O=C(CSc2nnc(COc1ccccc1)o2)NC3CCCCC3	ZINC000000087599	O=C(CSc2nnc(COc1ccccc1)o2)NC3CCCCC3
CCSc2nc(c1ccc(Cl)cc1)c(C#N)c(=O)n2CC	ZINC000000052789	O=c2cc(c1ccccc1)nc[nH]2
Nc2ccn([C@@H]1S[C@H](CO)C=C1)c(=O)n2	ZINC000000006004	O=c1ncccn1C2SCC=C2
CN(C)CCN2C(=O)N[C@@](C)(c1ccc(N(=O)=O)cc1)C2=O	ZINC000000181425	O=C2NC(c1ccccc1)C(=O)N2
CN3CCN(C(=O)c2ccc(c1ccc(Br)cc1)o2)CC3	ZINC000000101734	O=C(N1CCNCC1)c3ccc(c2ccccc2)o3
CCOC(=O)C1=CN(C)C=C(C(=O)OCC)C1c2cccc(Cl)c2	ZINC000000223172	N2C=CC(c1ccccc1)C=C2
COC(=O)c2cc(C(=O)Nc1c(C)cccc1C)cc(N(=O)=O)c2	ZINC000000060814	O=C(Nc1ccccc1)c2ccccc2
Fc1cccc(Cl)c1CSc2ccccc2C3=NCCCN3	ZINC000000139184	C3CNC(c1ccccc1SCc2ccccc2)=NC3
O=c2nc(N1CCOCC1)[nH]c2=Cc3ccccc3	ZINC000000035058	O=c2nc(N1CCOCC1)[nH]c2=Cc3ccccc3
CN(C(C)=O)c2ccc(NC(=O)c1cccc(Br)c1)cc2	ZINC000000031022	O=C(Nc1ccccc1)c2ccccc2
CN(C)S(=O)(=O)N=c2[nH]c1ccc(S(C)(=O)=O)cc1s2	ZINC000000031751	N=c2[nH]c1ccccc1s2
Cc2cc(OCc1c(F)cccc1Cl)cc3OC(C)(C)CC(=O)c23	ZINC000000083230	O=C2CCOc3cc(OCc1ccccc1)ccc23
CCOc2ccc(NC(=O)c1ccc(OC)cc1OC)cc2	ZINC000000029895	O=C(Nc1ccccc1)c2ccccc2
COc2ccc(CNC(=O)c1cnc(OC)cc1C(F)(F)F)cc2	ZINC000000077733	O=C(NCc1ccccc1)c2cccnc2
O=C3N(c1ccccc1)[C@H](\C=C\c2ccccc2)Nc4ccccc34	ZINC000000035053	O=C3N(c1ccccc1)C(C=Cc2ccccc2)Nc4ccccc34
CCN(CC)c3ccc([C@@H]2NC(=O)c1ccccc1N2)cc3	ZINC000000035056	O=C2NC(c1ccccc1)Nc3ccccc23
O=C(Cn1c(=S)[nH]c2ccccc12)c3ccc(N(=O)=O)cc3	ZINC000000045452	O=C(Cn1c(=S)[nH]c2ccccc12)c3ccccc3
O=C(NC1CCCCC1)c4ccc(COc2cccc3ccccc23)o4	ZINC000000115426	O=C(NC1CCCCC1)c4ccc(COc2cccc3ccccc23)o4
C/C(=N\OC(=O)c1ccc(Cl)c(Cl)c1)c2ccc(F)c(F)c2	ZINC000000092219	O=C(ON=Cc1ccccc1)c2ccccc2
CC3(C)OC(\C=C\c1ccnc2ccccc12)=CC3=O	ZINC000000013854	O=C3COC(C=Cc1ccnc2ccccc12)=C3
CSC(O)=NC(=O)NC(=O)c1ccc(N(=O)=O)cc1	ZINC000001584862	c1ccccc1
Cn2c(=O)oc3cc(C(=O)c1ccco1)ccc23	ZINC000000015566	O=C(c2ccc1[nH]c(=O)oc1c2)c3ccco3
O=c3nc2[nH]c(c1ccccc1)cn2[nH]c3=O	ZINC000000053261	O=c3nc2[nH]c(c1ccccc1)cn2[nH]c3=O
CC(C)(C)c1nccn1C[C@@H]4CC(c2ccccc2)(c3ccccc3)C(=O)O4	ZINC000000599226	O=C2OC(Cn1ccnc1)CC2(c3ccccc3)c4ccccc4
CCn2c(SCC(=O)Nc1ccc(N(C)C)cc1)nnc2C(C)C	ZINC000000410477	O=C(CSc1nnc[nH]1)Nc2ccccc2
O=C(Nc1cccnc1)c4ccc3c(=O)n(C2CCCCC2)c(=O)c3c4	ZINC000000462626	O=C(Nc1cccnc1)c4ccc3c(=O)n(C2CCCCC2)c(=O)c3c4
Clc3cc1COCOc1c(C[n+]2ccccc2)c3	ZINC000000139344	C3OCc2cccc(C[n+]1ccccc1)c2O3
COc1ccc(C(C)=O)c(O)c1	ZINC000000001906	c1ccccc1
Cc3ccc(c2c/c(=C/c1ccc(C)c(N(=O)=O)c1)c(=O)o2)c(C)c3	ZINC000000066720	O=c2oc(c1ccccc1)cc2=Cc3ccccc3
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
COc1ccccc1N3CCN(C(=O)\C=C\c2ccccc2)CC3	ZINC000000052145	O=C(C=Cc1ccccc1)N3CCN(c2ccccc2)CC3
CN=C(Nc1cc(Cl)cc(Cl)c1)S[C@@H]3CC(=O)N(c2ccc(C(O)=O)cc2)C3=O	ZINC000000852410	N=C(Nc1ccccc1)SC3CC(=O)N(c2ccccc2)C3=O
CC2CCN(C[C@H](O)COc1ccc(C)c(C)c1)CC2	ZINC000000064559	C2CCN(CCCOc1ccccc1)CC2
CC(C)CN(CC(C)C)C(=O)CCn2c(=O)c1ccccc1c2=O	ZINC000000044881	O=c1[nH]c(=O)c2ccccc12
Brc3ccc(CSc1nccn1c2cccnc2)cc3	ZINC000000074225	C(Sc1nccn1c2cccnc2)c3ccccc3
Cc3ccc(S(=O)(=O)NC(=O)NCc1csc2ccc(Cl)cc12)cc3	ZINC000001032487	O=C(NCc1csc2ccccc12)NS(=O)(=O)c3ccccc3
Nn3c(c1cccc(N(=O)=O)c1)nc2ccccc2c3=O	ZINC000000031620	O=c2[nH]c(c1ccccc1)nc3ccccc23
O=C2CS[C@@H](c1cccc(N(=O)=O)c1)N2CCN3CCCCC3	ZINC000000208069	O=C2CSC(c1ccccc1)N2CCN3CCCCC3
Cc2ccc(S(=O)(=O)N/N=C/c1ccccc1O)cc2	ZINC000000032137	O=S(=O)(NN=Cc1ccccc1)c2ccccc2
CC[N@@]2CCc1nc(N)oc1CC2	ZINC000000000982	C2Cc1ncoc1CCN2
NC(N1CCCCC1)=C(N=Nc2ccccc2C(F)(F)F)C#N	ZINC000000062886	C2CCN(C=CN=Nc1ccccc1)CC2
O=C(COC(=O)c1ccccc1C(=O)c2ccccc2)c3ccccc3	ZINC000000072816	O=C(COC(=O)c1ccccc1C(=O)c2ccccc2)c3ccccc3
COc2cc(NC(=O)CCS(=O)(=O)c1ccccc1)cc(OC)c2	ZINC000000223711	O=C(CCS(=O)(=O)c1ccccc1)Nc2ccccc2
Cn3c(=O)cc4c1ccccc1c(=O)c5c(N2CCOCC2)ccc3c45	ZINC000000033449	O=c3cc4c1ccccc1c(=O)c5c(N2CCOCC2)ccc([nH]3)c45
CC(C)(C)NC(=O)c1nccnc1C(O)=O	ZINC000000187694	c1cnccn1
CCOc1cc(C=O)ccc1OC(=O)c2ccco2	ZINC000000033990	O=C(Oc1ccccc1)c2ccco2
Cc4ccc3NC(=O)[C@@]1(C(C#N)=C(N)OC2=C1C(=O)CC(C)(C)C2)c3c4	ZINC000000051719	O=C1CCCC2=C1C4(C=CO2)C(=O)Nc3ccccc34
Cc3cc(=O)c(Oc1ccc(F)cc1F)c(c2ccc(S(C)(=O)=O)cc2)o3	ZINC000000588145	O=c2ccoc(c1ccccc1)c2Oc3ccccc3
COc2ccc(c1cc(CN)on1)cc2	ZINC000000169748	c2ccc(c1ccon1)cc2
O[C@H]2CCc3c(Nc1ccc(C#N)cc1)ncnc23	ZINC000000002857	C3Cc2ncnc(Nc1ccccc1)c2C3
Clc4ccc([C@H]2C[C@H](c1ccccc1)Nc3nnnn23)c(Cl)c4	ZINC000000113710	C3C(c1ccccc1)Nc2nnnn2C3c4ccccc4
Cc3ccc2nc(/N=C/c1ccc(Br)cc1)sc2c3	ZINC000000050178	C(=Nc2nc1ccccc1s2)c3ccccc3
Clc3ccc(Sc2cc(Cl)nn(c1ccccc1)c2=O)cc3	ZINC000000343688	O=c2c(Sc1ccccc1)ccnn2c3ccccc3
COc2ccc(C[N@]1CCCC[C@@H]1CO)cc2Br	ZINC000000209192	C2CCN(Cc1ccccc1)CC2
Cn2ccc(Nc1ccccc1O)n2	ZINC000000002922	N(c1ccccc1)c2cc[nH]n2
CN3CCN(c2ccc(NC(=O)COc1ccc(C)cc1)cc2)CC3	ZINC000000360000	O=C(COc1ccccc1)Nc3ccc(N2CCNCC2)cc3
CC(C)(C)NC[C@@H](O)c1cc(Cl)c(N)c(Cl)c1	ZINC000000057262	c1ccccc1
O=C(COc1ccc3c(c1)oc(=O)c2ccccc23)c5ccc4ccccc4c5	ZINC000000622108	O=C(COc1ccc3c(c1)oc(=O)c2ccccc23)c5ccc4ccccc4c5
Clc4ccc(Cn2c(CN1CCCC1)nc3ccccc23)cc4	ZINC000000057260	C4CCN(Cc2nc1ccccc1n2Cc3ccccc3)C4
COc1cc(Cl)c(C)cc1NC(=O)c2cc(Cl)ccc2Cl	ZINC000000472121	O=C(Nc1ccccc1)c2ccccc2
COc2ccc(OC)c(\C=c1/c(=O)[nH]c(=O)n(C)c1=O)c2	ZINC000000086748	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)[nH]2
CCc2c(C)[nH]n(c1ccc(C)c(C)c1)c2=O	ZINC000000041544	O=c1cc[nH]n1c2ccccc2
COc3ccc(C(=O)NC[C@@H]2COc1ccccc1O2)cc3N(=O)=O	ZINC000000118774	O=C(NCC2COc1ccccc1O2)c3ccccc3
O[C@@H]([C@@H](O)c2nc1ccccc1[nH]2)C(O)=O	ZINC000000281472	c2ccc1[nH]cnc1c2
FC(F)(F)c4ccc(c2nnc3ccc(N1CCCCC1)nn23)cc4	ZINC000000078783	C4CCN(c3ccc2nnc(c1ccccc1)n2n3)CC4
Cn2c(O)c(C(=O)Nc1ccccc1)c3cccnc23	ZINC000000014251	O=C(Nc1ccccc1)c2c[nH]c3ncccc23
Brc3ccc(C2=CC(=O)O[C@H](c1ccccc1)O2)cc3	ZINC000000053788	O=C3OC(c1ccccc1)OC(c2ccccc2)=C3
CC(C)(C)OC(=O)N1CCC(CN)CC1	ZINC000000161689	C1CCNCC1
Cc2ccc1nsnc1c2NC(=O)COc3ccc(Cl)c(C)c3	ZINC000000097739	O=C(COc1ccccc1)Nc2cccc3nsnc23
Oc3ccc(c1csc2=NCCn12)cc3O	ZINC000000050613	C3Cn2c(c1ccccc1)csc2=N3
OC(=O)c4ccc(N3C(O)=C2ON=C(C(=O)c1cccs1)[C@@H]2C3=O)cc4	ZINC000003849143	O=C1C3C(=CN1c2ccccc2)ON=C3C(=O)c4cccs4
CC2(C)CC(=O)C(=NNc1cccnc1Cl)C(=O)C2	ZINC000000061442	O=C1CCCC(=O)C1=NNc2cccnc2
COc3ccc(c2cc(C(F)(F)F)n1nc(C(O)=O)nc1n2)cc3	ZINC000000061441	c3ccc(c2ccn1ncnc1n2)cc3
Cc2ccc(OCC(=O)NCc1ccccc1)c(Br)c2	ZINC000000038443	O=C(COc1ccccc1)NCc2ccccc2
Cc2nc(SCC(=O)NCc1ccccc1)c(C#N)c(C)c2Cl	ZINC000000033666	O=C(CSc1ccccn1)NCc2ccccc2
CC(C)[C@H](NC(=O)CNC(=O)Cc4c(C)c3cc2c(c1ccccc1)coc2cc3oc4=O)C(O)=O	ZINC000002160346	O=c4ccc3cc2c(c1ccccc1)coc2cc3o4
O[C@@]2(c1ccc(Cl)cc1)C=C(C(F)(F)F)NN2C=O	ZINC000000033193	N2NC(c1ccccc1)C=C2
CN(C)CCn1c(C#N)cc2ccccc12	ZINC000000129803	c2ccc1[nH]ccc1c2
CC(C)Sc4nnc3c1ccccc1n(CCc2ccccc2)c3n4	ZINC000000079787	C(Cn2c1ccccc1c3nncnc23)c4ccccc4
O=C(Nc3ccc(CCc2nc1ccccc1o2)cc3)C4CCCCC4	ZINC000000189319	O=C(Nc3ccc(CCc2nc1ccccc1o2)cc3)C4CCCCC4
CCCc3cc(=O)oc4cc2occ(c1ccc(F)cc1)c2cc34	ZINC000000409130	O=c4ccc3cc2c(c1ccccc1)coc2cc3o4
Clc1ccccc1C(=O)Nc4cc3c(ccc2ccccc23)oc4=O	ZINC000000340249	O=C(Nc3cc2c(ccc1ccccc12)oc3=O)c4ccccc4
Nc3cc(c2nc1ccccc1[nH]2)n[nH]c3=O	ZINC000000031819	O=c3ccc(c2nc1ccccc1[nH]2)n[nH]3
NC(=S)n3[nH]c(c1ccc(N(=O)=O)cc1)c(N=Nc2ccc(C(O)=O)cc2)c3=O	ZINC000012275780	O=c2[nH][nH]c(c1ccccc1)c2N=Nc3ccccc3
Cc3ccc(/N=C/c1ccccc1OC(=O)c2ccc(Cl)cc2)cc3	ZINC000000058970	O=C(Oc1ccccc1C=Nc2ccccc2)c3ccccc3
CC(=O)O[C@H]1[C@H]3CC[C@@H]1[C@H](N2CCCCC2)CC3	ZINC000000121004	C3CCN(C1CCC2CCC1C2)CC3
Nc2cc(Oc1ccc(F)cc1)cc(N(=O)=O)c2	ZINC000000027783	O(c1ccccc1)c2ccccc2
Fc3ccc(CN2CCC(C(=O)NCc1cccnc1)CC2)cc3	ZINC000000236072	O=C(NCc1cccnc1)C3CCN(Cc2ccccc2)CC3
COc1cc(CO)c(Br)cc1OCc2ccccc2C#N	ZINC000000469730	C(Oc1ccccc1)c2ccccc2
FC(F)(F)c3cccc(N2CCN(C(=O)Nc1ccccc1)CC2)c3	ZINC000000275358	O=C(Nc1ccccc1)N3CCN(c2ccccc2)CC3
Cc2cccc(NC(=O)c1cccc(N(=O)=O)c1C)n2	ZINC000000033261	O=C(Nc1ccccn1)c2ccccc2
Cc4ccc(N3CCN(CCCN2C(=O)[C@@H]1CCCN1C2=O)CC3)cc4	ZINC000000633293	O=C2C1CCCN1C(=O)N2CCCN4CCN(c3ccccc3)CC4
COc3nc(NCc1cccnc1)nc(N2CCC(C)CC2)n3	ZINC000000033266	C3CCN(c2ncnc(NCc1cccnc1)n2)CC3
Fc3ccc(Oc2ncnc(Oc1ccc(F)cc1)c2N(=O)=O)cc3	ZINC000000042144	O(c1ccccc1)c3cc(Oc2ccccc2)ncn3
Fc3ccc(Nc2nc(=O)c1ccccc1o2)cc3	ZINC000000069197	O=c2nc(Nc1ccccc1)oc3ccccc23
C[C@@H](O)[C@@H](O)c1ccc(C#N)nc1	ZINC000000023802	c1ccncc1
Cc3nc(Nc1ccc(C)c(C)c1)cc(Nc2ccc(C)c(C)c2)n3	ZINC000000045126	N(c1ccccc1)c3cc(Nc2ccccc2)ncn3
COc4cccc(C(=O)Nc3c1CCCCc1nc2CCCc23)c4	ZINC000000198614	O=C(Nc3c1CCCCc1nc2CCCc23)c4ccccc4
c3ccc(c2cnc1nonc1n2)cc3	ZINC000000027762	c3ccc(c2cnc1nonc1n2)cc3
O=S(=O)(N(CC#N)CC#N)c1ccccc1	ZINC000000029390	c1ccccc1
Cc2nc(c1noc(C)n1)no2	ZINC000000027765	c2nc(c1ncon1)no2
COc2ccc(C(=O)NCc1ccccc1)c(OC)c2	ZINC000000029901	O=C(NCc1ccccc1)c2ccccc2
Cc3ccc(SC(=O)c1cccnc1Oc2ccccc2)cc3	ZINC000000150717	O=C(Sc1ccccc1)c2cccnc2Oc3ccccc3
COc2cnc1n(C)cc(CCNC(C)=O)c1c2	ZINC000000021664	c2cnc1[nH]ccc1c2
COc3ccc2[nH]cc(C[C@@H]1CCC[N@]1C)c2c3	ZINC000000005452	C3CNC(Cc1c[nH]c2ccccc12)C3
Cc2ccc(c1n[nH][nH]c1=S)c(C)c2	ZINC000000072496	S=c1[nH][nH]nc1c2ccccc2
CCN(CC)C(=O)c2ccc(Sc1ccc(F)cc1)c(N(=O)=O)c2	ZINC000000257407	S(c1ccccc1)c2ccccc2
Cc3cc(C(=O)Nc2cccc(COC(=O)c1cc(C)on1)c2)no3	ZINC000000154134	O=C(Nc2cccc(COC(=O)c1ccon1)c2)c3ccon3
CC(=O)Nc2ccc(NC(=O)\C=C\c1c(Cl)cccc1Cl)cc2	ZINC000000147143	O=C(Nc1ccccc1)C=Cc2ccccc2
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
CCOC(=O)c1c(C)c(C)sc1NC(=O)c2ccccc2N(=O)=O	ZINC000000032672	O=C(Nc1cccs1)c2ccccc2
COc2ccc([C@@H]1CNC(=O)C1)cc2OC3CCCC3	ZINC000000004982	O=C3CC(c2cccc(OC1CCCC1)c2)CN3
COC(=O)C2[C@@H](c1ccccc1)C(C(O)=O)[C@@H]2c3ccccc3	ZINC000000053361	C2C(c1ccccc1)CC2c3ccccc3
Cc3c1CCCCc1nc(SCC(=O)c2ccc(F)cc2)c3C#N	ZINC000000093290	O=C(CSc2ccc1CCCCc1n2)c3ccccc3
C4CCN(CCn2c(/N=C/c1cccs1)nc3ccccc23)CC4	ZINC000000196168	C4CCN(CCn2c(N=Cc1cccs1)nc3ccccc23)CC4
Fc3ccc(NC(=O)CCN2CCN(c1ccccc1)CC2)cc3	ZINC000000380753	O=C(CCN2CCN(c1ccccc1)CC2)Nc3ccccc3
OC(=O)c3ccc(NC=c2nc(c1ccc(Cl)cc1)oc2=O)cc3	ZINC000000177492	O=c2oc(c1ccccc1)nc2=CNc3ccccc3
CCc3ccc([C@@H]2[C@@H](C(O)=O)c1ccccc1C(=O)N2C)cc3	ZINC000000211795	O=C2NC(c1ccccc1)Cc3ccccc23
O=c2[nH]nc(c1cccnc1)c3ccccc23	ZINC000000005291	O=c2[nH]nc(c1cccnc1)c3ccccc23
O=C(OCc2ccc1OCOc1c2)OCc4ccc3OCOc3c4	ZINC000000075273	O=C(OCc2ccc1OCOc1c2)OCc4ccc3OCOc3c4
CC(C)(C)N2CCO[C@H](c1ccc(N)nc1)C2	ZINC000000005293	C2COC(c1cccnc1)CN2
C[C@H]2[C@H]3Cc1ccc(O)cc1[C@]2(C)CCN3	ZINC000000005296	C3CC1CC(Cc2ccccc12)N3
CCCc2ccc(OC(=O)COc1cccc(Br)c1)cc2	ZINC000000148529	O=C(COc1ccccc1)Oc2ccccc2
Cc3ccc(c2nc1ncccc1o2)cc3NC(=O)Cc4ccccc4	ZINC000000106353	O=C(Cc1ccccc1)Nc4cccc(c3nc2ncccc2o3)c4
CCCCCC[C@@H](C(=O)N1CCC[C@H]1C(O)=O)n3cnc(NC(=O)c2ccccc2S(O)(=O)=O)c3	ZINC000013739981	O=C(Cn2cnc(NC(=O)c1ccccc1)c2)N3CCCC3
CN4CCC(O)(c3nc(c1ccc(F)cc1)c(c2ccncc2)o3)CC4	ZINC000000602685	C4CC(c3nc(c1ccccc1)c(c2ccncc2)o3)CCN4
O=C(CCS(=O)(=O)c1ccccc1)NCc3ccc2OCOc2c3	ZINC000000223712	O=C(CCS(=O)(=O)c1ccccc1)NCc3ccc2OCOc2c3
CSc2[nH]nc(NC(=O)c1ccccc1Cl)c2S(=O)(=O)c3ccc(Cl)cc3	ZINC000001037457	O=C(Nc1n[nH]cc1S(=O)(=O)c2ccccc2)c3ccccc3
OC(=O)CCC(=O)Nc4ccc3c([C@H](N2CCN(CC(=O)N1CCCC1)CC2)C(O)=O)c[nH]c3c4	ZINC000031818371	O=C(CN3CCN(Cc1c[nH]c2ccccc12)CC3)N4CCCC4
Cc1cc(C)n(C)c(=O)c1C(=O)Nc2ccccc2Cl	ZINC000000034621	O=C(Nc1ccccc1)c2ccc[nH]c2=O
Cc3cccn4c(=O)c(\C=c1/sc(=S)n(CC(O)=O)c1=O)c(NC[C@@H](O)c2ccccc2)nc34	ZINC000001880162	O=c1[nH]c(=S)sc1=Cc4c(NCCc2ccccc2)nc3ccccn3c4=O
COc1cc(NC(=O)C(C)C)c(OC)cc1Cl	ZINC000000029787	c1ccccc1
COc3ccc(c2csc(c1ccccc1)n2)cc3Br	ZINC000000314973	c3ccc(c2csc(c1ccccc1)n2)cc3
Clc4ccc(N3CCN(Cc2cn1ccccc1n2)CC3)cc4	ZINC000000021403	C2CN(c1ccccc1)CCN2Cc4cn3ccccc3n4
Cc2cc(c1ccc(O)cc1)nnc2NCCN3CCOCC3	ZINC000000001756	C(CN1CCOCC1)Nc3ccc(c2ccccc2)nn3
OC(=O)CS(=O)(=O)c1ccccc1N(=O)=O	ZINC000000135526	c1ccccc1
C[N+](C)(C)c3nc(N1CCOCC1)nc(N2CCOCC2)n3	ZINC000000054244	C3CN(c2ncnc(N1CCOCC1)n2)CCO3
CO[C@H]1CCCC[C@H]1NCc2cc(OC)c(OC)c(OC)c2	ZINC000000267281	C2CCC(NCc1ccccc1)CC2
CNc2c1CCCCc1nn2C	ZINC000000000757	C2CCc1n[nH]cc1C2
Cc3ccc(C(=O)N2CCN(C(=O)CN1CCCC1)C2)cc3	ZINC000000063351	O=C(CN1CCCC1)N3CCN(C(=O)c2ccccc2)C3
CC(C)=C[C@@H]3[C@@H](C(=O)OCn2c(=O)c1CCCCc1c2=O)C3(C)C	ZINC000000000753	O=C(OCn2c(=O)c1CCCCc1c2=O)C3CC3
Cc3ccc(NC(=O)c2ccc(OC(=O)c1ccccc1F)cc2)cc3	ZINC000000132052	O=C(Nc1ccccc1)c3ccc(OC(=O)c2ccccc2)cc3
CCn2c(c1ccc(Cl)cc1)nn(C)c2=O	ZINC000000004187	O=c2[nH]nc(c1ccccc1)[nH]2
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
Oc2ccc(CCC(=O)c1ccc(O)cc1O)cc2	ZINC000000014168	O=C(CCc1ccccc1)c2ccccc2
Cn3c(c1nonc1NC(=O)c2ccc(F)cc2)nc4ccccc34	ZINC000000045639	O=C(Nc1nonc1c3nc2ccccc2[nH]3)c4ccccc4
OC(=O)c1ccc3c(c1)c(=O)c2ccccc23	ZINC000000155050	O=c2c1ccccc1c3ccccc23
CCn2c(c1ccc(Cl)cc1)n[nH]c2=O	ZINC000000004188	O=c2[nH]nc(c1ccccc1)[nH]2
Cc4cc(\C=c3\sc2nc1ccccc1n2c3=O)c(C)n4C	ZINC000000029099	O=c3c(=Cc1cc[nH]c1)sc4nc2ccccc2n34
O=C4[C@@H]2C6c1ccccc1C([C@@H]2c5nc3ccccc3n45)c7ccccc67	ZINC000000107176	O=C6C2C(C3c1ccccc1C2c4ccccc34)c7nc5ccccc5n67
COC(=O)c1ccccc1NC(=O)Cc2ccc(Br)cc2	ZINC000000030767	O=C(Cc1ccccc1)Nc2ccccc2
COc3c1OCOc1cc(CCN(C)C(=O)c2ccccc2)c3/C=C/C(=O)c4c(O)n(C)c(=O)n(C)c4=O	ZINC000008917985	O=C(NCCc2cc1OCOc1cc2C=CC(=O)c3c[nH]c(=O)[nH]c3=O)c4ccccc4
COC(=O)c2ccc(NC(=O)[C@@H](C)Oc1ccc(Cl)cc1C)cc2	ZINC000000129771	O=C(COc1ccccc1)Nc2ccccc2
OC(=O)CC[C@]1(O)OC(=O)C\C1=C/C(O)=O	ZINC000005382414	C=C1COC(=O)C1
CCOC(=O)c3ccc([C@@H]1C(C#N)=C(N)Oc2cc(C)oc(=O)c12)o3	ZINC000000048721	O=c3occc2OC=CC(c1ccco1)c23
OC(=O)c1cc(=O)[nH]c2c(Cl)cc(Cl)cc12	ZINC000000075661	O=c2ccc1ccccc1[nH]2
OC[C@H]1CCCN1C(=O)c3cc2ccccc2o3	ZINC000000008217	O=C(N1CCCC1)c3cc2ccccc2o3
O=C2Nc1ccccc1C23OCCCCO3	ZINC000000095524	O=C2Nc1ccccc1C23OCCCCO3
CCN(CC)CCN1C(=O)Cn2c(C)c(C)c3cccc1c23	ZINC000000036906	O=C1Cn2ccc3cccc(N1)c23
Nc2cc(Cl)nc(SCc1ccccc1)n2	ZINC000000021246	C(Sc1ncccn1)c2ccccc2
CCOc4ccc(N3C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C3=O)cc4	ZINC000000488477	O=C3NC(Cc1c[nH]c2ccccc12)C(=O)N3c4ccccc4
CCN(c2c(C)cc(C)c(N(CC(O)=O)S(=O)(=O)c1ccccc1)c2C)S(=O)(=O)c3ccccc3	ZINC000001610518	O=S(=O)(Nc2cccc(NS(=O)(=O)c1ccccc1)c2)c3ccccc3
OC(=O)CC[C@H](NC(=O)COc3ccc2c1CCCc1c(=O)oc2c3)C(O)=O	ZINC000002115518	O=c3oc1ccccc1c2CCCc23
COc3ccc(CN2CCN(c1ccc(F)cc1)CC2)cc3C	ZINC000000234520	C2CN(c1ccccc1)CCN2Cc3ccccc3
CN4C(=O)[C@H](NC(=O)c2cc1ccccc1[nH]2)N=C(c3ccccc3)c5ccccc45	ZINC000000586243	O=C3Nc1ccccc1C(c2ccccc2)=NC3NC(=O)c5cc4ccccc4[nH]5
Clc1ccccc1NS(=O)(=O)c4ccc(NS(=O)(=O)c3ccc2OCCOc2c3)cc4	ZINC000001053595	O=S(=O)(Nc1ccccc1)c4ccc(NS(=O)(=O)c3ccc2OCCOc2c3)cc4
Brc3cccc(C(=O)n1cnc2ccccc12)c3	ZINC000000041121	O=C(c1ccccc1)n2cnc3ccccc23
CCC(=O)Nc2ccc(S(=O)(=O)Nc1cccc(C)c1)cc2OC	ZINC000000463502	O=S(=O)(Nc1ccccc1)c2ccccc2
COc3ccc(C(=O)C[C@@]2(O)C(=O)Nc1ccccc12)cc3OC	ZINC000000045523	O=C(CC1C(=O)Nc2ccccc12)c3ccccc3
C5Oc4ccc(CNc3ccc(c2nc1ccccc1o2)cc3)cc4O5	ZINC000000442574	C5Oc4ccc(CNc3ccc(c2nc1ccccc1o2)cc3)cc4O5
COc3ccc(C(=NCc1ccc(C)cc1)c2ccc(OC)cc2)cc3	ZINC000000090476	C(N=C(c1ccccc1)c2ccccc2)c3ccccc3
Nc3ccc(n2c(=O)c1ccccc1c2=O)c(Cl)c3	ZINC000000008695	O=c2n(c1ccccc1)c(=O)c3ccccc23
COc2cc(NC(=O)c1ccccc1C)c(OC)cc2Cl	ZINC000000037528	O=C(Nc1ccccc1)c2ccccc2
O[C@]24N=C(c1ccccc1)S[C@H]2Cc3cc(Cl)ccc34	ZINC000000008690	C3C2SC(c1ccccc1)=NC2c4ccccc34
COC(=O)COc2ccc(Oc1nc(N(C)C)nc(N(C)C)n1)nn2	ZINC000000105958	O(c1cccnn1)c2ncncn2
Cc2c(c1ccccc1)n(C)c(=O)n2C4CCN(Cc3ccccc3)CC4	ZINC000000592273	O=c2[nH]c(c1ccccc1)cn2C4CCN(Cc3ccccc3)CC4
C[C@@H]1N[C@@H](C(O)=O)Cc2c1[nH]c3ccccc23	ZINC000000037832	C1Cc2c(CN1)[nH]c3ccccc23
C[C@H]4CC(=O)c3c(SCc1ncn(C)n1)ccc(c2nccs2)c3C4	ZINC000000589891	O=C3CCCc4c(c1nccs1)ccc(SCc2nc[nH]n2)c34
Fc2ccc(NC(=O)c1cccnc1)c(F)c2	ZINC000000029654	O=C(Nc1ccccc1)c2cccnc2
Cc2ccc(NC(=O)CCC(O)=O)c(C(=O)c1ccccc1)c2	ZINC000000312898	O=C(c1ccccc1)c2ccccc2
COc1cccc(OC)c1C(=O)N2CCOCC2	ZINC000000029650	O=C(N1CCOCC1)c2ccccc2
CCOC(=O)c1ccccc1NC(=O)c2cccc(C)c2	ZINC000000029651	O=C(Nc1ccccc1)c2ccccc2
O=C(CC2c1ccccc1Oc3ccccc23)Nc4ccccc4C#N	ZINC000000051049	O=C(CC2c1ccccc1Oc3ccccc23)Nc4ccccc4
FC(F)(F)c1ccccc1C=NN3C(c2cccnc2)N=NC3=S	ZINC000000028785	S=C2N=NC(c1cccnc1)N2N=Cc3ccccc3
CC(=O)Oc4ccc3c(=O)c(c2ccc1OCCOc1c2)coc3c4	ZINC000000064410	O=c3c(c2ccc1OCCOc1c2)coc4ccccc34
CCOC(=O)C1=C(CCl)OC(N)=C(C#N)[C@H]1c2ccccc2C	ZINC000000058557	O2C=CC(c1ccccc1)C=C2
COc3ccc(\C=c2/c(c1ccccc1)noc2=O)c(OC)c3	ZINC000000043602	O=c2onc(c1ccccc1)c2=Cc3ccccc3
CC(C)C(=O)Nc2ccc(C(=O)Nc1ccccc1C(O)=O)cc2	ZINC000000237503	O=C(Nc1ccccc1)c2ccccc2
CCOC(=O)c1cc(C)ccc1NC(=O)c2cc(C)ccc2N(=O)=O	ZINC000000067352	O=C(Nc1ccccc1)c2ccccc2
Fc4ccc3c1ccc(F)cc1C2(CC(=O)NC2=O)c3c4	ZINC000000009809	O=C1CC4(C(=O)N1)c2ccccc2c3ccccc34
Clc1ccccc1c3nc(\C=N\N2CCOCC2)c4ccccn34	ZINC000000071942	C4CN(N=Cc2nc(c1ccccc1)n3ccccc23)CCO4
OC(=O)CSc2nc1ccccc1o2	ZINC000000050892	c2ccc1ocnc1c2
O=c4cc3nc2[nH]c1ccccc1c2nn3c(=S)[nH]4	ZINC000000031966	O=c4cc3nc2[nH]c1ccccc1c2nn3c(=S)[nH]4
CN(C)C(=O)c3cccc(NC(=O)NCc2cccc(N1C(=N)NC(=N)NC1(C)C)c2)c3	ZINC000001728479	N=C3NCN(c2cccc(CNC(=O)Nc1ccccc1)c2)C(=N)N3
COc3cc(\C=N\c2sc1CCCCc1c2C#N)cc4OCOc34	ZINC000000063625	C4CCc3sc(N=Cc2ccc1OCOc1c2)cc3C4
CCN(CC)C[C@@H](O)Cn2c1C(=O)CCCc1c3cc(C)ccc23	ZINC000000074824	O=C1CCCc2c1[nH]c3ccccc23
COc3ccc2[C@@H](Nc1cccc(N(=O)=O)c1)OC(=O)c2c3OC	ZINC000000062712	O=C2OC(Nc1ccccc1)c3ccccc23
CCCc3cc(=O)oc4c(C)c2occ(c1ccc(OC)cc1)c2cc34	ZINC000000095343	O=c4ccc3cc2c(c1ccccc1)coc2cc3o4
Cc1ccccc1Cn2c(=O)ccc2=O	ZINC000000020200	O=c1ccc(=O)n1Cc2ccccc2
COc3ccc2[nH]c(C(=O)N(C)C1CCN(C)CC1)cc2c3	ZINC000000147249	O=C(NC1CCNCC1)c3cc2ccccc2[nH]3
COc3cc(OC)cc(C(=O)Nc2ccc(S(=O)(=O)Nc1cccc(Cl)c1)cc2)c3	ZINC000000665520	O=C(Nc2ccc(S(=O)(=O)Nc1ccccc1)cc2)c3ccccc3
C[C@H](NC(=O)NO)c1cc(C)sc1C	ZINC000000012844	c1ccsc1
Nc1[nH]cnc2nc(S(O)(=O)=O)nc12	ZINC000002486839	c2nc1c[nH]cnc1n2
COc4ccc(C3=C[C@H](c1ccccc1)c2ccccc2O3)cc4OC	ZINC000000266398	O3C(c1ccccc1)=CC(c2ccccc2)c4ccccc34
Cc3ccc(S(=O)(=O)N(C(F)F)c1cccc2ccccc12)cc3	ZINC000000314335	O=S(=O)(Nc1cccc2ccccc12)c3ccccc3
