3ccc(S(=O)(=O)Nc2ccccn2)cc3	ZINC000000188693	O=C1CCCN1c3ccc(S(=O)(=O)Nc2ccccn2)cc3
C[C@@H]1O[C@@H](N)[C@@H](O)[C@H](O)[C@@H]1O	ZINC000085630011	C1CCOCC1
CC1CCN(CC(=O)NC(CO)CO)CC1	ZINC000119644903	C1CCNCC1
COC(=O)CNC(=O)CN	ZINC000002168344	nonring
COC(=O)c3ccc2nc(C)cc(Nc1cccc(Cl)c1)c2c3	ZINC000000144070	N(c1ccccc1)c2ccnc3ccccc23
CCN2CCC(N1CCOCC1)CC2	ZINC000000280483	C2CC(N1CCOCC1)CCN2
F[C@@H]2CN[C@H](CNC(=O)CCCN1C(=O)CNC1=O)C2	ZINC000648140616	O=C(CCCN1C(=O)CNC1=O)NCC2CCCN2
COc3ccc(c2nnc(SCC(=O)NC1CCCCC1)o2)cc3	ZINC000000073397	O=C(CSc2nnc(c1ccccc1)o2)NC3CCCCC3
Fc3ccc(C(=O)Nc2nc(c1ccccc1)cs2)cc3Cl	ZINC000000089272	O=C(Nc2nc(c1ccccc1)cs2)c3ccccc3
Clc3ccc(CSc1nnc2[nH]cnn12)c(Cl)c3	ZINC000000036460	C(Sc1nnc2[nH]cnn12)c3ccccc3
CC(C)[C@H](N)C(=O)NCC(=O)N[C@@H](C(C)C)C(N)=O	ZINC000038778622	nonring
COc1ccccc1N3CCN(C(=O)Nc2cc(F)ccc2C)CC3	ZINC000000112380	O=C(Nc1ccccc1)N3CCN(c2ccccc2)CC3
NC(=O)[C@@H]1CNCCO1	ZINC000019686020	C1COCCN1
NCCS(=O)(=O)C[C@@H](N)C(O)=O	ZINC000139831926	nonring
Brc3ccc(NC(=O)c2ccc1nccnc1c2)cc3	ZINC000000055049	O=C(Nc1ccccc1)c3ccc2nccnc2c3
OCCCN2C(=O)[C@H]1CNC[C@H]1C2=O	ZINC000049113413	O=C2NC(=O)C1CNCC12
CC(C)NC[C@H](O)COc2ccc(\C=C\c1cc(C)no1)cc2	ZINC000000073965	C(=Cc1ccno1)c2ccccc2
COc2cccc([C@@]1(O)CC[S@@](=O)C[C@@H]1CN(C)C)c2	ZINC000000347489	O=S2CCC(c1ccccc1)CC2
C[C@@H](N1C[C@@H](O)[C@H](O)C1)C(\N)=N\O	ZINC000300058341	C1CCNC1
CCOC(=O)c2cc(C(C)(C)C)n(c1ccc(N(=O)=O)cc1)c2C	ZINC000000113936	c2ccc(n1cccc1)cc2
Cc4ccc(c2nc1sccn1c2NC(=O)c3ccc(Cl)cc3)cc4	ZINC000000624684	O=C(Nc2c(c1ccccc1)nc3sccn23)c4ccccc4
COc4cc(S(=O)(=O)Nc3cccc(c2cn1ccsc1n2)c3)c(C)cc4C	ZINC000000629455	O=S(=O)(Nc3cccc(c2cn1ccsc1n2)c3)c4ccccc4
CCOC(=O)c2ccc(NS(=O)(=O)c1ccc(F)cc1C)cc2	ZINC000000620280	O=S(=O)(Nc1ccccc1)c2ccccc2
FC(F)(F)c3cccc(Nc2nnc(Cc1ccccc1Cl)c(=O)[nH]2)c3	ZINC000002718991	O=c2[nH]c(Nc1ccccc1)nnc2Cc3ccccc3
O=C2C[C@@H](NC1=NCCN1)CN2	ZINC000229130947	O=C2CC(NC1=NCCN1)CN2
NCCc1nn[nH]n1	ZINC000019090380	c1nn[nH]n1
COC[C@@H](N)C(=O)N1CCN(C)C[C@@H]1CN	ZINC000571204912	C1CNCCN1
O=C4CN(C(=O)OCc1ccccc1)[C@@H](c2ccccc2)[C@@H](c3ccccc3)O4	ZINC000000626426	O=C4CN(C(=O)OCc1ccccc1)C(c2ccccc2)C(c3ccccc3)O4
Cn2c(=O)[nH]c(=O)c3n(C[C@@H](O)COc1ccccc1)c(NCCN)nc23	ZINC000001840591	O=c3[nH]c(=O)c2n(CCCOc1ccccc1)cnc2[nH]3
CN[C@H]1[C@H](O)[C@H](O)[C@@H](O)[C@@H](NC)[C@@H]1O	ZINC000256160855	C1CCCCC1
OC(=O)CCC(=O)Nc3ccc(Oc1ncnc2cc(Cl)ccc12)nc3	ZINC000001033971	O(c1ccccn1)c2ncnc3ccccc23
OC(=O)CCC(=O)Nc1ccccc1C#Cc2ccc(Br)cc2	ZINC000000705364	C(#Cc1ccccc1)c2ccccc2
COc2ccc1ccc(=O)oc1c2CC=C(C)C	ZINC000000000566	O=c2ccc1ccccc1o2
Cn1nc([C@@H](O)CN)nc1N	ZINC000128338179	c1nc[nH]n1
COc2cc(NC(=O)c1cccs1)ccc2NC(=O)c3ccco3	ZINC000000173500	O=C(Nc2ccc(NC(=O)c1cccs1)cc2)c3ccco3
N[C@@H]1C[C@@H]1C(=O)NCCC(=O)NC(N)=O	ZINC000424145997	C1CC1
O[C@@H]2CC[N@@](CC(=O)N1CCNC(=O)C1)C2	ZINC000114486476	O=C2CN(C(=O)CN1CCCC1)CCN2
O=C(CNC(=O)Nc1cccc(N(=O)=O)c1)NCC(=O)N2CCNCC2	ZINC000598661568	O=C(CNC(=O)Nc1ccccc1)NCC(=O)N2CCNCC2
CCc2ccc(OCC(=O)Nc1cccc(Cl)c1C)cc2	ZINC000000063616	O=C(COc1ccccc1)Nc2ccccc2
Cc2cc(S(=O)(=O)Nc1ccnn1C)c(C)cc2Cl	ZINC000000116706	O=S(=O)(Nc1ccn[nH]1)c2ccccc2
Cc2cc(C)c(S(=O)(=O)Nc1cccc(Cl)c1Cl)c(C)c2	ZINC000000246322	O=S(=O)(Nc1ccccc1)c2ccccc2
CS(=O)(=O)[C@@H]1CNCCN1CCO	ZINC000166040862	C1CNCCN1
CC[C@@H](NC(=O)[C@H]1CNCCO1)C(=O)OC	ZINC000187330964	C1COCCN1
Clc3ccc(C(=O)Nn2c(=O)c1ccccc1c2=O)c(Cl)c3	ZINC000000046210	O=C(Nn2c(=O)c1ccccc1c2=O)c3ccccc3