Cc4cc(=O)oc5cc(C)c3c(c2ccc1ccccc1c2)coc3c45	ZINC000000489321	O=c5ccc4c(ccc3c(c2ccc1ccccc1c2)coc34)o5
O=C(CSc2nn1CCCC(=O)N=c1s2)OCc3ccccc3	ZINC000000425846	O=C(CSc2nn1CCCC(=O)N=c1s2)OCc3ccccc3
O=C1CCCC(=O)C1=CNc3ccc(C(=O)NC2CCCCC2)cc3	ZINC000000090215	O=C1CCCC(=O)C1=CNc3ccc(C(=O)NC2CCCCC2)cc3
CCOc2ccc1sc(NC(NC(C)=O)(C(F)(F)F)C(F)(F)F)nc1c2	ZINC000000708330	c2ccc1scnc1c2
Cc3ccc(NC(=O)CSc2nn1CCCC(=O)N=c1s2)cc3	ZINC000000425841	O=C(CSc2nn1CCCC(=O)N=c1s2)Nc3ccccc3
C\C(=C/C(N)=O)c1ccccc1Br	ZINC000000007182	c1ccccc1
Cc4ccc(C2(c1ccc(C)cc1)C[C@@H]2C(=O)Nc3nccs3)cc4	ZINC000000191068	O=C(Nc1nccs1)C2CC2(c3ccccc3)c4ccccc4
Clc2ccc(OCC(=O)N/N=C/c1ccc(C#N)cc1)c(Cl)c2	ZINC000000358113	O=C(COc1ccccc1)NN=Cc2ccccc2
OC[C@H]1C[C@]1(CO)Cn2cc(C=CBr)c(=O)[nH]c2=O	ZINC000000006344	O=c2ccn(CC1CC1)c(=O)[nH]2
OP(O)(=O)c5cn4c3Cc2c(Cc1nn[nH]n1)cccc2c3[nH]c(=O)c4n5	ZINC000003937074	O=c4[nH]c3c2cccc(Cc1nn[nH]n1)c2Cc3n5ccnc45
CCOc1ccccc1NC(=O)c3cccc(NS(=O)(=O)c2ccccc2C)c3	ZINC000000683238	O=C(Nc1ccccc1)c3cccc(NS(=O)(=O)c2ccccc2)c3
COc1ccccc1CC(=O)Nc2ccc(C)cc2	ZINC000000030160	O=C(Cc1ccccc1)Nc2ccccc2
COc1ccccc1CC(=O)N2CCOCC2	ZINC000000030165	O=C(Cc1ccccc1)N2CCOCC2
Fc5ccc(n2c(CN1CCCCC1)nnc2SC[C@H]3NS(=O)(=O)N=C4CCCCCN34)cc5	ZINC000003331810	O=S5(=O)NC(CSc2nnc(CN1CCCCC1)n2c3ccccc3)N4CCCCCC4=N5
COc3cc(CNC2CCN(Cc1ccccc1)CC2)cc(OC)c3	ZINC000004989381	C2CN(Cc1ccccc1)CCC2NCc3ccccc3
Cc2cn(Cc1ccccn1)c(C)n2	ZINC000000008506	C(c1ccccn1)n2ccnc2
COc1ccc(NC(=O)NC(=O)C(F)(F)F)c(OC)c1	ZINC000000081863	c1ccccc1
CC(C)OC(=O)c2c(C)oc3ccc(OCc1cccc(F)c1)cc23	ZINC000000086264	C(Oc2ccc1occc1c2)c3ccccc3
NC(=O)CSc3nc(c1ccccc1)cc(c2ccccc2)n3	ZINC000000052208	c3ccc(c2cc(c1ccccc1)ncn2)cc3
NC(=O)C3CCN(CC(=O)N1N=CC[C@@H]1c2ccccc2)CC3	ZINC000000538969	O=C(CN1CCCCC1)N2N=CCC2c3ccccc3
OC(=O)[C@@H]1CCS[C@@H](C(O)=O)N1	ZINC000137258687	C1CNCSC1
CNc1ccc(Cl)cc1S(=O)(=O)c2ccccc2N(=O)=O	ZINC000000006769	O=S(=O)(c1ccccc1)c2ccccc2
Clc3cccc(c2nnc(SCC(=O)NCc1ccco1)o2)c3	ZINC000000417677	O=C(CSc2nnc(c1ccccc1)o2)NCc3ccco3
COc3ccc([C@@H]1SCC(=O)N1c2ccc(NC(C)=O)cc2)cc3	ZINC000000031852	O=C2CSC(c1ccccc1)N2c3ccccc3
CC[C@@H](C)NC(=O)c2ccc1OCOc1c2	ZINC000000030187	C2Oc1ccccc1O2
CC(C)c1cccc(C(C)C)c1NC(=O)Nc2cccc(C(C)=O)c2	ZINC000000610218	O=C(Nc1ccccc1)Nc2ccccc2
COCCn3c(C)cc(CNC2CCN(Cc1ccccc1)CC2)c3C	ZINC000007779656	C2CN(Cc1ccccc1)CCC2NCc3cc[nH]c3
Cc2nc(=O)c(c1ccccc1)c(C)n2c3ccc(C(O)=O)cc3	ZINC000000267426	O=c2ncn(c1ccccc1)cc2c3ccccc3
CC(C)[C@@H](NC(=O)OCc1ccccc1)C(=O)ON2C(=O)CCC2=O	ZINC000000392330	O=C(CNC(=O)OCc1ccccc1)ON2C(=O)CCC2=O
C[C@H]3C[C@H](NC(=O)c1ccc(F)c2ccccc12)CC(C)(C)C3	ZINC000000031366	O=C(NC1CCCCC1)c2cccc3ccccc23
Cc2c(C)c1ccccc1n2C[C@@H](O)CN3CCCCCC3	ZINC000000096649	C3CCCN(CCCn1ccc2ccccc12)CC3
O=C(NC1CCCCCC1)\C=C\c3ccc2OCOc2c3	ZINC000000044073	O=C(NC1CCCCCC1)C=Cc3ccc2OCOc2c3
CCN4CCN(c3c(N[C@@H](Cc2ccc(NC(=O)c1c(Cl)cncc1Cl)cc2)C(O)=O)c(=O)c3=O)CC4	ZINC000025998852	O=C(Nc3ccc(CCNc2c(N1CCNCC1)c(=O)c2=O)cc3)c4ccncc4
O/N=C/c2ccc(N1CCOCC1)cc2	ZINC000000034086	C2CN(c1ccccc1)CCO2
CCOC(=O)N1N=CC[C@@H]1C	ZINC000000025099	C1CC=NN1
Cc3c(O[C@@H]1CCCCC1=O)ccc4c(c2ccccc2)cc(=O)oc34	ZINC000000406876	O=C1CCCCC1Oc4ccc3c(c2ccccc2)cc(=O)oc3c4
Oc5cc(=O)n(c1cccc(Cl)c1)c(SCC(=O)Nc2ccc4CCc3cccc2c34)n5	ZINC000000657247	O=C(CSc1nccc(=O)n1c2ccccc2)Nc3ccc5CCc4cccc3c45
NC(=S)C(=C/c1cc(Br)cs1)/C#N	ZINC000000043555	c1ccsc1
COc1cc(OC)c(OC)cc1C[N@@](C)CCc2ccccn2	ZINC000000300712	C(Cc1ccccn1)NCc2ccccc2
CCOC(=O)c3cc(c1nonc1N2CCOCC2)no3	ZINC000000034645	C3CN(c1nonc1c2ccon2)CCO3
CCOC(=O)C[C@@H](N)c1ccccc1Cl	ZINC000000043551	c1ccccc1
Cc2cc(O)c(c1cc[nH]n1)c(=O)o2	ZINC000000075847	O=c1occcc1c2cc[nH]n2
CCOC(=O)C[C@@H](N)c1ccc(C)cc1	ZINC000000043553	c1ccccc1
COc2ccc(/C=C/C(=O)Nc1ccccc1)cc2	ZINC000000028321	O=C(Nc1ccccc1)C=Cc2ccccc2
O=C4CS[C@@H](c2cn(c1ccccc1)nc2c3ccccc3)N4	ZINC000000083783	O=C4CSC(c2cn(c1ccccc1)nc2c3ccccc3)N4
COCCNC(=O)[C@@H]3CCC[N@](C2CCN(Cc1ccccc1)CC2)C3	ZINC000004261693	C3CCN(C2CCN(Cc1ccccc1)CC2)CC3
C[C@H](C(=O)NC1CC1)S(=O)(=O)c2ccccc2Br	ZINC000000015175	O=C(CS(=O)(=O)c1ccccc1)NC2CC2
OC2=CS(=O)(=O)N(Cc1c(F)cccc1Cl)c3ccccc23	ZINC000000092210	O=S2(=O)C=Cc1ccccc1N2Cc3ccccc3
COCc3cc(C)nc4sc2C(=O)N[C@H](c1ccco1)Nc2c34	ZINC000000054357	O=C2NC(c1ccco1)Nc3c2sc4ncccc34
O=C(NCCN1CCCC1)C3c2ccccc2Oc4ccccc34	ZINC000000099861	O=C(NCCN1CCCC1)C3c2ccccc2Oc4ccccc34
Cc2cc1[nH]c(=O)c(=O)[nH]c1c(N(=O)=O)c2C	ZINC000000006308	O=c2[nH]c1ccccc1[nH]c2=O
Clc1ccccc1C(=O)NS(=O)(=O)c2ccccc2	ZINC000000092216	O=C(NS(=O)(=O)c1ccccc1)c2ccccc2
FC(F)(F)C(=O)NC(=O)NCc1ccccc1Cl	ZINC000000081893	c1ccccc1
Fc2ccc(NC(=O)C(=S)Nc1ccc(Cl)cc1)cc2Cl	ZINC000000124428	O=C(Nc1ccccc1)C(=S)Nc2ccccc2
CC1(C)CO[C@@H](CC(O)=O)CN1	ZINC000000006164	C1COCCN1
Cc3cc(C)c2oc(c1ccc(N)cc1)nc2c3	ZINC000000031293	c3ccc(c2nc1ccccc1o2)cc3
COc3ccc(N2C(=O)C[C@H](NC[C@@H]1CCCO1)C2=O)cc3	ZINC000000084384	O=C2CC(NCC1CCCO1)C(=O)N2c3ccccc3
COc2nc(Nc1ccccc1)nc(OCC(F)(F)F)n2	ZINC000000034463	N(c1ccccc1)c2ncncn2
O=C3CCCc4nc(c1ccccc1)nc(NC(=O)c2ccccc2)c34	ZINC000000103659	O=C3CCCc4nc(c1ccccc1)nc(NC(=O)c2ccccc2)c34
CN(C(C)=O)c3ccc(NC(=O)COc2ccc1ccccc1c2)cc3	ZINC000000143415	O=C(COc2ccc1ccccc1c2)Nc3ccccc3
Cc2cc(C)cc(NC(=O)CSc1nc(C)cc(C)n1)c2	ZINC000000031564	O=C(CSc1ncccn1)Nc2ccccc2
Cc2ccc(NCc1cc(Br)ccc1O)nc2	ZINC000000031566	C(Nc1ccccn1)c2ccccc2
Cc2cc(C)nc(SCC(=O)Nc1ccc(F)cc1F)n2	ZINC000000031563	O=C(CSc1ncccn1)Nc2ccccc2
CCCn2nc(Oc1nc(N(C)C)nc(N(C)C)n1)ccc2=O	ZINC000000032927	O=c2ccc(Oc1ncncn1)n[nH]2
C/C(=N\O)c1ccc(C)c(C)c1O	ZINC000000025891	c1ccccc1
OC(=O)c4ccc(S(=O)(=O)c3ccc2c(=O)n(NC(=O)c1cccnc1)c(=O)c2c3)cc4	ZINC000002195779	O=C(Nn3c(=O)c2ccc(S(=O)(=O)c1ccccc1)cc2c3=O)c4cccnc4
CCN(CC)CCc2c(C)c1ccc(O)cc1oc2=O	ZINC000000032923	O=c2ccc1ccccc1o2
COc4c1OCOc1cc3CC[N@](C)[C@@H](C[C@H](O)c2ccccc2)c34	ZINC000000486096	C4Cc2cc1OCOc1cc2C(CCc3ccccc3)N4
Cc3cccc(C(=O)N2CCc1ccccc1C2)c3	ZINC000000029310	O=C(N2CCc1ccccc1C2)c3ccccc3
C[C@@H]1CCCC[C@H]1OC(=O)Nc2cc(Cl)c(Cl)cc2Cl	ZINC000000396465	O=C(Nc1ccccc1)OC2CCCCC2
CC(C)(C)Nc1nc(Cl)nc(Cl)n1	ZINC000000039598	c1ncncn1
Fc3ccc(F)c(NCn1nnc2ccccc12)c3	ZINC000000031582	C(Nc1ccccc1)n2nnc3ccccc23
Nc1cccc(C(CC(O)=O)CC(O)=O)c1	ZINC000001857386	c1ccccc1
COc2cccc(CN1CCC(C(=O)NC(C)(C)C)CC1)c2OC	ZINC000000299576	C2CCN(Cc1ccccc1)CC2
CS(=O)(=O)c3ccc(c2cn1ccccc1n2)cc3	ZINC000000002261	c3ccc(c2cn1ccccc1n2)cc3
C[C@H]3C[C@H](c1ccccc1)c2cc(C)ccc2N3C(=O)c4ccco4	ZINC000000201474	O=C(N2CCC(c1ccccc1)c3ccccc23)c4ccco4
CC(=O)Nc1nc(O)c(CC(O)=O)s1	ZINC000005789478	c1cscn1
C[C@@H](OS(O)(=O)=O)C(O)=O	ZINC000006468788	nonring
Clc1ccc(Cl)c(S(=O)(=O)N(CC#N)CC#N)c1	ZINC000000029488	c1ccccc1
O=C(Oc2nc1ccccc1s2)c3cccc(N(=O)=O)c3	ZINC000000048813	O=C(Oc2nc1ccccc1s2)c3ccccc3
Clc1ccc(C(=O)N(CC=C)CC=C)cc1Cl	ZINC000000029883	c1ccccc1
CC(=O)\C=C\[C@@]1(O)C(C)=CC(=O)CC1(C)C	ZINC000000057359	O=C1CCCC=C1
CC(=O)O[C@@]4(c2ccc1ccccc1n2)COc3ccccc34	ZINC000000035298	C2Oc1ccccc1C2c4ccc3ccccc3n4
C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc3c(C)c2cc(Cl)c(O)cc2oc3=O)C(O)=O	ZINC000013591180	O=C(Cc2cc1ccccc1oc2=O)NCCc3ccccc3
Cc5ccc4nc(c3ccc(N2C(=O)C[C@H](N1CCCCC1)C2=O)cc3)sc4c5	ZINC000000689525	O=C2CC(N1CCCCC1)C(=O)N2c5ccc(c4nc3ccccc3s4)cc5
Cc3c(C(=O)CC[N@]2CCC(c1ccc(F)cc1)=CC2)cnn3CCO	ZINC000000537749	O=C(CCN2CCC(c1ccccc1)=CC2)c3cn[nH]c3
Fc3ccc(NC(=O)Cn2nnc(c1ccccc1Cl)n2)c(F)c3	ZINC000000035024	O=C(Cn2nnc(c1ccccc1)n2)Nc3ccccc3
O=C(NC1CCCCC1)[C@@H]2CCCN2C(=O)Oc3ccccc3	ZINC000000049448	O=C(NC1CCCCC1)C2CCCN2C(=O)Oc3ccccc3
NC(N1CCOCC1)=C(N=Nc2ccc(Br)cc2)C#N	ZINC000000067840	C2CN(C=CN=Nc1ccccc1)CCO2
O=c3n(c1ccccc1)c(C[n+]2ccccc2)nc4ccccc34	ZINC000000175086	O=c3n(c1ccccc1)c(C[n+]2ccccc2)nc4ccccc34
C3CN(Cc1ccccn1)c2ccccc2C3	ZINC000000024941	C3CN(Cc1ccccn1)c2ccccc2C3
Clc3ccc(NC(=O)NCc2ccc1OCOc1c2)cc3	ZINC000000038341	O=C(NCc2ccc1OCOc1c2)Nc3ccccc3
COc2ccc(NC(=O)CCC(=O)Nc1nnc(C(C)C)s1)cc2	ZINC000000539153	O=C(CCC(=O)Nc1nncs1)Nc2ccccc2
Nc3nc(c1ccc(Cl)cc1Cl)c(n2cncn2)s3	ZINC000000035113	c3ccc(c1ncsc1n2cncn2)cc3
Cn4c(SCc2ccc1OCOc1c2)nc3ccccc3c4=O	ZINC000000032725	O=c3[nH]c(SCc2ccc1OCOc1c2)nc4ccccc34
Nc3cc(c2nc1ncccc1o2)ccc3Cl	ZINC000000038188	c3ccc(c2nc1ncccc1o2)cc3
Cc3ccc(c2csc(NC(=O)c1cccc(Cl)c1)n2)c(C)c3	ZINC000000175156	O=C(Nc2nc(c1ccccc1)cs2)c3ccccc3
CC3=C(C(=O)OCCc1ccccc1)[C@@H](c2ccccc2)NC(=O)N3	ZINC000000039354	O=C3NC=C(C(=O)OCCc1ccccc1)C(c2ccccc2)N3
C4Cc1ccccc1C5=Nc2ccccc2S[C@@H](c3cccs3)[C@H]45	ZINC000000105074	C4Cc1ccccc1C5=Nc2ccccc2SC(c3cccs3)C45
CC(C)[C@H]1CN[C@@H](C(O)=O)[C@@H]1CC(O)=O	ZINC000000057309	C1CCNC1
Cc1ccccc1N[C@H](c2ccncc2)c3c(C)[nH]c4ccccc34	ZINC000000506047	N(C(c1ccncc1)c2c[nH]c3ccccc23)c4ccccc4
Nc1nonc1c3nc2ccccc2n3Cc4ccc(Cl)cc4	ZINC000000048968	C(c1ccccc1)n3c(c2cnon2)nc4ccccc34
CC(=O)Nc3ccc(n1c(CCC(O)=O)ccc1c2ccc(C)cc2)cc3	ZINC000000920205	c3ccc(c1cccn1c2ccccc2)cc3
COc2cc(CC1=NCCN1)cc(OC)c2OC	ZINC000000001914	C2CN=C(Cc1ccccc1)N2
O=C(NCCc1ccccc1)n3c2ccccc2sc4ccccc34	ZINC000000088019	O=C(NCCc1ccccc1)n3c2ccccc2sc4ccccc34
Cc1nccn1C[C@@H](O)COc2ccc(Cl)cc2Cl	ZINC000000074255	C(COc1ccccc1)Cn2ccnc2
NS(=O)(=O)c4ccc3N[C@H](c1ccc(F)cc1)[C@H]2CC=C[C@H]2c3c4	ZINC000000053178	C1C=CC3C1C(c2ccccc2)Nc4ccccc34
CC(C)c1cc(C(C)=O)c(C)cc1OC(=O)C(F)(F)F	ZINC000000045388	c1ccccc1
OC(=O)CN(CC(O)=O)c2ccc1cccc(O)c1n2	ZINC000001233325	c2ccc1ncccc1c2
CC(=O)Nc2ccc(C(=O)OCc1ccc(Br)cc1)cc2	ZINC000000469542	O=C(OCc1ccccc1)c2ccccc2
C[C@@]13CCC(=O)N1c2ccccc2N3	ZINC000000003982	O=C3CCC2Nc1ccccc1N23
COc3ccc(\C=c2\nc(c1ccco1)oc2=O)cc3Br	ZINC000000460675	O=c2oc(c1ccco1)nc2=Cc3ccccc3
CSc3nc(O)c(C(c1ccccn1)c2c(O)nc(SC)n(C)c2=O)c(=O)n3C	ZINC000016225709	O=c1[nH]cncc1C(c2ccccn2)c3cnc[nH]c3=O
Cc3ccc(C(O)(C(=O)Nc1ccccn1)c2ccc(C)cc2)cc3	ZINC000000053175	O=C(Nc1ccccn1)C(c2ccccc2)c3ccccc3
N#Cc1cnoc1N2CCCc3ccccc23	ZINC000000035331	C3CN(c1ccno1)c2ccccc2C3
Cn2c(=O)n(C)c1[nH]c(CCC(O)=O)nc1c2=O	ZINC000001652964	O=c2[nH]c(=O)c1nc[nH]c1[nH]2
CN3CCN(C(=O)[C@H]2[C@@H]1C[C@@H](C=C1)[C@@H]2C(O)=O)CC3	ZINC000000032101	O=C(C1CC2CC1C=C2)N3CCNCC3
CC(C)c1cccc2c(O)c(C(O)=O)cnc12	ZINC000000151629	c2ccc1ncccc1c2
COc3ccc(C(=O)n1c(=O)oc2cc(Br)ccc12)cc3	ZINC000000049752	O=C(c1ccccc1)n2c(=O)oc3ccccc23
COc2cc(OC)c(NC(=O)Nc1ccccc1C(N)=O)cc2Cl	ZINC000000400412	O=C(Nc1ccccc1)Nc2ccccc2
Cn1c(Br)nc(C(O)=O)c1C(O)=O	ZINC000004277632	c1c[nH]cn1
CN(C)S(=O)(=O)c2ccc(N)c(C(=O)N1CCN(C)CC1)c2	ZINC000000001255	O=C(N1CCNCC1)c2ccccc2
CC(C)(C)n2c(=O)[nH]c(=O)\c(=C/c1c(Cl)cccc1Cl)c2=O	ZINC000000192702	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)[nH]2
OC(=O)CCc2ccc(S(=O)(=O)Nc1cc(N(=O)=O)ccc1O)cc2	ZINC000005135084	O=S(=O)(Nc1ccccc1)c2ccccc2
S=c1[nH]ccn1Cc2nccs2	ZINC000000002913	S=c1[nH]ccn1Cc2nccs2
CCc1c(O)[nH]c(=O)n1c2ccccc2	ZINC000000078151	O=c1[nH]ccn1c2ccccc2
Cn3c(=O)c(c1ccccc1Cl)cc4cnc(NC2CCOCC2)nc34	ZINC000000594223	O=c3[nH]c2nc(NC1CCOCC1)ncc2cc3c4ccccc4
CC(C)C[C@@H](CC(O)=O)C(O)=O	ZINC000002392198	nonring
CC(=O)Nc2ccc(c1cc(=O)[nH]nc1C)cc2	ZINC000000002666	O=c2cc(c1ccccc1)cn[nH]2
CN[C@@H](C)Cc1ccc(Cl)cc1	ZINC000000057270	c1ccccc1
CO[C@](C)(OCCn2c1ccccc1c3ccccc23)c4ccccc4	ZINC000000033851	C(Cn2c1ccccc1c3ccccc23)OCc4ccccc4
OC(=O)c2ccc(NC=c1c(=O)[nH]c(=O)[nH]c1=O)c(N(=O)=O)c2	ZINC000016384557	O=c2[nH]c(=O)c(=CNc1ccccc1)c(=O)[nH]2
COC(=O)c4ccc(C[N+]3(C)CCc2[nH]c1ccccc1c2C3)o4	ZINC000000490868	C3Cc2[nH]c1ccccc1c2CN3Cc4ccco4
COc3cccc(C(=O)CSc2nc1ccc(C)cc1cc2C#N)c3	ZINC000000410777	O=C(CSc2ccc1ccccc1n2)c3ccccc3
COc3ccc(NC(=S)Nc1ccccc1N2CCOCC2)cc3	ZINC000000111695	S=C(Nc1ccccc1)Nc2ccccc2N3CCOCC3
CCC[N@](c1ccncc1F)n2cc(C)c3cc(OC(=O)NC)ccc23	ZINC000000598070	N(c1ccncc1)n2ccc3ccccc23
COc2ccc(OC[C@@H](O)CNC1CC(C)(C)NC(C)(C)C1)cc2	ZINC000000189012	C(CNC1CCNCC1)COc2ccccc2
Cc3cc(C)cc(COc2cc1oc(=O)c(C)c(C)c1cc2Cl)c3	ZINC000000608930	O=c3ccc2ccc(OCc1ccccc1)cc2o3
C[N@@](CCCn2c(=S)[nH]c1ncccc1c2=O)Cc3ccccc3	ZINC000000424570	O=c2n(CCCNCc1ccccc1)c(=S)[nH]c3ncccc23
Cc4[nH]c3ccc(c2nnc(SCc1ccccc1)o2)cc3c4C	ZINC000000221662	C(Sc3nnc(c2ccc1[nH]ccc1c2)o3)c4ccccc4
Fc2cc(Cl)c(C(=O)NCCc1ccccc1)cc2F	ZINC000000036002	O=C(NCCc1ccccc1)c2ccccc2
Cc1cc(Br)cc(C)c1NS(C)(=O)=O	ZINC000000036000	c1ccccc1
O=C(Nc1ccccn1)c3cccc(S(=O)(=O)N2CCOCC2)c3	ZINC000000288999	O=C(Nc1ccccn1)c3cccc(S(=O)(=O)N2CCOCC2)c3
Clc3ccc(CSc2nc1CSCc1c(=O)[nH]2)cc3	ZINC000000169170	O=c3[nH]c(SCc1ccccc1)nc2CSCc23
Brc2ccc(NCCC(=O)c1cccc(N(=O)=O)c1)cc2	ZINC000000446315	O=C(CCNc1ccccc1)c2ccccc2
C[C@H]1CC(=O)NN=C1c3ccc(n2ccc(=O)cc2)cc3	ZINC000000005598	O=C3CCC(c2ccc(n1ccc(=O)cc1)cc2)=NN3
Clc1cccc(Cl)c1c2nn[nH]n2	ZINC000000116114	c2ccc(c1nn[nH]n1)cc2
CC(C)CC(=O)Nc2ccc(S(=O)(=O)Nc1nccc(C)n1)cc2	ZINC000000116115	O=S(=O)(Nc1ncccn1)c2ccccc2
Clc3ccc(c2cc(=O)c1cc(Cl)cc(Cl)c1o2)cc3	ZINC000000057944	O=c2cc(c1ccccc1)oc3ccccc23
CC4=C(C(=O)Nc1ccccn1)[C@@H](c2ccc(O)cc2)n3ncnc3N4	ZINC000000190274	O=C(Nc1ccccn1)C3=CNc2ncnn2C3c4ccccc4
Fc1cccc(Cl)c1CSc2ccc(C(F)(F)F)cn2	ZINC000000069818	C(Sc1ccccn1)c2ccccc2
C[C@@H]3CCC[N@@](Cc2c(C)n(C)n(c1ccccc1)c2=O)C3	ZINC000000165155	O=c2c(CN1CCCCC1)c[nH]n2c3ccccc3
NC(=O)[C@@H]3C[C@@]1(NC(=O)NC1=O)c2cc(F)ccc2O3	ZINC000000002486	O=C3NC(=O)C2(CCOc1ccccc12)N3
COC(=O)C2[C@@H](c1ccc(C)cc1)NC(=O)N=C2C	ZINC000000078628	O=C2NC(c1ccccc1)CC=N2
CC(C)(c1ccccc1)c3ccc(Oc2ccc(C#N)c(C#N)c2)cc3	ZINC000000056908	C(c1ccccc1)c3ccc(Oc2ccccc2)cc3
CCOC(=O)c2c(Cl)c1cccc(C(F)(F)F)c1nc2SC	ZINC000000161525	c2ccc1ncccc1c2
CC(=O)C2=C(O)C(=O)N(Cc1ccco1)[C@@H]2c3ccc(O)cc3	ZINC000000034883	O=C2C=CC(c1ccccc1)N2Cc3ccco3
CN(c1ccccc1)c4nc(N2CCOCC2)nc(n3ccnc3)n4	ZINC000000022108	C4CN(c3nc(Nc1ccccc1)nc(n2ccnc2)n3)CCO4
O=c3c1ccccc1n4c(=O)c2ccccc2nc34	ZINC000000033299	O=c3c1ccccc1n4c(=O)c2ccccc2nc34
Nc1ccc(S(=O)(=O)C(F)(F)F)cc1	ZINC000000158190	c1ccccc1
OC(=O)c2ccc(NS(=O)(=O)c1ccc(F)c(Cl)c1)cc2	ZINC000000074544	O=S(=O)(Nc1ccccc1)c2ccccc2
COC(=O)[C@@H](CC(C)C)NC(=O)c1cc(OC)c(OC)c(OC)c1	ZINC000000078374	c1ccccc1
OC(=O)C[C@@](O)(CN(=O)=O)C(O)=O	ZINC000002047628	nonring
CC(=O)c2ccc(N1CCNCC1)c(F)c2	ZINC000000052575	C2CN(c1ccccc1)CCN2
Fc4ccc(C[C@]3(CCc1ccncc1)C(=O)NC(=O)N(c2ccc(Br)cc2)C3=O)cc4	ZINC000001128338	O=C3NC(=O)C(CCc1ccncc1)(Cc2ccccc2)C(=O)N3c4ccccc4
CCN3CCN(c2ccc(/N=C/c1ccccc1O)cc2)CC3	ZINC000000353113	C3CN(c2ccc(N=Cc1ccccc1)cc2)CCN3
Oc1c(N(=O)=O)cc(S(O)(=O)=O)cc1S(O)(=O)=O	ZINC000001655641	c1ccccc1
COC(=O)c2c(NC(=O)[C@@H]1CCCO1)scc2c3ccc(F)cc3	ZINC000000376160	O=C(Nc2cc(c1ccccc1)cs2)C3CCCO3
O=C(Nc1ccccc1)c4cn3nc(c2ccccc2)c(=O)nc3s4	ZINC000000113508	O=C(Nc1ccccc1)c4cn3nc(c2ccccc2)c(=O)nc3s4
COc2cccc(CNc1ccc(F)c(N(=O)=O)c1)c2O	ZINC000000041324	C(Nc1ccccc1)c2ccccc2
CCN(CC)C(=O)c1cccc(C)c1	ZINC000000001291	c1ccccc1
Cc3ccc(NS(=O)(=O)c2cccc(S(=O)(=O)c1ccc(Cl)cc1)c2)cc3	ZINC000000825806	O=S(=O)(Nc1ccccc1)c3cccc(S(=O)(=O)c2ccccc2)c3
COc2cc(C)nc(n1cccn1)n2	ZINC000000009772	c2cnc(n1cccn1)nc2
COc2cc(n1ccnc1)ncn2	ZINC000000009770	c2cc(n1ccnc1)ncn2
C[C@@H](SC(=S)N1CCOCC1)C(O)=O	ZINC000000208494	C1COCCN1
C[C@@H](Nc2c(Cl)c(=O)n(Cc1ccccc1)c2=O)c3ccccc3	ZINC000000112051	O=c2cc(NCc1ccccc1)c(=O)n2Cc3ccccc3
C4CCN(CCc3nc(CC(c1ccccc1)c2ccccc2)no3)CC4	ZINC000000538227	C4CCN(CCc3nc(CC(c1ccccc1)c2ccccc2)no3)CC4
O=S(=O)(N1CCCCC1)c3ccc2OCCOc2c3	ZINC000000038968	O=S(=O)(N1CCCCC1)c3ccc2OCCOc2c3
COC(=O)C1=C(C)CC(C)=C(C(N)=O)[C@H]1c2ccc(Cl)c(C(F)(F)F)c2	ZINC000000577339	C2C=CC(c1ccccc1)C=C2
Nc3ccc(c2nc1cc(Cl)ccc1o2)c(O)c3	ZINC000000027774	c3ccc(c2nc1ccccc1o2)cc3
COc2ccnc3c(=O)c5nccc4c1ccccc1nc(c23)c45	ZINC000000026685	O=c3c1ncccc1c5nc2ccccc2c4ccnc3c45
Cc1ccccc1C(=O)Nc3nc2c(Cl)c(Cl)ccc2s3	ZINC000000557491	O=C(Nc2nc1ccccc1s2)c3ccccc3
CN4CCN(c2nc1n(C)c(=O)n(C)c(=O)c1n2Cc3ccc(Cl)cc3Cl)CC4	ZINC000000641044	O=c4[nH]c(=O)c3n(Cc1ccccc1)c(N2CCNCC2)nc3[nH]4
C=Cc3cccc2Oc1ccccc1S(=O)(=O)c23	ZINC000000005449	O=S3(=O)c1ccccc1Oc2ccccc23
Clc3ccc(CS(=O)(=O)c2nc1CCCCc1cc2C#N)cc3	ZINC000000074079	O=S(=O)(Cc1ccccc1)c3ccc2CCCCc2n3
CSc1c(C(N)=O)c(C(N)=O)c2nc(C)cc(C)n12	ZINC000000036960	c2cnc1cccn1c2
Nc3ccc2nc4c(=O)c1cccnc1c5nccc(c2c3)c45	ZINC000000026777	O=c3c1cccnc1c5nccc4c2ccccc2nc3c45
CCOc2ccc1nc(C)cc(SC[C@@H](NC(=O)CC[C@@H](O)C(O)=O)C(=O)NCC(O)=O)c1c2	ZINC000009344581	c2ccc1ncccc1c2
OC(=O)CCC(=O)Nc1nn[nH]n1	ZINC000005282298	c1nn[nH]n1
CCOC(=O)c3cc(c2coc(\C=N/n1cnnc1)c2)ccc3Cl	ZINC000000033999	C(=Nn1cnnc1)c3cc(c2ccccc2)co3
COc3ccc(c1ncc2ccccn12)cc3OC	ZINC000000086097	c3ccc(c1ncc2ccccn12)cc3
Brc2cnc(N1CCNCC1)nc2	ZINC000000083576	C2CN(c1ncccn1)CCN2
Cc4cccc(OCC(=O)N3CCN(C[C@@H]1C[C@@H]2C[C@H]1C=C2)CC3)c4	ZINC000000447315	O=C(COc1ccccc1)N4CCN(CC2CC3CC2C=C3)CC4
COc3cc(C(=O)Nc2ccc(S(=O)(=O)Nc1ccccn1)cc2)c(Br)c(OC)c3OC	ZINC000000936818	O=C(Nc2ccc(S(=O)(=O)Nc1ccccn1)cc2)c3ccccc3
CSc2c(CC(=O)NCCc1ccccc1)n(C)c3ccccc23	ZINC000000036644	O=C(Cc2cc1ccccc1[nH]2)NCCc3ccccc3
Cc4cccc(NC(=O)C1[C@@H]2CC[C@@H]3[C@@H](CC[C@H]12)C3(Cl)Cl)c4	ZINC000000064024	O=C(Nc1ccccc1)C4C3CCC2CC2CCC34
Cc2ncc(C[n+]1csc(CCO)c1C)c(N)n2	ZINC000000049153	C(c1cncnc1)[n+]2ccsc2
CC(C)(C)c2cc(N1CCCC1=O)cc(C(C)(C)C)c2O	ZINC000000005286	O=C1CCCN1c2ccccc2
COc1ccc(/C=C/C(=O)NC(C)(C)C)cc1	ZINC000000028315	c1ccccc1
COC(=O)c2c(C)[nH]c(C(=O)CN1CCC(C)CC1)c2C	ZINC000000090023	O=C(CN1CCCCC1)c2ccc[nH]2
O=c4[nH]c3c2ccc(n1ccnc1)cc2Cc3n5ccnc45	ZINC000000018317	O=c4[nH]c3c2ccc(n1ccnc1)cc2Cc3n5ccnc45
O=c4[nH]c3c2cccc(c1ccccc1)c2Cc3n5ccnc45	ZINC000000018316	O=c4[nH]c3c2cccc(c1ccccc1)c2Cc3n5ccnc45
COc2ccc(C(=O)N1CCCC1=O)cc2	ZINC000000015951	O=C1CCCN1C(=O)c2ccccc2
Cc4ccc(n3c(c2ccc1[nH]c(C)c(C)c1c2)n[nH]c3=S)cc4	ZINC000000221552	S=c3[nH]nc(c2ccc1[nH]ccc1c2)n3c4ccccc4
C[N@]1[C@H]3CC[C@@H]1CC(NC(=O)c2c(F)cccc2F)C3	ZINC000000132876	O=C(NC1CC2CCC(C1)N2)c3ccccc3
CCOc1cc(C=O)cc(Br)c1OCc2cccc(C)c2	ZINC000000037196	C(Oc1ccccc1)c2ccccc2
OC3(c2nc1ccccc1s2)C=CC(=O)C=C3	ZINC000000009111	O=C3C=CC(c2nc1ccccc1s2)C=C3
COc4cc(NS(=O)(=O)c3ccc(NC=c2c(=O)[nH]c(=O)n(c1cccc(Cl)c1)c2=O)cc3)nc(OC)n4	ZINC000008429925	O=c3[nH]c(=O)c(=CNc2ccc(S(=O)(=O)Nc1ccncn1)cc2)c(=O)n3c4ccccc4
Brc3ccc(S(=O)(=O)Nc1cccc2ccccc12)s3	ZINC000000627994	O=S(=O)(Nc1cccc2ccccc12)c3cccs3
FC(F)(F)c3cccc(NC(=O)NC2(c1ccccc1)CC2)c3	ZINC000000054348	O=C(Nc1ccccc1)NC3(c2ccccc2)CC3
CC(C)C(=O)N4CCN(c1ccccc1NC(=O)c3sc2ccccc2c3Cl)CC4	ZINC000000624089	O=C(Nc1ccccc1N2CCNCC2)c4cc3ccccc3s4
CN(C)c3ccc(c1nn(C)c(=O)nc1c2ccc(N(C)C)cc2)cc3	ZINC000000001726	O=c3nc(c1ccccc1)c(c2ccccc2)n[nH]3
O=c2[nH]c3ccc(CNS(=O)(=O)c1ccccc1)c4cccc2c34	ZINC000000072098	O=c2[nH]c3ccc(CNS(=O)(=O)c1ccccc1)c4cccc2c34
CS(=O)(=O)c1ccc(O)c(N(=O)=O)c1	ZINC000000343430	c1ccccc1
O=C(Nc2ccc(C(=O)OC1CCCCC1)cc2)\C=C\c3ccccc3	ZINC000000147040	O=C(Nc2ccc(C(=O)OC1CCCCC1)cc2)C=Cc3ccccc3
CC3(C)CC(NC(=O)c2scc1CCCCc12)CC(C)(C)N3	ZINC000000140798	O=C(NC1CCNCC1)c3scc2CCCCc23
C[N@]2[C@H](c1ccccc1)CC(=O)[C@]3(O)CCCC[C@H]23	ZINC000000085683	O=C3CC(c1ccccc1)NC2CCCCC23
C[C@H](N1CCCC1)C(=O)Nc2cc(Cl)cc(Cl)c2	ZINC000000110415	O=C(CN1CCCC1)Nc2ccccc2
OC(=O)[C@@H](Cc1ccc(O)c(N(=O)=O)c1)n3c(=O)c2ccccc2c3=O	ZINC000001698096	O=c2n(CCc1ccccc1)c(=O)c3ccccc23
COc4cc3cc2c(=O)nc(c1ccc(C)cc1)nc2[nH]c3cc4OC	ZINC000000140791	O=c3nc(c1ccccc1)nc4[nH]c2ccccc2cc34
CC(C)n4c(=O)c3c(c2noc(C1CC1)n2)ncn3c5ccccc45	ZINC000000004220	O=c4[nH]c1ccccc1n5cnc(c3noc(C2CC2)n3)c45
O=C1SCCN1Cc2ccccc2	ZINC000000004221	O=C1SCCN1Cc2ccccc2
CCN(CC)[C@@H](C)Cn2c1ccccc1sc3ccccc23	ZINC000000004227	c3ccc2sc1ccccc1[nH]c2c3
Cc3ccc(C(O)=O)c(C(=O)Nc2nc1ccccc1s2)c3	ZINC000000053228	O=C(Nc2nc1ccccc1s2)c3ccccc3
C[C@@H](N)Cc2ccc1OCOc1c2	ZINC000000000741	C2Oc1ccccc1O2
CN4CCN(c2ccnc3ccc(NC(=O)Cc1cccc(Cl)c1Cl)cc23)CC4	ZINC000000586016	O=C(Cc1ccccc1)Nc4ccc3nccc(N2CCNCC2)c3c4
CCN(CC)CCCn2c(C)c(C)c3c(NCc1ccco1)ncnc23	ZINC000005345502	C(Nc1ncnc2[nH]ccc12)c3ccco3
COC(=O)C(/CC(O)=O)=C/C(O)=O	ZINC000003870063	nonring
COc1ccccc1NC(=O)CSCc2cnc(C)c(O)c2CO	ZINC000000094351	O=C(CSCc1cccnc1)Nc2ccccc2
Cc2cc(NC(=O)NC(=O)c1ccc(Cl)cc1Cl)n[nH]2	ZINC000000033745	O=C(NC(=O)c1ccccc1)Nc2cc[nH]n2
Cn2cnc3n(C)c(=O)n(Cc1ccc(Cl)cc1Cl)c(=O)c23	ZINC000000047079	O=c2[nH]c1nc[nH]c1c(=O)n2Cc3ccccc3
CCOC(=O)c2nn(c1ccc(C(C)=O)cc1)c(=NC(C)=O)s2	ZINC000000075674	N=c1scnn1c2ccccc2
CCOC(=O)c3ccc([n+]1nnc2ccccn12)cc3	ZINC000000048712	c3ccc([n+]1nnc2ccccn12)cc3
CN(C)CC(=O)N1C[C@@H]4C[C@H](C1)c3ccc(c2ccccc2CN(C)C)c(=O)n3C4	ZINC000004237219	O=c4c(c1ccccc1)ccc3C2CNCC(C2)Cn34
O=c4n(c3ccc(S(=O)(=O)N2CCN(c1ccccc1)CC2)cc3)c(=O)c5ccccc45	ZINC000000591665	O=c4n(c3ccc(S(=O)(=O)N2CCN(c1ccccc1)CC2)cc3)c(=O)c5ccccc45
C[C@@H]([C@@H](O)c1ccc(O)cc1)N3CCC(O)(c2ccccc2)CC3	ZINC000000005936	C2CN(CCc1ccccc1)CCC2c3ccccc3
O=C(Nc1ccccc1)N2CCN3CCC2CC3	ZINC000000026226	O=C(Nc1ccccc1)N2CCN3CCC2CC3
CN(C)c2nc(F)c(F)c(S(=O)(=O)c1ccccc1)c2F	ZINC000000036918	O=S(=O)(c1ccccc1)c2ccncc2
OS(=O)(=O)[C@H]2CCc1ccc(S(O)(=O)=O)cc1C2=O	ZINC000003134111	O=C1CCCc2ccccc12
OC(C(=O)Nc1cc(Cl)ccc1Cl)=c2c(=O)[nH]c(=O)[nH]c2=O	ZINC000001630097	O=C(Nc1ccccc1)C=c2c(=O)[nH]c(=O)[nH]c2=O
O[C@H]1CCC[C@H]1n2[nH]c(C(O)=O)cc2=O	ZINC000054599450	O=c1cc[nH]n1C2CCCC2
Brc2ccc(OC(=O)c1cccc(N(=O)=O)c1)cc2	ZINC000000059858	O=C(Oc1ccccc1)c2ccccc2
Cc3cc(C)n2c(NC(C)(C)C)c(c1ccc(F)cc1)nc2c3	ZINC000000320298	c3ccc(c2cn1ccccc1n2)cc3
FC(F)(F)C(=O)NCc1nn[nH]n1	ZINC000044929547	c1nn[nH]n1
OC3([C@@]2(O)C[C@@H](c1ccco1)NO2)CCCCC3	ZINC000000036916	C3CCC(C2CC(c1ccco1)NO2)CC3
C[C@H](Cc1ccccc1)NC(=O)c2ccccc2NC(=O)c3ccco3	ZINC000000433601	O=C(NCCc1ccccc1)c2ccccc2NC(=O)c3ccco3
CC(=O)c4ccc3sc1ccccc1n(CCCN2CCC(CCO)CC2)c3c4	ZINC000000538186	C4CCN(CCCn2c1ccccc1sc3ccccc23)CC4
C/C=C1\[C@H]3CCC[C@]1(N)c2ccc(=O)[nH]c2C3	ZINC000000007990	C=C1C3CCCC1c2ccc(=O)[nH]c2C3
Cc2cc(\C=N\n1cnnc1)c(C)n2c3ccc(F)c(Cl)c3	ZINC000000037518	C(=Nn1cnnc1)c3ccn(c2ccccc2)c3
Fc3ccc(N2CCN(CCCN1CCCC1=O)CC2)cc3	ZINC000000026355	O=C1CCCN1CCCN3CCN(c2ccccc2)CC3
COc3ccc(Nc2nc(N)nc(C[N@@](C)C1CCCCC1)n2)cc3	ZINC000000200068	C3CCC(NCc2ncnc(Nc1ccccc1)n2)CC3
CC(C)Oc2ccc(S(=O)(=O)c1ccc(Cl)cc1)cc2	ZINC000000041894	O=S(=O)(c1ccccc1)c2ccccc2
Cc2ccc(c1nnc(N)s1)cc2	ZINC000000039838	c2ccc(c1nncs1)cc2
Cc3c(/C=C/c1cccc(N(=O)=O)c1)c(=O)n(c2ccccc2)n3C	ZINC000000055219	O=c2c(C=Cc1ccccc1)c[nH]n2c3ccccc3
Cc4sc3ncnc(NCCc2ccc1OCCOc1c2)c3c4C	ZINC000000089252	C(Cc2ccc1OCCOc1c2)Nc3ncnc4sccc34
COc1cc(Br)ccc1CNc2cc(F)ccc2C	ZINC000000041890	C(Nc1ccccc1)c2ccccc2
Cn2c1CC[N@](C[C@@H](O)C(C)(C)C)Cc1nc2c3cccs3	ZINC000000536719	C3Cc2[nH]c(c1cccs1)nc2CN3
O=C1CS[C@@H]2N1CCCNC23CCCCC3	ZINC000000102284	O=C1CSC2N1CCCNC23CCCCC3
C[C@H](C(=O)OC1CCCCC1)c2ccncc2	ZINC000000009590	O=C(Cc1ccncc1)OC2CCCCC2
COc2cc(NC(=O)C1CCCCC1)cc3sc(NC(C)=O)nc23	ZINC000000089303	O=C(Nc2ccc1ncsc1c2)C3CCCCC3
CNC(=O)OC(C)(C)C#Cc1cncnc1	ZINC000000077680	c1cncnc1
C[N@@](CCCC(O)=O)Cc1ccc(Cl)cc1	ZINC000000011304	c1ccccc1
CCCn2c(COc1ccc(Cl)cc1Cl)nc3ccccc23	ZINC000000099619	C(Oc1ccccc1)c3nc2ccccc2[nH]3
Cc3ccc(NC(=O)c2c(C)nn(c1ccccc1)c2Cl)c(C)c3	ZINC000000044664	O=C(Nc1ccccc1)c3cnn(c2ccccc2)c3
COC(=O)c2ccc(NC(=O)Cc1ccccc1)cc2	ZINC000000029644	O=C(Cc1ccccc1)Nc2ccccc2
COC(=O)CNC(=O)c1ccccc1C	ZINC000000029647	c1ccccc1
NC(=O)[C@@H]2CCC[N@@](Cc1ccc(F)c(Br)c1)C2	ZINC000000217937	C2CCN(Cc1ccccc1)CC2
Oc2cc(O)c1ccccc1c2N(=O)=O	ZINC000001703961	c2ccc1ccccc1c2
O=C2CNC(=O)[C@@H](c1cccs1)N2	ZINC000000004710	O=C2CNC(=O)C(c1cccs1)N2
Cc3ccc(C(=O)Oc2ccc1c(Br)cccc1c2)cc3	ZINC000000383802	O=C(Oc2ccc1ccccc1c2)c3ccccc3
COc2ccc(CN1CCC(O)CC1)c(OC)c2	ZINC000000042941	C2CCN(Cc1ccccc1)CC2
Cc1cc(NC(=O)C(Cl)(Cl)Cl)ccc1Br	ZINC000000073328	c1ccccc1
COc2cc(CN1CCC(O)CC1)cc(OC)c2	ZINC000000042942	C2CCN(Cc1ccccc1)CC2
COc4ccc3[C@@H]2CC[C@]1(C)[C@H](CC[C@@]1(O)C#C)[N@]2CCc3c4	ZINC000000000259	C4CC3CCC1N(CCc2ccccc12)C3C4
Cc3nc2sc1CCCCc1c2c(=O)n3NC(=O)c4nn(C)cc4Br	ZINC000000651008	O=C(Nn3cnc2sc1CCCCc1c2c3=O)c4cc[nH]n4
COC(=O)CNC(=O)c1ccc(Cl)cc1	ZINC000000029636	c1ccccc1
COc3ccc(N2CCN(C(=O)c1c(F)cccc1Cl)CC2)cc3	ZINC000000474875	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
COc1ccccc1CNCc2cc(OC)c(OC)cc2OC	ZINC000000355359	C(NCc1ccccc1)c2ccccc2
CCOc3ccc(C(=O)Nc1cccc2ccccc12)cc3Cl	ZINC000000445325	O=C(Nc1cccc2ccccc12)c3ccccc3
FC(F)(F)Oc3ccc(S(=O)(=O)NC(=O)Nc2nc(c1cccs1)cc(C(F)(F)F)n2)cc3	ZINC000001075215	O=C(Nc2nccc(c1cccs1)n2)NS(=O)(=O)c3ccccc3
C/C=C(/CC(O)=O)C(O)=O	ZINC000005132614	nonring
CSCC[C@@H](NC(=O)C(O)=O)C(O)=O	ZINC000026579833	nonring
COc3ccc(OC)c(Nc2cc(c1ccccc1)nc(N)n2)c3	ZINC000000092771	N(c1ccccc1)c3cc(c2ccccc2)ncn3
Nc4ccc(CN3CCN(c2ccc1ccccc1n2)CC3)cc4	ZINC000000110981	C3CN(c2ccc1ccccc1n2)CCN3Cc4ccccc4
COc2ccc(OC)c(S(=O)(=O)Nc1ccc(C(C)(C)C)cc1)c2	ZINC000000138814	O=S(=O)(Nc1ccccc1)c2ccccc2
CCN(CC)Cc3cc(NC1=NS(=O)(=O)c2ccccc12)ccc3OC(=O)c4ccccc4	ZINC000000716260	O=C(Oc3ccc(NC1=NS(=O)(=O)c2ccccc12)cc3)c4ccccc4
CCc3nc(=NN)c2c1CCCCc1sc2[nH]3	ZINC000000081215	N=c2nc[nH]c3sc1CCCCc1c23
OC(=O)CSC(=S)Nc1ccccn1	ZINC000001560659	c1ccncc1
Cc1ncc(N(=O)=O)n1CCOP(O)(O)=O	ZINC000001855987	c1c[nH]cn1
COc4cccc(Cn3c(=S)[nH]c2cc1OCOc1cc2c3=O)c4	ZINC000000425091	O=c3n(Cc1ccccc1)c(=S)[nH]c4cc2OCOc2cc34
C[C@@H](C(=O)OCc2nc1ccccc1[nH]2)n4cnc3ccccc3c4=O	ZINC000000389151	O=C(Cn2cnc1ccccc1c2=O)OCc4nc3ccccc3[nH]4
CCOc2ccc(CC(=O)Nc1ccc(C(N)=O)cc1)cc2OCC	ZINC000000072317	O=C(Cc1ccccc1)Nc2ccccc2
CC(C)N=Nc2nc1n(C)c(=O)[nH]c(=O)c1n2Cc3ccccc3	ZINC000000042830	O=c3[nH]c(=O)c2n(Cc1ccccc1)cnc2[nH]3
Fc1cccc(F)c1[C@@H]3SCc4nc2ccccc2n34	ZINC000000005370	C2SC(c1ccccc1)n3c2nc4ccccc34
CN1CCc3c(C1=O)n(C[C@@H](O)CN2CCCC2)c4ccccc34	ZINC000000202099	O=C1NCCc3c1n(CCCN2CCCC2)c4ccccc34
Clc2cc(Cl)cc(C(=O)N1CCCCCC1)c2	ZINC000000027800	O=C(N1CCCCCC1)c2ccccc2
Cn2nc(C(=O)NCc1ccccc1)cc2C(=O)NCc3ccccc3	ZINC000000027802	O=C(NCc1ccccc1)c3cc(C(=O)NCc2ccccc2)[nH]n3
Cc2ccc(C(=O)NC1CCCCC1)cc2Br	ZINC000000038579	O=C(NC1CCCCC1)c2ccccc2
CCOC(=O)c1c(N)sc(C)c1CC	ZINC000000035858	c1ccsc1
C[C@@H]2CCCN(C(=O)c1ccccc1Cl)C2	ZINC000000029250	O=C(N1CCCCC1)c2ccccc2
Clc3cccc(N2CCN(C(=O)NC(=O)c1ccccc1)CC2)c3	ZINC000000081850	O=C(NC(=O)c1ccccc1)N3CCN(c2ccccc2)CC3
CCN4CCN(c3ccc(NC(=O)[C@H]1C[C@@H]1c2ccccc2)cc3)CC4	ZINC000000197052	O=C(Nc2ccc(N1CCNCC1)cc2)C3CC3c4ccccc4
CN(C)c2cccc(NS(=O)(=O)c1ccccc1)c2	ZINC000000036063	O=S(=O)(Nc1ccccc1)c2ccccc2
Cc3cc(C(=O)N2CCN(c1ccc(F)cc1)CC2)ccc3N(=O)=O	ZINC000000064711	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
O[C@H]3[C@@H](COP(O)(O)=O)O[C@@H](n1cnc2c(=O)[nH]cnc12)[C@@H]3O	ZINC000008613164	O=c2[nH]cnc3n(C1CCCO1)cnc23
O=C(COC(=O)c2ccc1OCOc1c2)c3cccc(N(=O)=O)c3	ZINC000000031356	O=C(COC(=O)c2ccc1OCOc1c2)c3ccccc3
CCOC(=O)c3ccc2nc(C)cc(Nc1ccc(N(C)C)cc1)c2c3	ZINC000000081030	N(c1ccccc1)c2ccnc3ccccc23
C[C@H](CO)c2cccc(C(=O)c1ccccc1)c2	ZINC000000006711	O=C(c1ccccc1)c2ccccc2
FC(F)(F)c3cccc(NC(=O)CN1CCc2ccccc12)c3	ZINC000000043123	O=C(CN1CCc2ccccc12)Nc3ccccc3
COc2ccc(\C=C/c1cc(OC)c(OC)c(OC)c1)cc2N	ZINC000000007280	C(=Cc1ccccc1)c2ccccc2
NC(=N)Nc2nc1ccc(Cl)cc1c(=O)[nH]2	ZINC000000056263	O=c1[nH]cnc2ccccc12
NC(=O)Cc1ccc(Br)cc1	ZINC000000030519	c1ccccc1
COC(=O)c2cccc(N1CCCC1=O)c2	ZINC000000027620	O=C1CCCN1c2ccccc2
C[N@]3CC[C@@H](COC(=O)C(O)(c1ccccc1)c2ccccc2)C3	ZINC000000000806	O=C(OCC1CCNC1)C(c2ccccc2)c3ccccc3
Cn1cnnc1c2cccc(F)c2	ZINC000000006371	c2ccc(c1nnc[nH]1)cc2
Cc3ccc(NC(=O)Cn2c(=O)s\c(=C/c1cc(Cl)c(O)c(Cl)c1)c2=O)cc3	ZINC000001008330	O=C(Cn2c(=O)sc(=Cc1ccccc1)c2=O)Nc3ccccc3
NNc1nc(N)c3c(n1)c2ccccc2CC34CCCC4	ZINC000000078979	C1CCC4(C1)Cc2ccccc2c3ncncc34
Clc4nc(Nc1cccc2ccccc12)nc(N3CCOCC3)n4	ZINC000000078978	C4CN(c3ncnc(Nc1cccc2ccccc12)n3)CCO4
Clc1ccccc1NC(=O)NC2CCCCC2	ZINC000000028359	O=C(NC1CCCCC1)Nc2ccccc2
O=C(Oc2ccc(OCc1ccccc1)cc2)\C=C\c3ccccc3	ZINC000000059458	O=C(Oc2ccc(OCc1ccccc1)cc2)C=Cc3ccccc3
Cc2[nH]n(c1nc(O)c(C)c(=O)[nH]1)c(=O)c2CCO	ZINC000019797259	O=c2ccnc(n1[nH]ccc1=O)[nH]2
Cc3nn(CCN1CCCC1)c(=O)c4nn(c2ccccc2F)c(C)c34	ZINC000000642658	O=c3n(CCN1CCCC1)ncc4cn(c2ccccc2)nc34
CCOC(=O)c1ccccc1NCn3c(=O)c2ccccc2c3=O	ZINC000000044284	O=c2n(CNc1ccccc1)c(=O)c3ccccc23
O=S(=O)(C(=CNc2ccc1OCCOc1c2)C#N)c3cccs3	ZINC000000149274	O=S(=O)(C=CNc2ccc1OCCOc1c2)c3cccs3
CC(=O)NCCN2CCc3ccc1OCCc1c23	ZINC000000006392	C3Cc2ccc1OCCc1c2N3
COc3ccc(N[C@H]2CC(=O)N(c1cccc(Cl)c1)C2=O)cc3	ZINC000000059348	O=C2CC(Nc1ccccc1)C(=O)N2c3ccccc3
Cc5c4N[C@H](c2ccc(S(=O)(=O)N1CCOCC1)cc2)[C@H]3CC=C[C@H]3c4ccc5C(O)=O	ZINC000000894054	O=S(=O)(N1CCOCC1)c5ccc(C3Nc2ccccc2C4C=CCC34)cc5
COc1ccc(Cl)cc1NC(=O)Cn2c(=O)sc3ccccc23	ZINC000000203512	O=C(Cn1c(=O)sc2ccccc12)Nc3ccccc3
Cc5cc(COc3ccc(C(=O)N[C@H]1CN(C(=O)OC(C)(C)C)C[C@@H]1c2n[nH]c(=O)[nH]2)cc3)c4ccccc4n5	ZINC000014190781	O=C(NC1CNCC1c2n[nH]c(=O)[nH]2)c5ccc(OCc3ccnc4ccccc34)cc5
OC(=O)[C@H]1OCCC(=O)C[C@@]1(O)C(O)=O	ZINC000006361442	O=C1CCCOCC1
C[C@@H](C[C@@H](C)C(=O)N1CCOCCN(C(=O)[C@@H](C)C[C@@H](C)C(O)=O)CCOCC1)C(O)=O	ZINC000004388897	C1COCCNCCOCCN1
Cc3ccc2cccc(SCc1ccc(Br)cc1)c2n3	ZINC000000063931	C(Sc1cccc2cccnc12)c3ccccc3
COC(=O)[C@@H](Cc1ccc(O)c(O)c1)/N=C/c2ccc(N(C)C)cc2	ZINC000000517863	C(Cc1ccccc1)N=Cc2ccccc2
OC(=O)c3ccc(NC(=O)c2ccc(Cl)c(S(=O)(=O)N1CCCCC1)c2)cc3	ZINC000000888079	O=C(Nc1ccccc1)c3cccc(S(=O)(=O)N2CCCCC2)c3
CCNC(=O)N2CCN(c1ccnc(C)n1)CC2	ZINC000000013139	C2CN(c1ccncn1)CCN2
O=c5[nH]nc(c1ccccc1)c4[C@@H](c2ccccc2)Nc3nnnn3c45	ZINC000000100130	O=c5[nH]nc(c1ccccc1)c4C(c2ccccc2)Nc3nnnn3c45
Cn2cc(S(=O)(=O)Nc1cnccn1)cc2C(O)=O	ZINC000036333820	O=S(=O)(Nc1cnccn1)c2cc[nH]c2
COc2cc(S(=O)(=O)NC1CCCCC1)ccc2Br	ZINC000000384671	O=S(=O)(NC1CCCCC1)c2ccccc2
CCOC(=O)c3nn(c2ccc1OCCOc1c2)cc3O	ZINC000000087117	C3COc2cc(n1cccn1)ccc2O3
COc4ccc3CC[C@H]([C@@]2(O)C(=O)N(C)c1ccccc12)C(=O)c3c4	ZINC000000034707	O=C2Nc1ccccc1C2C4CCc3ccccc3C4=O
O=C(Nc1nccs1)c3ccc2OCOc2c3	ZINC000000030207	O=C(Nc1nccs1)c3ccc2OCOc2c3
N[C@]2(C(O)=O)C[C@@]([C@@H]1C[C@@H]1C(O)=O)(C(O)=O)C2	ZINC000101337447	C2CC(C1CC1)C2
Cc2cc(O)cc3cc1[C@@H](O)CCC(=O)c1c(O)c23	ZINC000000015095	O=C2CCCc3cc1ccccc1cc23
O=C(CSc1nnc3c(n1)[nH]c2ccccc23)NC[C@@H]4CCCO4	ZINC000000051843	O=C(CSc1nnc3c(n1)[nH]c2ccccc23)NCC4CCCO4
O=c3n(CCc2cn1cccnc1n2)c(=O)c4ccccc34	ZINC000000032937	O=c3n(CCc2cn1cccnc1n2)c(=O)c4ccccc34
COc2cccc(C(=O)Nc1cc(OC)c(Cl)cc1OC)c2	ZINC000000035616	O=C(Nc1ccccc1)c2ccccc2
C/C(=N\O)c2ccc1ccccc1c2O	ZINC000000025885	c2ccc1ccccc1c2
Oc1ccc(Cl)cc1Cn3nc(c2ccc(C(F)(F)F)cc2)oc3=S	ZINC000000581962	S=c2oc(c1ccccc1)nn2Cc3ccccc3
Cc2cc(C)c1c(=O)cc(C(O)=O)[nH]c1c2	ZINC000000025331	O=c1cc[nH]c2ccccc12
CCc2ccc(O)c(NC(=S)NC(=O)Cc1ccc(Cl)cc1)c2	ZINC000000457087	O=C(Cc1ccccc1)NC(=S)Nc2ccccc2
CC2(C)[C@H](C(=O)c1ccc(F)cc1)OC(=O)C(C)(C)C2=O	ZINC000000032931	O=C2CC(C(=O)c1ccccc1)OC(=O)C2
CC(C)CNC(=O)c1cccnc1	ZINC000000029329	c1ccncc1
COc2ccc(CNC(=O)c1cccnc1)cc2	ZINC000000029325	O=C(NCc1ccccc1)c2cccnc2
O=c3[nH]nc4nc(N1CCCCC1)nc(N2CCCCC2)n34	ZINC000000032938	O=c3[nH]nc4nc(N1CCCCC1)nc(N2CCCCC2)n34
CC(C)c4ccc(\C=c3\sc2nc(c1cccnc1)nn2c3=O)cc4	ZINC000000199490	O=c3c(=Cc1ccccc1)sc4nc(c2cccnc2)nn34
COc3ccc(\C=c2/sc(N1CCC(C)CC1)nc2=O)c(OC)c3	ZINC000000066702	O=c2nc(N1CCCCC1)sc2=Cc3ccccc3
Cc2cc(C)nc(SCC(=O)Nc1cccc(N(=O)=O)c1)n2	ZINC000000041416	O=C(CSc1ncccn1)Nc2ccccc2
C[C@@H]1CCCC[N@]1Cc3c(O)ccc4c(c2ccccc2)cc(=O)oc34	ZINC000000123384	O=c4cc(c1ccccc1)c3cccc(CN2CCCCC2)c3o4
COc2cc(C=Cc1[nH]c(=O)[nH]c(=O)c1N(=O)=O)cc(N(=O)=O)c2O	ZINC000006906053	O=c2cc(C=Cc1ccccc1)[nH]c(=O)[nH]2
CC[C@@H]2Oc1ccccc1C(=O)NC2=O	ZINC000000134956	O=C2COc1ccccc1C(=O)N2
Cc3nn(Cc2ccc(C(=O)n1cccn1)o2)c(C)c3Br	ZINC000000483866	O=C(c2ccc(Cn1cccn1)o2)n3cccn3
Cc4cc3nc1c(=O)[nH]c(=O)nc1n(C[C@@H](O)[C@@H](O)[C@@H]2CO[P@@](O)(=O)O2)c3cc4C	ZINC000013513828	O=P4OCC(CCCn2c1ccccc1nc3c(=O)[nH]c(=O)nc23)O4
CC(=O)O[C@@]2(c1ccccc1)C[C@H](C(C)(C)C)C[N@](C(C)(C)C)C2	ZINC000000049434	C2CNCC(c1ccccc1)C2
CCOC(=O)[C@@H]2C3c1ccccc1C([C@@H]2C(O)=O)c4ccccc34	ZINC000000400393	C2CC3c1ccccc1C2c4ccccc34
O=C2CC[C@@H](N(=O)=O)[C@H]([C@@H]1CCC=CC1)N2	ZINC000000101241	O=C2CCCC(C1CCC=CC1)N2
Cc4cccc(N2CCN(c1cccc(C)c1)C2c3cccs3)c4	ZINC000000342915	C3CN(c1ccccc1)C(c2cccs2)N3c4ccccc4
C[C@@H](C(=O)NC(C)(C)C)n2c(=O)c1ccccc1c2=O	ZINC000000042055	O=c1[nH]c(=O)c2ccccc12
COc2cc(C(=O)NCC(=O)n1nc(C)cc1C)cc(OC)c2OC	ZINC000000233123	O=C(CNC(=O)c1ccccc1)n2cccn2
OC(=O)CCNS(=O)(=O)c1cccs1	ZINC000000224229	c1ccsc1
Cn2c(SCC(=O)Nc1ccccc1)nnc2c3ccco3	ZINC000000035109	O=C(CSc2nnc(c1ccco1)[nH]2)Nc3ccccc3
COc1cc(CC=C)ccc1OC(=O)Nc2cccc3ccccc23	ZINC000000401557	O=C(Nc1cccc2ccccc12)Oc3ccccc3
CC[C@@H](C)Nc2nc(C)nc3c(c1c(C)cc(OC)cc1OC)c(C)nn23	ZINC000000588890	c3ccc(c1cnn2cncnc12)cc3
CC2(C)CC(NCc1cccc(N(=O)=O)c1)CC(C)(C)N2	ZINC000000032735	C2CC(NCc1ccccc1)CCN2
CCOC(=O)Nc1cccc2nsnc12	ZINC000000034329	c2ccc1nsnc1c2
CSc3ccc(OC(=O)Nc1cccc2ccccc12)cc3C	ZINC000000401559	O=C(Nc1cccc2ccccc12)Oc3ccccc3
CN2CCN(c1cc(C)c(C(C)=O)cc1F)CC2	ZINC000000035100	C2CN(c1ccccc1)CCN2
CC(=O)c2nn(c1ccc(N(=O)=O)cc1)cc2C(=O)c3cccs3	ZINC000000035106	O=C(c2cnn(c1ccccc1)c2)c3cccs3
O=C(COc2ccc(NC(=O)c1cccs1)cc2)N3CCOCC3	ZINC000000038356	O=C(COc2ccc(NC(=O)c1cccs1)cc2)N3CCOCC3
COC(=O)c2c1CCCCCCc1sc2NC(=S)NNS(=O)(=O)c3ccc(OC)cc3OC	ZINC000015919320	O=S(=O)(NNC(=S)Nc2cc1CCCCCCc1s2)c3ccccc3
CCOC(=O)N2CCC(NC1CCCCCC1)CC2	ZINC000000182234	C2CCCC(NC1CCNCC1)CC2
CN(C1CCCCC1)S(=O)(=O)Cc2ccccc2	ZINC000000029850	O=S(=O)(Cc1ccccc1)NC2CCCCC2
Clc2ccc(OCC(=O)N1CCOCC1)c(Cl)c2	ZINC000000028121	O=C(COc1ccccc1)N2CCOCC2
CCOC(=O)C(Cc1ccc(Cl)cc1Cl)=C(O)c3cn(c2ccc(C(=O)OCC)cc2)nn3	ZINC000001403867	C(C=Cc2cn(c1ccccc1)nn2)c3ccccc3
CN(C)Cc2csc(c1ccccc1)n2	ZINC000000023311	c2ccc(c1nccs1)cc2
CC(C)CC(=O)Nc2ccc(N1CCCCC1)c(Cl)c2	ZINC000000038195	C2CCN(c1ccccc1)CC2
C2Cc1ccccc1C5=C2[C@@H](c3cccs3)n4[nH]cnc4=N5	ZINC000000038307	C2Cc1ccccc1C5=C2C(c3cccs3)n4[nH]cnc4=N5
CC(=O)\C=C\c1ccc(O)c(O)c1	ZINC000000005614	c1ccccc1
Clc3ccc(COc2cccc(C=c1sc(=O)[nH]c1=O)c2)c(Cl)c3	ZINC000001005051	O=c3[nH]c(=O)c(=Cc2cccc(OCc1ccccc1)c2)s3
CCC(=O)N[C@@H](Nc2ccc1ccccc1c2)C(Cl)(Cl)Cl	ZINC000000046627	c2ccc1ccccc1c2
OCCn2c(c1ccc(F)cc1)cs\c2=N/c3cccc(Cl)c3	ZINC000000074242	N(c1ccccc1)=c3[nH]c(c2ccccc2)cs3
Cc3oc2c(C)c1oc(=O)cc(C)c1cc2c3CN	ZINC000000057192	O=c3ccc2cc1ccoc1cc2o3
COC(=O)C2CCN(C(=O)c1ccco1)CC2	ZINC000000031646	O=C(N1CCCCC1)c2ccco2
OC(=O)Cn1c(=O)c3cccc2cccc1c23	ZINC000000128288	O=c1[nH]c3cccc2cccc1c23
COc1ccccc1NS(=O)(=O)c4ccc3[nH]c(=S)n(CCCN2CCOCC2)c(=O)c3c4	ZINC000002637098	O=c3n(CCCN1CCOCC1)c(=S)[nH]c4ccc(S(=O)(=O)Nc2ccccc2)cc34
COC(=O)[C@H](Cc1c[nH]c2ccccc12)N[P@](O)(=O)OC[C@H]4O[C@H](n3cc(C)c(=O)[nH]c3=O)C=C4	ZINC000005822775	O=P(NCCc1c[nH]c2ccccc12)OCC4OC(n3ccc(=O)[nH]c3=O)C=C4
C[C@@H]2C(=O)O[C@@H](c1ccc(Br)cc1)C(C)(C)C2=O	ZINC000000035095	O=C2CC(c1ccccc1)OC(=O)C2
CC(=O)N[C@@H](CSc2c(N)c(=O)cc3oc1ccc(C(O)=O)cc1nc23)C(O)=O	ZINC000015264106	O=c3ccc2nc1ccccc1oc2c3
Cc2cc(C)c(C#N)c(SCC(=O)c1ccc(N(=O)=O)cc1)n2	ZINC000000075072	O=C(CSc1ccccn1)c2ccccc2
O=N(=O)c1ccccc1S(=O)(=O)Nc2ccccc2	ZINC000000067942	O=S(=O)(Nc1ccccc1)c2ccccc2
O=N(=O)c4ccc(c3csc(N2CCc1ccccc1C2)n3)cc4	ZINC000000033466	C2Cc1ccccc1CN2c4nc(c3ccccc3)cs4
Cc1c(C(O)=O)oc2ccccc12	ZINC000000107768	c2ccc1occc1c2
CN(C[C@@H]1CCCO1)c3nc(c2ccc(N(=O)=O)cc2)cs3	ZINC000000033464	C3COC(CNc2nc(c1ccccc1)cs2)C3
Cc3ccc(S(=O)(=O)N1CCC[C@H]1c2ccsc2)cc3	ZINC000000026230	O=S(=O)(N1CCCC1c2ccsc2)c3ccccc3
Cc1cccc2c(C(O)=O)cc(C(O)=O)nc12	ZINC000000192843	c2ccc1ncccc1c2
CN(/N=C/c1ccccc1F)C2=NS(=O)(=O)c3ccccc23	ZINC000000032020	O=S3(=O)N=C(NN=Cc1ccccc1)c2ccccc23
COc3ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)cc3C(=O)N4CCCC4	ZINC000038756895	O=C(N1CCCC1)c4cccc(S(=O)(=O)Nc3ccc(S(=O)(=O)Nc2ncccn2)cc3)c4
O=C(Cc1ccccc1)Nc4ncc3C(=O)C[C@H](c2ccco2)Cc3n4	ZINC000000228035	O=C(Cc1ccccc1)Nc4ncc3C(=O)CC(c2ccco2)Cc3n4
Cc2[nH]c1ccccc1c2CCNC(=O)Cn3cnc(N(=O)=O)n3	ZINC000000032848	O=C(Cn1cncn1)NCCc2c[nH]c3ccccc23
O=N(=O)c3ccc(\C=N\c2ccc(N1CCOCC1)cc2)s3	ZINC000000032029	C3CN(c2ccc(N=Cc1cccs1)cc2)CCO3
COc2ccc(C1C(C#N)=C(N)SC(N)=C1C#N)cc2	ZINC000000049938	S2C=CC(c1ccccc1)C=C2
CCS(=O)(=O)c2ccc(O)c(NC(=O)Cn1cnnn1)c2	ZINC000000046827	O=C(Cn1cnnn1)Nc2ccccc2
CCC[C@@H](C)NC(=O)c1ccccc1Br	ZINC000000030349	c1ccccc1
N[C@@H](Cc1ccc(O)cc1)C(=O)NO	ZINC000000009568	c1ccccc1
OC(=O)\C=C\S(O)(=O)=O	ZINC000001711665	nonring
CC(C)(O)[C@](C)(O)c1cccc(Cl)c1	ZINC000000000464	c1ccccc1
Fc3ccc(CSc1nncn1NCc2ccc(Cl)cc2)cc3	ZINC000000359855	C(Nn1cnnc1SCc2ccccc2)c3ccccc3
OC(=O)[C@@H]1CCC(=O)N1C3c2ccccc2Oc4ccccc34	ZINC000000134555	O=C1CCCN1C3c2ccccc2Oc4ccccc34
COC(=O)c1sccc1N=NC(C#N)=C(O)c2ccc(Cl)cc2	ZINC000000125826	C(=Cc1ccccc1)N=Nc2ccsc2
COc3cccc(C(=O)N2CCN([C@@H]1CCC[C@@H](C)C1)CC2)c3OC	ZINC000000239661	O=C(N2CCN(C1CCCCC1)CC2)c3ccccc3