C[C@H](N(C)C)C(=O)Nc2cc(c1ccccc1)nn2c3ccccc3	ZINC000000000217	c3ccc(c2ccn(c1ccccc1)n2)cc3
CCOc2cc(C)c(\C=c1/n(C)c(=S)n(CC)c1=O)cc2C(C)C	ZINC000000476545	O=c1[nH]c(=S)[nH]c1=Cc2ccccc2
C[C@@H]1CC(=O)N(C[C@@H](N)C(N)=O)C1=O	ZINC000127823770	O=C1CCC(=O)N1
CN(C)c1cnnc(=O)[nH]1	ZINC000000500123	O=c1nncc[nH]1
CC(=O)c1c(C)oc4c1cc(NS(=O)(=O)c2ccc(C)cc2C)c3ccccc34	ZINC000000834417	O=S(=O)(Nc2cc1ccoc1c3ccccc23)c4ccccc4
OC(=O)c3cccc(Nc2nc(c1ccc(F)cc1F)cs2)c3	ZINC000000271678	N(c1ccccc1)c3nc(c2ccccc2)cs3
Cn2cc(C(=O)O/N=C/c1ccc(Cl)cc1)c(C(F)(F)F)n2	ZINC000000081705	O=C(ON=Cc1ccccc1)c2cn[nH]c2
Cc3ccc(NC(=O)CSc2nc1c(N)ncnc1[nH]2)cc3	ZINC000000034128	O=C(CSc2nc1cncnc1[nH]2)Nc3ccccc3
CN(C)CCNC(=O)C[C@@H]3O[C@H](CNC(=O)c2ccc1OCOc1c2)[C@@H](O)[C@H]3O	ZINC000015675162	O=C(NCC1CCCO1)c3ccc2OCOc2c3
COC(=O)c2cccc(NC(=S)N/N=C/c1ccc(OC)cc1)c2	ZINC000000134339	S=C(NN=Cc1ccccc1)Nc2ccccc2
Cc2ccc(NC(=O)CCc1ccccc1)cc2F	ZINC000000028404	O=C(CCc1ccccc1)Nc2ccccc2
OCCN(CCO)CCOc1ccncc1	ZINC000000383847	c1ccncc1
CCCC(=O)c1cc(F)ccc1OC[C@H](O)CNC(C)(C)C	ZINC000000000112	c1ccccc1
O=c2[nH]cc(CN1CCCCC1)c(=O)[nH]2	ZINC000000181793	O=c2[nH]cc(CN1CCCCC1)c(=O)[nH]2
COc1ccc(S(=O)(=O)NCCN)cc1C(N)=O	ZINC000036286524	c1ccccc1
Cc2ccc1nsnc1c2NC(=O)COc3ccccc3N(=O)=O	ZINC000000097721	O=C(COc1ccccc1)Nc2cccc3nsnc23
O=C(Nc3ccc(c2csc(c1ccccc1)n2)cc3)c4ccco4	ZINC000000387107	O=C(Nc3ccc(c2csc(c1ccccc1)n2)cc3)c4ccco4
CCC(=O)N2[C@@H](C)C[C@H](N(C(C)=O)c1ccccc1)c3ccccc23	ZINC000000031399	C3CC(Nc1ccccc1)c2ccccc2N3
C[C@@H](CO)N[C@H]1CC(=O)NC1=O	ZINC000045626665	O=C1CCC(=O)N1
NN(N)C(N)=N	ZINC000100011503	nonring
N[C@H]2[C@@H](O)[C@H](n1cnc(C(N)=O)n1)O[C@@H]2CO	ZINC000169319708	C2COC(n1cncn1)C2
CSc3nc(c1ccccc1)nc(c2ccccc2OC(C)=O)n3	ZINC000000044245	c3ccc(c2ncnc(c1ccccc1)n2)cc3
NC(=N)N1CCNC(=O)C1	ZINC000019874146	O=C1CNCCN1
CC(=C)CSc2nc1ccccc1n2C(=O)c3ccccc3C(O)=O	ZINC000000794530	O=C(c1ccccc1)n2cnc3ccccc23
NN=C(N)NCc1ccc(=O)[nH]n1	ZINC000306689402	O=c1cccn[nH]1
O[C@H]2CN(C(=O)CC1CNC1)C[C@H]2O	ZINC000227317757	O=C(CC1CNC1)N2CCCC2
CN(C)Cc2ccc1OCOc1c2CO	ZINC000000336954	C2Oc1ccccc1O2
CCC(=O)c2ccc(OC(=O)c1ccc(C)c(Br)c1)cc2	ZINC000000357382	O=C(Oc1ccccc1)c2ccccc2
CCO[C@H]1CCC(=O)N1S(=O)(=O)c2ccccc2	ZINC000000002308	O=C1CCCN1S(=O)(=O)c2ccccc2
COc2ccc(C(=O)Nc1nn[nH]n1)c(OC(C)C)c2	ZINC000000024979	O=C(Nc1nn[nH]n1)c2ccccc2
COC(=O)c3cccc(NCn2c(=O)c1ccccc1c2=O)c3	ZINC000000047669	O=c2n(CNc1ccccc1)c(=O)c3ccccc23
Cc2nnc(SCC(=O)Nc1ccc(F)cc1)s2	ZINC000000031556	O=C(CSc1nncs1)Nc2ccccc2
COc4ccc3CC[C@H]([C@@]2(O)C(=O)N(C)c1ccccc12)C(=O)c3c4	ZINC000000034707	O=C2Nc1ccccc1C2C4CCc3ccccc3C4=O
COc2ccc(S(=O)(=O)Nc1c(C)cccc1C)c3cccnc23	ZINC000000032970	O=S(=O)(Nc1ccccc1)c2cccc3ncccc23
Cn3c(=O)n(C)c2nc(Nc1ccccc1)n(CCO)c2c3=O	ZINC000000032603	O=c3[nH]c(=O)c2[nH]c(Nc1ccccc1)nc2[nH]3
OC2(C(=O)N[C@@H]1CCNC1)CNC2	ZINC000638792555	O=C(NC1CCNC1)C2CNC2
Cc2ccc(NC(=O)c1ccccc1)cc2I	ZINC000000046078	O=C(Nc1ccccc1)c2ccccc2
Clc1ccccc1C(=O)Nc2ccc(C#N)c(Cl)c2	ZINC000000030304	O=C(Nc1ccccc1)c2ccccc2
CCC(=O)N2CCN(c1ccc(C(C)=O)cc1F)CC2	ZINC000000035092	C2CN(c1ccccc1)CCN2
NCC(F)(F)CNC(=O)N[C@H]1CCNC1	ZINC000583333751	C1CCNC1
Nc1nc(N)nc(NCO)n1	ZINC000001845500	c1ncncn1
Cc2nn(c1ccccc1)nc2CN	ZINC000000158831	c2ccc(n1nccn1)cc2
N[C@@H]1C[C@@H]1NC(=O)c2c[nH]c(=O)cn2	ZINC000036233573	O=C(NC1CC1)c2c[nH]c(=O)cn2
NS(=O)(=O)N2CCC(C(=O)NC[C@@H]1C[C@H](F)CN1)CC2	ZINC000648140936	O=C(NCC1CCCN1)C2CCNCC2
CC(C)COC(=O)c1ccc(NC(=O)CCC(O)=O)cc1	ZINC000000049822	c1ccccc1
CN3C(=O)C[C@H](N2CCC(N1CCCCC1)(C(N)=O)CC2)C3=O	ZINC000000127739	O=C3CC(N2CCC(N1CCCCC1)CC2)C(=O)N3