CCOC(=O)c3cc(C(=O)Nc1ccc(F)c(Cl)c1)n4ccc2ccccc2c34	ZINC000000626855	O=C(Nc1ccccc1)c3ccc4c2ccccc2ccn34
CC[C@@]4(c1ccccc1)Oc2cccnc2n3cccc3C4=O	ZINC000000009136	O=C3C(c1ccccc1)Oc2cccnc2n4cccc34
COc3ccc(\C=N\CC2(c1ccccc1)CCCC2)cc3OC	ZINC000000507028	C3CCC(CN=Cc1ccccc1)(c2ccccc2)C3
Cc4ccc(n2ncc3c(NCCCn1ccnc1)ncnc23)c(C)c4	ZINC000003912193	C(CNc2ncnc3n(c1ccccc1)ncc23)Cn4ccnc4
COc3ccc(NS(=O)(=O)c2ccc1OCC(=O)N(CC(O)=O)c1c2)c(OC)c3	ZINC000022990131	O=C3COc2ccc(S(=O)(=O)Nc1ccccc1)cc2N3
CSCC[C@@H](C(O)=O)n3c(=S)s\c(=C/[C@@H]1C(=O)N(CC(O)=O)c2ccccc12)c3=O	ZINC000008820699	O=C2Nc1ccccc1C2C=c3sc(=S)[nH]c3=O
CCC[C@@H](NC(=O)[C@@H]2Cc3ccc4OCCCCCCC(=O)N[C@@H](C1CCCCC1)C(=O)N2Cc3c4)C(=O)C(=O)NCC(O)=O	ZINC000010743313	O=C4CCCCCCOc2ccc1CCN(Cc1c2)C(=O)C(C3CCCCC3)N4
CC(=O)Nc2ccc(NC(=O)c1cc(C)ccc1N(=O)=O)c(C)c2	ZINC000000067894	O=C(Nc1ccccc1)c2ccccc2
FC(F)(F)c2cccc(NC(=O)C(=S)NCc1ccccc1)c2	ZINC000000031471	O=C(Nc1ccccc1)C(=S)NCc2ccccc2
CN[C@H]1Cc2cccc3[nH]c(=O)n(C1)c23	ZINC000000007049	O=c1[nH]c3cccc2CCCn1c23
CCN4CCC(N[C@@H]1CCCc2c1[nH]c3ccc(N(=O)=O)cc23)CC4	ZINC000005032129	C4CC(NC1CCNCC1)c3[nH]c2ccccc2c3C4
Cc1cscc1NC(=O)/C=C/C(O)=O	ZINC000000082767	c1ccsc1
Nc2nc(=O)n([C@H]1O[C@@H](CO)C=C1)cc2F	ZINC000000007048	O=c1ncccn1C2OCC=C2
Cc4sc3nc1CC(C)(C)CC(=O)c1c(c2ccccc2)c3c4C	ZINC000000478580	O=C3CCCc4nc1sccc1c(c2ccccc2)c34
CCCc4cc3c(=O)c(c2cc1ccccc1o2)c(C)oc3cc4OC	ZINC000000178270	O=c3c(c2cc1ccccc1o2)coc4ccccc34
Cc4cccc(NC(=O)CSc2n/c(=C/c1ccc(F)cc1)c(=O)n2c3ccccc3)c4	ZINC000000625432	O=C(CSc2nc(=Cc1ccccc1)c(=O)n2c3ccccc3)Nc4ccccc4
CCc3c(C(=O)c1ccccc1)oc4c(C)c2oc(=O)cc(C)c2cc34	ZINC000000088200	O=C(c1ccccc1)c4cc3cc2ccc(=O)oc2cc3o4
COc3ccc(c2csc(Nc1cccc(Cl)c1C)n2)cc3	ZINC000000073666	N(c1ccccc1)c3nc(c2ccccc2)cs3
Cc4nc(SCc1ccccc1)c3c2CCCCc2sc3n4	ZINC000000552189	C1CCc3c(C1)sc4ncnc(SCc2ccccc2)c34
Fc1ccccc1C(=O)N3CCC(Cc2ccccc2)CC3	ZINC000000027165	O=C(N2CCC(Cc1ccccc1)CC2)c3ccccc3
COc4ccc(CCn3c(=O)[nH]c(=O)c(=CNN=c2[nH]c1n(C)c(=O)n(C)c(=O)c1n2C)c3=O)cc4OC	ZINC000001874127	O=c4[nH]c(=O)c3[nH]c(=NNC=c2c(=O)[nH]c(=O)n(CCc1ccccc1)c2=O)[nH]c3[nH]4
Clc2cccc(c1c[nH]cc1Cl)c2N(=O)=O	ZINC000000002012	c2ccc(c1cc[nH]c1)cc2
Cc2cccc(OCC(=O)NCc1cccnc1)c2C	ZINC000000029049	O=C(COc1ccccc1)NCc2cccnc2
OC(=O)c1ccccc1C(=O)c2ccc(O)c(N(=O)=O)c2	ZINC000001706916	O=C(c1ccccc1)c2ccccc2
CC3(C)C[C@@H](C(=O)COc2ccc1ccc(=O)oc1c2)CCO3	ZINC000000046539	O=C(COc2ccc1ccc(=O)oc1c2)C3CCOCC3
COC(=O)c/1c(C)n(CC(C)C)c(=O)c\1=C/c2cccc(Cl)c2	ZINC000000068626	O=c1[nH]ccc1=Cc2ccccc2
COC(=O)c3cccc(NC(=O)Cn2c(=O)c1ccccc1c2=O)c3	ZINC000000078347	O=C(Cn2c(=O)c1ccccc1c2=O)Nc3ccccc3
Cc4ccc(n1nnnc1c2cnc(N)nc2c3ccccc3)cc4	ZINC000000068622	c4ccc(c1ncncc1c2nnnn2c3ccccc3)cc4
CC[N@]1CC=C3[C@H](C1)[C@@H](c2ccncc2)C(C#N)=C(N)C3(C#N)C#N	ZINC000000483828	C3NCC2C(c1ccncc1)C=CCC2=C3
Cc3ccc2nc(SCc1ccccc1)c(\C=N\O)c(=O)n2c3	ZINC000000046530	O=c2cc(SCc1ccccc1)nc3ccccn23
CCN(CC)C(=O)[C@@H]2CCC[N@@](Cc1ccc(N(=O)=O)o1)C2	ZINC000000292230	C2CCN(Cc1ccco1)CC2
OC(=O)\C=C\C(=O)Nc2ccc(N1CCOCC1)cc2	ZINC000000077652	C2CN(c1ccccc1)CCO2
CN2[C@@H]([N+](=O)Cc1c(F)cccc1Cl)C(C)(C)SC2=S	ZINC000000070485	O=[N+](Cc1ccccc1)C2CSC(=S)N2
O=C(CC1CCCCC1)N3CCC(c2cnc[nH]2)CC3	ZINC000000017071	O=C(CC1CCCCC1)N3CCC(c2cnc[nH]2)CC3
Cn2nc(C(F)(F)F)c3cc(C(=O)Nc1ccc(F)cc1)sc23	ZINC000000082899	O=C(Nc1ccccc1)c3cc2cn[nH]c2s3
COc3ccc(NS(=O)(=O)c2cc(NN=c1c(=O)[nH]c(=O)[nH]c1=O)ccc2Cl)cc3	ZINC000009507844	O=c3[nH]c(=O)c(=NNc2cccc(S(=O)(=O)Nc1ccccc1)c2)c(=O)[nH]3
COc3ccc(OCc2c(C#N)c1ccccc1n2C)cc3	ZINC000000049160	C(Oc1ccccc1)c3cc2ccccc2[nH]3
OC(=O)Cc1ccccc1Nc2c(Cl)cccc2Cl	ZINC000000001281	N(c1ccccc1)c2ccccc2
CCN(CC)C(=O)c2ccc(CSc1ccc(Cl)cc1)cc2	ZINC000000044448	C(Sc1ccccc1)c2ccccc2
CCN(CC)CCn2c(=N)n(CC(=O)c1ccco1)c3ccccc23	ZINC000000182192	N=c2[nH]c1ccccc1n2CC(=O)c3ccco3
O=C(CN1CCCCCC1)Nc2sccc2C#N	ZINC000000127954	O=C(CN1CCCCCC1)Nc2cccs2
CCN(CC)C(=S)SC	ZINC000000001289	nonring
CC2CCN(C(=O)c1cccs1)CC2	ZINC000000029171	O=C(N1CCCCC1)c2cccs2
CC(C)(C#N)c2cc(Cn1cncn1)cc(C(C)(C)C#N)c2	ZINC000000000941	C(c1ccccc1)n2cncn2
COC(=O)[C@H](NC(=O)[C@@H]2C[C@@H](NC(=O)Nc1cccc(F)c1)CCN2C(=O)CCC(O)=O)C(C)C	ZINC000004151715	O=C(NC1CCNCC1)Nc2ccccc2
Cc3cc(C)n2nc(SCC(=O)NC1CCCCCCC1)nc2n3	ZINC000000217328	O=C(CSc2nc1ncccn1n2)NC3CCCCCCC3
Oc3c(Br)cc(n2c(=O)c1ccc(N(=O)=O)cc1c2=O)cc3Br	ZINC000000838279	O=c2n(c1ccccc1)c(=O)c3ccccc23
COc3ccc2c(C)c(c1ccc(Cl)cc1Cl)c(=O)oc2c3	ZINC000000057996	O=c2oc1ccccc1cc2c3ccccc3
CC2CCN(C(=O)c1ccc(N(=O)=O)o1)CC2	ZINC000000038972	O=C(N1CCCCC1)c2ccco2
Cc2csc3sc(C(=O)Nc1ccc(Cl)cc1)c(C)c23	ZINC000000125606	O=C(Nc1ccccc1)c3cc2ccsc2s3
COc2ccc(CCNc1ccc(C(F)(F)F)cc1N)cc2OC	ZINC000000068282	C(Cc1ccccc1)Nc2ccccc2
C[C@@H](NC(=O)CSc1nnc(N)s1)c2ccccc2	ZINC000000036089	O=C(CSc1nncs1)NCc2ccccc2
Cc1ccccc1n3nnc4cnc2ccccc2c34	ZINC000000005128	c4ccc(n2nnc3cnc1ccccc1c23)cc4
CN(C)c1ccncc1C(=O)Nc2ccc(F)cc2F	ZINC000000078582	O=C(Nc1ccccc1)c2cccnc2
C[C@H]1CC(=O)NN=C1c4ccc3[nH]c2n[nH]cc2oc3c4	ZINC000000005437	O=C4CCC(c3ccc2[nH]c1n[nH]cc1oc2c3)=NN4
C[C@H](N(O)[C@@H](C)C(O)=O)C(O)=O	ZINC000014516378	nonring
CC2(C)CC(NC(=O)Cn1cccc(N(=O)=O)c1=O)CC(C)(C)N2	ZINC000000104899	O=C(Cn1ccccc1=O)NC2CCNCC2
Cc2cc(NS(=O)(=O)c1n[nH]cc1C(O)=O)no2	ZINC000037731620	O=S(=O)(Nc1ccon1)c2cc[nH]n2
CN2CCC=C(c1nc(N)sc1Cl)C2	ZINC000000005516	C2CC=C(c1cscn1)CN2
C[C@@H](Sc2nc1ccccc1[nH]2)C(=O)Nc3c(C)cc(C)cc3C	ZINC000000036103	O=C(CSc2nc1ccccc1[nH]2)Nc3ccccc3
Cc3ccc(CSc1nnnn1c2ccccc2)cc3	ZINC000000036101	C(Sc1nnnn1c2ccccc2)c3ccccc3
COc3ccc(c2oc1ccccc1c(=O)c2O)cc3	ZINC000000057683	O=c2cc(c1ccccc1)oc3ccccc23
CS(=O)(=O)N2CCN(c1ccc(F)cc1)CC2	ZINC000000029520	C2CN(c1ccccc1)CCN2
CC(C)(C#N)C(C)(C)c1nn[nH]n1	ZINC000000052306	c1nn[nH]n1
COc1ccccc1c2nc(N)nc(N)n2	ZINC000000011428	c2ccc(c1ncncn1)cc2
CC(C)NC(=O)c1ccc(C)cc1	ZINC000000029525	c1ccccc1
Fc3ccc(S(=O)(=O)Nc1nonc1NS(=O)(=O)c2ccc(F)cc2)cc3	ZINC000000784773	O=S(=O)(Nc1nonc1NS(=O)(=O)c2ccccc2)c3ccccc3
CCc4ccc(C(=O)Nc3cccc(c2nn1cnnc1s2)c3)cc4	ZINC000000558047	O=C(Nc3cccc(c2nn1cnnc1s2)c3)c4ccccc4
Oc2cccc(c1cn[nH]n1)c2	ZINC000000009120	c2ccc(c1cn[nH]n1)cc2
CCN(CC)CCOc1c(Br)ccc4c1sc3nc2CCCn2c(=O)c34	ZINC000000754186	O=c3n1CCCc1nc4sc2ccccc2c34
O=c4c1ccccc1c(=O)c5c3Cc2ccccc2Cn3cc45	ZINC000000001738	O=c4c1ccccc1c(=O)c5c3Cc2ccccc2Cn3cc45
OC(=O)[C@H](CC(=O)c1ccc(Cl)cc1)c2cccc(Br)c2	ZINC000001397657	O=C(CCc1ccccc1)c2ccccc2
Nc2cc(N1CCCCC1)nc(N)n2=O	ZINC000000001735	O=n2ccc(N1CCCCC1)nc2
COc2ccc(n1c(=O)sn(C)c1=O)cc2	ZINC000000027363	O=c1[nH]sc(=O)n1c2ccccc2
Oc3c([C@@H](Nc1cccc(F)c1)c2ccccn2)ccc4cccnc34	ZINC000000079237	N(C(c2ccc1cccnc1c2)c3ccccn3)c4ccccc4
Nc3nc(CSCc1ccccc1)nc(N2CCOCC2)n3	ZINC000000034291	C3CN(c2ncnc(CSCc1ccccc1)n2)CCO3
Cn2c(=N\NS(=O)(=O)c1ccc(C(O)=O)cc1)\sc3cc(C(O)=O)ccc23	ZINC000013763800	O=S(=O)(NN=c2[nH]c1ccccc1s2)c3ccccc3
COc3ccc2cc(C(=O)Nc1cc(C)on1)sc(=O)c2c3OC	ZINC000000079344	O=C(Nc1ccon1)c3cc2ccccc2c(=O)s3
COc1ccccc1Oc3ccc(NC=CC(=O)c2ccc(C)o2)cc3	ZINC000000468280	O=C(C=CNc2ccc(Oc1ccccc1)cc2)c3ccco3
CC(=O)c3cccc(NC(=O)Nc2ccc(Oc1ccccc1)cc2)c3	ZINC000000609280	O=C(Nc1ccccc1)Nc3ccc(Oc2ccccc2)cc3
CC(C)(CO)NC[C@@H](O)c1ccccc1	ZINC000000004237	c1ccccc1
Cn4c(=O)c(Sc1ccccc1C(O)=O)c(O)c5c(=O)n(c2ccccc2)c(=O)n(c3ccccc3)c45	ZINC000000704406	O=c4[nH]c3n(c1ccccc1)c(=O)n(c2ccccc2)c(=O)c3cc4Sc5ccccc5
Cc1nccn1Cc2ccncc2	ZINC000000008508	C(c1ccncc1)n2ccnc2
CC4(C)C(=O)Nc3cc2[nH]c(c1ccncc1)nc2cc34	ZINC000000000883	O=C4Cc3cc2nc(c1ccncc1)[nH]c2cc3N4
CC(=O)NC1CCC(CC(O)=O)CC1	ZINC000000000880	C1CCCCC1
CN(C)\C=C\C(=O)c2nnn(C1CCCCC1)c2NC3CCCCC3	ZINC000000055350	C3CCC(Nc1cnnn1C2CCCCC2)CC3
NC(=O)c1ccc(N(=O)=O)cc1Cl	ZINC000000000887	c1ccccc1
c5ccc(c4nnc(c1ccccc1)c(c2c[nH]c3ccccc23)n4)cc5	ZINC000000510330	c5ccc(c4nnc(c1ccccc1)c(c2c[nH]c3ccccc23)n4)cc5
O[C@@H](COC[C@H]1CCC=CC1)Cn3c2ccccc2c4ccccc34	ZINC000000036215	C(COCC1CCC=CC1)Cn3c2ccccc2c4ccccc34
CCN(CC)CCNc2ncnc3sc1COC(C)(C)Cc1c23	ZINC000000550138	C1Cc2c(CO1)sc3ncncc23
COC(=O)c2ccc(NC(=O)CNc1cc(Cl)ccc1OC)cc2	ZINC000000128718	O=C(CNc1ccccc1)Nc2ccccc2
CCN(CC)c3ccc(\C=c2/c(=O)[nH]n(c1ccc(C)cc1)c2=O)cc3	ZINC000000050426	O=c2[nH]n(c1ccccc1)c(=O)c2=Cc3ccccc3
Clc1ccccc1OCC(=O)Nc2cccc(Br)c2	ZINC000000094364	O=C(COc1ccccc1)Nc2ccccc2
CO/N=C(\C)c1scnc1C	ZINC000000010270	c1cscn1
C5Oc4ccc(Oc2nnc(c1cccs1)c3ccccc23)cc4O5	ZINC000000091477	C5Oc4ccc(Oc2nnc(c1cccs1)c3ccccc23)cc4O5
CN1CNS(=O)(=O)c2ncccc12	ZINC000000019124	O=S2(=O)NCNc1cccnc12
Cc4ccc(C)c(Nc3cc(n1cccn1)nc(c2ccccc2)n3)c4	ZINC000000300007	N(c1ccccc1)c4cc(n2cccn2)nc(c3ccccc3)n4
CC(=O)NCCc2cccc3ccc1OCCCc1c23	ZINC000000020590	C3COc2ccc1ccccc1c2C3
CC(C)(c1ccccc1)c3ccc(OCC(=O)N2CCOCC2)cc3	ZINC000000037982	O=C(COc2ccc(Cc1ccccc1)cc2)N3CCOCC3
OC(=O)CCC(=O)Nc2ccc(OCc1ccccc1)cc2	ZINC000000064856	C(Oc1ccccc1)c2ccccc2
OS(=O)(=O)CC(CS(O)(=O)=O)C(=O)c1ccc(Cl)c(Cl)c1	ZINC000001737497	c1ccccc1
CC(=O)Cn2c(=O)c1ccccc1c2=O	ZINC000000036650	O=c1[nH]c(=O)c2ccccc12
Oc1ccccc1C(=O)Nn2cnnc2	ZINC000000039807	O=C(Nn1cnnc1)c2ccccc2
S=C(Nc1cccnc1)N(CCc2ccccc2)Cc3ccccc3	ZINC000000111912	S=C(Nc1cccnc1)N(CCc2ccccc2)Cc3ccccc3
COc3ccc(OC)c(Cc2cnc1nc(N)nc(N)c1c2C)c3	ZINC000000000640	C(c1ccccc1)c3cnc2ncncc2c3
Cc3cccc(=C(c1c(O)n(C)c(=O)n(C)c1=O)c2c(O)n(C)c(=O)n(C)c2=O)c3=O	ZINC000001120554	O=c3[nH]cc(C(c1c[nH]c(=O)[nH]c1=O)=c2ccccc2=O)c(=O)[nH]3
Cc2cc(C)c1c(O)csc1n2	ZINC000000120811	c2cnc1sccc1c2
N[C@@H](CC(=O)c1cc(Cl)ccc1N)C(O)=O	ZINC000000007614	c1ccccc1
CCC[N@]1CCC[C@H]2[C@H]1COc3ccc(O)cc23	ZINC000000004090	C3CNC2COc1ccccc1C2C3
Cc2ccnc(NC(=O)c1ccc(Cl)cc1N(=O)=O)c2	ZINC000000038990	O=C(Nc1ccccn1)c2ccccc2
Cc2cc(\C=N\n1cnnc1)c(C)n2c3cccc(Cl)c3C	ZINC000000037504	C(=Nn1cnnc1)c3ccn(c2ccccc2)c3
CC3(C)C(=O)N(c1ccc(Cl)cc1)c2ncccc23	ZINC000000011331	O=C2Cc1cccnc1N2c3ccccc3
COc3ccc(C[C@@H](C)N[C@H](C)c1cccc2ccccc12)cc3OC	ZINC000000217435	C(Cc1ccccc1)NCc2cccc3ccccc23
ClC1=CC[C@H]4[C@@H](C1)C(=O)N(c3sc2CCCCc2c3C#N)C4=O	ZINC000000102271	O=C2C1CC=CCC1C(=O)N2c4cc3CCCCc3s4
Brc3ccc(CC(=O)n1nnc2ccccc12)cc3	ZINC000000038999	O=C(Cc1ccccc1)n2nnc3ccccc23
COC(=O)c2ccc(NC(=O)c1ccc(Cl)cc1)cc2	ZINC000000029637	O=C(Nc1ccccc1)c2ccccc2
CCOC(=O)c3c(NC(=O)NCC1CCNCC1)sc2CCCCc23	ZINC000000734250	O=C(NCC1CCNCC1)Nc3cc2CCCCc2s3
Cc2ccc(C(=O)Nc1cccc(Cl)c1)cc2	ZINC000000029633	O=C(Nc1ccccc1)c2ccccc2
COc1ccc(N(=O)=O)cc1NS(=O)(=O)c3ccc(C(=O)NN2CC(=O)NC2=O)cc3	ZINC000012536063	O=C3CN(NC(=O)c2ccc(S(=O)(=O)Nc1ccccc1)cc2)C(=O)N3
COC(=O)[C@@H](C)N(C(=O)c1c(F)cccc1F)c2c(C)cccc2C	ZINC000000062069	O=C(Nc1ccccc1)c2ccccc2
O=C4C=CC2(CC1(CCCCC1)N=C2SCc3ccccc3)C=C4	ZINC000000056260	O=C4C=CC2(CC1(CCCCC1)N=C2SCc3ccccc3)C=C4
CC(C)(C)c2cc1OC(=O)Cc1c(C(C)(C)C)c2O	ZINC000000021359	O=C2Cc1ccccc1O2
OC(=O)Cn1[nH]c(Br)nc1=N	ZINC000604400429	N=c1nc[nH][nH]1
C[C@H](NC(=O)C(\C)=N\O)C(O)=O	ZINC000039135913	nonring
COC(=O)Nc2ccc(SCC(=O)c1ccc(Cl)cc1)cc2	ZINC000000048369	O=C(CSc1ccccc1)c2ccccc2
Nc3ccc(c2cc(=O)c1cc(O)ccc1o2)cc3	ZINC000000004898	O=c2cc(c1ccccc1)oc3ccccc23
Cc2ccc(/N=C/c1ccc(C#N)cc1)cc2I	ZINC000000048567	C(=Nc1ccccc1)c2ccccc2
CN1C(=O)Cc2cc(C(C)=O)cnc12	ZINC000000020775	O=C2Cc1cccnc1N2
O=C(NC[C@@H]1CCCO1)c4ccc(c3nnc(c2ccccc2)o3)cc4	ZINC000000529149	O=C(NCC1CCCO1)c4ccc(c3nnc(c2ccccc2)o3)cc4
C[C@@H](NCc1ccccc1)c2ccccc2O	ZINC000000099319	C(NCc1ccccc1)c2ccccc2
O=S(=O)(N2CCC(c1ccccc1)=CC2)c4ccc3ccccc3c4	ZINC000000129876	O=S(=O)(N2CCC(c1ccccc1)=CC2)c4ccc3ccccc3c4
Fc4ccc(CN2C(=O)C1(OCCCO1)c3ccccc23)c(Cl)c4	ZINC000000217585	O=C3N(Cc1ccccc1)c2ccccc2C34OCCCO4
Cc3ccc(CC2(O)CCN(CCOc1ccc(O)cc1)CC2)cc3	ZINC000000007382	C(CN2CCC(Cc1ccccc1)CC2)Oc3ccccc3
Clc2cc(Cl)c(S(=O)(=O)NCc1ccccc1)cc2Cl	ZINC000000855887	O=S(=O)(NCc1ccccc1)c2ccccc2
Cc4cc(C)n3nc(Cc2nc1nc(C)cc(C)n1n2)nc3n4	ZINC000000041975	C(c2nc1ncccn1n2)c4nc3ncccn3n4
O=C(Nc2ccc(OCc1ccccc1)cc2)c3ccccc3N(=O)=O	ZINC000000101871	O=C(Nc2ccc(OCc1ccccc1)cc2)c3ccccc3
COc3ccc(n2c(SC)nc1nc(SC)n(C)c1c2=O)cc3	ZINC000000041972	O=c2n(c1ccccc1)cnc3nc[nH]c23
Cc4ccc(c3cc(N)n2nc(c1ccc(C)cc1)cc2n3)cc4	ZINC000000033230	c4ccc(c3ccn2nc(c1ccccc1)cc2n3)cc4
COc1ccccc1N3CCN(Cc2ccc(C)cc2)CC3	ZINC000000135939	C2CN(c1ccccc1)CCN2Cc3ccccc3
C3CC(c2nnc(c1ccccc1)o2)CCN3	ZINC000000154385	C3CC(c2nnc(c1ccccc1)o2)CCN3
CN(C)c2cccc(C(=O)NCc1ccc(S(N)(=O)=O)cc1)c2	ZINC000000030345	O=C(NCc1ccccc1)c2ccccc2
COP(O)(O)=N[P@@](O)(=O)OC	ZINC000090556625	nonring
C[C@H](Oc1ccccc1)C(=O)Nc2cc(C)ccc2C	ZINC000000030691	O=C(COc1ccccc1)Nc2ccccc2
NS(=O)(=O)c2ccc(CNC(=O)c1ccccc1Cl)cc2	ZINC000000030341	O=C(NCc1ccccc1)c2ccccc2
CC(=O)Nc2ccc(S(=O)(=O)Nn1cnnc1)cc2	ZINC000000406653	O=S(=O)(Nn1cnnc1)c2ccccc2
Cc1cccc(C)c1N2C(=O)C[C@H](SC(C)(C)[C@@H](N)C(O)=O)C2=O	ZINC000000257886	O=C1CCC(=O)N1c2ccccc2
Cc3cc(C)c2cc(C)c(SCC(=O)c1ccccc1F)nc2c3	ZINC000000412484	O=C(CSc2ccc1ccccc1n2)c3ccccc3
Cc3ccc(NC(=O)c2ccc(COc1cc(C)cc(C)c1)o2)c(C)c3	ZINC000000115676	O=C(Nc1ccccc1)c3ccc(COc2ccccc2)o3
COc1ccccc1\C=c3\nc(c2ccc(C(C)(C)C)cc2)oc3=O	ZINC000000055332	O=c2oc(c1ccccc1)nc2=Cc3ccccc3
COc4ccc(Cc3nc(NC[C@@H]1CCCO1)c2ccccc2n3)cc4	ZINC000000269135	C4COC(CNc2nc(Cc1ccccc1)nc3ccccc23)C4
Clc3ccc(N2C[C@H](C(=O)Nc1nccs1)CC2=O)cc3	ZINC000000050631	O=C2CC(C(=O)Nc1nccs1)CN2c3ccccc3
CCOC(=O)C[n+]2c(c1ccc(C)cc1)n(C)c3ccccc23	ZINC000000388791	c3ccc(c2nc1ccccc1[nH]2)cc3
O=N(=O)c4ccc(c3nc2n(c1ccccc1)ncc2c(=O)o3)cc4	ZINC000000035922	O=c3oc(c1ccccc1)nc4n(c2ccccc2)ncc34
Cc4ccc(NS(=O)(=O)Cc3nnc(CS(=O)(=O)c1c[nH]cc1S(=O)(=O)c2ccc(C)cc2)n3N)cc4	ZINC000084654008	O=S(=O)(Cc3nnc(CS(=O)(=O)c1c[nH]cc1S(=O)(=O)c2ccccc2)[nH]3)Nc4ccccc4
CCOC(=O)c2cn(CC)c1ccc(Br)cc1c2=O	ZINC000000052340	O=c1cc[nH]c2ccccc12
CCN(CC)c2ccc(NC(=O)COc1ccccc1OC)cc2	ZINC000000038507	O=C(COc1ccccc1)Nc2ccccc2
CC4(C)COC([C@@H](Cc1ccccc1)n3c(=O)c2ccccc2c3=O)=N4	ZINC000000140909	O=c3n(C(Cc1ccccc1)C2=NCCO2)c(=O)c4ccccc34
FC(F)(F)c1ccccc1c2nn[nH]n2	ZINC000000089780	c2ccc(c1nn[nH]n1)cc2
CCOC(=O)c4sc(N3[C@@H](c1ccc(C)cc1)C(=C(O)c2ccc(OCC)cc2C)C(=O)C3=O)nc4C	ZINC000000631093	O=C4N(c1nccs1)C(c2ccccc2)C(=Cc3ccccc3)C4=O
O=c2oc1ncccc1n2CCN3CCCC3	ZINC000000016339	O=c2oc1ncccc1n2CCN3CCCC3
Cc2cccc(NC(=O)c1ccccc1I)c2	ZINC000000034198	O=C(Nc1ccccc1)c2ccccc2
Clc1ccccc1NC(=O)c3sc2ccccc2c3Cl	ZINC000000041624	O=C(Nc1ccccc1)c3cc2ccccc2s3
CCn1c(=O)c(NC)nc2ccccc12	ZINC000000006705	O=c2cnc1ccccc1[nH]2
COC(=O)CC2=C(C)C(=O)C[C@@H]1C(C)(C)CCC[C@]12C	ZINC000000034194	O=C2CC1CCCCC1C=C2
Cc2nn(c1cc(Cl)ccc1N)c(=O)c3ccccc23	ZINC000000034191	O=c2n(c1ccccc1)ncc3ccccc23
CN(C)CCNC(=O)c3ccc(OC2CCN(CC1CCCC1)CC2)c(Cl)c3	ZINC000011661548	C3CCC(CN2CCC(Oc1ccccc1)CC2)C3
OC2CCN(Cc1cc(Br)cs1)CC2	ZINC000000040751	C2CCN(Cc1cccs1)CC2
CC(C)Oc3ccc(Cc2ccc(NC1=NCCN1)cc2)cc3	ZINC000000007547	C3CN=C(Nc2ccc(Cc1ccccc1)cc2)N3
COC(=O)c2cc1c(OC)cc(OC)cc1[nH]2	ZINC000000032326	c2ccc1[nH]ccc1c2
Oc3c(Sc2c(O)c1cccnc1[nH]c2=O)c(=O)[nH]c4ncccc34	ZINC000006694564	O=c2[nH]c1ncccc1cc2Sc4cc3cccnc3[nH]c4=O
CCOC(=O)CCc3ccc2O[C@H](c1ccc(N(=O)=O)s1)Nc2c3	ZINC000000094482	N2C(c1cccs1)Oc3ccccc23
Cc2ccc(C)c(OCC(=O)Nc1cccc(Br)c1)c2C	ZINC000000144579	O=C(COc1ccccc1)Nc2ccccc2
O=C2OC(c1ccccc1)OC(=O)C2=Cc4ccc(N3CCCC3)cc4	ZINC000000387317	O=C2OC(c1ccccc1)OC(=O)C2=Cc4ccc(N3CCCC3)cc4
c4cncc(c2cnn3cc(c1ccncc1)cnc23)c4	ZINC000000026951	c4cncc(c2cnn3cc(c1ccncc1)cnc23)c4
COC(=O)C1=C(C)N(C)C(=S)N[C@@H]1c2ccc(Cl)cc2Cl	ZINC000000067074	S=C2NC=CC(c1ccccc1)N2
CC(C)(O)[C@@H]3Cc2cc1ccc(=O)oc1cc2O3	ZINC000000051924	O=c3ccc2cc1CCOc1cc2o3
Nc4nc(Cl)c3ncn([C@@H]2C[C@H]1C[C@](CC(O)=O)(C(O)=O)O[C@H]1C2)c3n4	ZINC000013826870	C4CC3CC(n1cnc2cncnc12)CC3O4
CC[N@@](CCO)Cc1csc2c(Br)cccc12	ZINC000000338987	c2ccc1sccc1c2
COc2ccc(NC(=S)Nc1ccc(NC(C)=O)cc1)cc2	ZINC000000034666	S=C(Nc1ccccc1)Nc2ccccc2
NS(=O)(=O)c3ccc(NS(=O)(=O)c2ccc(NS(=O)(=O)c1c(F)c(F)c(F)c(F)c1F)cc2)cc3	ZINC000027518920	O=S(=O)(Nc2ccc(S(=O)(=O)Nc1ccccc1)cc2)c3ccccc3
Cn1ccnc1C(=O)Nc2cc(C(O)=O)n(C)c2	ZINC000002541362	O=C(Nc1cc[nH]c1)c2ncc[nH]2
Fc3ccc(c2nnc(c1ccc(Cl)cc1Cl)o2)cc3	ZINC000000039029	c3ccc(c2nnc(c1ccccc1)o2)cc3
CCc3nnc(NS(=O)(=O)c2ccc(NC(=O)c1ccc(Cl)cc1Cl)cc2)s3	ZINC000000711898	O=C(Nc2ccc(S(=O)(=O)Nc1nncs1)cc2)c3ccccc3
COc2cc1OC[C@H](O)c1c(OC)c2OC	ZINC000000024212	C2Cc1ccccc1O2
Nc3ccc(c2cc(=O)c1c(N)c(F)c(CO)c(F)c1o2)cc3F	ZINC000000019626	O=c2cc(c1ccccc1)oc3ccccc23
COc3ccc2nc1cc(Cl)ccc1c(NCCCNCCO)c2c3	ZINC000004428776	c3ccc2nc1ccccc1cc2c3
O=N(=O)c1ccccc1c3nnc(c2cccs2)o3	ZINC000000039020	c3ccc(c2nnc(c1cccs1)o2)cc3
CC4(C)CC(Nc2ncnc3sc1CCCCc1c23)CC(C)(C)N4	ZINC000000148070	C1CCc3c(C1)sc4ncnc(NC2CCNCC2)c34
OC(Nc1ccc(Cl)cc1)=NS(=O)(=O)c2csc3ccccc23	ZINC000000606265	O=S(=O)(N=CNc1ccccc1)c2csc3ccccc23
O[C@H]1CCC(C(O)=O)=C[C@H]1OC(=C)C(O)=O	ZINC000028006666	C1CCC=CC1
O=C(Nc2ccc(C(=O)Nc1nccs1)cc2)\C=C\c3ccco3	ZINC000000081336	O=C(Nc2ccc(C(=O)Nc1nccs1)cc2)C=Cc3ccco3
Clc3ccc(S(=O)(=O)Nc2cccc(NC(=O)c1ccco1)c2)cc3	ZINC000000802352	O=C(Nc2cccc(NS(=O)(=O)c1ccccc1)c2)c3ccco3
Cc4cc(C)c(C(=O)Oc3ccc2c1CCCc1c(=O)oc2c3)c(C)c4	ZINC000000117682	O=C(Oc3ccc2c1CCCc1c(=O)oc2c3)c4ccccc4
OP(O)(=O)OC#Cc1ccccc1	ZINC000003181745	c1ccccc1
CC(C)(C)NCCn2c(c1ccc(Br)cc1)cn4c2nc3ccccc34	ZINC000000708905	c4ccc(c3cn2c(nc1ccccc12)[nH]3)cc4
Cc2cc(C)c[n+](c1c(\C=N\NC(N)=S)sc(=O)n1C)c2	ZINC000000206763	O=c2[nH]c([n+]1ccccc1)cs2
Cc1ccccc1NC(=N)Nc2nc(C(F)(F)F)cc(=O)[nH]2	ZINC000000269242	N=C(Nc1ccccc1)Nc2nccc(=O)[nH]2
CC(C)CC2=C[C@@](O)(C(F)(F)F)N(C(=O)c1cccc(Cl)c1)N2	ZINC000000081534	O=C(N1CC=CN1)c2ccccc2
Clc1cc(N(=O)=O)ccc1SC2=NCCN2	ZINC000000145426	C2CN=C(Sc1ccccc1)N2
CCS(=O)(=O)N2CCC(C(=O)NCCN1CCCC1)CC2	ZINC000000262524	O=C(NCCN1CCCC1)C2CCNCC2
CN(C(=O)Nc1ccc(Br)cc1)c2ccccc2	ZINC000000051580	O=C(Nc1ccccc1)Nc2ccccc2
Clc3ccc(S(=O)(=O)N/N=C/c2ccc1OCOc1c2)cc3	ZINC000000071989	O=S(=O)(NN=Cc2ccc1OCOc1c2)c3ccccc3
COc1ccc(Cl)cc1NC(=O)CC(C)(C)CC(O)=O	ZINC000000102362	c1ccccc1
CC(C)=CCCc3cc(C(=O)NC1=NCCS1)c2ccccc2n3	ZINC000000034203	O=C(NC1=NCCS1)c2ccnc3ccccc23
S=C2NN[C@@H](c1ccccn1)S2	ZINC000000127319	S=C2NNC(c1ccccn1)S2
OC(=O)COCC(=O)Nc1ccc(C#N)cc1	ZINC000000151606	c1ccccc1
Cc3cc(N)n2ncc(c1cccc(Br)c1)c2n3	ZINC000000038213	c3ccc(c1cnn2cccnc12)cc3
CSc2ccc(Oc1cccc(C(=O)CC#N)c1)cc2	ZINC000000042287	O(c1ccccc1)c2ccccc2