Fc4ccc([C@@H]3CC(=O)n2nc(c1ccccc1)nc2S3)cc4	ZINC000000067879	O=C3CC(c1ccccc1)Sc4nc(c2ccccc2)nn34
Cc2nc(SCC(=O)c1ccc(Cl)cc1)c(C#N)c(C)c2C	ZINC000000187789	O=C(CSc1ccccn1)c2ccccc2
OC(=O)[C@H]2CN(c1ccc(Br)c(Cl)c1)C(=O)C2	ZINC000000032771	O=C1CCCN1c2ccccc2
Nc1nnnn1CC(=O)OCc2cccc(Br)c2	ZINC000000032773	O=C(Cn1cnnn1)OCc2ccccc2
CC(C)CCCNC(=O)C(=O)NCC(=O)N1CCNCC1	ZINC000583921932	C1CNCCN1
CCCCNC(=O)NC(=O)C[N@]1CC[C@@](O)(C(N)=O)C1	ZINC000312504925	C1CCNC1
Cc3cc(=O)oc4cc(Oc1ncnc2sc(C)c(C)c12)ccc34	ZINC000000038153	O=c4ccc3ccc(Oc1ncnc2sccc12)cc3o4
CCOC(=O)c1c(C)c(C)sc1NC(=O)c3cc2ccccc2o3	ZINC000000118535	O=C(Nc1cccs1)c3cc2ccccc2o3
NCC(=O)NCC(=O)N1CCCNCC1	ZINC000037482149	C1CNCCNC1
Cc1ccccc1OCC(=O)NCc2ccco2	ZINC000000041451	O=C(COc1ccccc1)NCc2ccco2
C[C@@H](N)CNC(=O)[C@H]1CNC(=O)C1	ZINC000134903983	O=C1CCCN1
CCOC(=O)c2c(N)c1nonc1nc2c3ccccc3	ZINC000000032158	c3ccc(c2ccc1nonc1n2)cc3
Cn2c(c1ccc(Cl)cc1)csc2=Nc3ccc(F)cc3F	ZINC000000164145	N(c1ccccc1)=c3[nH]c(c2ccccc2)cs3
Nc2ncnc3n(Cc1c(F)cccc1Cl)cnc23	ZINC000000000969	C(c1ccccc1)n2cnc3cncnc23
OC1CNCCNC1	ZINC000026896718	C1CNCCNC1
CCOC(=O)[C@@H](N)C(=O)N1CCNCC1	ZINC000145044295	C1CNCCN1
CCC(CC)Nc1ncnc2n(C)cnc12	ZINC000000025178	c2ncc1nc[nH]c1n2
COc2ccc1cc([C@H](C)NC(=O)NO)ccc1c2	ZINC000000012347	c2ccc1ccccc1c2
CCOC(=O)CC(=O)Nc1nnc(C)s1	ZINC000000039720	c1nncs1
CC3CCN(C(=O)\C=C\c2ccc(OCc1ccccc1)cc2)CC3	ZINC000000131080	O=C(C=Cc2ccc(OCc1ccccc1)cc2)N3CCCCC3
Oc1ccn(=O)cc1	ZINC000000331810	O=n1ccccc1
N[C@@H]1CS(=O)(=O)C[C@@H]1N2CCN(CCO)CC2	ZINC000062810204	O=S2(=O)CCC(N1CCNCC1)C2
C[C@H](NC(C)=O)C(N)=O	ZINC000000399492	nonring
CC[N@@](C)C[C@@H]2CCN(C(=O)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1)C2	ZINC000646882510	O=C(N1CCCC1)C2=CCCCC2
Cc1c(Cl)cccc1/N=C/c2ccc(Cl)c(N(=O)=O)c2	ZINC000000065186	C(=Nc1ccccc1)c2ccccc2
Cc1n[nH]c(C(N)=O)c1N	ZINC000000399494	c1cn[nH]c1
CN1CNC(=O)C12CNC2	ZINC000039078817	O=C1NCNC12CNC2
CC[C@@H](O)CN2CCN(C(=O)CCn1cc[nH]c(=O)c1=O)CC2	ZINC000071882231	O=C(CCn1cc[nH]c(=O)c1=O)N2CCNCC2
Cc2ccc(N[C@@H](NC(=O)c1ccco1)C(Cl)(Cl)Cl)cc2	ZINC000000046665	O=C(NCNc1ccccc1)c2ccco2
CC(C)NC[C@@H](O)COc1cccn2nccc12	ZINC000000005305	c2ccn1nccc1c2
NCC(=O)N[C@@H]1O[C@@H](CO)[C@@H](O)[C@@H](O)[C@@H]1O	ZINC000026839571	C1CCOCC1
C[S@@](=O)C[C@@H](N)C(N)=O	ZINC000127980252	nonring
CNC(=O)C(=O)NCCN1CCNCC1	ZINC000019853313	C1CNCCN1
Fc1cccc(Cl)c1COc2ccc(Br)cc2C=O	ZINC000000227078	C(Oc1ccccc1)c2ccccc2
O[C@@H]2CN(C(=O)[C@@H]1CCN1)C[C@H]2O	ZINC000307142217	O=C(C1CCN1)N2CCCC2
COc3ccc(OC)c(S(=O)(=O)Nc2ccc1COC(=O)c1c2)c3	ZINC000000147986	O=C2OCc3ccc(NS(=O)(=O)c1ccccc1)cc23
CN(C)CCCN2C[C@@H](c1ccccc1)CC2=O	ZINC000000189939	O=C2CC(c1ccccc1)CN2
O=C(NCCC1=CCCCC1)c2ccc(N(=O)=O)cc2	ZINC000000038847	O=C(NCCC1=CCCCC1)c2ccccc2
COC[C@@H](N)C(N)=O	ZINC000045507030	nonring
CNC(=O)NC(=O)[C@@H](C)[N@]1C[C@H](O)[C@H](O)C1	ZINC000086331234	C1CCNC1
CC[C@H](C)N2[C@@H]1NC(=O)N[C@@H]1NC2=O	ZINC000000073423	O=C2NC1NC(=O)NC1N2
CC(=O)Nc2sc1CCCc1c2C(=O)Nc3ccccc3	ZINC000000046866	O=C(Nc1ccccc1)c3csc2CCCc23
CN2CCN(CCNS(=O)(=O)NC1CC1)CC2	ZINC000530492007	O=S(=O)(NCCN1CCNCC1)NC2CC2
O[C@H]1CNC[C@H]1CNC(=O)CCNS(=O)(=O)c2cccs2	ZINC000648133593	O=C(CCNS(=O)(=O)c1cccs1)NCC2CCNC2
O[C@@H]2CC[N@@](CCNC(=O)NCCN1CCNC(=O)C1)C2	ZINC000637032998	O=C2CN(CCNC(=O)NCCN1CCCC1)CCN2
CN1CCN(C=O)CC1	ZINC000000394174	C1CNCCN1
COC(=O)CSc3nnc(c1ccccc1)c(c2ccccc2)n3	ZINC000000117081	c3ccc(c1ncnnc1c2ccccc2)cc3
FC(F)(F)c3ccc2nc(c1ccc(Cl)c(Cl)c1)cnc2c3	ZINC000000090707	c3ccc(c2cnc1ccccc1n2)cc3