Cc1cc(C#N)c(=S)[nH]c1c2cccs2	ZINC000000037815	S=c2cccc(c1cccs1)[nH]2
O=C(Nc1nn[nH]n1)c3cc(c2cccs2)on3	ZINC000000020838	O=C(Nc1nn[nH]n1)c3cc(c2cccs2)on3
C[C@H](Nc1ccc(Cl)cc1)c2ccncc2	ZINC000000006038	C(Nc1ccccc1)c2ccncc2
COC(=O)c1ccccc1NS(=O)(=O)c2ccc(Cl)cc2	ZINC000000047658	O=S(=O)(Nc1ccccc1)c2ccccc2
CC(C)(C)CC(=O)NCc1ccc(S(N)(=O)=O)cc1	ZINC000000030836	c1ccccc1
O=C(Nc3nc(c1ccccc1)c(C(=O)c2ccccc2)s3)c4ccccc4	ZINC000000626960	O=C(Nc3nc(c1ccccc1)c(C(=O)c2ccccc2)s3)c4ccccc4
CC(C)CC(=O)Nc3ccc2oc(c1ccccc1Cl)nc2c3	ZINC000000306179	c3ccc(c2nc1ccccc1o2)cc3
Cc3cccc4c(=O)c(C=c2c(c1ccccc1)n[nH]c2=O)c(O)[nH]c34	ZINC000000097130	O=c2[nH]nc(c1ccccc1)c2=Cc4c[nH]c3ccccc3c4=O
N#Cc4ccc(Oc3ccc(c2cnc1ccccc1n2)cc3)cc4C#N	ZINC000000039407	O(c1ccccc1)c4ccc(c3cnc2ccccc2n3)cc4
CN1C[C@@H]2C[C@H]1CN2c3ccc(Cl)nn3	ZINC000000025854	C1NC3CC1N(c2cccnn2)C3
COc1ccc(OC)c(NC(=O)CC(C)(C)C)c1	ZINC000000030831	c1ccccc1
COc4ccc(n2cnc3cc(NCc1ccccc1O)ccc23)cc4	ZINC000000034532	C(Nc3ccc2n(c1ccccc1)cnc2c3)c4ccccc4
CCOC(=O)c2nc1ccccc1c(=O)n2c3cccc4ccccc34	ZINC000000102872	O=c3n(c1cccc2ccccc12)cnc4ccccc34
CC(C)[C@H](NC(=O)N1CC(=O)Nc2ccccc12)C(=O)N[C@@H](CC(O)=O)C(O)=O	ZINC000009041459	O=C2CNc1ccccc1N2
CC(=O)c3cccc(S(=O)(=O)Nc2ccc(S(=O)(=O)Nc1nc(C)cc(C)n1)cc2)c3	ZINC000003424343	O=S(=O)(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c3ccccc3
CCOC(=O)[C@@H]1CNC(=O)C[C@@H]1C(=O)OCC	ZINC000000024927	O=C1CCCCN1
COc1ccccc1c3coc2cc(OC(=O)C(C)C)ccc2c3=O	ZINC000000101410	O=c2c(c1ccccc1)coc3ccccc23
Cn1cccc1\C=c3\c(=O)[nH]c(=O)n(Cc2ccco2)c3=O	ZINC000000308902	O=c2[nH]c(=O)c(=Cc1ccc[nH]1)c(=O)n2Cc3ccco3
C[C@@H]3CN(c2oc(COc1ccc(Cl)cc1)nc2C#N)C[C@@H](C)O3	ZINC000000108712	C3CN(c2cnc(COc1ccccc1)o2)CCO3
Fc3cccc(NC(=O)Cn2cnc1ccc(Cl)cc1c2=O)c3	ZINC000000038325	O=C(Cn2cnc1ccccc1c2=O)Nc3ccccc3
COc3ccc2N[C@@H](c1ccccc1)C(C)(C)[C@@H](OC(C)=O)c2c3	ZINC000000035134	C2Cc1ccccc1NC2c3ccccc3
Fc1ccccc1NC(=O)CSCC(=O)Nc2ccccc2	ZINC000000042667	O=C(CSCC(=O)Nc1ccccc1)Nc2ccccc2
Cc3cccc(NC(=O)c2sc1ccccc1c2Cl)c3	ZINC000000042193	O=C(Nc1ccccc1)c3cc2ccccc2s3
NS(=O)(=O)c2nc1c(C(O)=O)cccc1[nH]2	ZINC000082189593	c2ccc1[nH]cnc1c2
CC(C)Oc2ccc(C(=O)N1NC(C(F)F)=C[C@@]1(O)C(F)F)cc2	ZINC000000204542	O=C(N1CC=CN1)c2ccccc2
C[C@@H](NC(=O)C2CCN(Cc1ccc(F)cc1)CC2)c3ccccc3	ZINC000000455582	O=C(NCc1ccccc1)C3CCN(Cc2ccccc2)CC3
CCc1ccccc1NC(=S)NNS(=O)(=O)c2ccc(C)cc2	ZINC000000072504	O=S(=O)(NNC(=S)Nc1ccccc1)c2ccccc2
OC(=O)c1scn(=O)c1C(O)=O	ZINC000247390923	O=n1ccsc1
Cc3nn(c2nc1ccccc1s2)c(N)c3c4ccc(Cl)cc4	ZINC000000112819	c4ccc(c3cnn(c2nc1ccccc1s2)c3)cc4
CCS(=O)(=O)N(CC(=O)N1CCCC1)c2ccc(OC)cc2	ZINC000000039333	O=C(CNc1ccccc1)N2CCCC2
Clc1ccccc1/N=C/c3ccc(c2cccc(N(=O)=O)c2)o3	ZINC000000330574	C(=Nc1ccccc1)c3ccc(c2ccccc2)o3
Cc1ccccc1NC(=O)C[N+]34CC[N+](CC(=O)Nc2ccccc2C)(CC3)CC4	ZINC000001768510	O=C(C[N+]23CC[N+](CC(=O)Nc1ccccc1)(CC2)CC3)Nc4ccccc4
CC3(C)Oc1ccncc1C(n2ccccc2=O)=C3	ZINC000000010479	O=c1ccccn1C2=CCOc3ccncc23
NC(=O)c2c1CCCCc1sc2NC(=O)COC(=O)c4ccc(S(=O)(=O)Nc3ccccc3)cc4	ZINC000003348581	O=C(COC(=O)c2ccc(S(=O)(=O)Nc1ccccc1)cc2)Nc4cc3CCCCc3s4
OC(=O)c3c2CN(Cc1ccccc1)CCc2nc4ccccc34	ZINC000000125838	C3Cc2nc1ccccc1cc2CN3Cc4ccccc4
Clc3ccc(Cl)c(C(=O)Nc2ccc(N1CCCCC1)cc2)c3	ZINC000000447404	O=C(Nc2ccc(N1CCCCC1)cc2)c3ccccc3
OC(=O)COCC(=O)N2CCN(c1ncccc1C#N)CC2	ZINC000000151332	C2CN(c1ccccn1)CCN2
CC[C@H]2Cn1cc(N(=O)=O)nc1O2	ZINC000000005609	C2Cn1ccnc1O2
COc1ccccc1NC(=O)COc2ccccc2C(O)=O	ZINC000000035316	O=C(COc1ccccc1)Nc2ccccc2
COc2cc(\C=N\n1cnnc1)ccc2OCc3ccc(C)cc3	ZINC000000049399	C(Oc2ccc(C=Nn1cnnc1)cc2)c3ccccc3
Cc2ccc(NS(=O)(=O)c1ccc(Cl)cc1)c(N)c2	ZINC000000067950	O=S(=O)(Nc1ccccc1)c2ccccc2
COC(=O)CSc1cc(C(F)(F)F)nc2cc(C(C)(C)C)nn12	ZINC000000169714	c2cnc1ccnn1c2
Oc2cc(S(=O)(=O)c1ccccc1)ccc2N(=O)=O	ZINC000000091871	O=S(=O)(c1ccccc1)c2ccccc2
Cc3sc2nc(SCc1ccccc1)nc(N)c2c3C	ZINC000000123046	C(Sc2ncc1ccsc1n2)c3ccccc3
Cn1cnc(N(=O)=O)c1Oc2ccccc2	ZINC000000033508	O(c1ccccc1)c2cnc[nH]2
C[C@@H](Sc1nc(N)cc(N)n1)C(=O)Nc2ccc(C)cc2C	ZINC000000420957	O=C(CSc1ncccn1)Nc2ccccc2
COc3ccc2oc(c1cccs1)cc(=O)c2c3	ZINC000000033505	O=c2cc(c1cccs1)oc3ccccc23
O=N(=O)N(CCc1ccncc1)c3ccc(OCc2ccccc2)cc3	ZINC000000033504	C(Cc1ccncc1)Nc3ccc(OCc2ccccc2)cc3
Cn3c(=O)[nH]c(=O)\c(=C/c2ccc(c1ccccc1F)o2)c3=O	ZINC000000118142	O=c3[nH]c(=O)c(=Cc2ccc(c1ccccc1)o2)c(=O)[nH]3
C[N+](C)(C)CCNC(=O)c2cc[n+](Cc1ccccc1)c(\C=N\O)c2	ZINC000000307025	C(c1ccccc1)[n+]2ccccc2
COc3cccc(NC(=O)c2nc(N)nc(Nc1ccccc1)n2)c3	ZINC000000039240	O=C(Nc1ccccc1)c3ncnc(Nc2ccccc2)n3
C[C@H](Cc1ccccc1)NC(=O)Cc2ccc(N)cc2	ZINC000000000614	O=C(Cc1ccccc1)NCCc2ccccc2
CCOC(=O)C2[C@@H](c1ccc(C)cc1)n3c(N=C2C)nc4ccccc34	ZINC000000039245	C3C=Nc2nc1ccccc1n2C3c4ccccc4
Cc1ccccc1CN3CCN(c2ccccn2)CC3	ZINC000000236597	C2CN(c1ccccn1)CCN2Cc3ccccc3
OC(=O)c3cccc(NC(=O)C(/NC(=O)c1cccc(Br)c1)=C/c2cccc(N(=O)=O)c2)c3	ZINC000002117265	O=C(Nc1ccccc1)C(NC(=O)c2ccccc2)=Cc3ccccc3
OC(=O)c2ccc(NS(=O)(=O)c1cccc(C(F)(F)F)c1)cc2	ZINC000000074474	O=S(=O)(Nc1ccccc1)c2ccccc2
NC(=O)n3ccc(c2ccc(Oc1ccc(F)cc1)cc2)n3	ZINC000000026224	O(c1ccccc1)c3ccc(c2cc[nH]n2)cc3
COc3ccc(OC)c([C@H]1[N@@](C)CCc2cc(OC)c(OC)cc12)c3	ZINC000000197203	C3Cc1ccccc1C(c2ccccc2)N3
CCOc1ccccc1NC(=O)c3cc2cccc(OC)c2oc3=O	ZINC000000084715	O=C(Nc1ccccc1)c3cc2ccccc2oc3=O
OC(=O)c4cccc(n1cccc1\C=c3\sc(=O)n(CC(=O)Nc2ccc(Cl)cc2)c3=O)c4	ZINC000001006166	O=C(Cn3c(=O)sc(=Cc1cccn1c2ccccc2)c3=O)Nc4ccccc4
C3CN(c2nc(c1ccccc1)cs2)CCN3	ZINC000000105414	C3CN(c2nc(c1ccccc1)cs2)CCN3
COc2ccc(CCC(=O)Nc1ccc(CC#N)cc1)cc2	ZINC000000037209	O=C(CCc1ccccc1)Nc2ccccc2
CCc2ccc(OCC(=O)NCCc1ccccc1)cc2	ZINC000000036021	O=C(COc1ccccc1)NCCc2ccccc2
O=c4[nH]n(c2nn1nnnc1c3ccccc23)c(=O)c5ccccc45	ZINC000000032557	O=c4[nH]n(c2nn1nnnc1c3ccccc23)c(=O)c5ccccc45
C1CN4CCC1C(c3nc2ccccc2s3)=C4	ZINC000000017172	C1CN4CCC1C(c3nc2ccccc2s3)=C4
Brc2c(OCC(=O)N1CCCCC1)ccc3ccccc23	ZINC000000038881	O=C(COc2ccc1ccccc1c2)N3CCCCC3
NS(=O)(=O)c3cc2C(=O)N[C@H](c1ccccc1)Nc2cc3Cl	ZINC000000000305	O=C2NC(c1ccccc1)Nc3ccccc23
CN4CCN(c2cc(c1cccnc1)nc3ccccc23)CC4	ZINC000000018409	C4CN(c2cc(c1cccnc1)nc3ccccc23)CCN4
Fc1ccccc1Nc3nc(c2ccc(Br)cc2)cs3	ZINC000000077808	N(c1ccccc1)c3nc(c2ccccc2)cs3
OC(=O)c2cccc(NC(=O)Nc1cc(Cl)c(Cl)cc1Cl)c2	ZINC000000641386	O=C(Nc1ccccc1)Nc2ccccc2
O[C@H]4[C@H](Oc3cc(O)c2c(=O)cc(c1ccccc1)oc2c3)O[C@H](C(O)=O)[C@@H](O)[C@@H]4O	ZINC000031161007	O=c3cc(c1ccccc1)oc4cc(OC2CCCCO2)ccc34
C[N@@](C[C@@H](O)COc2ccc1OCOc1c2)C3CCCCC3	ZINC000000307778	C3CCC(NCCCOc2ccc1OCOc1c2)CC3
CN(C)S(=O)(=O)c4ccc(C(=O)C2=C(O)C(=O)N(c1cccc(C)n1)[C@H]2c3ccc(F)cc3)cc4	ZINC000001481437	O=C3C=C(C(=O)c1ccccc1)C(c2ccccc2)N3c4ccccn4
C[C@H]2[C@@H](OC(C)=O)CC[N@](Cc1ccco1)[C@H]2C	ZINC000000111486	C2CCN(Cc1ccco1)CC2
Cc2cn([C@@H]1C[C@@H](N=N#N)[C@H](COP(O)(O)=O)O1)c(=O)[nH]c2=O	ZINC000003870864	O=c2ccn(C1CCCO1)c(=O)[nH]2
O[C@H]4[C@H](Oc3ccc(c2coc1cc(O)ccc1c2=O)cc3)O[C@H](C(O)=O)[C@@H](O)[C@@H]4O	ZINC000036375370	O=c3c(c2ccc(OC1CCCCO1)cc2)coc4ccccc34
Clc1cc(N(=O)=O)ccc1Oc3ccc(C2=NCCN2)cc3	ZINC000000349349	C3CN=C(c2ccc(Oc1ccccc1)cc2)N3
OC(=O)C2=Cc1cc(Cl)ccc1OC2	ZINC000000074589	C2Oc1ccccc1C=C2
O[C@H]4C[C@H](C(O)=O)N(C(=O)OCC2c1ccccc1c3ccccc23)C4	ZINC000000622029	O=C(OCC2c1ccccc1c3ccccc23)N4CCCC4
Clc3cc(NS(=O)(=O)c1ccccc1)c2ccccc2c3OC(=O)c4ccccc4	ZINC000000822146	O=C(Oc2ccc(NS(=O)(=O)c1ccccc1)c3ccccc23)c4ccccc4
CCOc1ccccc1\C=N\c3sc2CCCCc2c3C(N)=O	ZINC000000066912	C3CCc2sc(N=Cc1ccccc1)cc2C3
Cc2cc(C(O)=O)cc(S(=O)(=O)N1CCOCC1)c2C	ZINC000000078355	O=S(=O)(N1CCOCC1)c2ccccc2
CN2CCc1cccc4c1[C@H]2Cc3cccc(O)c34	ZINC000000002530	C2Cc3cccc4c1ccccc1CC(N2)c34
NS(=O)(=O)c2ccc(CNC(=O)Cc1ccccc1N(=O)=O)cc2	ZINC000000288082	O=C(Cc1ccccc1)NCc2ccccc2
Cc1cc(Cl)ccc1NC(=O)[C@H]2CCCN2C(=O)c3cccs3	ZINC000000241192	O=C(Nc1ccccc1)C2CCCN2C(=O)c3cccs3
CSc3nc(Nc1ccccc1)c2cccnc2n3	ZINC000000005044	N(c1ccccc1)c2ncnc3ncccc23
O=C(Oc3c(c1ccccc1)oc2ccccc2c3=O)c4cccs4	ZINC000000150946	O=C(Oc3c(c1ccccc1)oc2ccccc2c3=O)c4cccs4
CCOC(=O)C(=NNc1nn[nH]n1)C#N	ZINC000009434459	c1nn[nH]n1
CC2(C)CC(=O)C(=CNc1ncc(C(F)(F)F)cc1Cl)C(=O)C2	ZINC000000083798	O=C1CCCC(=O)C1=CNc2ccccn2
O=c2[nH]c(=O)c(=C/c1cccs1)\[nH]2	ZINC000000072154	O=c2[nH]c(=O)c(=Cc1cccs1)[nH]2
CCOc3ccc2nc(SCC(=O)N1CCOCC1)sc2c3	ZINC000000036119	O=C(CSc2nc1ccccc1s2)N3CCOCC3
O=N(=O)c3ccc(Cn1c(=O)sc2ccccc12)cc3	ZINC000000041163	O=c2sc1ccccc1n2Cc3ccccc3
COc3ccc([C@@H]2Sc1cc(Cl)ccc1N(CCN(C)C)C(=O)[C@@H]2OC(C)=O)cc3	ZINC000000607779	O=C3CC(c1ccccc1)Sc2ccccc2N3
O=C(NCc2ccc1OCOc1c2)C3CCCCC3	ZINC000000049179	O=C(NCc2ccc1OCOc1c2)C3CCCCC3
OC(=O)c4cc(c2ccc1ccccc1n2)nc5ccc3ccccc3c45	ZINC000000494051	c5ccc4nc(c3ccc2c(ccc1ccccc12)n3)ccc4c5
CN(C)CCn3nc(Cc1ccccc1)c2ccccc2c3=O	ZINC000000002122	O=c2[nH]nc(Cc1ccccc1)c3ccccc23
Cc2[nH]n(c1ccc(C(O)=O)cc1)c(=O)c2CCO	ZINC000003883698	O=c1cc[nH]n1c2ccccc2
CN1CCN=C1c5ccc(NC(=O)c4ccc(C(=O)Nc3ccc(C2=NCCN2C)cc3)cc4)cc5	ZINC000001694045	O=C(Nc2ccc(C1=NCCN1)cc2)c5ccc(C(=O)Nc4ccc(C3=NCCN3)cc4)cc5
COc2ccc1ccccc1c2CCNC(C)=O	ZINC000000018247	c2ccc1ccccc1c2
Fc5ccc(S(=O)(=O)Nc2nc1ccccc1nc2N4CCN(S(=O)(=O)c3ccc(F)c(F)c3F)CC4)cc5	ZINC000003430610	O=S(=O)(Nc2nc1ccccc1nc2N4CCN(S(=O)(=O)c3ccccc3)CC4)c5ccccc5
Clc2ccc1nc(=O)[nH]n(=O)c1c2	ZINC000000018724	O=c2nc1ccccc1n(=O)[nH]2
CC3(C)C[C@]([C@@H](CO)CNCc1ccccc1)(c2ccccc2)CCO3	ZINC000000755051	C(CC2(c1ccccc1)CCOCC2)NCc3ccccc3
Cc2ccc(c1nc(N(=O)=O)n[nH]1)cc2	ZINC000000033097	c2ccc(c1ncn[nH]1)cc2
OC(=O)C[C@@H](F)C(=O)C(O)=O	ZINC000013542350	nonring
Clc3cc(Cl)c2c(Cl)c(C(=O)N1CCCCC1)sc2c3	ZINC000000312623	O=C(N1CCCCC1)c3cc2ccccc2s3
COC(=O)c1cc(Cl)ccc1OCC(=O)Nc2ccc(OC)cc2	ZINC000000480549	O=C(COc1ccccc1)Nc2ccccc2
COc2ccc(NC(=O)C1C[C@@H](C(C)(C)C)C[C@H](C(C)(C)C)C1)cc2	ZINC000000058655	O=C(Nc1ccccc1)C2CCCCC2
CCOC(=O)c2[nH]c(C)c(CNc1cc(OC)ccc1OC)c2C	ZINC000000033658	C(Nc1ccccc1)c2cc[nH]c2
Clc3ccc(S[C@@H]2CC(=O)N(Cc1cccnc1)C2=O)cc3	ZINC000000068833	O=C2CC(Sc1ccccc1)C(=O)N2Cc3cccnc3
Clc1cccc(Cl)c1/C=C/C(=O)Nc3nc2ccccc2s3	ZINC000000147113	O=C(Nc2nc1ccccc1s2)C=Cc3ccccc3
CN(C)CCN(Cc1ccc(Cl)s1)c2ccccn2	ZINC000000001128	C(Nc1ccccn1)c2cccs2
Cn3c(SCC(=O)NC(C(O)=O)(c1ccccc1)c2ccccc2)nc4n(C)c(=O)n(C)c(=O)c34	ZINC000002421025	O=C(CSc2nc1[nH]c(=O)[nH]c(=O)c1[nH]2)NC(c3ccccc3)c4ccccc4
Oc1ccc(Cl)c2CCCc12	ZINC000000001122	C2Cc1ccccc1C2
Clc3c(C(=O)Nc2ccc1OCOCc1c2)sc4ccccc34	ZINC000000067775	O=C(Nc2ccc1OCOCc1c2)c4cc3ccccc3s4
COc3ccc(C(=O)Oc2ccc1oc(=O)sc1c2)cc3OC	ZINC000000067773	O=C(Oc2ccc1oc(=O)sc1c2)c3ccccc3
CCOC(=O)c1c(C)oc2ccc(O)c(CN(C)C)c12	ZINC000000083554	c2ccc1occc1c2
CCOC(=O)CNc2c(c1ccc(O)cc1)nc3ccc(Cl)cn23	ZINC000000416312	c3ccc(c2cn1ccccc1n2)cc3
COc1ccccc1n2c(N)c(C(N)=O)sc2=S	ZINC000000089966	S=c1sccn1c2ccccc2
O=C(Nc3ccc(c2nc1ccccc1[nH]2)cc3)c4ccc(C#N)cc4	ZINC000000190211	O=C(Nc3ccc(c2nc1ccccc1[nH]2)cc3)c4ccccc4
COc2ccc(c1nc(N)nc(N)n1)cc2OC	ZINC000000011431	c2ccc(c1ncncn1)cc2
Cc1cc(Br)ccc1NC(=S)N2CCCCCC2	ZINC000000072983	S=C(Nc1ccccc1)N2CCCCCC2
C/N=C/c1cc(O)ccc1O	ZINC000000018331	c1ccccc1
O=C(Nc2cccc(NC(=O)c1ccccn1)c2)c3ccccn3	ZINC000000022436	O=C(Nc2cccc(NC(=O)c1ccccn1)c2)c3ccccn3
Cn2c(=O)c1c[nH][nH]c(=S)nc1c3ccccc23	ZINC000000032155	O=c2[nH]c1ccccc1c3nc(=S)[nH][nH]cc23
Oc5ccc([C@@H]4Oc1ccccc1[C@H]3CC(c2cccs2)=NN34)cc5	ZINC000000099144	C1C4N(N=C1c2cccs2)C(c3ccccc3)Oc5ccccc45
CCOC(=O)N[C@@H](CC(O)=O)C(O)=O	ZINC000001694468	nonring
COc1ccccc1n3c(=O)[nH]c(=O)c(=Cc2ccc(F)cc2)c3=O	ZINC000000296422	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)n2c3ccccc3
OC(=O)Cn2c(=O)c(=O)[nH]c3cc(N(=O)=O)c(n1ccc(C(O)=O)c1)cc23	ZINC000013445026	O=c3[nH]c2ccc(n1cccc1)cc2[nH]c3=O
Cc3cc2nc1c(=O)[nH]c(=O)nc1n(CC(O)=O)c2cc3C	ZINC000003650711	O=c3nc2[nH]c1ccccc1nc2c(=O)[nH]3
COc2ccc(c1nc(N)nc(N)n1)cc2	ZINC000000004396	c2ccc(c1ncncn1)cc2
CCOC(=O)Cc3c(C)nc2c(c1ccccc1)c(C)nn2c3C	ZINC000000054165	c3ccc(c1cnn2cccnc12)cc3
CCOC(=O)c1sc(NC(=O)C(F)(F)F)c(C(=O)OC)c1C	ZINC000000038693	c1ccsc1
CCCc3nn2c(=N)c(=C/c1ccccc1C)/c(=O)nc2s3	ZINC000000054169	N=c2c(=Cc1ccccc1)c(=O)nc3scnn23
Cc2ccc(S(=O)(=O)Nc1cccc(C(O)=O)c1)cc2	ZINC000000058794	O=S(=O)(Nc1ccccc1)c2ccccc2
O=C3CN(C(=O)c1cccnc1)c2ccccc2N3	ZINC000000063255	O=C3CN(C(=O)c1cccnc1)c2ccccc2N3
C[C@@H](C[N@@](C)Cc1ccccc1)OC(=O)c2ccc(Br)cc2	ZINC000000641652	O=C(OCCNCc1ccccc1)c2ccccc2
COc3cc(Nc2nc(c1ccccc1)cs2)c(OC)cc3Cl	ZINC000000432118	N(c1ccccc1)c3nc(c2ccccc2)cs3
Clc4ccc(Oc2nc(c1ccccn1)nc3ccccc23)cc4	ZINC000000522184	O(c1ccccc1)c3nc(c2ccccn2)nc4ccccc34
COc4ccc(CNC(=O)C2c1ccccc1Oc3ccccc23)cc4	ZINC000000030230	O=C(NCc1ccccc1)C3c2ccccc2Oc4ccccc34
OC(=O)CNS(=O)(=O)c1ccc3c(c1)c(=O)c2cc(S(=O)(=O)NCC(O)=O)ccc23	ZINC000001814192	O=c2c1ccccc1c3ccccc23
Cc1ccc(N(=O)=O)cc1N(CC(=O)Nc3ccc(S(=O)(=O)Nc2ncccn2)cc3)S(C)(=O)=O	ZINC000060028319	O=C(CNc1ccccc1)Nc3ccc(S(=O)(=O)Nc2ncccn2)cc3
OC(=O)c1ccccc1c3ccc(C=c2c(=O)[nH]c(=S)[nH]c2=O)o3	ZINC000000270415	O=c1[nH]c(=S)[nH]c(=O)c1=Cc3ccc(c2ccccc2)o3
COc3ccc(NS(=O)(=O)c2ccc(S(=O)(=O)c1ncc(C(F)(F)F)cc1Cl)s2)cc3	ZINC000001038598	O=S(=O)(Nc1ccccc1)c3ccc(S(=O)(=O)c2ccccn2)s3
Cc3cc1c(=O)[nH]c(=O)c1c(Sc2ccc(Cl)cc2)n3	ZINC000000075834	O=c2[nH]c(=O)c3c(Sc1ccccc1)nccc23
Cc3ccnc(NC(=O)C(c1ccccc1)c2ccccc2)c3	ZINC000000036599	O=C(Nc1ccccn1)C(c2ccccc2)c3ccccc3
Cc1ccc(P(O)(O)=O)c(Br)c1	ZINC000001870272	c1ccccc1
CCOC(=O)Cn1nc(C(F)(F)F)c(Br)c1C	ZINC000000027595	c1cn[nH]c1
Cc2ccc(N[C@@H](NC(=O)c1ccco1)C(Cl)(Cl)Cl)cc2	ZINC000000046665	O=C(NCNc1ccccc1)c2ccco2
Cc3ccc(NC(=O)c1ccccc1N)c(C(=O)c2ccccc2)c3	ZINC000000045085	O=C(Nc1ccccc1C(=O)c2ccccc2)c3ccccc3
Clc1ccc(N(=O)=O)cc1C(=O)Nc3sc2CCCc2c3C#N	ZINC000000036204	O=C(Nc2cc1CCCc1s2)c3ccccc3
NC(=O)OC[C@@H](O)c1ccccc1	ZINC000000000725	c1ccccc1
C[C@@H](Oc1ccccc1Br)C(=O)N2CCc3ccccc23	ZINC000000036206	O=C(COc1ccccc1)N2CCc3ccccc23
Cc1nccc2c(=O)c(C)c(N)c(=O)c12	ZINC000000005656	O=c1ccc(=O)c2cnccc12
COc2ccc(NC(=S)N1CCN(C)CC1)cc2	ZINC000000037376	S=C(Nc1ccccc1)N2CCNCC2
Cc4ccc(n2n3c1cc(C)c(S(O)(=O)=O)cc1n23)cc4S(O)(=O)=O	ZINC000004265592	c4ccc(n2n3c1ccccc1n23)cc4
CCOc1ccccc1C(N)=O	ZINC000000001384	c1ccccc1
NC(=O)OC1(C#C)CCCCC1	ZINC000000001385	C1CCCCC1
COc1ccc(N(=O)=O)cc1NC(=O)c3cc2ccccc2oc3=O	ZINC000000145358	O=C(Nc1ccccc1)c3cc2ccccc2oc3=O
COc4ccc3nc2n(SCc1c(C)c(OC)c(C)c[n+]12)c3c4	ZINC000000000728	C3Sn1c(nc2ccccc12)[n+]4ccccc34
COc1ccc(C)cc1NC(=O)C(c2ccccc2)c3ccccc3	ZINC000000058502	O=C(Nc1ccccc1)C(c2ccccc2)c3ccccc3
C[C@H](NC(=O)[C@@H]2CN(c1ccc(C)cc1)C(=O)C2)c3ccccc3	ZINC000000050536	O=C2CC(C(=O)NCc1ccccc1)CN2c3ccccc3
COC(=O)c1ccc(Cl)cc1OC(=O)c2ccccc2	ZINC000000037086	O=C(Oc1ccccc1)c2ccccc2
COc4ccc(n3c2NC(=O)[C@](NC(=O)c1ccccc1OC)(C(F)(F)F)c2c(=O)[nH]c3=O)cc4	ZINC000003624309	O=C1Nc3c(C1NC(=O)c2ccccc2)c(=O)[nH]c(=O)n3c4ccccc4
c5coc(c3nc(c1ccco1)c(c2ccco2)nc3c4ccco4)c5	ZINC000000407393	c5coc(c3nc(c1ccco1)c(c2ccco2)nc3c4ccco4)c5
NC(=N)c3ccc(N2CCC(C1CCN(CC(O)=O)CC1)CC2)cc3	ZINC000000015847	C3CC(C2CCN(c1ccccc1)CC2)CCN3
Clc2ccc(CC(=O)Nc1ccccn1)cc2	ZINC000000030754	O=C(Cc1ccccc1)Nc2ccccn2
CCOc3cc([C@@H]1NCCc2cc(OCC)c(OCC)cc12)ccc3O	ZINC000000718277	C3Cc1ccccc1C(c2ccccc2)N3
CC(=O)NS(=O)(=O)c2ccc(NC(=O)COc1cc(Cl)c(Cl)cc1Cl)cc2	ZINC000000678805	O=C(COc1ccccc1)Nc2ccccc2
CCN(CC)CCCn1c(N)c(C#N)c2nc(C#N)c(C#N)nc12	ZINC000000138298	c2cnc1[nH]ccc1n2
CNC(=S)Nc2ccc(Oc1ccc(NC(=S)NC)cc1)cc2	ZINC000000099279	O(c1ccccc1)c2ccccc2
CC(=C)Cn3c(COc1cccc2ccccc12)nc4ccccc34	ZINC000000468601	C(Oc1cccc2ccccc12)c4nc3ccccc3[nH]4
C[C@@H]2C[C@H](OC(=O)c1ccccc1)CC(C)(C)N2	ZINC000000001410	O=C(OC1CCNCC1)c2ccccc2
COc1cc(CC=C)ccc1O	ZINC000000001411	c1ccccc1
COc2ccc(CS(=O)(=O)/C=C/c1ccc(F)cc1)cc2	ZINC000000026245	O=S(=O)(Cc1ccccc1)C=Cc2ccccc2
Oc1c(Br)cc(Br)cc1\C=N\n2cnnc2	ZINC000000028590	C(=Nn1cnnc1)c2ccccc2
CCC[N@]1CCc2c(C1)sc4c2c(NCCN(C)C)nc3nnnn34	ZINC000002328666	C1Cc2c(CN1)sc4c2cnc3nnnn34
C(Nc2ccc1ncccc1c2)n3nnc4ccccc34	ZINC000000042321	C(Nc2ccc1ncccc1c2)n3nnc4ccccc34
CC(C)(C)NC[C@@H](O)COc1ccccc1c2ccc(NN)nn2	ZINC000000000658	c2ccc(c1cccnn1)cc2
O=C(NN1CCC=CC1)Nc2ccncc2	ZINC000000004551	O=C(NN1CCC=CC1)Nc2ccncc2
COc3ccc(Nc1ncnc2[nH]cnc12)cc3	ZINC000000032156	N(c1ccccc1)c2ncnc3[nH]cnc23
CC(C)[N+](C)(C)C[C@@H](O)COc1cccc2ccccc12	ZINC000000000653	c2ccc1ccccc1c2
CC(=O)Nc1c(=O)[nH]c2cssc12	ZINC000000001259	O=c2cc1sscc1[nH]2
COc3ccc(N2CCN(C[C@@H](O)COc1ccc(N(=O)=O)cc1)CC2)cc3	ZINC000000719709	C(COc1ccccc1)CN3CCN(c2ccccc2)CC3
Clc2ccc(OCC(=O)NC[C@@H]1CCCO1)c(Cl)c2	ZINC000000037574	O=C(COc1ccccc1)NCC2CCCO2
Fc1ccccc1N3CCN(C(=O)c2ccco2)CC3	ZINC000000037576	O=C(N2CCN(c1ccccc1)CC2)c3ccco3
CCOc1ccc(NC(=O)C[C@@H](C)O)cc1	ZINC000000000099	c1ccccc1
OC(=O)CC(=O)CC(O)=O	ZINC000000388410	nonring
Oc1cc(Cl)c(O)c2c(=O)c(O)c(O)c(=O)c12	ZINC000005816893	O=c1ccc(=O)c2ccccc12
Cc3cccc(OCC(=O)Nc2ccc1OCOc1c2)c3C	ZINC000000037579	O=C(COc1ccccc1)Nc3ccc2OCOc2c3
COc1ccc(C(=O)C(/Br)=C/C(O)=O)cc1	ZINC000000000093	c1ccccc1
CS(=O)(=O)N1CCCc2ccccc12	ZINC000000029620	C2CNc1ccccc1C2
COC(=O)c2cc(c1cccs1)nc3ccc(Br)cc23	ZINC000000211073	c3ccc2nc(c1cccs1)ccc2c3
Brc2c(N1CCCC1)cn[nH]c2=O	ZINC000000113843	O=c2cc(N1CCCC1)cn[nH]2
COC(=O)C=C1NS(=O)(=O)C(C(=O)OC)=C1O	ZINC000584659279	C=C1NS(=O)(=O)C=C1
CC[C@H]([C@@H](O)C(O)=O)C(O)=O	ZINC000000901206	nonring
Cc4ccc(C3=Nc1ccccc1N[C@](C)(c2ccc(C)o2)C3)o4	ZINC000000550461	C3C(c1ccco1)Nc2ccccc2N=C3c4ccco4
Cc3ccc2nc(Sc1ccccc1)c(C#N)c(=O)n2c3	ZINC000000037881	O=c2cc(Sc1ccccc1)nc3ccccn23
C/C(CCc2oc1ccccc1c2c3ccc(C)o3)=N\NC(N)=S	ZINC000000089029	c3ccc2c(c1ccco1)coc2c3
CNc2oc(c1ccc(Cl)cc1)nc2C#N	ZINC000000037883	c2ccc(c1ncco1)cc2
O=C(Nc1cccnc1)Nc2cccc(N(=O)=O)c2	ZINC000000040583	O=C(Nc1ccccc1)Nc2cccnc2
COc1ccccc1Oc3ccc(S(=O)(=O)N2CCCC2)cc3	ZINC000000074875	O=S(=O)(N1CCCC1)c3ccc(Oc2ccccc2)cc3
C[C@H](C(O)=O)c3ccc2oc(c1ccc(Cl)cc1)nc2c3	ZINC000000000070	c3ccc(c2nc1ccccc1o2)cc3
Nc2c(C(=O)NC1CCCCC1)sc(=S)n2Cc3ccccc3	ZINC000000211077	O=C(NC1CCCCC1)c3cn(Cc2ccccc2)c(=S)s3
CCOC(=O)CC(=O)Nc2nc1ccc(Br)cc1s2	ZINC000000040589	c2ccc1scnc1c2
O[C@H](C(=O)OCc1ccccc1)c2ccccc2	ZINC000000000078	O=C(Cc1ccccc1)OCc2ccccc2
COc4cc(\C=c3/s\c(=N/c2ccc(N1CCOCC1)cc2)n(C)c3=O)ccc4O[C@H](C)C(O)=O	ZINC000002089378	O=c3[nH]c(=Nc2ccc(N1CCOCC1)cc2)sc3=Cc4ccccc4
Cc4ccc(C)c(c3csc(Nc1cccc2ccccc12)n3)c4	ZINC000000207089	N(c2nc(c1ccccc1)cs2)c3cccc4ccccc34