COC(=O)CNN=C(N)N	ZINC000028248528	nonring
CC[C@@H](CO)NC[C@@H](O)Cn1c(C)c(C)c2ccccc12	ZINC000000106240	c2ccc1[nH]ccc1c2
CC(=O)Nc3ccc(S(=O)(=O)Nc2ccn(Cc1ccccc1Cl)n2)cc3	ZINC000000680064	O=S(=O)(Nc2ccn(Cc1ccccc1)n2)c3ccccc3
Cn1nnnc1N2CCNCC2	ZINC000003716147	C2CN(c1nnn[nH]1)CCN2
CCN(CC)c2ccc(\C=N\n1c(C)cc(C)cc1=O)cc2	ZINC000000038932	O=c1ccccn1N=Cc2ccccc2
COC(=O)c2ccc(NC(=S)N/N=C/c1ccc(C)cc1C)cc2	ZINC000000138561	S=C(NN=Cc1ccccc1)Nc2ccccc2
COC(=O)[C@H](Cc1c[nH]c2ccccc12)/N=C/c3ccc(O)cc3	ZINC000000009017	C(Cc1c[nH]c2ccccc12)N=Cc3ccccc3
COc2ccc(OC)c(/C=C/C(=O)Nc1nccs1)c2	ZINC000000022066	O=C(Nc1nccs1)C=Cc2ccccc2
CC(C)N(Cc1ccccc1)S(=O)(=O)c2ccc(NC(C)=O)cc2	ZINC000000029694	O=S(=O)(NCc1ccccc1)c2ccccc2
COc3cc2CC(C)=NN=C(c1cccc(Cl)c1)c2cc3OC	ZINC000000000340	C2C=NN=C(c1ccccc1)c3ccccc23
C[C@@H](O)CNCCO	ZINC000002035190	nonring
O[C@H]1CNC[C@H]1CNC(=O)Cc3ccc2CC(=O)Nc2c3	ZINC000648133288	O=C(Cc2ccc1CC(=O)Nc1c2)NCC3CCNC3
CNC(=O)c1ccc(CN(C(C)C)C(C)C)o1	ZINC000000186795	c1ccoc1
O=C3N[C@@H](c1cccs1)C[C@H](c2cccs2)[C@H]3C#N	ZINC000000049122	O=C3CC(c1cccs1)CC(c2cccs2)N3
CC(=O)N[C@@H](C(=O)NCc1ccccc1)c2ccco2	ZINC000000004383	O=C(Cc1ccco1)NCc2ccccc2
O=C2N[C@H](c1cccs1)Nc3c2sc(=S)n3c4ccccc4	ZINC000000051790	O=C2NC(c1cccs1)Nc3c2sc(=S)n3c4ccccc4
OC2(C(=O)NCCNS(=O)(=O)c1ccccc1)CNC2	ZINC000662463876	O=C(NCCNS(=O)(=O)c1ccccc1)C2CNC2
COc2c(OC)c(OC(C)=O)c1cc(Cl)ccc1c2OC(C)=O	ZINC000000001630	c2ccc1ccccc1c2
CC[C@H]2NC(=O)c1cc(S(N)(=O)=O)c(Cl)cc1N2	ZINC000000000686	O=C1NCNc2ccccc12
N[C@H]1CO[C@H](CO)[C@@H](O)[C@@H]1O	ZINC000005157116	C1CCOCC1
O=c4n(C2c1ccccc1Oc3ccccc23)c(=O)c5ccccc45	ZINC000000055222	O=c4n(C2c1ccccc1Oc3ccccc23)c(=O)c5ccccc45
C[C@H](N1CCCCCC1)C(=O)c2ccc(N)cc2	ZINC000000004272	O=C(CN1CCCCCC1)c2ccccc2
NC(=O)CCN[C@@H]1CCS(=O)(=O)C1	ZINC000036923062	O=S1(=O)CCCC1
CC(C)c4ccc(Nc2c(c1ccc(F)cc1)nc3cnccn23)cc4	ZINC000000200586	N(c1ccccc1)c3c(c2ccccc2)nc4cnccn34
CN(C)C3(CNC(=O)c2nc1NCCCn1n2)CC3	ZINC000616340361	O=C(NCC1CC1)c3nc2NCCCn2n3
COc2ncnc(Sc1ccc(Cl)cc1)c2N(=O)=O	ZINC000000040225	S(c1ccccc1)c2ccncn2
CC(=O)c2ccc(N1CCNCC1)cc2	ZINC000000029076	C2CN(c1ccccc1)CCN2
CC(C)NC(=O)C(=O)N1CCCNCC1	ZINC000034963033	C1CNCCNC1
Cc3c(c1cccc(Cl)c1)nc2ccccc2c3C(=O)NC4CC4	ZINC000000371618	O=C(NC1CC1)c3cc(c2ccccc2)nc4ccccc34
COC(=O)c1ccccc1NC(=O)CSc2nc(C)cc(C)n2	ZINC000000050761	O=C(CSc1ncccn1)Nc2ccccc2
OCC(CO)NCc1cc(=O)[nH]c(=O)[nH]1	ZINC000238692218	O=c1cc[nH]c(=O)[nH]1
C[C@@H]1O[C@@H](OCCN)[C@H](O)[C@H](O)[C@H]1O	ZINC000201658766	C1CCOCC1
CC(C)c1cc(I)c(C)cc1O	ZINC000000001574	c1ccccc1
CN1CCCN(C(N)=NN)CC1=O	ZINC000228891928	O=C1CNCCCN1
CCc2ccc(NC(=O)CSc1ccc(C)cc1)cc2	ZINC000000043997	O=C(CSc1ccccc1)Nc2ccccc2
Fc2ccc(Oc1ccc(C(F)(F)F)cc1N(=O)=O)c(F)c2	ZINC000000090562	O(c1ccccc1)c2ccccc2
COC(=O)C1=C(N)OC3=C([C@@H]1c2ccc(OC)cc2)C(=O)CCC3	ZINC000000043623	O=C1CCCC3=C1C(c2ccccc2)C=CO3
CNC(=O)CS(=O)(=O)[C@@H]1CNC[C@@H]1O	ZINC000306820686	C1CCNC1
CN(N)c1cc(=O)n(C)c(=O)n1C	ZINC000000381774	O=c1cc[nH]c(=O)[nH]1
COc1ccccc1N3CCN(C(=O)c2ccccc2)CC3	ZINC000000038711	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
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
NCCN1CCNC1=O	ZINC000000164791	O=C1NCCN1
CC1(C)[C@@]3(C)CC[C@]1(C(=O)Nc2c(Cl)cccc2Cl)CC3=O	ZINC000000310349	O=C2CC3(C(=O)Nc1ccccc1)CCC2C3
O=C(Cc1cccc2ccccc12)N/N=C/c3ccc(C#N)cc3	ZINC000000059222	O=C(Cc1cccc2ccccc12)NN=Cc3ccccc3
CC[C@@H](N)CNC(=O)[C@@H]1COCCO1	ZINC000082578762	C1COCCO1