CCN(CC)c2ccc(NS(=O)(=O)c1ccc(N(=O)=O)cc1)cc2	ZINC000000137061	O=S(=O)(Nc1ccccc1)c2ccccc2
O=c3nc(N2CCN(c1ccccc1)CC2)s/c3=C/c4ccccc4	ZINC000000133254	O=c3nc(N2CCN(c1ccccc1)CC2)sc3=Cc4ccccc4
Cc2cc(C)cc(OC[C@H]1CNC(=O)O1)c2	ZINC000000000471	O=C2NCC(COc1ccccc1)O2
OC(=O)Cn1c(=S)[nH]c2ccccc12	ZINC000000045460	S=c2[nH]c1ccccc1[nH]2
CC(C)Cc2ccc([C@H](C)C(=O)OCc1ccccn1)cc2	ZINC000000000380	O=C(Cc1ccccc1)OCc2ccccn2
CC(C)CNC(=O)c1ccc(F)cc1	ZINC000000029756	c1ccccc1
Fc1ccc(C(=O)N(CC#N)CC#N)cc1	ZINC000000029755	c1ccccc1
OC3(c1ccc(Br)cc1)CCN([C@@H]2CCSC2)CC3	ZINC000000219997	C3CC(N2CCC(c1ccccc1)CC2)CS3
Nc2ccc(N1CCOCC1)c(Br)c2	ZINC000000037791	C2CN(c1ccccc1)CCO2
Cc2c(c1ccccc1)c(=O)oc3c(Br)cc(Cl)cc23	ZINC000000057984	O=c2oc1ccccc1cc2c3ccccc3
O=c2[nH]n(c1ccccn1)c(=O)c3ccccc23	ZINC000000081236	O=c2[nH]n(c1ccccn1)c(=O)c3ccccc23
Cc2c(c1ccc(Cl)cc1)c(=O)oc3ccc(Br)cc23	ZINC000000057982	O=c2oc1ccccc1cc2c3ccccc3
CCCN(Cc1ccccc1)C(=O)Nc3ccc2snnc2c3	ZINC000000094971	O=C(NCc1ccccc1)Nc3ccc2snnc2c3
CCOC(=O)[C@@H]2[C@@H](c1ccco1)[C@H](C(=O)OCC)[C@](C)(O)CC2=O	ZINC000000044117	O=C2CCCC(c1ccco1)C2
C[C@@H](Sc1ccccc1Cl)C(=O)NCC2CC2	ZINC000000007159	O=C(CSc1ccccc1)NCC2CC2
CN(C)CCSc2nc1ccccc1c(=O)n2c3ccccc3	ZINC000000028373	O=c2n(c1ccccc1)cnc3ccccc23
Cc2cc(C)c(S(=O)(=O)Nc1nnc(C)s1)c(C)c2	ZINC000000052356	O=S(=O)(Nc1nncs1)c2ccccc2
COC(=O)c3c(NC(=O)C1CC1)sc2CCCCc23	ZINC000000038513	O=C(Nc2cc1CCCCc1s2)C3CC3
Cc2[nH]c1ccccc1c2Sc3ccccc3	ZINC000000028375	S(c1ccccc1)c2c[nH]c3ccccc23
Cc1[nH]c(=O)[nH]c(=O)c1S(=O)(=O)NC[C@@H]2CCCO2	ZINC000000062617	O=c2[nH]cc(S(=O)(=O)NCC1CCCO1)c(=O)[nH]2
CCOC(=O)Cn1cc(N(=O)=O)cn1	ZINC000000028379	c1cn[nH]c1
OC(=O)CC[C@@H](NC(=O)c4cccc(N3C(=O)[C@@H]2Cc1ccccc1CN2C3=O)c4)C(O)=O	ZINC000013576870	O=C3C2Cc1ccccc1CN2C(=O)N3c4ccccc4
CC1(C)C[C@@]2(CCO1)OC(=O)C[C@@H]2C(O)=O	ZINC000000306561	O=C2CCC1(CCOCC1)O2
OC(=O)c\2nn(c1ccccc1)c(=O)c/2=C/c3c[nH]c4ccccc34	ZINC000000196509	O=c2n(c1ccccc1)ncc2=Cc3c[nH]c4ccccc34
CNc3cc(OC)c(C(=O)N[C@@H]2CC[N@@](Cc1ccccc1)[C@@H]2C)cc3Cl	ZINC000000538069	O=C(NC2CCN(Cc1ccccc1)C2)c3ccccc3
C4CCN(CCn2c(N1CCOCC1)nc3ccccc23)CC4	ZINC000000339595	C4CCN(CCn2c(N1CCOCC1)nc3ccccc23)CC4
CCc5cc3c(=O)c(Oc2cnn(c1ccccc1)c2)coc3c(CN4CCOCC4)c5O	ZINC000000632987	O=c4c(Oc2cnn(c1ccccc1)c2)coc5c(CN3CCOCC3)cccc45
Cn3c(O)c(C(c1ccccn1)c2c(O)n(C)c(=S)n(C)c2=O)c(=O)n(C)c3=S	ZINC000008450559	O=c1[nH]c(=S)[nH]cc1C(c2ccccn2)c3c[nH]c(=S)[nH]c3=O
Cc4ccc(c3nnn(CC(=O)N[C@@H]1CCCc2ccccc12)n3)cc4	ZINC000000378672	O=C(Cn2nnc(c1ccccc1)n2)NC3CCCc4ccccc34
CCOc3ccc(\C=c2/c(=O)[nH]c(=S)n(c1cccc(C)c1C)c2=O)cc3	ZINC000000664577	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc3ccccc3
CCNc2ncnc3sc1CCCCc1c23	ZINC000000040747	C1CCc2c(C1)sc3ncncc23
CC(C)(C)c3ccc(C(=O)N2CCN(c1ccccn1)CC2)cc3	ZINC000000093939	O=C(N2CCN(c1ccccn1)CC2)c3ccccc3
COC(=O)c1sccc1NC(=O)Nc2cc(C)oc2C(F)(F)F	ZINC000000148068	O=C(Nc1ccoc1)Nc2ccsc2
CC(=O)N[C@@H]1[C@H](O)[C@H](O)[C@@H](CO)O[C@H]1Oc3ccc2ccccc2c3	ZINC000000173198	C3CCC(Oc2ccc1ccccc1c2)OC3
COc1ccccc1O[C@]3(C)OC(=O)c2ccccc2O3	ZINC000000003877	O=C2OC(Oc1ccccc1)Oc3ccccc23
C[C@@H]4C[C@@H](N(C(=O)c1cccs1)c2ccccc2)c3ccccc3N4	ZINC000000081305	O=C(N(C1CCNc2ccccc12)c3ccccc3)c4cccs4
C[C@@H](NC(=O)n2c1ccccc1sc3ccccc23)c4ccccc4	ZINC000000091223	O=C(NCc1ccccc1)n3c2ccccc2sc4ccccc34
Cc2cc(C)c(OCC(=O)Nc1ccc(Br)cc1)c(C)c2	ZINC000000059672	O=C(COc1ccccc1)Nc2ccccc2
CN(C)CCC[C@]3(O)c1ccccc1CSc2sccc23	ZINC000000347400	C2Sc1sccc1Cc3ccccc23
CC(C)NC(=O)[C@@H](Cc1ccccc1)n3c(=O)c2ccccc2c3=O	ZINC000000047234	O=c2n(CCc1ccccc1)c(=O)c3ccccc23
CC1(C)Cc3c(CO1)sc4[nH]c(=O)n(c2ccccc2)c(=O)c34	ZINC000000048915	O=c3[nH]c2sc1COCCc1c2c(=O)n3c4ccccc4
C[N@]1CC=C3[C@@H](C1)C(c2cc(C)ccc2C)=C(C#N)C(N)=C3C#N	ZINC000000043582	C1NCC2C(=C1)C=CC=C2c3ccccc3
C[N@@]2CC(CNC(=O)OCc1ccccc1)CC3C2Cc4cn(C)c5cccc3c45	ZINC000000537987	O=C(NCC2CNC1Cc3c[nH]c4cccc(C1C2)c34)OCc5ccccc5
Oc1c(Br)cc(Br)cc1C(=O)Nc2ccccc2	ZINC000000537985	O=C(Nc1ccccc1)c2ccccc2
OC(=O)Cn3c(C(=O)Nc2nc(c1ccccc1Cl)cs2)cc4ccccc34	ZINC000000537914	O=C(Nc2nc(c1ccccc1)cs2)c4cc3ccccc3[nH]4
CCn3c(C)cc(\C=c2/c(=O)[nH]c(=S)n(c1ccc(C)c(Cl)c1)c2=O)c3C	ZINC000000686753	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc3cc[nH]c3
CCCc3c2C(=O)C[C@H](c1ccccc1)Cc2nn3c4ccccc4F	ZINC000000111205	O=C3CC(c1ccccc1)Cc4nn(c2ccccc2)cc34
COC(=O)c2c1CCCCc1sc2n4c(=O)c3ccccc3c4=O	ZINC000000116531	O=c3n(c2cc1CCCCc1s2)c(=O)c4ccccc34
Cc1cc(C(F)(F)F)c(C#N)c(SCC(O)=O)n1	ZINC000000039037	c1ccncc1
Cc2ccc(NC(=O)c1cccs1)cc2C	ZINC000000029349	O=C(Nc1ccccc1)c2cccs2
CCOc1ccccc1OCC(=O)Nc3nc2ccc(C)cc2s3	ZINC000000145238	O=C(COc1ccccc1)Nc3nc2ccccc2s3
COc2ccc(N(C)C(=O)CC1(CC(O)=O)CCCCC1)cc2	ZINC000000217002	O=C(CC1CCCCC1)Nc2ccccc2
CC[N@@](CCO)Cc1csc2ccc(Br)cc12	ZINC000000338779	c2ccc1sccc1c2
OC(=O)[C@@H]1C=C[C@@H](C(O)=O)c2ccccc12	ZINC000001564620	C1C=CCc2ccccc12
C[C@@H](Sc1ccc(C)cc1)C(=O)Nc2ccc(Cl)c(Cl)c2	ZINC000000610484	O=C(CSc1ccccc1)Nc2ccccc2
Nc3nc(N)c2ncn(C[C@H]1O[C@@H](P(O)(O)=O)C[C@@H]1O)c2n3	ZINC000003943274	C3COC(Cn1cnc2cncnc12)C3
Nc2cccc3c(=O)[nH]c1sccc1c23	ZINC000000009264	O=c2[nH]c1sccc1c3ccccc23
OC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CCCCC(=O)N[C@@H](Cc2ccc(O)cc2)C(O)=O	ZINC000016401373	O=C(CCCCC(=O)NCCc1ccccc1)NCCc2ccccc2
CC(=O)OC[C@H](NC(=O)OC(C)(C)C)C(O)=O	ZINC000002517130	nonring
C[C@@]1(C(O)=O)CCCC=C1C(O)=O	ZINC000002048576	C1CCC=CC1
COc3ccc(C[N@]2CCC[C@@H](CCC(=O)N(C)C1CCN(C)CC1)C2)cc3O	ZINC000011999648	O=C(CCC2CCCN(Cc1ccccc1)C2)NC3CCNCC3
Oc3ccc(NC1=NS(=O)(=O)c2ccccc12)cc3	ZINC000000051868	O=S3(=O)N=C(Nc1ccccc1)c2ccccc23
Cc3n/c(=C/c1c(O)ccc2ccccc12)c(=O)o3	ZINC000000050844	O=c1ocnc1=Cc2cccc3ccccc23
CCOc2ccc(\C=N\OC(=O)\C=C\c1ccccc1)cc2	ZINC000000044339	O=C(ON=Cc1ccccc1)C=Cc2ccccc2
Cn3c(NCCc1ccccc1)nc(c2ccncc2)cc3=O	ZINC000000009114	O=c3cc(c1ccncc1)nc(NCCc2ccccc2)[nH]3
CCN(Cc1ccccc1)C(=O)c2cc(OC)c(OC)c(OC)c2	ZINC000000030222	O=C(NCc1ccccc1)c2ccccc2
Fc3ccc(C(=O)C[C@H](C#N)c2ccc1OCOc1c2)cc3	ZINC000000042985	O=C(CCc2ccc1OCOc1c2)c3ccccc3
CN(C)C(=O)Cn1c(=O)oc2ccccc12	ZINC000000034233	O=c2[nH]c1ccccc1o2
CC2(C)CC(=O)N=C(Nc1ccc(Br)cc1)C(=O)C2	ZINC000000048822	O=C2CCCC(=O)C(Nc1ccccc1)=N2
COc1ccccc1C(=O)Nc2nc(C)c(C(C)=O)s2	ZINC000000035639	O=C(Nc1nccs1)c2ccccc2
CC[C@@H]1CCCCN1C(=O)c4cc3cc2ccc(C)cc2nc3s4	ZINC000000428309	O=C(N1CCCCC1)c4cc3cc2ccccc2nc3s4
CCCc3cc(c2nc(c1ccc(Cl)c(Cl)c1)cs2)ccn3	ZINC000000032915	c3ccc(c2csc(c1ccncc1)n2)cc3
COc2cccc3c1S[C@H](C)Cc1c(C)nc23	ZINC000000034238	C3Cc2cnc1ccccc1c2S3
Cc2ccc1nsnc1c2S(=O)(=O)NCc3cccnc3	ZINC000000032910	O=S(=O)(NCc1cccnc1)c2cccc3nsnc23
Cn1nccc1NC(=O)CSCC(O)=O	ZINC000000153158	c1cn[nH]c1
C[C@@H]2C[C@@H](C)CN(CC(=O)Nc1ccc(S(N)(=O)=O)cc1)C2	ZINC000000139303	O=C(CN1CCCCC1)Nc2ccccc2
CCN3CCN(C(=O)c2ccc(COc1ccc(Cl)cc1)o2)CC3	ZINC000000204840	O=C(N1CCNCC1)c3ccc(COc2ccccc2)o3
CC(=O)c3sc2nsc(SCCN1CCCCC1)c2c3N	ZINC000000160603	C3CCN(CCSc1snc2sccc12)CC3
CN(Cc2nc1ccccc1n2C)S(=O)(=O)c3ccc(Cl)cc3	ZINC000000527846	O=S(=O)(NCc2nc1ccccc1[nH]2)c3ccccc3
OC(=O)[C@H]1CS[C@H](CS)C1	ZINC000000016788	C1CCSC1
Cc2cc(N1CCCCC1)nn3cnnc23	ZINC000000002256	C3CCN(c2ccc1nncn1n2)CC3
COc2cc(C(=O)NN=C(C)c1ccc(N)cc1)cc(OC)c2OC	ZINC000000058540	O=C(NN=Cc1ccccc1)c2ccccc2
Clc3ccc(C(=O)N(Cc1ccccc1)Cc2cccnc2)cc3	ZINC000000076960	O=C(N(Cc1ccccc1)Cc2cccnc2)c3ccccc3
C[C@]1(C(O)=O)CCC[C@]3(C)[C@H]1CCc2ccc(O)cc23	ZINC000000031962	C1CCC2C(C1)CCc3ccccc23
CC(C)(C)c3ccc(c2nc(c1nonc1N)no2)cc3	ZINC000000032681	c3ccc(c2nc(c1cnon1)no2)cc3
Clc3cccc(N2CCN(c1cc(Cl)nnc1Cl)CC2)c3	ZINC000000076966	C2CN(c1ccnnc1)CCN2c3ccccc3
CCOc3ccc(Nc2nc(c1ccc(CC)cc1)c(CC(O)=O)s2)cc3	ZINC000000658167	N(c1ccccc1)c3nc(c2ccccc2)cs3
Fc3ccc(COC(=O)c1ccccc1NC(=O)c2ccccc2)cc3	ZINC000000564080	O=C(Nc1ccccc1C(=O)OCc2ccccc2)c3ccccc3
Cc3c(S(=O)(=O)c1ccc(Cl)cc1)cnc4cc(C2CC2)nn34	ZINC000000096244	O=S(=O)(c1ccccc1)c4cnc3cc(C2CC2)nn3c4
CN(C)c2ccc(NC(=O)c1ccc(N(C)C)cc1)cc2	ZINC000000031793	O=C(Nc1ccccc1)c2ccccc2
COc3ccc(Oc1ncccc1NC(=O)c2cccc(C)c2C)cc3	ZINC000000083892	O=C(Nc1cccnc1Oc2ccccc2)c3ccccc3
CN3CCN(C(=O)c2ccc(C#Cc1ccccc1)cc2)CC3	ZINC000000101265	O=C(N1CCNCC1)c3ccc(C#Cc2ccccc2)cc3
C[C@H]2C[C@H](C)CN(C(=O)c1ccccc1C)C2	ZINC000000029297	O=C(N1CCCCC1)c2ccccc2
COc2ccc(C1SCCS1)cc2N(=O)=O	ZINC000000031489	C2CSC(c1ccccc1)S2
C(c3ccc(Cc2nc1ccccc1o2)cc3)c5nc4ccccc4o5	ZINC000000481707	C(c3ccc(Cc2nc1ccccc1o2)cc3)c5nc4ccccc4o5
Fc1cccc(Cl)c1\C=N\NS(=O)(=O)c2ccc(Cl)cc2	ZINC000000369507	O=S(=O)(NN=Cc1ccccc1)c2ccccc2
O=C(Nc2ccc(Oc1ccccc1)cc2)\C=C\c3ccco3	ZINC000000045886	O=C(Nc2ccc(Oc1ccccc1)cc2)C=Cc3ccco3
C[C@@H](C(=O)c1ccccc1)n3ccc2cc(Cl)ccc2c3=O	ZINC000000038333	O=C(Cn2ccc1ccccc1c2=O)c3ccccc3
C[C@@H]1CC[C@H]2[C@]14CC[C@@]3(C)O[C@]2(C)[C@@H](NCCCC[N@@](C)CCCN(C)C)[C@H]3C4	ZINC000003806412	C2CC1C4CC3CC1(C2)CCC3O4
COc5ccc4c2C[N@@]1CCC[C@H]1Cc2c3cc(OC)c(OC)cc3c4c5OC	ZINC000000608124	C2CC1Cc4c(CN1C2)c3ccccc3c5ccccc45
Cc4cccc(\C=N\c3ccc2oc(c1ccc(F)cc1)nc2c3)c4O	ZINC000000318219	C(=Nc3ccc2oc(c1ccccc1)nc2c3)c4ccccc4
COc3ccc(C=c2sc(Nc1cccnc1)nc2=O)c(OC)c3	ZINC000000140553	O=c2nc(Nc1cccnc1)sc2=Cc3ccccc3
CCOc1ccccc1NC(=O)c2ccco2	ZINC000000029989	O=C(Nc1ccccc1)c2ccco2
Cc3cc(n1nc(C)cc1C)nc(NS(=O)(=O)c2ccccc2)n3	ZINC000000267498	O=S(=O)(Nc2nccc(n1cccn1)n2)c3ccccc3
Clc2ccc(Cl)c(NC(=O)c1ccco1)c2	ZINC000000029983	O=C(Nc1ccccc1)c2ccco2
CCOc3cc(\C=N\NC(=O)Cn1cnc2ccccc12)ccc3O	ZINC000000073065	O=C(Cn1cnc2ccccc12)NN=Cc3ccccc3
OC(=O)c6ccc(C(=O)c4c2c(=O)n(c1cccc(O)c1)c(=O)c2cc5c(=O)n(c3cccc(O)c3)c(=O)c45)cc6	ZINC000003142794	O=C(c1ccccc1)c5c3c(=O)n(c2ccccc2)c(=O)c3cc6c(=O)n(c4ccccc4)c(=O)c56
O=C(Nc3ccc2nc1CCCCCn1c(=O)c2c3)\C=C\c4ccco4	ZINC000000429895	O=C(Nc3ccc2nc1CCCCCn1c(=O)c2c3)C=Cc4ccco4
OC(=O)[C@@H]2[C@H]1CC[C@H](C1)[C@H]2C(O)=O	ZINC000005456421	C1CC2CCC1C2
C[C@@]3(c2cccc(OCc1ccc(Cl)cc1)c2)NC(=O)NC3=O	ZINC000000078294	O=C3NC(c2cccc(OCc1ccccc1)c2)C(=O)N3
FC(F)(F)c2cc(NC(=O)CSc1ccccn1)ccc2Cl	ZINC000000031461	O=C(CSc1ccccn1)Nc2ccccc2
Cc2ccc(NC(=O)CN1CCCCC1)cc2	ZINC000000031463	O=C(CN1CCCCC1)Nc2ccccc2
CN(C)c3ccc(\C=N\C[C@H](O)CSc2nc1CCCCc1cc2C#N)cc3	ZINC000000709709	C3CCc2nc(SCCCN=Cc1ccccc1)ccc2C3
Cc3cc2oc(=O)c1CCCCc1c2c(O)c3CN4CCCC4	ZINC000000044849	O=c4oc2ccc(CN1CCCC1)cc2c3CCCCc34
Cn2c(CN1CCCCC1)c(C#N)c3ccccc23	ZINC000000049567	C3CCN(Cc2cc1ccccc1[nH]2)CC3
CSc3ccc(NC(=O)N(Cc1ccccc1)c2ccccc2)cc3	ZINC000000399753	O=C(Nc1ccccc1)N(Cc2ccccc2)c3ccccc3
CNC(=O)c3ccc(C(=O)N(C1CCCCC1)C2CCCCC2)cc3	ZINC000000049565	O=C(N(C1CCCCC1)C2CCCCC2)c3ccccc3
O[C@@]4(c1ccccc1)CSC3=C(C#N)[C@@H](c2ccccc2)CC(=O)N34	ZINC000000544539	O=C3CC(c1ccccc1)C=C4SCC(c2ccccc2)N34
COc3ccc(NC(=O)Cc1cccc2ccccc12)c4ccccc34	ZINC000000231496	O=C(Cc1cccc2ccccc12)Nc3cccc4ccccc34
COc2cc(CN1CCCN(C(C)=O)CC1)ccc2OC[C@@H](O)C[N@@](C)C(C)C	ZINC000011839555	C2CNCCN(Cc1ccccc1)C2
COC(=O)Cc3cc2c(=O)c1cccc(O)c1c(=O)c2c(O)c3C(C)=O	ZINC000003850721	O=c2c1ccccc1c(=O)c3ccccc23
CC(C)c1cccc(C(C)C)c1NC(=O)CN2C(=O)COc3ccccc23	ZINC000000581124	O=C(CN1C(=O)COc2ccccc12)Nc3ccccc3
COc1ccccc1C3CCN(C(=O)c2cccc(N(=O)=O)c2)CC3	ZINC000000083307	O=C(N2CCC(c1ccccc1)CC2)c3ccccc3
Nc3ncc(Cc2ccc1OCOc1c2)c(N)n3	ZINC000000010465	C3Oc2ccc(Cc1cncnc1)cc2O3
C[C@H](c2cc(=O)[nH]c(SC1CCCC1)n2)c3c(F)cccc3F	ZINC000000024485	O=c3cc(Cc1ccccc1)nc(SC2CCCC2)[nH]3
N#Cc4ccc(c3ccc(\C=N\c2ccc(c1ccccc1)cc2)o3)cc4	ZINC000000561147	C(=Nc2ccc(c1ccccc1)cc2)c4ccc(c3ccccc3)o4
CCOc3nc(NCc1ccccc1)nc(NCc2cccnc2)n3	ZINC000000070505	C(Nc2ncnc(NCc1cccnc1)n2)c3ccccc3
Cc1ccccc1N3CCN(C(=O)c2ccccc2O)CC3	ZINC000000034441	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
Cc3cc(N2CCN(C(=O)c1ccccc1)CC2)ncn3	ZINC000000013143	O=C(N2CCN(c1ccncn1)CC2)c3ccccc3
C[C@@H](O)[C@@H]5[C@H]4CC(COC(=O)c3cn(CCF)c2c(F)c(N1CCN(C)CC1)c(F)cc2c3=O)=C(C(O)=O)N4C5=O	ZINC000003927284	O=C5CC4CC(COC(=O)c3c[nH]c2cc(N1CCNCC1)ccc2c3=O)=CN45
COC(=O)c1c(C)c(C)sc1NC(=O)/C=C/C(O)=O	ZINC000000046753	c1ccsc1
COc3cc(OC)c(NC(=O)Oc2ccc1CCCc1c2)cc3Cl	ZINC000000401887	O=C(Nc1ccccc1)Oc3ccc2CCCc2c3
C[C@H](C(O)=O)c2ccc(c1cccc(F)c1)cc2	ZINC000000000322	c2ccc(c1ccccc1)cc2
CSc3sc(C(=O)N1CCCCC1)c(c2cccs2)c3C#N	ZINC000000095897	O=C(N1CCCCC1)c2sccc2c3cccs3
NNc2nnc(Cl)c1CCCCc12	ZINC000000039712	C2CCc1cnncc1C2
CCOC(=O)c3c(NC(=O)C1CC1)sc2C[C@H](C)CCc23	ZINC000000035549	O=C(Nc2cc1CCCCc1s2)C3CC3
O=C2CCN(CCc1ccccc1)CC2	ZINC000000119408	O=C2CCN(CCc1ccccc1)CC2
OC(=O)Cc3ccc2c(=O)c1ccc(CC(O)=O)c(O)c1c(=O)c2c3O	ZINC000005840584	O=c2c1ccccc1c(=O)c3ccccc23
COC(=O)c3nn2cc(c1n[nH]cc1N(=O)=O)cnc2c3Cl	ZINC000000032049	c3cc2ncc(c1cc[nH]n1)cn2n3
COc2ccc(c1nn(CCC(O)=O)cc1/C=C/C(O)=O)cc2N(=O)=O	ZINC000003272980	c2ccc(c1cc[nH]n1)cc2
Cn2cc(C(=O)OCC1CCN(CCNS(C)(=O)=O)CC1)c3ccccc23	ZINC000000598220	O=C(OCC1CCNCC1)c2c[nH]c3ccccc23
O=c2[nH]c(=O)n(OCc1ccccc1)cc2C#N	ZINC000000338796	O=c2ccn(OCc1ccccc1)c(=O)[nH]2
CN(C)CC[C@H]2CN(C)C(=O)c1cccnc1C2	ZINC000000002656	O=C1NCCCc2ncccc12
CO[C@@H](CC(O)=O)[P@](O)(O)=O	ZINC000219370295	nonring
OC(=O)C4(NC(=O)OCC2c1ccccc1c3ccccc23)CC4	ZINC000000105368	O=C(NC1CC1)OCC3c2ccccc2c4ccccc34
O=C(O[C@@H]2CCN3Cc1ccccc1N=C23)c4ccccc4	ZINC000000526265	O=C(OC2CCN3Cc1ccccc1N=C23)c4ccccc4
FC(F)(F)Sc1ccccc1NC(=O)c2ccccc2Cl	ZINC000000451635	O=C(Nc1ccccc1)c2ccccc2
O=C(N1CCCCCC1)c4ccc(n3c(=O)c2ccccc2c3=O)cc4	ZINC000000069642	O=C(N1CCCCCC1)c4ccc(n3c(=O)c2ccccc2c3=O)cc4
N#CN3Cc2cc1ccccc1nc2C3	ZINC000000027294	C2NCc3nc1ccccc1cc23
O=C(NC[C@@H]1CCCN1C#N)c2ccccc2	ZINC000000027295	O=C(NCC1CCCN1)c2ccccc2
O=S(=O)(Cc1ccccc1)N3CCc2ccccc2C3	ZINC000000029835	O=S(=O)(Cc1ccccc1)N3CCc2ccccc2C3
CC(=O)C(=Cc1ccc(C#N)cc1)C(C)=O	ZINC000000014898	c1ccccc1
COc4ccc3oc(c1ccccc1)c(C(=O)N2CCCCC2)c3c4	ZINC000000045105	O=C(N1CCCCC1)c3c(c2ccccc2)oc4ccccc34
Nc1cc(S(O)(=O)=O)cc2cccc(S(O)(=O)=O)c12	ZINC000001686995	c2ccc1ccccc1c2
Oc2ccc(N(=O)=O)c3c(=O)c1c(S(O)(=O)=O)ccc(N(=O)=O)c1c(=O)c23	ZINC000008898240	O=c2c1ccccc1c(=O)c3ccccc23
O=S3(=O)C=C(SCCN1CCCCC1)c2ccccc23	ZINC000000201650	O=S3(=O)C=C(SCCN1CCCCC1)c2ccccc23
CC(=O)C(=Cc1ccc(N(=O)=O)cc1)C(C)=O	ZINC000000014897	c1ccccc1
C[C@@H]4Sc3cc2N(Cc1ccccc1)C(=O)COc2cc3NC4=O	ZINC000000038321	O=C4CSc3cc2N(Cc1ccccc1)C(=O)COc2cc3N4
NC4=C(C#N)[C@@H](c1ccccc1)c3ccc2cccnc2c3O4	ZINC000000044594	O3C=CC(c1ccccc1)c4ccc2cccnc2c34
Cc2onc(c1ccccc1Cl)c2NC(=O)NCc3cccs3	ZINC000000151009	O=C(NCc1cccs1)Nc2conc2c3ccccc3
O[C@@H]2C[C@@H](C(O)=O)N(C(=O)Oc1ccccc1)C2	ZINC000000049741	O=C(Oc1ccccc1)N2CCCC2
CCOc4ccc(n2c1ccccc1cc3c(=O)n(C)c(=O)nc23)cc4	ZINC000000078728	O=c4nc3n(c1ccccc1)c2ccccc2cc3c(=O)[nH]4
Cc1ccccc1n4[nH]c(C)c(C=c3c(C)nn(c2cccc(Cl)c2)c3=O)c4=O	ZINC000000659509	O=c3c(C=c2cnn(c1ccccc1)c2=O)c[nH]n3c4ccccc4
Cc3ccc([C@@H]1C[C@H]1Nc2occ(O)c2C(O)=O)cc3	ZINC000000003928	C2C(Nc1ccco1)C2c3ccccc3
OC(=O)c1c(Cl)c(Cl)c(Cl)c(Cl)c1C(=O)Nc3ccc2c[nH]nc2c3	ZINC000000641395	O=C(Nc2ccc1c[nH]nc1c2)c3ccccc3
Cc2ccc(Nc1nccc(=O)[nH]1)cc2	ZINC000000113440	O=c2ccnc(Nc1ccccc1)[nH]2
Cc1ccsc1[C@@H]2N[C@@H](C(O)=O)CS2	ZINC000000082610	C2CSC(c1cccs1)N2
OC(=O)[C@@H]1CCCC[C@@H]1C(=O)Nc2ccc(Br)cc2F	ZINC000000474116	O=C(Nc1ccccc1)C2CCCCC2
Cc4ccc3nc(N1CCC(C(N)=O)CC1)c(\C=c2\sc(=S)n(CC(O)=O)c2=O)c(=O)n3c4	ZINC000003667880	O=c1[nH]c(=S)sc1=Cc4c(N2CCCCC2)nc3ccccn3c4=O
COc2cc(CN1CCC(C(=O)NCC(C)(C)CN(C)C)CC1)cc(Br)c2O	ZINC000009833619	C2CCN(Cc1ccccc1)CC2
CC(=O)O[C@@H]4[C@H](N1CCCCC1)c3c(O)c(/C=C/C(=O)N2CCCCC2)ccc3OC4(C)C	ZINC000000676886	O=C(C=Cc3ccc2OCCC(N1CCCCC1)c2c3)N4CCCCC4
CSc1ccccc1N3C(=O)Cc2ccccc2C3=O	ZINC000000023113	O=C2Cc1ccccc1C(=O)N2c3ccccc3
O=N(=O)c3ccc(S(=O)(=O)N2CCN(c1ccccc1)CC2)cc3	ZINC000000247708	O=S(=O)(N2CCN(c1ccccc1)CC2)c3ccccc3
COc2cc(c1ccc(O)cc1)c(OC)c(O)c2c3ccc(OCC=C(C)C)c(O)c3	ZINC000000579895	c3ccc(c2ccc(c1ccccc1)cc2)cc3
O=C(CSc2nc1ccccc1s2)Nc3ccncc3	ZINC000000033408	O=C(CSc2nc1ccccc1s2)Nc3ccncc3
CCOC(=O)c5ccc(S(=O)(=O)Nn4c(SCc2cc(=O)n1ccccc1n2)nc3ccccc3c4=O)cc5	ZINC000002974062	O=c4cc(CSc2nc1ccccc1c(=O)n2NS(=O)(=O)c3ccccc3)nc5ccccn45
OC(=O)c2ccc(C(O)=O)c(n1cnnn1)c2	ZINC000012243862	c2ccc(n1cnnn1)cc2
CN(C)c4ccc(C(=O)Nc3nc2c(ccc1ccccc12)s3)cc4	ZINC000000189359	O=C(Nc3nc2c(ccc1ccccc12)s3)c4ccccc4
CCOC(=O)c2cnc1c(C(F)(F)F)cccc1c2Nc4ccc(S(=O)(=O)Nc3nc(C)cc(C)n3)cc4	ZINC000000645726	O=S(=O)(Nc1ncccn1)c4ccc(Nc2ccnc3ccccc23)cc4
Cc1ccccc1/C=C/C(N)=O	ZINC000000005707	c1ccccc1
COc2cccc(NC(=O)C[C@@H](C)NC1CC(C)(C)NC(C)(C)C1)c2	ZINC000007985288	O=C(CCNC1CCNCC1)Nc2ccccc2
COc4ccc3[C@@H](C1C(=O)CCCC1=O)C2=C(CCCC2=O)Oc3c4	ZINC000000090466	O=C1CCCC(=O)C1C3C2=C(CCCC2=O)Oc4ccccc34
Cc3cc(OCc1c(C)c(C)c(C)c(C)c1C)c2cc(F)ccc2n3	ZINC000000067740	C(Oc1ccnc2ccccc12)c3ccccc3
OC(=O)\C=C\c1cc(N(=O)=O)ccc1O	ZINC000002579268	c1ccccc1
Cc4nc3ccc(C(=O)CCC2CCN(Cc1ccccc1)CC2)cc3s4	ZINC000000606695	O=C(CCC2CCN(Cc1ccccc1)CC2)c4ccc3ncsc3c4
Oc5ccc(C(=O)N[C@@H]1CNC[C@@H]1OC(=O)c4cc(O)c(C(=O)c2c(O)ccc3ccccc23)c(O)c4)cc5	ZINC000026578965	O=C(NC1CNCC1OC(=O)c4ccc(C(=O)c2cccc3ccccc23)cc4)c5ccccc5
Cc3nc2n(c1ccccc1)ncc2c(=O)n3Cc4ccccc4	ZINC000000049186	O=c3n(Cc1ccccc1)cnc4n(c2ccccc2)ncc34
CCOc2ccc(CC(=O)NCc1cn(C)nc1C)cc2OCC	ZINC000000045660	O=C(Cc1ccccc1)NCc2cn[nH]c2
CC(C)Cc1c(C#N)c(N)[nH]c(=S)c1C#N	ZINC000000051264	S=c1cccc[nH]1
OC(=O)c1cc(Br)ccc1NC(=O)Cn3c(=O)c2ccccc2c3=O	ZINC000000716509	O=C(Cn2c(=O)c1ccccc1c2=O)Nc3ccccc3
COc1ccccc1n4c(O)c3[nH][nH]c(C(=O)c2cnccn2)c3c4=O	ZINC000006928299	O=C(c1cnccn1)c3[nH][nH]c4cn(c2ccccc2)c(=O)c34
Clc1ncccc1NC(=O)\C=C\c2ccco2	ZINC000000027725	O=C(Nc1cccnc1)C=Cc2ccco2
Oc1c(Br)cc(Br)cc1\C=N\NC(=O)CNC(=O)c2cccc(Br)c2	ZINC000001922142	O=C(CNC(=O)c1ccccc1)NN=Cc2ccccc2
Cc1ccccc1n3c(=O)c(Cl)c(Nc2cccc(Cl)c2)c3=O	ZINC000000138013	O=c2cc(Nc1ccccc1)c(=O)n2c3ccccc3
C[C@H](CC(=O)Nc1cc(C)ccc1C)[C@@H]2CCCO2	ZINC000000035485	O=C(CCC1CCCO1)Nc2ccccc2
CCO[P@@](O)(=O)C(O)=O	ZINC000003653723	nonring
Cn1cnc2sncc(=O)c12	ZINC000000005385	O=c1cnsc2nc[nH]c12
OCc1ccccc1CN2CCCC2	ZINC000000054753	C2CCN(Cc1ccccc1)C2
O=C(Nc4ccc3c(=O)n(CCC2CCN(Cc1ccccc1)CC2)c(=O)c3c4)c5ccccc5	ZINC000000598356	O=C(Nc4ccc3c(=O)n(CCC2CCN(Cc1ccccc1)CC2)c(=O)c3c4)c5ccccc5
O=C(COc1ccccc1)n3c2ccccc2sc4ccccc34	ZINC000000027613	O=C(COc1ccccc1)n3c2ccccc2sc4ccccc34
Clc4cccc(NS(=O)(=O)c2cccc3c(S(=O)(=O)Nc1cccc(Cl)c1)cccc23)c4	ZINC000000841049	O=S(=O)(Nc1ccccc1)c3cccc4c(S(=O)(=O)Nc2ccccc2)cccc34