COC(=O)CCC(=O)Nc1sc(C)c(C)c1C(N)=O	ZINC000000038431	c1ccsc1
COc3ccc(COC[C@@H](O)CNC2Cc1ccccc1C2)cc3	ZINC000000119013	C(CNC2Cc1ccccc1C2)COCc3ccccc3
Cc2ccc(S(=O)(=O)c1ccc(C(O)=O)cc1N(=O)=O)cc2	ZINC000000092142	O=S(=O)(c1ccccc1)c2ccccc2
CN(CC(N)=O)C(=O)CN1CCCNCC1	ZINC000061269529	C1CNCCNC1
CC[C@@H](C)[C@H](N)C(=O)NCC(=O)NCC(N)=O	ZINC000004761042	nonring
Cn1c(=O)cc(CN)[nH]c1=O	ZINC000002572480	O=c1cc[nH]c(=O)[nH]1
CCOC(=O)N2CCN(C(=O)CSc1ccccc1)CC2	ZINC000000037727	O=C(CSc1ccccc1)N2CCNCC2
COC(=O)c1ccc(C(=O)OC)c(NC(=O)CC(C)(C)C)c1	ZINC000000030410	c1ccccc1
NCCC(=O)NC[C@@H]1CCCCN1C(=O)c3nc2NCCCn2n3	ZINC000648128007	O=C(N1CCCCC1)c3nc2NCCCn2n3
CCC(C)(C)C(=O)N2CCN(c1ccccc1)CC2	ZINC000000030414	C2CN(c1ccccc1)CCN2
Cc3nn2c(C(F)(F)F)cc(c1ccco1)nc2c3c4ccccc4	ZINC000000618929	c4ccc(c2cnn3ccc(c1ccco1)nc23)cc4
CNS(=O)(=O)CC(=O)N[C@@H](C)CCN(C)C	ZINC000332492468	nonring
NS(=O)(=O)c2ccc(NC(=O)COc1ccccc1)cc2	ZINC000000047196	O=C(COc1ccccc1)Nc2ccccc2
N[C@H]1[C@@H](O)[C@H](O)[C@H](CO)O[C@H]1NO	ZINC000004804375	C1CCOCC1
CNC(=O)CN[C@@H](C)C(=O)NC(N)=O	ZINC000037207674	nonring
CN(C)CCOC(=O)c1ccc(S(=O)(=O)N(C)C)o1	ZINC000000180494	c1ccoc1
COc2ccc(CN[C@@H](CC(=O)c1ccc(F)cc1)C(O)=O)cc2	ZINC000000049114	O=C(CCNCc1ccccc1)c2ccccc2
OC(=O)c1cccnc1SCC(=O)N2CCCc3ccccc23	ZINC000000215836	O=C(CSc1ccccn1)N2CCCc3ccccc23
OC(=O)c3cn(c1ccc(F)cc1)c2cc(Cl)c(F)cc2c3=O	ZINC000000386998	O=c2ccn(c1ccccc1)c3ccccc23
O=C1OCc2c1[nH]c(=O)[nH]c2=O	ZINC000000031381	O=C1OCc2c1[nH]c(=O)[nH]c2=O
Cc3ccc(Nc2cc(C)nc(Nc1ccc(C)cc1C)n2)c(C)c3	ZINC000000031382	N(c1ccccc1)c3ccnc(Nc2ccccc2)n3
CNC(=NN)N1CCO[C@@H](CO)C1	ZINC000164753513	C1COCCN1
CC(C)(N)C(=O)NCC(N)=O	ZINC000040912430	nonring
CCOC(=O)c2ccc1n(CCO)c(C)[n+](CCO)c1c2	ZINC000000262673	c2ccc1[nH]cnc1c2
CC(=O)Nc3ccc2nc(SCC(=O)NC1CC1)sc2c3	ZINC000000051969	O=C(CSc2nc1ccccc1s2)NC3CC3
CCNC(=O)CNC(=O)[C@H](C)N	ZINC000036780632	nonring
CN2CC(=O)N1CCNC[C@@H]1C2=O	ZINC000014743731	O=C2CNC(=O)C1CNCCN12
Cc2onc(c1ccccc1)c2c3ccc(S(N)(=O)=O)cc3	ZINC000000006694	c3ccc(c1conc1c2ccccc2)cc3
NC(=N)NN=C[C@H](O)[C@@H](O)[C@H](O)CO	ZINC000253393408	nonring
O=C2CC[C@@H](C(=O)Nc1ccccn1)N2C(=O)OCc3ccccc3	ZINC000000052048	O=C2CCC(C(=O)Nc1ccccn1)N2C(=O)OCc3ccccc3
CC(C)c3ccc(c1c(Cl)ncn1c2ccc(S(C)(=O)=O)cc2)cc3	ZINC000000592941	c3ccc(c1cncn1c2ccccc2)cc3
CN(C)C(=O)Cn2c(c1ccc(C(F)(F)F)cc1)nc3cccnc23	ZINC000000002336	c3ccc(c2nc1cccnc1[nH]2)cc3
NC2=N[C@H]1N=CN[C@@H]1N2	ZINC000238580313	N1C=NC2N=CNC12
CCO[C@@H]2CC(c1nonc1N)=NO2	ZINC000000492916	C2CC(c1cnon1)=NO2
CSc1ccc(CN(CCO)CCO)cc1	ZINC000000041591	c1ccccc1
NCC(=O)N1CCOC[C@@H](O)C1	ZINC000307360334	C1CNCCOC1
C(Sc2nc1ccccc1[nH]2)c4ccc3nonc3c4	ZINC000000034405	C(Sc2nc1ccccc1[nH]2)c4ccc3nonc3c4
O=C(OCc2ccc1nonc1c2)c4c3CCCc3nc5ccccc45	ZINC000000034404	O=C(OCc2ccc1nonc1c2)c4c3CCCc3nc5ccccc45
CCOC(=O)c2c1CCCCc1sc2NCc3ccc(C)cc3O	ZINC000000521154	C3CCc2sc(NCc1ccccc1)cc2C3
Cc2nnc(c1ccccc1)c(=O)n2/N=C/c3cccs3	ZINC000000032944	O=c2c(c1ccccc1)nncn2N=Cc3cccs3
Cc2ccc(OC[C@@H](O)CN1CCC(C(N)=O)CC1)c(N(=O)=O)c2	ZINC000000119233	C2CCN(CCCOc1ccccc1)CC2
O=C2CSC(N1CCOCC1)=N2	ZINC000000088101	O=C2CSC(N1CCOCC1)=N2
FC(F)(F)Oc2cc(OC(F)(F)F)cc(c1ccc(C=O)o1)c2	ZINC000000124989	c2ccc(c1ccco1)cc2
CC(C)c4ccc(Nc2c(c1ccncc1)nc3ccc(C)cn23)cc4	ZINC000000427509	N(c1ccccc1)c3c(c2ccncc2)nc4ccccn34
N=c1[nH]nc[nH][nH]1	ZINC000038700903	N=c1[nH]nc[nH][nH]1
Cn1c(N)cc(=O)n(C)c1=O	ZINC000000105224	O=c1cc[nH]c(=O)[nH]1
O[C@@H](COCc1ccccc1)CN3CCN(c2ccccn2)CC3	ZINC000000234864	C(COCc1ccccc1)CN3CCN(c2ccccn2)CC3
O=C(CNS(=O)(=O)c2ccc1[nH]c(=O)[nH]c1c2)N3CCNCC3	ZINC000320208261	O=C(CNS(=O)(=O)c2ccc1[nH]c(=O)[nH]c1c2)N3CCNCC3
C[C@@H]1C[N@@](CCO)[C@H](C)CN1C(=O)C[C@@H]2CC(=O)N2	ZINC000616342335	O=C2CC(CC(=O)N1CCNCC1)N2
CS(=O)(=O)c1ccc(N)c(N)c1	ZINC000000405758	c1ccccc1
COc2cc(C(=O)NN1CCN(C)CC1)cc(OC)c2OC	ZINC000000168530	O=C(NN1CCNCC1)c2ccccc2
CC1(N)C(=O)NC(=O)NC1=O	ZINC000031672095	O=C1CC(=O)NC(=O)N1
Oc1ccccc1[C@@H](CC(=O)N2CCOCC2)c3ccccc3	ZINC000000038360	O=C(CC(c1ccccc1)c2ccccc2)N3CCOCC3
CCNC(CO)(CO)CO	ZINC000005858487	nonring
CCc3ccc(C(=O)Nc1cccnc1Oc2ccc(OC)cc2)cc3	ZINC000000083930	O=C(Nc1cccnc1Oc2ccccc2)c3ccccc3
CON2C(=O)CC1(CCNCC1)C2=O	ZINC000000003887	O=C2CC1(CCNCC1)C(=O)N2
COc1ccccc1N4CCN(\N=c2\c(=O)[nH]c3ccccc23)CC4	ZINC000000046712	O=c2[nH]c1ccccc1c2=NN4CCN(c3ccccc3)CC4
Cc4ccc(c3nc(NC[C@@H]1CCCO1)c2ccccc2n3)cc4	ZINC000000109536	C4COC(CNc2nc(c1ccccc1)nc3ccccc23)C4
COc1ccccc1N3CCN(\N=C(\C)c2ccccc2)CC3	ZINC000000046716	C2CN(c1ccccc1)CCN2N=Cc3ccccc3
COCC[N@]2CC[C@@H](NC(=O)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1)C2	ZINC000668436454	O=C(NC1CCNC1)C2=CCCCC2
COC(=O)C1=C(C)NC(=O)N[C@@H]1c2ccc(OC)c(OC)c2	ZINC000000039379	O=C2NC=CC(c1ccccc1)N2
CC1(C)[C@@H](C=C(Cl)Cl)[C@@H]1C(=O)Nc2ccccc2	ZINC000000041443	O=C(Nc1ccccc1)C2CC2
O=c3n(Cc1ccccc1)n(Cc2ccccc2)c(=O)c4ccccc34	ZINC000000072785	O=c3n(Cc1ccccc1)n(Cc2ccccc2)c(=O)c4ccccc34
COC(=O)[C@@H](C)NC(=O)[C@@H]2[C@H]1CNC[C@H]12	ZINC000309623929	C1NCC2CC12
COC(=O)c1c(C)c(C(N)=O)sc1NC(=O)C(C)C	ZINC000000053152	c1ccsc1
C[C@H]([C@H](CC(O)=O)C(=O)Nc1cccc(Cl)c1C)c2ccccc2	ZINC000000049607	O=C(CCc1ccccc1)Nc2ccccc2
CCOc3ccc(NCn2nc(c1ccco1)oc2=S)cc3	ZINC000000032123	S=c2oc(c1ccco1)nn2CNc3ccccc3
COC[C@@H](C)NC(=O)N1CCOCC1	ZINC000000285380	C1COCCN1
FC(F)(F)c4cccc([C@@H]1CC(=O)Nc2c1ccc3ccccc23)c4	ZINC000000083024	O=C4CC(c1ccccc1)c3ccc2ccccc2c3N4
NCC(=O)NCC(=O)NC1CCOCC1	ZINC000037482315	C1CCOCC1
NC(=N)CN1C[C@@H](O)[C@H](O)C1	ZINC000300058898	C1CCNC1
N[C@@H]([C@H](O)C=O)[C@H](O)[C@H](O)CO	ZINC000255972165	nonring
CCOc1ccccc1OC[C@@H](O)CNC	ZINC000000322089	c1ccccc1
NS(=O)(=O)c2ccc(N1CCCCS1(=O)=O)cc2	ZINC000000002119	O=S1(=O)CCCCN1c2ccccc2
COc2ccc1sc(C)[n+](CCO)c1c2	ZINC000000236058	c2ccc1scnc1c2
CCN(O)CCc3ccc2OCc1ccccc1C(=O)c2c3	ZINC000000004931	O=C2c1ccccc1COc3ccccc23
CCOC(=O)c1[nH]c(=O)[nH]c1C	ZINC000000169113	O=c1[nH]cc[nH]1
N[C@@H](CO)C1CCCCC1	ZINC000000391869	C1CCCCC1
COc2c(Sc1ccc(N(=O)=O)cc1)c(C)nn2c3ccccc3	ZINC000000083110	S(c1ccccc1)c3cnn(c2ccccc2)c3
CC(C)C[C@@H](NC(=O)[C@@H]1CCCN1)c2nnnn2CC(N)=O	ZINC000005760052	O=C(NCc1nnn[nH]1)C2CCCN2
CNC(=O)NC(=O)CC[N@@](C)CC1(CO)CC1	ZINC000186791092	C1CC1
C[C@@H](N)CNC(=O)C(=O)NCC(=O)N2CCN(c1ccccc1)CC2	ZINC000642694816	C2CN(c1ccccc1)CCN2
CC1(C)N(CO)C(=O)NC1=O	ZINC000000156245	O=C1CNC(=O)N1
OC(=O)CC3(CC(=O)Nc1cccc2nonc12)CCCCC3	ZINC000000129697	O=C(CC1CCCCC1)Nc2cccc3nonc23
CCCn1c(=O)[nH]c(=O)c2nc[nH]c12	ZINC000000403567	O=c2[nH]c(=O)c1nc[nH]c1[nH]2
COC(=O)C2(C(=O)OC)[C@@H](c1ccccc1)[C@@]2(C#N)C(=O)OC	ZINC000000033614	C1CC1c2ccccc2
Cc3ccc(OCc2nn(CN1CCCC1)c(=S)n2C)cc3C	ZINC000000069879	S=c2[nH]c(COc1ccccc1)nn2CN3CCCC3
OC(=O)c1nccnc1C(=O)Nc2cc(Cl)cc(Cl)c2	ZINC000000068908	O=C(Nc1ccccc1)c2cnccn2
CN3CCN(c2nc1n(C)c(=O)[nH]c(=O)c1n2CC(C)=C)CC3	ZINC000000189490	O=c3[nH]c(=O)c2[nH]c(N1CCNCC1)nc2[nH]3
COc3ccc([C@@H]2Nc1ccccc1C(=O)N2O)cc3OC	ZINC000000079918	O=C2NC(c1ccccc1)Nc3ccccc23
N#Cc3c(N1CCOCC1)nnc(c2ccccc2)c3c4ccccc4	ZINC000000068676	C4CN(c3cc(c1ccccc1)c(c2ccccc2)nn3)CCO4
C[C@@H](CCN(C)C)NC(=O)CNC(N)=O	ZINC000332459592	nonring