OCc1ccccc1CNCc2ccccc2	ZINC000000054755	C(NCc1ccccc1)c2ccccc2
Clc1ccccc1c3nnc(c2ccc(Br)cc2)o3	ZINC000000054851	c3ccc(c2nnc(c1ccccc1)o2)cc3
O=c2[nH]c(NCc1ccccc1)nc3[nH]ncc23	ZINC000000009011	O=c2[nH]c(NCc1ccccc1)nc3[nH]ncc23
OC(=O)CNC(=O)c1ncccc1O	ZINC000033978615	c1ccncc1
CSc4nnc3c(O[C@@H](\C=C\c1ccccc1)Nc2ccccc23)n4	ZINC000000345004	N3C(C=Cc1ccccc1)Oc2ncnnc2c4ccccc34
OC(=O)c2cc(Cl)cn(Cc1ccc(C(F)(F)F)cc1)c2=O	ZINC000000170487	O=c1ccccn1Cc2ccccc2
COc4cccc(c3nc2cc(NC(=O)c1cccnc1)ccc2o3)c4	ZINC000000070599	O=C(Nc3ccc2oc(c1ccccc1)nc2c3)c4cccnc4
Clc3cc(Cl)cc(NC(=O)c2csc(c1ccccc1)n2)c3	ZINC000000121757	O=C(Nc1ccccc1)c3csc(c2ccccc2)n3
Oc1ccc(Br)cc1\C=N\c3nc2CCCCc2s3	ZINC000000064298	C3CCc2sc(N=Cc1ccccc1)nc2C3
CNc2nc1n(C)c(=O)[nH]c(=O)c1n2Cc3ccccc3Cl	ZINC000000041375	O=c3[nH]c(=O)c2n(Cc1ccccc1)cnc2[nH]3
COC(=O)[C@H](Cc1c[nH]c2ccccc12)/N=C/c3ccc(O)cc3	ZINC000000009017	C(Cc1c[nH]c2ccccc12)N=Cc3ccccc3
Clc3ccc(S(=O)(=O)NC[C@@H](N1CCCCC1)c2ccccc2)cc3	ZINC000000629122	O=S(=O)(NCC(N1CCCCC1)c2ccccc2)c3ccccc3
COc4cccc(\C=c3\sc2nnc(c1ccccc1)n2c3=O)c4	ZINC000000076613	O=c3c(=Cc1ccccc1)sc4nnc(c2ccccc2)n34
OC(=O)c1ncsc1C(O)=O	ZINC000003650097	c1cscn1
FC(F)(F)c3cccc(Nc2cc(=O)n(Cc1ccccc1)c2=O)c3	ZINC000000115479	O=c2cc(Nc1ccccc1)c(=O)n2Cc3ccccc3
COc1ccc(CNS(C)(=O)=O)cc1	ZINC000000029506	c1ccccc1
COc1ccccc1CNS(C)(=O)=O	ZINC000000029507	c1ccccc1
Nc1ccc(CC(O)=O)cc1S(O)(=O)=O	ZINC000001724654	c1ccccc1
COc3ccc(c2nc1cccnc1[nH]2)cc3N	ZINC000000027433	c3ccc(c2nc1cccnc1[nH]2)cc3
OC3CCN(C(=O)Cn1c(=O)sc2ccc(Cl)cc12)CC3	ZINC000000005602	O=C(Cn1c(=O)sc2ccccc12)N3CCCCC3
Nc2nc(c1ccc(N(=O)=O)cc1)cs2	ZINC000000039796	c2ccc(c1cscn1)cc2
CC(C)=C1[C@H]2C=C[C@@H]1[C@@H]4[C@H]2C(=O)N(c3cc(N(=O)=O)ccc3C)C4=O	ZINC000000064188	C=C1C2C=CC1C4C2C(=O)N(c3ccccc3)C4=O
C[C@@H](C[N@@](C)Cc1ccccc1)OC(=O)c2ccc(Cl)cc2Cl	ZINC000000641646	O=C(OCCNCc1ccccc1)c2ccccc2
Cc2ccc(F)c3c(CCNC(=O)c1ccnn1C)c(C)[nH]c23	ZINC000000029002	O=C(NCCc1c[nH]c2ccccc12)c3ccn[nH]3
CC(C)c2cc(NS(=O)(=O)c1ccc(C)cc1)cc(C(C)C)c2O	ZINC000000008011	O=S(=O)(Nc1ccccc1)c2ccccc2
Cc2nc(C)c(Cl)c(NS(=O)(=O)c1ccc(N)cc1)n2	ZINC000000002090	O=S(=O)(Nc1ccncn1)c2ccccc2
Cc3ccc([C@H]1C(C#N)=C(N)Oc2cc(C)oc(=O)c12)cc3	ZINC000000043078	O=c3occc2OC=CC(c1ccccc1)c23
CC(=O)Nc1c(=O)n(C)c2cssc12	ZINC000000000868	O=c2cc1sscc1[nH]2
C3C[C@H](CN2CCN(c1ncccn1)CC2)CC=C3	ZINC000000217806	C3CC(CN2CCN(c1ncccn1)CC2)CC=C3
COC(=O)c2nnn(c1ccc(C(F)(F)F)cc1N(=O)=O)c2C	ZINC000000054283	c2ccc(n1ccnn1)cc2
OC(=O)CCn4c3SC[C@H]2COc1ccccc1[C@H]2c3sc4=O	ZINC000000216630	O=c4[nH]c3SCC2COc1ccccc1C2c3s4
CN(Cc1ccccc1)C(=O)Cn2nc(N(=O)=O)cc2C	ZINC000000033099	O=C(Cn1cccn1)NCc2ccccc2
Cc2ccc(CNC(=O)c1ccco1)cc2	ZINC000000030005	O=C(NCc1ccccc1)c2ccco2
O=N(=O)c4ccc(n2nc(c1ccccc1)cc2c3ccccc3)cc4	ZINC000000045072	c4ccc(c3cc(c1ccccc1)n(c2ccccc2)n3)cc4
C[C@@H](O)Cn1c(C)ncc1N(=O)=O	ZINC000000000711	c1c[nH]cn1
CC(=O)Oc1cc(C)c(OC(C)=O)c2ccccc12	ZINC000000000867	c2ccc1ccccc1c2
CCOP(=S)(OCC)SCSc1ccc(Cl)cc1	ZINC000000001092	c1ccccc1
CC[C@@]1(C)Cc3c(CO1)c(N2CCOCC2)[nH]c(=S)c3C#N	ZINC000000266623	S=c3cc1CCOCc1c(N2CCOCC2)[nH]3
Oc1ccc(N(=O)=O)cc1C=NN=c3nc2[nH]onc2nc3Nc4ccc(I)cc4	ZINC000002181598	N(c1ccccc1)c3nc2no[nH]c2nc3=NN=Cc4ccccc4
CN(C)c2ccc(\C=N\c1cc(NS(C)(=O)=O)ccc1C)cc2	ZINC000000067577	C(=Nc1ccccc1)c2ccccc2
CC(C)c1ccccc1NC(=O)Cn3c(=O)c2ccccc2c3=O	ZINC000000045213	O=C(Cn2c(=O)c1ccccc1c2=O)Nc3ccccc3
COc3ccc(OC)c2C[C@@H](Nc1ccc(O)cc1)CCc23	ZINC000000009654	C2Cc1ccccc1CC2Nc3ccccc3
OC(=O)C1CC(O)(S(O)(=O)=O)C1	ZINC000236412086	C1CCC1
O=S(=O)(Nc1ccccn1)c2ccccc2	ZINC000000050504	O=S(=O)(Nc1ccccn1)c2ccccc2
O=C(CCn1c(=O)oc2ccccc12)n3c(=O)oc4ccccc34	ZINC000000036804	O=C(CCn1c(=O)oc2ccccc12)n3c(=O)oc4ccccc34
CCOC(=O)c1cncn1[C@H](C)c2ccccc2	ZINC000000001408	C(c1ccccc1)n2ccnc2
CCc3c(Sc1ccccc1)n(COCc2ccccc2)c(=S)[nH]c3=O	ZINC000000586596	O=c3cc(Sc1ccccc1)n(COCc2ccccc2)c(=S)[nH]3
COc3ccc2[nH]cc(CCNC(=O)C1CC1)c2c3	ZINC000000008253	O=C(NCCc1c[nH]c2ccccc12)C3CC3
COc3ccc2nc(SCc1ccc(Br)cc1)[nH]c2c3	ZINC000000348621	C(Sc2nc1ccccc1[nH]2)c3ccccc3
CN(c1ccc(O)cc1)c3nc(O)c([C@@H]2SC(=O)NC2=O)s3	ZINC000001170438	O=C3NC(=O)C(c2cnc(Nc1ccccc1)s2)S3
CC3CCN(S(=O)(=O)c2ccc1ncc(C(O)=O)c(O)c1c2)CC3	ZINC000000215724	O=S(=O)(N1CCCCC1)c3ccc2ncccc2c3
CCNc1nsc2ccccc12	ZINC000000001401	c2ccc1sncc1c2
Cc2ccc(\C=N\n1cnnc1)s2	ZINC000000028584	C(=Nn1cnnc1)c2cccs2
CN(C)CCN(Cc2cc1ccccc1o2)c3ccccn3	ZINC000000001405	C(Nc1ccccn1)c3cc2ccccc2o3
Oc3ccc2CC[C@@H](Cc1c[nH]cn1)c2c3	ZINC000000006860	C2Cc1ccccc1C2Cc3c[nH]cn3
Clc3ccc(C(=O)CSc2nnc(c1cnccn1)s2)cc3	ZINC000000127613	O=C(CSc2nnc(c1cnccn1)s2)c3ccccc3
C[N+](C)(CCn2c(=O)c1SCCSc1c2=O)Cc3ccccc3	ZINC000000392543	O=c2c1SCCSc1c(=O)n2CCNCc3ccccc3
CCC(=O)c3ccc2sc1ccccc1n(C[C@H](C)N(C)C)c2c3	ZINC000000000669	c3ccc2sc1ccccc1[nH]c2c3
Nc2nc(NS(=O)(=O)c1ccccc1)cc3ncnn23	ZINC000001406485	O=S(=O)(Nc2cc1ncnn1cn2)c3ccccc3
CC[C@@H](C)c3ccc2oc(c1cc(Cl)c(N)c(Cl)c1)nc2c3	ZINC000000569842	c3ccc(c2nc1ccccc1o2)cc3
Cc3cccc4c(C(=O)Nc1ccccc1)cc(c2ccccc2)nc34	ZINC000000045182	O=C(Nc1ccccc1)c3cc(c2ccccc2)nc4ccccc34
Clc3ccc(CSc2nc1cc(Cl)c(Cl)cc1[nH]2)cc3	ZINC000000155123	C(Sc2nc1ccccc1[nH]2)c3ccccc3
CCCc2nnc(NC(=O)COc1cc(C)c(Cl)c(C)c1)s2	ZINC000000148474	O=C(COc1ccccc1)Nc2nncs2
COC(=O)c1sc(S(=O)(=O)NNC(=O)CC(C)C)c(C(=O)OC)c1C	ZINC000023385807	c1ccsc1
CC(=O)Oc1ccccc1C(=O)N(CC=C)CC=C	ZINC000000030088	c1ccccc1
Cc4cccc(N[C@H](c1ccccn1)c3ccc2ccc(C)nc2c3O)n4	ZINC000000684054	N(C(c2ccc1cccnc1c2)c3ccccn3)c4ccccn4
Cc4ccc(Oc2nc(c1ccccc1F)nc3ccccc23)cc4	ZINC000000520591	O(c1ccccc1)c3nc(c2ccccc2)nc4ccccc34
O=C(Cn2nc(c1ccccc1)ccc2=O)NCCN3CCCC3	ZINC000000219351	O=C(Cn2nc(c1ccccc1)ccc2=O)NCCN3CCCC3
OC(=O)C=c1sc(=O)[nH]c1=O	ZINC000008743488	C=c1sc(=O)[nH]c1=O
CCOC(=O)Cc2csc(NC(=O)c1ccc(NC(C)=O)cc1)n2	ZINC000000285341	O=C(Nc1nccs1)c2ccccc2
COC(=O)c1c(C)c(C)sc1NC(=O)c2ccc(C(C)(C)C)cc2	ZINC000000090875	O=C(Nc1cccs1)c2ccccc2
CCOc1ccccc1NC3=CC(=O)C[C@@H](c2cccc(Cl)c2)C3	ZINC000000305475	O=C3CC(c1ccccc1)CC(Nc2ccccc2)=C3
Fc3ccc(OCC(=O)Nc1cccc2ccccc12)cc3	ZINC000000037891	O=C(COc1ccccc1)Nc2cccc3ccccc23
COc3ccc(C(=O)Nc1ccccc1c2ccccc2)cc3Cl	ZINC000000467190	O=C(Nc1ccccc1c2ccccc2)c3ccccc3
Clc3ccc(CC(=O)Nc1ccccc1Oc2ccccc2)cc3	ZINC000000475848	O=C(Cc1ccccc1)Nc2ccccc2Oc3ccccc3
O[C@@H](CNc1ccccc1)Cn3c2ccc(Cl)cc2c4cc(Cl)ccc34	ZINC000000626543	C(CNc1ccccc1)Cn3c2ccccc2c4ccccc34
OC(=O)CC2SC(=N/N=C/c1cccnc1)/NC2=O	ZINC000001143015	O=C2CSC(=NN=Cc1cccnc1)N2
C(Oc2ccc(\C=N\n1cnnc1)cc2)c3cccc4ccccc34	ZINC000000048583	C(Oc2ccc(C=Nn1cnnc1)cc2)c3cccc4ccccc34
CCOC(=O)c1c(CN(C)C)n(C)c2ccc(OC(C)=O)cc12	ZINC000000523645	c2ccc1[nH]ccc1c2
C(Sc2nnc(c1ccco1)o2)c3cccc4ccccc34	ZINC000000063668	C(Sc2nnc(c1ccco1)o2)c3cccc4ccccc34
COc1ccc(C=O)cc1CSc2nnc(C)s2	ZINC000000037149	C(Sc1nncs1)c2ccccc2
CC(C)(C)c3cccc(c2nc1ccc(C(N)=N)cc1[nH]2)c3O	ZINC000000007706	c3ccc(c2nc1ccccc1[nH]2)cc3
C5Oc4ccc(Nc2ncnc3sc(c1ccccc1)cc23)cc4O5	ZINC000000090093	C5Oc4ccc(Nc2ncnc3sc(c1ccccc1)cc23)cc4O5
COc3ccc2[C@H](c1c[nH]cn1)CCCc2c3	ZINC000000021284	C3CC(c1c[nH]cn1)c2ccccc2C3
Fc4ccc(CSc1nnnn1c2cccc3ccccc23)cc4	ZINC000000060574	C(Sc1nnnn1c2cccc3ccccc23)c4ccccc4
Cc3cc(C)nc(S[C@@H]2CC(=O)N(c1ccc(Cl)cc1)C2=O)n3	ZINC000000077223	O=C2CC(Sc1ncccn1)C(=O)N2c3ccccc3
C=C4C[C@H]1COC(=O)[C@@]1(Cc3ccc2ccccc2c3)C4	ZINC000000007708	C=C4CC1COC(=O)C1(Cc3ccc2ccccc2c3)C4
O[C@@]3(CC(=O)c1ccco1)C(=O)N(CC=C)c2ccccc23	ZINC000000037416	O=C(CC1C(=O)Nc2ccccc12)c3ccco3
CC2(C)OC(\C=C\c1cccnc1)=CC2=O	ZINC000000013855	O=C2COC(C=Cc1cccnc1)=C2
O=S(=O)(Cc1ccccc1)N2CCCCC2	ZINC000000030325	O=S(=O)(Cc1ccccc1)N2CCCCC2
O[C@@]4(c1ccc(Cl)cc1)N2CCN=C2c3ccccc34	ZINC000000000440	C4CN3C(c1ccccc1)c2ccccc2C3=N4
CCOc2ccc(C(=O)N1CCCCC1)cc2	ZINC000000030327	O=C(N1CCCCC1)c2ccccc2
COc2ccc([C@@H]1NC(=O)O[C@@H]1CO)cc2	ZINC000000007490	O=C2NC(c1ccccc1)CO2
C[C@@H]2C[C@@H](C)CN(C(=O)c1ccc(F)cc1)C2	ZINC000000029760	O=C(N1CCCCC1)c2ccccc2
Oc2ccc(C(=S)N1CCOCC1)cc2O	ZINC000000039177	S=C(N1CCOCC1)c2ccccc2
CC(=O)Nc4ccc(S(=O)(=O)Nc3ccc(S(=O)(=O)N1CCc2ccccc12)cc3)cc4	ZINC000000670652	O=S(=O)(Nc3ccc(S(=O)(=O)N1CCc2ccccc12)cc3)c4ccccc4
Cc1c(NC(=O)C(O)=O)ccc2c(=O)cc(C(O)=O)[nH]c12	ZINC000005385805	O=c1cc[nH]c2ccccc12
CC(=O)Nc1sc(C)c(C)c1C(C)=O	ZINC000000040138	c1ccsc1
OCCn2c(SCc1ccccc1)nc3ccccc23	ZINC000000037780	C(Sc2nc1ccccc1[nH]2)c3ccccc3
O=C(Oc3ccc(c2cnc1ccccc1n2)cc3)c4ccccc4	ZINC000000058605	O=C(Oc3ccc(c2cnc1ccccc1n2)cc3)c4ccccc4
CN(C)C(=O)C(\NC(=O)c1ccc(C)cc1)=C/c2ccccc2F	ZINC000000035942	O=C(NC=Cc1ccccc1)c2ccccc2
COCc1c(N)c(C)nc(Cl)c1C#N	ZINC000000035808	c1ccncc1
CC(C)(C)c1cc(NC(=O)CC#N)c(C(N)=O)s1	ZINC000000081860	c1ccsc1
COc2ccc(OC)c3c(N1CCOCC1)cc(C(F)(F)F)nc23	ZINC000000092782	C3CN(c1ccnc2ccccc12)CCO3
OCc2cc(O)c1OCOc1c2	ZINC000000016968	C2Oc1ccccc1O2
CCOC(=O)c3c(N)n(c1ccc(C)cc1)c4nc2ccccc2nc34	ZINC000000088047	c4ccc(n2ccc3nc1ccccc1nc23)cc4
CCN(CC)CC(=O)Nc1c(C)c(CC)nc2ccccc12	ZINC000000104412	c2ccc1ncccc1c2
COc1ccc(S(=O)(=O)NCC(O)=O)cc1	ZINC000000091132	c1ccccc1
CC(C)COC(=O)C1=C(C)NC(=O)N[C@@H]1c2cccc(F)c2	ZINC000000042867	O=C2NC=CC(c1ccccc1)N2
OC(=O)CC[C@H](NC(=O)Oc1ccc(N(CCI)CCI)cc1)C(O)=O	ZINC000003944268	c1ccccc1
CO[P@](O)(=O)C[C@@H](NC(=O)c4ccc3nc(Cc2nc1cc(C(N)=O)ccc1[nH]2)n(C)c3c4)C(O)=O	ZINC000003587450	C(c2nc1ccccc1[nH]2)c4nc3ccccc3[nH]4
Cc2cc(C)cc(Sc1c(C)c[nH]c(=O)c1N)c2	ZINC000000022099	O=c2cc(Sc1ccccc1)cc[nH]2
CCc4ccc(OCc1ccccc1C(=O)Nc3ccc2nc(C)cc(N)c2c3)cc4	ZINC000000602902	O=C(Nc2ccc1ncccc1c2)c3ccccc3COc4ccccc4
CCOC(=O)COc2ccc1oc(C(C)(C)C)c(C(=O)OCC)c1c2	ZINC000000547623	c2ccc1occc1c2
CCOC(=O)c2cn(CC)c1cc(Cl)c(N(=O)=O)cc1c2=O	ZINC000000039133	O=c1cc[nH]c2ccccc12
Cc1cc(Br)ccc1NC(=O)CSc2nncn2C	ZINC000000040646	O=C(CSc1nnc[nH]1)Nc2ccccc2
COc1ccccc1NS(=O)(=O)c2[nH]c(=O)[nH]c(=O)c2C	ZINC000000313211	O=c2cc(S(=O)(=O)Nc1ccccc1)[nH]c(=O)[nH]2
O=C(Cn1cc(C#N)c2ccccc12)NCc3ccccc3	ZINC000000029024	O=C(Cn1ccc2ccccc12)NCc3ccccc3
COc3ccc(CCNC(=O)c1c(C)nc2ccccn12)cc3	ZINC000000038035	O=C(NCCc1ccccc1)c2cnc3ccccn23
COC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)c2ccc(Cl)cc2	ZINC000000043159	O=C(NCCc1ccccc1)c2ccccc2
OCCS(=O)(=O)c1non(=O)c1c2ccccc2	ZINC000000017995	O=n1oncc1c2ccccc2
O=N(=O)C1=Cc4c(O[C@@H]1c3ccc2OCOc2c3)ccc5ccccc45	ZINC000000091885	C5Oc4ccc(C3Oc2ccc1ccccc1c2C=C3)cc4O5
CCC(C)(C)[C@@H]4CCc3oc2ccc(NS(=O)(=O)c1ccc(Br)cc1)cc2c3C4	ZINC000000645623	O=S(=O)(Nc3ccc2oc1CCCCc1c2c3)c4ccccc4
COc3cccc(C(=O)Nc2nc1ccccc1s2)c3	ZINC000000030033	O=C(Nc2nc1ccccc1s2)c3ccccc3
COC(=O)N3Cc1cc(OC)ccc1C(Cc2c(Cl)cncc2Cl)=N3	ZINC000000587579	C2NN=C(Cc1ccncc1)c3ccccc23
COC(=O)C(=Cc2cn(Cc1ccccc1)c3ccccc23)C(=O)OC	ZINC000000510253	C(c1ccccc1)n2ccc3ccccc23
COc2cccc(N(CC(=O)NCc1ccccn1)S(C)(=O)=O)c2	ZINC000000308580	O=C(CNc1ccccc1)NCc2ccccn2
COc2cc(CNc1ccc(C(O)=O)cc1)ccc2OCc3ccc(Cl)cc3	ZINC000000679354	C(Nc1ccccc1)c3ccc(OCc2ccccc2)cc3
O[C@@H]2CO[C@H](c1ccc(Cl)cc1)O[C@H]2c3ccc(N(=O)=O)cc3	ZINC000000085106	C3CC(c1ccccc1)OC(c2ccccc2)O3
CC(C)(C)Nc2c(c1ccccc1Cl)nc3ccc(Cl)cn23	ZINC000000320244	c3ccc(c2cn1ccccc1n2)cc3
CC(C)(Cn2c(=O)c1ccccc1c2=O)[C@@H](O)C(O)=O	ZINC000000360738	O=c1[nH]c(=O)c2ccccc12
Cc1cc(Br)cc(C)c1NC(=O)c3ccc2OCOc2c3	ZINC000000587089	O=C(Nc1ccccc1)c3ccc2OCOc2c3
COc1cc(S(O)(=O)=O)c(N)cc1S(O)(=O)=O	ZINC000002569612	c1ccccc1
C[C@@H](C#Cc1ccco1)N(O)C(N)=O	ZINC000000015688	c1ccoc1
Cc3cccc4nc(C(F)(F)c2nc1ccc(C(=O)N[C@@H](C[P@](O)(O)=O)C(O)=O)cc1n2C)[nH]c34	ZINC000003587582	C(c2nc1ccccc1[nH]2)c4nc3ccccc3[nH]4
Cc5cn([C@@H]4C[C@@H](O)[C@H](COC(c1ccccc1)(c2ccccc2)c3ccc(OCC(O)=O)cc3)O4)c(=O)[nH]c5=O	ZINC000005493280	O=c5ccn(C4CCC(COC(c1ccccc1)(c2ccccc2)c3ccccc3)O4)c(=O)[nH]5
Cc3ccc(n2nc(c1ccc(F)cc1)cc2C(O)=O)c(C)c3	ZINC000000324150	c3ccc(c2ccn(c1ccccc1)n2)cc3
CC(C)[C@H]3C[C@](C)(c2csc(Nc1ccccc1C)n2)OC3=O	ZINC000000084472	O=C3CCC(c2csc(Nc1ccccc1)n2)O3
Clc3ccc(N2C(=O)C[C@@H](NCCc1ccccn1)C2=O)cc3	ZINC000000210914	O=C2CC(NCCc1ccccn1)C(=O)N2c3ccccc3
Cc4cc(=O)n3[C@@H]([C@H]1CCC=CC1)N=C(NCCN2CCCCC2)Nc3n4	ZINC000009289477	O=c4ccnc3NC(NCCN1CCCCC1)=NC(C2CCC=CC2)n34
Cn4c1ccccc1c5nnc(SCc3ccc2nonc2c3)nc45	ZINC000000210910	C(Sc1nnc3c(n1)[nH]c2ccccc23)c5ccc4nonc4c5
Cc2cccc(NS(=O)(=O)c1ccccc1C#N)c2	ZINC000000074799	O=S(=O)(Nc1ccccc1)c2ccccc2
O=C(Oc2ccc(OC(=O)c1ccco1)c(C#N)c2C#N)c3ccco3	ZINC000000240763	O=C(Oc2ccc(OC(=O)c1ccco1)cc2)c3ccco3
COC(=O)c2c(I)c1cc(OC)ccc1n2C	ZINC000000096957	c2ccc1[nH]ccc1c2
COc3ccc([C@@H]1[C@@H](C(O)=O)CC(=O)N1Cc2ccccc2)cc3	ZINC000000142565	O=C2CCC(c1ccccc1)N2Cc3ccccc3
CCc2ccc(OC(=O)c1ccc(N(=O)=O)cc1)cc2	ZINC000000038620	O=C(Oc1ccccc1)c2ccccc2
Cn3cnc(S(=O)(=O)Nc1ccccc1Oc2ccccc2)c3	ZINC000000153368	O=S(=O)(Nc1ccccc1Oc2ccccc2)c3c[nH]cn3
CC1(C)NC(=N)NC(=N)N1c3cccc(OCc2cccc(N)c2)c3	ZINC000001701931	N=C3NCN(c2cccc(OCc1ccccc1)c2)C(=N)N3
O=Cc2ccc(N1CCOCC1)cc2	ZINC000000031321	C2CN(c1ccccc1)CCO2
Fc3ccc(c2ccc(CNS(=O)(=O)c1ccccc1)o2)c(F)c3	ZINC000000142183	O=S(=O)(NCc2ccc(c1ccccc1)o2)c3ccccc3
Cc3ccc(c2n/c(=C/c1ccc(Br)s1)c(=O)o2)cc3	ZINC000000292063	O=c2oc(c1ccccc1)nc2=Cc3cccs3
CC(C)=C3[C@H]1C[C@H]1[C@@H]2[C@@H](C(O)=O)[C@@H]23	ZINC000000058339	C=C3C1CC1C2CC23
COc2cc(NC(=O)c1ccc(Cl)cc1)c(Cl)cc2NS(=O)(=O)c3ccc(C(C)(C)C)cc3	ZINC000000671297	O=C(Nc2ccc(NS(=O)(=O)c1ccccc1)cc2)c3ccccc3
Cc1cccc(NC(O)=NC(=O)C(F)(F)F)c1	ZINC000000107991	c1ccccc1
Oc2cc(\C=C(/C#N)C(=O)NCCCNC(=O)C(=C/c1cc(O)c(O)c(Br)c1)/C#N)cc(Br)c2O	ZINC000006007124	O=C(NCCCNC(=O)C=Cc1ccccc1)C=Cc2ccccc2
COc4ccc(c3nc(c1ccccc1)c(c2ccccc2)[nH]3)cc4	ZINC000000286748	c4ccc(c3nc(c1ccccc1)c(c2ccccc2)[nH]3)cc4
CNc3nc(Nc1cccc2ccccc12)nc(OCC(F)(F)F)n3	ZINC000000449026	N(c1ncncn1)c2cccc3ccccc23
CC(=O)C3[C@@H](c1ccc(Cl)cc1)N(Cc2ccco2)C(=O)C3=O	ZINC000000074604	O=C3CC(c1ccccc1)N(Cc2ccco2)C3=O
Clc3ccc(c2noc(c1csc(N(=O)=O)c1)n2)c(Cl)c3	ZINC000000108649	c3ccc(c2noc(c1ccsc1)n2)cc3
O=C(Cc1cccs1)Nc2ccc(C#N)cc2	ZINC000000030816	O=C(Cc1cccs1)Nc2ccccc2
Fc4ccc(C(=O)NCCN3CCC(n1c(=O)[nH]c2cc(Cl)ccc12)CC3)cc4	ZINC000000537818	O=C(NCCN3CCC(n1c(=O)[nH]c2ccccc12)CC3)c4ccccc4
COc2cc(\C=c1\[nH]c(=O)[nH]c1=O)ccc2OCc3ccc(C(O)=O)o3	ZINC000004738527	O=c3[nH]c(=O)c(=Cc2ccc(OCc1ccco1)cc2)[nH]3
COc3ccc(c2cc(N)n(c1ccc(Cl)c(Cl)c1)n2)cc3	ZINC000000114223	c3ccc(c2ccn(c1ccccc1)n2)cc3
Fc3ccc(NC(=O)C[C@@H]2Nc1ccccc1NC2=O)cc3	ZINC000000046779	O=C(CC2Nc1ccccc1NC2=O)Nc3ccccc3
Cn4c(=O)n(C)c3cn(Cc1ccccc1)c(c2ccccc2)c3c4=O	ZINC000000033678	O=c4[nH]c(=O)c3c(c1ccccc1)n(Cc2ccccc2)cc3[nH]4
Cc3ccc(Oc2coc1cc(O)cc(O)c1c2=O)cc3	ZINC000000042246	O=c2c(Oc1ccccc1)coc3ccccc23
NCCCc4nc3ccc(c2ccc1nc(CCCN)[nH]c1c2)cc3[nH]4	ZINC000004115445	c2cc1nc[nH]c1cc2c4ccc3nc[nH]c3c4
C[C@@H]4CN(c2nc(c1ccc(C)cc1)nc3ccccc23)C[C@@H](C)O4	ZINC000000080979	C4CN(c2nc(c1ccccc1)nc3ccccc23)CCO4
CC[C@@H](Sc1nc(N)cc(N)n1)C(O)=O	ZINC000000317199	c1cncnc1
Cc2c(NC(=O)Nc1ccc(Cl)cc1Cl)sc(=S)n2C	ZINC000000171099	O=C(Nc1ccccc1)Nc2c[nH]c(=S)s2
COC(=O)c3ccc(C(C1C(O)=NC(C)=NC1=O)C2C(O)=NC(C)=NC2=O)cc3	ZINC000016363266	O=C1N=CN=CC1C(C2C=NC=NC2=O)c3ccccc3
Cc3ccc(S(=O)(=O)Nc2ccc(n1cncn1)nc2)cc3C(O)=O	ZINC000026542584	O=S(=O)(Nc2ccc(n1cncn1)nc2)c3ccccc3
S=C2NCCN(c1ccccc1)N2	ZINC000000025270	S=C2NCCN(c1ccccc1)N2
CCC[C@H]2[C@@H](c1ccccc1)C(C#N)(C#N)C(C#N)(C#N)CC2=O	ZINC000000034318	O=C2CCCC(c1ccccc1)C2
COc2cccc([C@H]([C@@H](C)N(=O)=O)c1c(N)n(C)c(=O)n(C)c1=O)c2	ZINC000000102866	O=c2[nH]cc(Cc1ccccc1)c(=O)[nH]2
CCOC(=O)c2c(N)sc1CCCc12	ZINC000000035797	C2Cc1ccsc1C2
COc2ccc(CC(=O)Nc1cc(C)cc(C)c1)cc2	ZINC000000029280	O=C(Cc1ccccc1)Nc2ccccc2
OC(=O)CNS(=O)(=O)c1c(F)cccc1F	ZINC000003289727	c1ccccc1
Cc4ccc3cc(c2c/c(=C/c1cccs1)c(=O)o2)ccc3c4	ZINC000000434165	O=c3oc(c2ccc1ccccc1c2)cc3=Cc4cccs4
NN(CCc1ccccn1)C2=NS(=O)(=O)c3ccccc23	ZINC000000034315	O=S3(=O)N=C(NCCc1ccccn1)c2ccccc23
CC4(C)Oc2ccc1ccc(=O)oc1c2[C@@H](N3CCCCC3)[C@@H]4O	ZINC000000293716	O=c4ccc3ccc2OCCC(N1CCCCC1)c2c3o4
CCOC(=O)N2CCN(C(=O)c1ccco1)CC2	ZINC000000034316	O=C(N1CCNCC1)c2ccco2
Clc3ccc(OCc2nc(c1ccccn1)no2)c(Cl)c3	ZINC000000080685	C(Oc1ccccc1)c3nc(c2ccccn2)no3
CCOC(=O)c3cccc(NC(=O)\C=C\c2ccc1OCOc1c2)c3	ZINC000000064352	O=C(Nc1ccccc1)C=Cc3ccc2OCOc2c3
Oc1[nH]c(=S)[nH]c(=O)c1N=Nc2nccs2	ZINC000038311293	O=c1[nH]c(=S)[nH]cc1N=Nc2nccs2
COc1ccccc1OCCN(C#N)c2nc(Cl)nc(N(C)C)n2	ZINC000000267488	C(COc1ccccc1)Nc2ncncn2
COc3ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)Nc1ccc(F)cc1)cc2)cc3C	ZINC000000628882	O=S(=O)(Nc2ccc(S(=O)(=O)Nc1ccccc1)cc2)c3ccccc3
C[C@H]2CC1=CC(=O)CCN1c3ccc(Cl)cc23	ZINC000000025479	O=C1CCN2C(=C1)CCc3ccccc23
CC(C)c1ccccc1NC(=O)c2ccco2	ZINC000000029991	O=C(Nc1ccccc1)c2ccco2
Cc4ccc([C@@]2(O)CN1CCCSC1=[N+]2Cc3ccccc3)cc4	ZINC000000239738	C4CSC3=[N+](Cc1ccccc1)C(c2ccccc2)CN3C4
C[C@@H](NC2CCN(CCc1ccccc1)CC2)c3ccc(F)cc3	ZINC000000213915	C2CN(CCc1ccccc1)CCC2NCc3ccccc3
CCn2c(C)[n+](C[C@@H](O)COc1ccccc1)c3ccccc23	ZINC000000316206	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
Cc3cc(S(=O)(=O)Nc1ccccn1)c(C)c(S(=O)(=O)c2ccc(Cl)cc2)c3	ZINC000000832294	O=S(=O)(Nc1ccccn1)c3cccc(S(=O)(=O)c2ccccc2)c3
O=C2Nc1ccccc1[C@@]24CC(c3ccccc3)=NN4	ZINC000000047747	O=C2Nc1ccccc1C24CC(c3ccccc3)=NN4
CC(C)c3nn2c(=N)c(=C/c1ccc(Cl)cc1)/c(=O)nc2s3	ZINC000000054315	N=c2c(=Cc1ccccc1)c(=O)nc3scnn23
OC(=O)c2cc(Br)cc(CNC(=O)c1ccccc1)c2O	ZINC000000186805	O=C(NCc1ccccc1)c2ccccc2
CCn2c(SCC(=O)N1[C@@H](C)CCC[C@@H]1C)nnc2c3ccco3	ZINC000000560653	O=C(CSc2nnc(c1ccco1)[nH]2)N3CCCCC3
O=C3C(=C/c1cccs1)\[C@H](c2ccccc2)Oc4ccccc34	ZINC000000084858	O=C3C(=Cc1cccs1)C(c2ccccc2)Oc4ccccc34
CCOc2ccc(CCn1c(N)cc(=O)[nH]c1=O)cc2OCC	ZINC000000032782	O=c2ccn(CCc1ccccc1)c(=O)[nH]2
COc3ccc(Nc2nc(N)nc(CN1C[C@H](C)C[C@@H](C)C1)n2)cc3	ZINC000000542772	C3CCN(Cc2ncnc(Nc1ccccc1)n2)CC3
COc3cc2CC[N@](C)[C@H](Cc1ccc(O)cc1)c2cc3OC	ZINC000000044851	C3Cc1ccccc1C(Cc2ccccc2)N3
CC(=O)Oc1ccccc1C(=O)NCc3ccc2OCOc2c3	ZINC000000031677	O=C(NCc2ccc1OCOc1c2)c3ccccc3
COc3c(O)ccc([C@@H]2NC(=O)c1c(C)c(C)sc1N2)c3N(=O)=O	ZINC000000043412	O=C2NC(c1ccccc1)Nc3sccc23
Cc1ccccc1Nc2c(Cl)c(Cl)nc3c(C)cccc23	ZINC000000083310	N(c1ccccc1)c2ccnc3ccccc23
COc2ccc(CN1CCC(C(=O)NCCC(C)C)CC1)cc2	ZINC000000299653	C2CCN(Cc1ccccc1)CC2
Cc2cc(C)n1nc(C)c(C#N)c1n2	ZINC000000024499	c2cnc1ccnn1c2