O=C(NCCN1CCNC1=O)Nc2ccccc2	ZINC000000005006	O=C(NCCN1CCNC1=O)Nc2ccccc2
COc3cc(c1c(Cl)ncn1c2ccc(S(C)(=O)=O)cc2)ccc3F	ZINC000000592932	c3ccc(c1cncn1c2ccccc2)cc3
OC(=O)c2[nH]c1ccccc1c2CC(=O)N[C@@H]3CCCc4ccccc34	ZINC000000201620	O=C(Cc1c[nH]c2ccccc12)NC3CCCc4ccccc34
Nc2nc(N)nc(c1cnccn1)n2	ZINC000000023810	c2cnc(c1ncncn1)cn2
NN=C(N)N[C@@H]1CCN(C(N)=O)C1	ZINC000307159585	C1CCNC1
OC[C@@H]1C[C@@H](O)CN1	ZINC000012362904	C1CCNC1
CCNC[C@@H](O)CO	ZINC000005650436	nonring
COC(=O)CN1CCC(N(CCO)CCO)CC1	ZINC000600179678	C1CCNCC1
NC(=O)CC(=O)N[C@@H]1CNCCC1(F)F	ZINC000648146981	C1CCNCC1
CN(C)CCNc2nc1n(C)c(=O)[nH]c(=O)c1n2CC(C)=C	ZINC000000079575	O=c2[nH]c(=O)c1[nH]cnc1[nH]2
Cc3cccc(NC(=O)c2cc(S(=O)(=O)Nc1ccc(Cl)cn1)ccc2Cl)c3	ZINC000000826752	O=C(Nc1ccccc1)c3cccc(S(=O)(=O)Nc2ccccn2)c3
CN(CC(N)=O)C(=O)CN	ZINC000037269110	nonring
Cn2c(NC(=O)c1ccccc1)nc(=O)c3ccccc23	ZINC000000005264	O=C(Nc2nc(=O)c1ccccc1[nH]2)c3ccccc3
CN(C)CCC(=O)c1ccco1	ZINC000000036665	c1ccoc1
C[C@H](O)C[C@@H]([C@H](O)CN=NC(N)=S)N(C)C	ZINC000005763049	nonring
COc2cc(NS(=O)(=O)c1ccc(N)cc1)ncn2	ZINC000000049137	O=S(=O)(Nc1ccncn1)c2ccccc2
CCOC(=O)[C@H](CCCNC(N)=N)NC(C)=O	ZINC000002556507	nonring
CSc1nc(N)cc(=O)n1C	ZINC000000332674	O=c1ccnc[nH]1
O=Cc3c(c1ccccc1)nn(c2ccccc2)c3c4ccccc4	ZINC000000065249	c4ccc(c3cc(c1ccccc1)n(c2ccccc2)n3)cc4
C[C@H]1CCc3c(C1)sc4ncnc(SCc2c(C)noc2C)c34	ZINC000000102333	C1CCc3c(C1)sc4ncnc(SCc2cnoc2)c34
CSCC[C@H](NC(=O)[C@@H]1C[N@@]2CCCN1CC2)C(N)=O	ZINC000600258249	C1CN2CCN(C1)CC2
CCOC(=O)CCc3ccc2O[C@H](c1ccc(N(=O)=O)s1)Nc2c3	ZINC000000094482	N2C(c1cccs1)Oc3ccccc23
CN(C)[C@H]1CNC[C@@H]1O	ZINC000023094266	C1CCNC1
CC3(C)C(=O)Nc2cc(C(=O)Nc1ccccc1)ccc23	ZINC000000011459	O=C3Cc2ccc(C(=O)Nc1ccccc1)cc2N3
CC(=O)NC[C@H]1[C@H](O)[C@H](O)[C@@H]2[C@H](O)C[C@@H](CO)[N@@]12	ZINC000045348318	C2CC1CCCN1C2
CC(C)OC(=O)Nc1ccc(NC(=O)OC(C)C)c(C(F)(F)F)c1	ZINC000000232016	c1ccccc1
CNC(=O)CN(C)C(=O)[C@@H]1CNCCO1	ZINC000043707999	C1COCCN1
Clc3ccc(c2n\c(=C/c1cccs1)c(=O)o2)c(Cl)c3	ZINC000000055303	O=c2oc(c1ccccc1)nc2=Cc3cccs3
COc1ccccc1NC(=O)CCN3CCN(c2ccccc2)CC3	ZINC000000036711	O=C(CCN2CCN(c1ccccc1)CC2)Nc3ccccc3
Nc1nonc1c2nnnn2CC(=O)Nc3cccc4ccccc34	ZINC000000036245	O=C(Cn1nnnc1c2cnon2)Nc3cccc4ccccc34
COc2cc([C@@H]1NC(=O)CC[C@@H]1N(=O)=O)cc(OC)c2OC	ZINC000000036484	O=C2CCCC(c1ccccc1)N2
COC(OC)c3ccc2c(N)c(C(=O)Nc1ccccc1)sc2n3	ZINC000000123530	O=C(Nc1ccccc1)c3cc2cccnc2s3
C4COC(c3nc(c1ccccc1)c(c2ccccc2)[nH]3)OC4	ZINC000000014233	C4COC(c3nc(c1ccccc1)c(c2ccccc2)[nH]3)OC4
C[N+](C)(C)C[C@@H](O)CC(N)=O	ZINC000000901338	nonring
C(Sc3nnc(c1ccco1)c(c2ccco2)n3)c4ccccc4	ZINC000000085190	C(Sc3nnc(c1ccco1)c(c2ccco2)n3)c4ccccc4
CNC(=O)C(=O)NCCN	ZINC000037242768	nonring
Nc1nonc1c3noc(c2ccccc2N(=O)=O)n3	ZINC000000053803	c3ccc(c2nc(c1cnon1)no2)cc3
NC(=O)CN[C@@H]1CC(=O)NC1=O	ZINC000102669220	O=C1CCC(=O)N1
O=C(CN1CCCC1)NCC3(c2ccccc2)CCOCC3	ZINC000000200485	O=C(CN1CCCC1)NCC3(c2ccccc2)CCOCC3
Cc2cc(C)c(C#N)c(SCC(=O)NC1CC1)n2	ZINC000000062500	O=C(CSc1ccccn1)NC2CC2
Oc3c([C@H](Nc1ccccc1)c2ccccc2)ccc4cccnc34	ZINC000000037823	N(C(c1ccccc1)c3ccc2cccnc2c3)c4ccccc4
Cc2cccc(OCc1nnc(SCC(=O)NC(C)(C)C)n1C)c2	ZINC000000416226	C(Oc1ccccc1)c2nnc[nH]2
COc2cc(C(=O)NN=C(C)c1ccc(N)cc1)cc(OC)c2OC	ZINC000000058540	O=C(NN=Cc1ccccc1)c2ccccc2
CCc4ccc(N3C[C@@H](c2nc1ccccc1n2CC=C)CC3=O)cc4	ZINC000000252020	O=C3CC(c2nc1ccccc1[nH]2)CN3c4ccccc4
COc4ccc([C@@H]2C(C(O)=O)=C(C)Oc3cc1OCOc1cc23)cc4	ZINC000000044642	C4Oc3cc2OC=CC(c1ccccc1)c2cc3O4
O=C(C2=NCC(c1ccccc1)=N2)c3cccc(N(=O)=O)c3	ZINC000000031927	O=C(C2=NCC(c1ccccc1)=N2)c3ccccc3
CCNC(=O)NC(=O)C[N@]1CC[C@@H]([C@H](C)O)C1	ZINC000246092543	C1CCNC1
CCOC(=O)COc1ccccc1\C=c2\[nH]c(=O)[nH]c2=O	ZINC000000089669	O=c2[nH]c(=O)c(=Cc1ccccc1)[nH]2
O=C(Nc1nn[nH]n1)C=Cc2cccnc2	ZINC000000012759	O=C(Nc1nn[nH]n1)C=Cc2cccnc2
CC(C)(C)NC[C@@H](O)c1ccc(O)c(CO)c1	ZINC000000020230	c1ccccc1
C[C@H](NC(=O)\C=C\c1ccccc1)c3nc2scc(C)c2c(=O)o3	ZINC000000007518	O=C(NCc2nc1sccc1c(=O)o2)C=Cc3ccccc3
CCOc2nc1ccccc1c(=O)n2CCO	ZINC000000040701	O=c1[nH]cnc2ccccc12
C[C@H]2Oc1ccc(Cl)cc1N(C[C@H](O)CO)C2=O	ZINC000000000235	O=C2COc1ccccc1N2
NC(=N)NC(=N)NCC(O)=O	ZINC000028247518	nonring
CC(C)CCNS(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000000030397	c1ccccc1
CCN1CCC[C@@H]1CNS(=O)(=O)c2cc(Cl)c(N)cc2OC	ZINC000000000430	O=S(=O)(NCC1CCCN1)c2ccccc2
Cc1cc(C)c(OC[C@H](O)CO)c(C)c1	ZINC000000000437	c1ccccc1
COc1ccc(CC(=O)NCCC(C)C)cc1	ZINC000000030390	c1ccccc1
CN3CCN([C@@H]1[C@@H](O)[C@H](N)[C@H]2CO[C@@H]1O2)CC3	ZINC000022922167	C3CN(C1CCC2COC1O2)CCN3
COc1ccc(Br)cc1S(=O)(=O)Nc2ccncc2	ZINC000000367638	O=S(=O)(Nc1ccncc1)c2ccccc2
Clc3ccc(N1C[C@@H]2CC[C@H](C1)N2)nn3	ZINC000000007429	C2CC3CN(c1cccnn1)CC2N3
COc2ccc(C(=O)C=CNc1ccc(C(O)=O)cc1)cc2OC	ZINC000000318124	O=C(C=CNc1ccccc1)c2ccccc2
O=C(CC(c1ccccc1)c2ccccc2)Nc3cccnc3	ZINC000000030155	O=C(CC(c1ccccc1)c2ccccc2)Nc3cccnc3
O[C@H]1C=CCN[C@H]1C(O)=O	ZINC000001616718	C1CC=CCN1
Clc3ccc([C@H]2Oc1ccc(Cl)cc1C=C2N(=O)=O)cc3	ZINC000000103565	O2C(c1ccccc1)C=Cc3ccccc23
O=C(N/C(=C/c1cccs1)C(=O)N2CCCC2)c3ccccc3	ZINC000000044390	O=C(NC(=Cc1cccs1)C(=O)N2CCCC2)c3ccccc3
NC(=O)C2CCN(CC(=O)N1CCC(C(N)=O)CC1)CC2	ZINC000004737119	O=C(CN1CCCCC1)N2CCCCC2
N[C@H]1CNC(=O)[C@@H]1O	ZINC000032302735	O=C1CCCN1
OCC[N@]1C[C@@H](O)C[C@@H](O)C1	ZINC000224402413	C1CCNCC1
CCN2CCN(C[C@@H](C)CNC(=O)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1)CC2	ZINC000646901490	O=C(NCCCN1CCNCC1)C2=CCCCC2
CN1CC[N@](C)C[C@@H]1CNc2nnnn2C	ZINC000082669152	C2CNC(CNc1nnn[nH]1)CN2
Clc3ccc(C(=O)\C=c2/oc(c1ccc(Cl)cc1)cc2=O)cc3	ZINC000000290232	O=C(C=c2oc(c1ccccc1)cc2=O)c3ccccc3
Cc3ccc(c2ccc(=O)n(CCC(=O)NCc1ccccn1)n2)cc3	ZINC000000220404	O=C(CCn2nc(c1ccccc1)ccc2=O)NCc3ccccn3
Cc1cc(Cl)nc(Cl)c1C(=O)NCc2ccc(Cl)cc2	ZINC000000081507	O=C(NCc1ccccc1)c2cccnc2
Cc2cc(NC(=O)CNC[C@@H]1CCCO1)ccc2n3cnnn3	ZINC000000413015	O=C(CNCC1CCCO1)Nc3ccc(n2cnnn2)cc3
CCN(CC)c2ccc(/N=C/c1ccc(Br)s1)cc2	ZINC000000046321	C(=Nc1ccccc1)c2cccs2
NCC(=O)N1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO	ZINC000028246802	C1CCNCC1
NCCN2C[C@H]1NC(=O)C[C@@H]1C2=O	ZINC000082394220	O=C2CC1C(CNC1=O)N2
NS(=O)(=O)c2ccc(C(=O)NC[C@@H]1C[C@H](F)CN1)nc2	ZINC000648140648	O=C(NCC1CCCN1)c2ccccn2
Nc2cnc(c1cc(Cl)cc(Cl)c1Cl)c(N)n2	ZINC000000009967	c2ccc(c1cnccn1)cc2
NS(=O)(=O)NC[C@@H]1CCCCN1	ZINC000012506584	C1CCNCC1
NCC(=O)N(CCO)C1CC1	ZINC000036136819	C1CC1
CC(C)NC[C@@H](O)COc1ccccc1n2cccc2	ZINC000000002322	c2ccc(n1cccc1)cc2
O=C(N1CCOCC1)c3ccc(C(=O)c2ccccc2)o3	ZINC000000034276	O=C(N1CCOCC1)c3ccc(C(=O)c2ccccc2)o3
CC(C)O[C@@H]1O[C@H](CO)[C@H](O)[C@@H](O)[C@@H]1N	ZINC000255973597	C1CCOCC1
NCCN1CCNC(=O)C1	ZINC000022219288	O=C1CNCCN1
C[N@@](C[C@@H](O)CC1(O)CCC1)CC(N)=O	ZINC000625075306	C1CCC1
NC(CO)(CO)COCc1ccccc1	ZINC000000122448	c1ccccc1
Cc4nc(N1CCCCCC1)c3cc(c2ccccc2)sc3n4	ZINC000000089447	C4CCCN(c2ncnc3sc(c1ccccc1)cc23)CC4
CN=c2[nH]c(N)c1NCCN=c1[nH]2	ZINC000039114546	N=c2[nH]cc1NCCN=c1[nH]2
Cc1ccccc1C(=O)N2CCCC[C@@H]2CO	ZINC000000029301	O=C(N1CCCCC1)c2ccccc2