C[C@@H](Cn2c(=O)c1cccnc1[nH]c3ccccc23)N(C)C	ZINC000000000671	O=c2[nH]c1ccccc1[nH]c3ncccc23
COC[C@@H](C)NC(=O)c1ccc(C(C)(C)C)cc1	ZINC000000031679	c1ccccc1
Fc1ccccc1C(=O)NC3CCC(NC(=O)c2ccccc2)CC3	ZINC000000035371	O=C(NC2CCC(NC(=O)c1ccccc1)CC2)c3ccccc3
C/C(=N\NC(N)=S)c1ccc(Cl)c(Cl)c1	ZINC000000003248	c1ccccc1
O=C(COc1ccccc1)NCc3ccc2OCOc2c3	ZINC000000031783	O=C(COc1ccccc1)NCc3ccc2OCOc2c3
CC(=O)Nc1nonc1c3nc2ccccc2n3Cc4ccc(C)cc4	ZINC000000205101	C(c1ccccc1)n3c(c2cnon2)nc4ccccc34
O=C(C#Cc1cccnc1)c2ccccc2	ZINC000000015664	O=C(C#Cc1cccnc1)c2ccccc2
Fc2ccc(/C=C/C(=O)Nc1cc(Cl)cc(Cl)c1)cc2	ZINC000000045983	O=C(Nc1ccccc1)C=Cc2ccccc2
Cc2ccc(NS(=O)(=O)c1ccc(Cl)c(C(O)=O)c1)cc2	ZINC000000049975	O=S(=O)(Nc1ccccc1)c2ccccc2
Fc3ccc(Nc1ccccc1C(=O)OCC(=O)c2ccccc2)cc3	ZINC000000072675	O=C(COC(=O)c1ccccc1Nc2ccccc2)c3ccccc3
Clc3ccc(C(=O)Nc1cccc2ccccc12)c(Cl)c3	ZINC000000073204	O=C(Nc1cccc2ccccc12)c3ccccc3
C[C@@H](NC(=O)c2ccc(CSc1ccccc1)cc2)c3ccccc3	ZINC000000039266	O=C(NCc1ccccc1)c3ccc(CSc2ccccc2)cc3
CCC[C@@H](C)C(=O)Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2	ZINC000000081231	O=S(=O)(Nc1ncccn1)c2ccccc2
Fc2ccc(S(=O)(=O)Cc1ccc(N(=O)=O)cc1Cl)c(F)c2	ZINC000000120238	O=S(=O)(Cc1ccccc1)c2ccccc2
COc4ccc(c2nc(c1ccc(F)cc1F)[nH]c2c3ccc(OC)cc3)cc4	ZINC000000608375	c4ccc(c3nc(c1ccccc1)c(c2ccccc2)[nH]3)cc4
Cc2cc(C)nc(SCc1c(Cl)ccc(Cl)c1Cl)n2	ZINC000000131016	C(Sc1ncccn1)c2ccccc2
O=c2cc(c1ccccc1)sc(=O)[nH]2	ZINC000000032891	O=c2cc(c1ccccc1)sc(=O)[nH]2
COC(=O)c3c(C)n(S(=O)(=O)c1ccc(C)cc1)c4ccc(NS(=O)(=O)c2ccc(C)cc2)cc34	ZINC000001926234	O=S(=O)(Nc3ccc2n(S(=O)(=O)c1ccccc1)ccc2c3)c4ccccc4
COc4ccc3[nH]c2[C@H](Cc1ccc(OC)c(OC)c1)NCCc2c3c4	ZINC000000622003	C4Cc1c([nH]c2ccccc12)C(Cc3ccccc3)N4
CC(C)=c2c(=O)[nH]n(c1ccc(C)c(Cl)c1)c2=O	ZINC000000088348	C=c2c(=O)[nH]n(c1ccccc1)c2=O
CN(C)Cc2c[nH]c3c(OCc1ccccc1)cccc23	ZINC000000057233	C(Oc1cccc2cc[nH]c12)c3ccccc3
C[N@@](CCOC(=O)c2ccc1OCCOc1c2)Cc3ccccc3	ZINC000000108112	O=C(OCCNCc1ccccc1)c3ccc2OCCOc2c3
OC(=O)[C@@H]1COCN1C(=O)OCc2ccccc2	ZINC000000057091	O=C(OCc1ccccc1)N2CCOC2
Cc1nccn1Cc2ccccn2	ZINC000000005710	C(c1ccccn1)n2ccnc2
COC(=O)Cc3c(C)c2ccc(O)c(CN1CCCCC1)c2oc3=O	ZINC000000489063	O=c3ccc2cccc(CN1CCCCC1)c2o3
COC(=O)c2c(N)sc1C[C@H](C(C)(C)C)CCc12	ZINC000000035848	C2CCc1sccc1C2
CC(C)C[C@@H]2NC(=O)C1(CCCC1)NC2=O	ZINC000000014888	O=C2CNC(=O)C1(CCCC1)N2
Cc1ccc(N(=O)=O)cc1S(=O)(=O)Nc2ccc(O)c(C(O)=O)c2	ZINC000005508717	O=S(=O)(Nc1ccccc1)c2ccccc2
Cc3cc(C)[n+]2c(c1ccccc1)csc2n3	ZINC000000041311	c3ccc(c1csc2nccc[n+]12)cc3
COC(=O)c2ccc(C(=O)OC)c(S(=O)(=O)Nc1ccc(C(O)=O)cc1)c2	ZINC000012604595	O=S(=O)(Nc1ccccc1)c2ccccc2
Cc1nonc1N(Cc2ccc(F)cc2)S(=O)(=O)c3ccccc3	ZINC000000135790	O=S(=O)(N(Cc1ccccc1)c2cnon2)c3ccccc3
COc4ccc(c3c[n+]2cn(Cc1ccccc1)c(C)c2c(=O)[nH]3)cc4	ZINC000000161368	O=c3[nH]c(c1ccccc1)c[n+]4cn(Cc2ccccc2)cc34
COc5ccc(N4COc3ccc2c1CCCc1c(=O)oc2c3C4)cc5	ZINC000000076865	O=c5oc3c2CN(c1ccccc1)COc2ccc3c4CCCc45
O=C3N(c1ccccn1)[C@H](c2ccncc2)Nc4ccccc34	ZINC000000035204	O=C3N(c1ccccn1)C(c2ccncc2)Nc4ccccc34
COC(=O)C2=CN(C1CC1)C=C(C(=O)OC)C2c3cccc(OC)c3	ZINC000000035206	C1CC1N3C=CC(c2ccccc2)C=C3
O=C1CC[C@@]3(O1)OC(=O)c2ccccc23	ZINC000000032527	O=C1CCC3(O1)OC(=O)c2ccccc23
O=C(Nc3cccc(c2nnc(c1ccccc1)o2)c3)c4cccs4	ZINC000000182077	O=C(Nc3cccc(c2nnc(c1ccccc1)o2)c3)c4cccs4
COc4cc([C@@H]2Nc1ccccc1C(=O)N2NS(=O)(=O)c3ccccc3)c(N(=O)=O)cc4OC	ZINC000001441631	O=C3N(NS(=O)(=O)c1ccccc1)C(c2ccccc2)Nc4ccccc34
CC(=O)Oc2cccc(C(=O)Nc1ccc(Br)cc1C)c2	ZINC000000052551	O=C(Nc1ccccc1)c2ccccc2
CC(C)C[C@H](NC(=O)N1CCCCCC1)C(=O)N[C@H](Cc2cn(C)c3ccccc23)C(=O)N[C@H](CC(O)=O)C(O)=O	ZINC000028000676	O=C(CNC(=O)N1CCCCCC1)NCCc2c[nH]c3ccccc23
CN4CCN(c3cc2n(C)c1ccccc1oc2nn3)CC4	ZINC000000050247	C4CN(c3cc2[nH]c1ccccc1oc2nn3)CCN4
CCOc2cc(CNCC1CCNCC1)ccc2OCC(=O)NC(C)(C)C	ZINC000010434673	C2CC(CNCc1ccccc1)CCN2
CC(C)c2cc(C(C)C)c(S(=O)(=O)Nc1ccc(S(N)(=O)=O)cc1)c(C(C)C)c2	ZINC000000755081	O=S(=O)(Nc1ccccc1)c2ccccc2
Cc1ccncc1C2=NCCCC2	ZINC000000018649	C2CCC(c1cccnc1)=NC2
CSc2ccc(OCc1ncc(N(=O)=O)n1C)cc2	ZINC000000001448	C(Oc1ccccc1)c2ncc[nH]2
OS(=O)(=O)c2ccc1c(N(=O)=O)c(N(=O)=O)c(S(O)(=O)=O)cc1c2	ZINC000004538750	c2ccc1ccccc1c2
COc3cc(C2SCc1cc(C)c(C)cc1CS2)ccc3O	ZINC000000066932	C2SC(c1ccccc1)SCc3ccccc23
O[C@@H]([C@H](N1CCCCCC1)c2ccccc2)c3ccc(Cl)cc3	ZINC000000500990	C3CCCN(C(Cc1ccccc1)c2ccccc2)CC3
FC(F)(F)C4=Nc1ccccc1N=C(c3ccc2ccccc2c3)C4	ZINC000000340547	C2C=Nc1ccccc1N=C2c4ccc3ccccc3c4
COc2cc(C(=O)N1CCC[C@H](C(F)(F)F)C1)cc(OC)c2OC	ZINC000000239810	O=C(N1CCCCC1)c2ccccc2
CSCC[C@@H](NC(=O)C(/NC(=O)c1ccc(Br)cc1)=C/c2ccc(N(=O)=O)cc2)C(O)=O	ZINC000002117331	O=C(NC=Cc1ccccc1)c2ccccc2
N[C@@H](CO)C(=O)N[C@@H](CC(O)=O)C(O)=O	ZINC000002522588	nonring
CCOC(=O)c1sc(NC(=O)C(C)C)c(C(=O)OCC)c1C	ZINC000000045217	c1ccsc1
CC[C@@](C)(NC(=O)CN3c1cccc2cccc(c12)S3(=O)=O)C#C	ZINC000000033788	O=S1(=O)Nc2cccc3cccc1c23
Fc4ccc(N3CCN(C(=O)Nc1cccc2ccccc12)CC3)cc4	ZINC000000311669	O=C(Nc1cccc2ccccc12)N4CCN(c3ccccc3)CC4
Cc2cc(C)cc(NC(=O)COc1ccc(Br)cc1C)c2	ZINC000000070637	O=C(COc1ccccc1)Nc2ccccc2
OC(=O)c5cccc(C(=O)N1C[C@@H]4C[C@H](C1)c3ccc(NS(=O)(=O)c2ccc(Cl)cc2)c(=O)n3C4)c5	ZINC000004150056	O=C(N1CC4CC(C1)c3ccc(NS(=O)(=O)c2ccccc2)c(=O)n3C4)c5ccccc5
COc1cc(N(=O)=O)ccc1c2ccc(\C=N\NC(N)=S)o2	ZINC000000033233	c2ccc(c1ccco1)cc2
CCOC(=O)c1c(C)c(C)sc1NC(=S)N2CCN(C)CC2	ZINC000000160373	S=C(Nc1cccs1)N2CCNCC2
CCOc4ccc([C@@H]2C[C@H](c1ccc(C)cc1)Nc3nc(N)nn23)cc4	ZINC000000526662	C3C(c1ccccc1)Nc2ncnn2C3c4ccccc4
CC(C)(C)NC(=O)C3CCN(Cc2ccc1OCOc1c2)CC3	ZINC000000299275	C3CCN(Cc2ccc1OCOc1c2)CC3
Nc3nc(N)c2nc(CSc1ccccc1)cnc2n3	ZINC000000005088	C(Sc1ccccc1)c3cnc2ncncc2n3
Oc2ccc(\C=C(/C#N)C(=O)OCCc1cccs1)cc2O	ZINC000000012514	O=C(OCCc1cccs1)C=Cc2ccccc2
COC(=O)c/2c(C)n(Cc1ccccc1)c(=O)c\2=C/c3cccc(O)c3	ZINC000000113015	O=c2n(Cc1ccccc1)ccc2=Cc3ccccc3
NC(=O)c1cccc2cccc(C(O)=O)c12	ZINC000000156339	c2ccc1ccccc1c2
COc2cc4CC[N+](C)(C)[C@H]3Cc1cccc(OC)c1c(c2O)c34	ZINC000000174794	C2Cc3cccc4c1ccccc1CC(N2)c34
C[C@H](Oc1ccc(Cl)cc1C)C(=O)Nc3ccc(S(=O)(=O)Nc2ccccn2)cc3	ZINC000000790783	O=C(COc1ccccc1)Nc3ccc(S(=O)(=O)Nc2ccccn2)cc3
O=C3CCN(C(=O)C=Cc1ccccc1)c4cc2ccccc2cc34	ZINC000000028952	O=C3CCN(C(=O)C=Cc1ccccc1)c4cc2ccccc2cc34
Fc2ccc(F)c(NC(=O)NCC1CCCCC1)c2	ZINC000000023541	O=C(NCC1CCCCC1)Nc2ccccc2
COC(=O)CCC(=O)N1CCc2ccccc12	ZINC000000027609	C2Cc1ccccc1N2
COc1ccccc1C(=O)Nc3ccc2nc(SC)sc2c3	ZINC000000028951	O=C(Nc2ccc1ncsc1c2)c3ccccc3
Cc2ccc(NC(=O)[C@@H]1CCCN1C(=O)C(C)(C)C)cc2	ZINC000000028957	O=C(Nc1ccccc1)C2CCCN2
CC[C@H](C(=O)NC(N)=O)c1ccccc1	ZINC000000000274	c1ccccc1
CC2(C)OC(=O)N(c1cccnc1)[C@@]2(C)O	ZINC000000062835	O=C1OCCN1c2cccnc2
CCN(CC)c3ccc(NC(=O)[C@@H]1C[C@@H]1c2ccccc2)cc3	ZINC000000027607	O=C(Nc1ccccc1)C2CC2c3ccccc3
CC(=O)Nc4ccc(c3cn2nc(c1ccc(C)cc1)sc2n3)cc4	ZINC000000046988	c4ccc(c3cn2nc(c1ccccc1)sc2n3)cc4
CCOC(=O)c2cc(C(=O)c1ccc(Br)cc1)n4c2ccc3ccccc34	ZINC000000624970	O=C(c1ccccc1)c3ccc4ccc2ccccc2n34
COc2ccc(OC)c(NC(=S)NC(=O)C=Cc1cccs1)c2	ZINC000000511741	O=C(NC(=S)Nc1ccccc1)C=Cc2cccs2
Clc3ccc2NC(=O)CN=C(c1ccc[nH]1)c2c3	ZINC000000005155	O=C3CN=C(c1ccc[nH]1)c2ccccc2N3
CC(C)CNC(=O)C[C@H](c1ccccc1)c2c(O)ccc3ccccc23	ZINC000000226882	C(c1ccccc1)c2cccc3ccccc23
Brc3cccc(C(=O)NCCc1c[nH]c2ccccc12)c3	ZINC000000068506	O=C(NCCc1c[nH]c2ccccc12)c3ccccc3
CNC(=O)c3cc2c(C)nn(c1ccccc1)c2s3	ZINC000000041344	c3ccc(n1ncc2ccsc12)cc3
C[C@@]3(CC(=O)c1ccccc1)Cn2c(=O)c5cccc4cccc(c2=[O+]3)c45	ZINC000000640036	O=C(CC2Cn1c(=O)c4cccc3cccc(c1=[O+]2)c34)c5ccccc5
C[C@@H](NCCn2c(=O)n(C)c1ncn(C)c1c2=O)c3ccccc3	ZINC000000033849	O=c2[nH]c1nc[nH]c1c(=O)n2CCNCc3ccccc3
CCc3ccc(c2ccc(C(=O)Nc1cccc(Cl)c1)cc2)nc3	ZINC000000254498	O=C(Nc1ccccc1)c3ccc(c2ccccn2)cc3
Cc3ccc(COc2ccc(\C=N\c1oc(C)c(C)c1C#N)cc2)cc3	ZINC000000561463	C(Oc2ccc(C=Nc1ccco1)cc2)c3ccccc3
Cc2nnc3[nH]c(c1ccc(Br)cc1)nn23	ZINC000000033120	c3ccc(c2nn1cnnc1[nH]2)cc3
Cc2[nH]c1nc(=O)sc1cc2c3ccncc3	ZINC000000018359	O=c3nc2[nH]cc(c1ccncc1)cc2s3
COc1ccccc1N5CCN(C[C@@H]2CN=c3n2c(=O)[nH]c4ccccc34)CC5	ZINC000000601766	O=c4[nH]c1ccccc1c5=NCC(CN3CCN(c2ccccc2)CC3)n45
COC(=O)Cn1c(C)cc(C=O)c1C	ZINC000000009390	c1cc[nH]c1
Cc2cc(C(F)(F)F)n1ncnc1n2	ZINC000000033128	c2cnc1ncnn1c2
Cc2cc(C)c(NC(=O)c1ccccc1Br)c(C)c2	ZINC000000038835	O=C(Nc1ccccc1)c2ccccc2
OC(=O)[C@@H]1CCCN1NC(S)=S	ZINC000114375367	C1CCNC1
Cc1c(O)c(=O)ccn1CC=C	ZINC000000004379	O=c1cc[nH]cc1
COC(=O)C2(c1ccccc1Cl)CCNCC2	ZINC000000022417	C2CC(c1ccccc1)CCN2
CC(=O)NCCc2c(Cc1ccccc1)[nH]c3ccccc23	ZINC000000003941	C(c1ccccc1)c3cc2ccccc2[nH]3
COc1ccccc1n4c(=S)[nH]c(=O)\c(=C/c3ccc(c2cc(C(O)=O)ccc2C)o3)c4=O	ZINC000000665794	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc4ccc(c3ccccc3)o4
OC(=O)c1nc[nH]c(=O)c1Br	ZINC000019865245	O=c1ccnc[nH]1
ONC(=O)CCOc2ccc(c1ccc(C#N)cc1)cc2	ZINC000000022419	c2ccc(c1ccccc1)cc2
CC(=O)N[C@@H](c1ccc(Br)cc1)c2cc(C)cc(C)c2O	ZINC000000360123	C(c1ccccc1)c2ccccc2
Oc3cc2[C@H](c1ccccc1)CNCCc2c(Cl)c3O	ZINC000000005579	C3Cc1ccccc1C(c2ccccc2)CN3
OC(=O)CCC(=O)Nc2ccc(Oc1ccc(Cl)cc1)cc2	ZINC000000277191	O(c1ccccc1)c2ccccc2
CCOC(=O)n1ccn(C)c1=S	ZINC000000001091	S=c1[nH]cc[nH]1
Clc3ccc(S(=O)(=O)C2(C(=O)NCc1ccccc1)CC2)cc3	ZINC000000427173	O=C(NCc1ccccc1)C3(S(=O)(=O)c2ccccc2)CC3
NC(=O)C4CCN(C3(n1nnc2ccccc12)CCCCC3)CC4	ZINC000000053066	C4CCN(C3(n1nnc2ccccc12)CCCCC3)CC4
FC(F)(Cl)Oc2ccc(NC(=O)NC(=O)c1cccs1)cc2	ZINC000000091524	O=C(NC(=O)c1cccs1)Nc2ccccc2
O=c2[nH]c(=O)c1ccccc1o2	ZINC000000001098	O=c2[nH]c(=O)c1ccccc1o2
Cc1ccc(N(=O)=O)cc1NC(=O)[C@@H]2CCCN2C(=O)OC(C)(C)C	ZINC000000313405	O=C(Nc1ccccc1)C2CCCN2
Clc3c(CSc1nnnn1c2ccccc2)nc4ccccn34	ZINC000000055566	C(Sc1nnnn1c2ccccc2)c4cn3ccccc3n4
O=C(N2c1ccccc1CCc3ccccc23)c4ccc(N(=O)=O)cc4	ZINC000000055116	O=C(N2c1ccccc1CCc3ccccc23)c4ccccc4
Nc1cc(C(O)=O)cc(N(=O)=O)c1O	ZINC000039084539	c1ccccc1
C[C@@]3(C(=O)Nc1nccs1)CC4c2ccccc2C3c5ccccc45	ZINC000000036779	O=C(Nc1nccs1)C3CC4c2ccccc2C3c5ccccc45
Cc3cc(OCc2ccc(C(=O)NC1CCCCC1)o2)ccc3Cl	ZINC000000115492	O=C(NC1CCCCC1)c3ccc(COc2ccccc2)o3
Cc1cc(=O)[nH]c(SCCS(O)(=O)=O)n1	ZINC000004024330	O=c1ccnc[nH]1
Cc3cccc(/N=C/c2ccc(OCc1cccc(Cl)c1)cc2)c3	ZINC000000061696	C(Oc2ccc(C=Nc1ccccc1)cc2)c3ccccc3
Cc3nn(C(=O)[C@H]2[C@@H]1CC[C@@H](O1)[C@@H]2C(O)=O)c(C)c3Br	ZINC000000215085	O=C(C1CC2CCC1O2)n3cccn3
FC(F)C(F)(F)COCc2ccc(C(=O)NC[C@@H]1CCCO1)cc2	ZINC000000468071	O=C(NCC1CCCO1)c2ccccc2
CCc3cc2c(=S)c(c1ccccc1Cl)coc2cc3OC	ZINC000000311061	S=c2c(c1ccccc1)coc3ccccc23
On2c(=O)c(c1ccccc1)n(=O)c3ccccc23	ZINC000000102109	O=c2[nH]c1ccccc1n(=O)c2c3ccccc3
Clc2ccc(C(=O)NC(=S)NCc1ccccc1)c(Cl)c2	ZINC000000067502	O=C(NC(=S)NCc1ccccc1)c2ccccc2
CCOC(=O)c2nc(C)n([C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1O)c2N	ZINC000009329394	C2COC(n1ccnc1)C2
CCCn3c([C@H]2CN(c1ccc(C)c(C)c1)C(=O)C2)nc4ccccc34	ZINC000000252082	O=C3CC(c2nc1ccccc1[nH]2)CN3c4ccccc4
COc2c1CNCCn1c3ccc(F)cc23	ZINC000000017967	C1Cn2c(CN1)cc3ccccc23
O=C2CSc1ccccc1CN2	ZINC000000008066	O=C2CSc1ccccc1CN2
CCOC(=O)c3sc2ncn(CCc1ccccc1)c(=O)c2c3C	ZINC000000098308	O=c2n(CCc1ccccc1)cnc3sccc23
CC2SC(c1ccc(Cl)cc1)=NC2=O	ZINC000000012803	O=C2CSC(c1ccccc1)=N2
C[C@H]1CC(=O)NN=C1c3ccc2N(C)C(=O)C(C)(C)c2c3	ZINC000000004118	O=C3CCC(c2ccc1NC(=O)Cc1c2)=NN3
CC(C)(C)NC(=O)c3sc2nc(c1cccs1)ccc2c3N	ZINC000000055386	c3csc(c2ccc1ccsc1n2)c3
Cc2cc(C)c(OCC(=O)NN=Cc1cc(N(=O)=O)cc(Br)c1O)c(Br)c2	ZINC000002051871	O=C(COc1ccccc1)NN=Cc2ccccc2
CCOC2C(=C)C(=O)c1cc(=O)n(C)cc1C2=O	ZINC000000008262	C=C2CC(=O)c1c[nH]c(=O)cc1C2=O
O=C(N(Cc1ccccc1)c2ccccn2)c3ccccc3N(=O)=O	ZINC000000047033	O=C(N(Cc1ccccc1)c2ccccn2)c3ccccc3
OC(=O)c1ccc(Cl)cc1Nc2ccccc2	ZINC000000029077	N(c1ccccc1)c2ccccc2
OC(=O)C(O)(C1CCCCC1)C2CCCCC2	ZINC000000080873	C2CCC(CC1CCCCC1)CC2
COc2ccc(OC)c(/C=C/C(=O)Nc1cc(Cl)ccc1C)c2	ZINC000000048116	O=C(Nc1ccccc1)C=Cc2ccccc2
COc4cccc(c3nnn(CC(=O)N1CCCc2ccccc12)n3)c4	ZINC000000416118	O=C(Cn2nnc(c1ccccc1)n2)N3CCCc4ccccc34
CC(C)(C)OC(=O)N[C@@]1(C(O)=O)C[C@@H]1C(O)=O	ZINC000060071030	C1CC1
O=C(N[C@H]2CCc1nc[nH]c1C2)c3ccccc3Oc4ccccc4	ZINC000000027170	O=C(NC2CCc1nc[nH]c1C2)c3ccccc3Oc4ccccc4
Cc1ccc(Cl)cc1NC(=O)CCn3c(=O)c2ccccc2c3=O	ZINC000000045197	O=C(CCn2c(=O)c1ccccc1c2=O)Nc3ccccc3
Clc3ccc(COc2ccc1ccccc1c2C=O)c(Cl)c3	ZINC000000167878	C(Oc2ccc1ccccc1c2)c3ccccc3
Cc2cc(NC(=O)c1ccsc1)cc(C)c2O	ZINC000000004574	O=C(Nc1ccccc1)c2ccsc2
CCOC(=O)c1c(C)c(C(C)=O)sc1NC(=O)C(C)(C)C	ZINC000000045190	c1ccsc1
C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)Nc2ccc(CC#N)cc2	ZINC000000037228	O=C(COc1ccccc1)Nc2ccccc2
NS(=O)(=O)c3ccc(c1coc(=O)n1c2ccc(F)cc2)cc3	ZINC000000008604	O=c2occ(c1ccccc1)n2c3ccccc3
CC4CCN(C[C@@H](O)Cn2c1ccccc1sc3ccccc23)CC4	ZINC000000706985	C4CCN(CCCn2c1ccccc1sc3ccccc23)CC4
Cc2cc(=O)n(C(=S)Nc1ccccc1)[nH]2	ZINC000000040345	O=c1cc[nH]n1C(=S)Nc2ccccc2
CCN(CC)C[C@H]2COc1ccccc1O2	ZINC000000000674	C2COc1ccccc1O2
C[C@@H](Cc2ccc1OCOc1c2)NC[C@H](O)c3ccc(O)c(O)c3	ZINC000000000677	C(Cc1ccccc1)NCCc3ccc2OCOc2c3
COc3ccc2n(C)c1cc([C@H](C)C(O)=O)ccc1sc2c3	ZINC000000000676	c3ccc2sc1ccccc1[nH]c2c3
CC(C)c1cccc(C(C)C)c1NC(=O)NCCc2ccccc2	ZINC000000011347	O=C(NCCc1ccccc1)Nc2ccccc2
CCc2nnc(/N=C/c1ccc(O)cc1)s2	ZINC000000040348	C(=Nc1nncs1)c2ccccc2
CCc4nc(C)c(CN3CCC(N2CCC(C(=O)NCc1ccccn1)CC2)CC3)[nH]4	ZINC000011936570	O=C(NCc1ccccn1)C4CCN(C3CCN(Cc2cnc[nH]2)CC3)CC4
O=C(NCc2ccc1OCOc1c2)C(c3ccccc3)c4ccccc4	ZINC000000035971	O=C(NCc2ccc1OCOc1c2)C(c3ccccc3)c4ccccc4
CCN(CC)S(=O)(=O)c2cccc(C(=O)Nc1nccs1)c2	ZINC000000050605	O=C(Nc1nccs1)c2ccccc2
COc1cc(C=O)cc(Cl)c1OC(=O)N2CCOCC2	ZINC000000028987	O=C(Oc1ccccc1)N2CCOCC2
COc1ccccc1NC(=O)[C@H]3CCc2[nH]cnc2C3	ZINC000000004596	O=C(Nc1ccccc1)C3CCc2[nH]cnc2C3
C2CC=C(c1ncco1)CN2	ZINC000000004597	C2CC=C(c1ncco1)CN2
COc2ccc(O)c(C=NNC1=NC(=O)C(C)S1)c2	ZINC000000048626	O=C2CSC(NN=Cc1ccccc1)=N2
CC(C)Oc1ccccc1NC(=O)Nc2ccc(Br)cc2	ZINC000000035979	O=C(Nc1ccccc1)Nc2ccccc2
COc1ccccc1C(=O)Nc3ccc2c(C)cc(=O)oc2c3	ZINC000000047102	O=C(Nc2ccc1ccc(=O)oc1c2)c3ccccc3
CCOC(=O)Nc2ccc(S(=O)(=O)Nc1c(C)cccc1C)cc2	ZINC000000073812	O=S(=O)(Nc1ccccc1)c2ccccc2
NC(=O)\C(=C/c1ccc(N(=O)=O)o1)c2ccco2	ZINC000000001501	C(=Cc1ccco1)c2ccco2
CC3(C)Oc1ccc(C#N)cc1[C@H](OC2=CC(=O)CC2)[C@H]3O	ZINC000000004023	O=C3CCC(OC1CCOc2ccccc12)=C3
C4Oc3ccc(C=Nc2ccc1n[nH]cc1c2)cc3O4	ZINC000000028480	C4Oc3ccc(C=Nc2ccc1n[nH]cc1c2)cc3O4
Cn2c(c1ccc(F)cc1)[n+](C)c3ccccc23	ZINC000000041836	c3ccc(c2nc1ccccc1[nH]2)cc3
CC2(C)CC(=O)C(=NNc1cc(C(F)(F)F)ccc1Cl)C(=O)C2	ZINC000000041837	O=C1CCCC(=O)C1=NNc2ccccc2
C[C@H](N1CCCC1)C(=O)Nc2ccccc2C	ZINC000000000051	O=C(CN1CCCC1)Nc2ccccc2
Cc3ccc2c(N)c(C(=O)c1ccc(Cl)cc1)sc2n3	ZINC000000076112	O=C(c1ccccc1)c3cc2cccnc2s3
COc2ccc1nc(C)cc(SC[C@@H](NC(=O)/C=C/C(O)=O)C(O)=O)c1c2	ZINC000006719280	c2ccc1ncccc1c2
O=S(=O)(Nc2ccc1OCCOc1c2)c3ccccc3C#N	ZINC000000074854	O=S(=O)(Nc2ccc1OCCOc1c2)c3ccccc3
Cc4cc(N2CCN(c1ccccc1)CC2)nc(n3nc(C)cc3C)n4	ZINC000000477618	C3CN(c2ccnc(n1cccn1)n2)CCN3c4ccccc4
C3CN=C(NCCc2ccc1OCOc1c2)N3	ZINC000000017382	C3CN=C(NCCc2ccc1OCOc1c2)N3
Cc3ccc(S(=O)(=O)N2CCN(c1ccccc1C)CC2)cc3	ZINC000000036406	O=S(=O)(N2CCN(c1ccccc1)CC2)c3ccccc3
CC(=O)NN3[C@@H](c1ccccc1O)Nc2ccccc2C3=O	ZINC000000032163	O=C2NC(c1ccccc1)Nc3ccccc23
Cn1nnnc1SCC(=O)Nc2ccc(F)c(Cl)c2	ZINC000000031472	O=C(CSc1nnn[nH]1)Nc2ccccc2
OC(=O)[C@@H](S)[C@H](S)C(O)=O	ZINC000003831474	nonring
CCc3c(C(=O)c1cc(C)cc(C)c1)n(CC2CCC2)c(=O)[nH]c3=O	ZINC000000026268	O=C(c1ccccc1)c2cc(=O)[nH]c(=O)n2CC3CCC3
Cc1ccccc1OC[C@H](O)COC(N)=O	ZINC000000000451	c1ccccc1
Cc1ccccc1OC[C@H](O)CO	ZINC000000000450	c1ccccc1
COc1ccccc1OC[C@@H]2CNC(=O)O2	ZINC000000000452	O=C2NCC(COc1ccccc1)O2
CN(C1CCCCC1)C(=O)c2ccc(F)cc2	ZINC000000029774	O=C(NC1CCCCC1)c2ccccc2
NC(=O)c2ccc(NC(=O)c1c(Cl)cccc1Cl)cc2	ZINC000000030339	O=C(Nc1ccccc1)c2ccccc2
Cc1ccccc1NC(=O)c2ccc(F)cc2	ZINC000000029776	O=C(Nc1ccccc1)c2ccccc2
Cc2ccc(NC(=O)Oc1cc(Cl)c(Cl)cc1Cl)c(C)c2	ZINC000000401777	O=C(Nc1ccccc1)Oc2ccccc2
COc2cc(NC(=O)c1cccc(Br)c1)nc(OC)n2	ZINC000000075890	O=C(Nc1ccncn1)c2ccccc2
Nc3c(c2nc1ccccc1[nH]2)nnn3Cc4ccccc4	ZINC000000031867	C(c1ccccc1)n4cc(c3nc2ccccc2[nH]3)nn4
C(NCc1ccncc1)c2ccncc2	ZINC000000001506	C(NCc1ccncc1)c2ccncc2
Cn3c(N2CCN(CCc1ccccc1)CC2)cc(=O)n(C)c3=O	ZINC000000015120	O=c3cc(N2CCN(CCc1ccccc1)CC2)[nH]c(=O)[nH]3
CC(=O)OC(OC(C)=O)c1ccc(OC(C)=O)c(OC(C)=O)c1	ZINC000000004755	c1ccccc1
CCOC(=O)c2c(C)n(CC)c3ccc(OC(=O)c1ccco1)cc23	ZINC000000103759	O=C(Oc2ccc1[nH]ccc1c2)c3ccco3
CCN(CC)c1ccc(C=C(C#N)C#N)cc1	ZINC000000028397	c1ccccc1
Cc4ccc3nc(c2ccc(/N=C/c1sccc1C)cc2)sc3c4	ZINC000000096034	C(=Nc3ccc(c2nc1ccccc1s2)cc3)c4cccs4
Cc3ccc(C)c(N2C(=O)C[C@H]([C@@H]1CCCO1)C2=O)c3	ZINC000000032303	O=C2CC(C1CCCO1)C(=O)N2c3ccccc3
Cc3ccc2oc(c1ccccc1)c(O)c(=O)c2c3	ZINC000000039120	O=c2cc(c1ccccc1)oc3ccccc23
Cc1cc(Cl)ccc1OCc3nc(c2ccc(N(=O)=O)cc2)no3	ZINC000000099435	C(Oc1ccccc1)c3nc(c2ccccc2)no3
Clc1ccc(N(=O)=O)cc1C(=O)N2CCNC2=O	ZINC000000037041	O=C1NCCN1C(=O)c2ccccc2
COc3ccc(S(=O)(=O)Nc2ccc1C(=O)OCc1c2)cc3OC	ZINC000000106900	O=C2OCc3cc(NS(=O)(=O)c1ccccc1)ccc23
C[C@H]1NC(=O)CO[C@@H]1c2ccccc2	ZINC000000000298	O=C2COC(c1ccccc1)CN2
C4CCN(CCOc2nnc(c1ccccc1)c3ccccc23)CC4	ZINC000000532384	C4CCN(CCOc2nnc(c1ccccc1)c3ccccc23)CC4
CCC(Nc1ccc(OC)cc1)=C3C(=O)CC(c2ccccc2)CC3=O	ZINC000000439128	O=C2CC(c1ccccc1)CC(=O)C2=CNc3ccccc3
Oc1ccc(Br)cc1CNc3ccc2OCOc2c3	ZINC000000032307	C3Oc2ccc(NCc1ccccc1)cc2O3
Oc2c(\C=c1\c(=O)[nH]c(=S)n(CC=C)c1=O)cc(N(=O)=O)cc2N(=O)=O	ZINC000009311197	O=c1[nH]c(=S)[nH]c(=O)c1=Cc2ccccc2
C[N@]1[C@H]3CC[C@@H]1CC(NC(=O)CSc2ccc(C)cc2)C3	ZINC000000136053	O=C(CSc1ccccc1)NC2CC3CCC(C2)N3
O=C(N1CCCCC1)c5cccc(C[N@]4CCN2[C@@H](COc3ccccc23)C4)c5	ZINC000000600835	O=C(N1CCCCC1)c5cccc(CN4CCN2C(COc3ccccc23)C4)c5
CC(C)OC(=O)C(C(=O)Nc1nc(C)cs1)=C2SCS2	ZINC000000006847	O=C(Nc1nccs1)C=C2SCS2
CC[C@@H]1CCCCN1C(=O)c3cc(c2ccc(C)o2)nc4ccccc34	ZINC000000483293	O=C(N1CCCCC1)c3cc(c2ccco2)nc4ccccc34
OC(=O)Cn4c1ccccc1c5nnc(SCC(=O)N(C2CCCCC2)C3CCCCC3)nc45	ZINC000001331111	O=C(CSc1nnc3c(n1)[nH]c2ccccc23)N(C4CCCCC4)C5CCCCC5
COc3ccc(Cn2c(=S)[nH]c1cc(C(O)=O)ccc1c2=O)cc3	ZINC000000269672	O=c2n(Cc1ccccc1)c(=S)[nH]c3ccccc23
C4CN(CCn2c(NCc1ccco1)nc3ccccc23)CCO4	ZINC000000350258	C4CN(CCn2c(NCc1ccco1)nc3ccccc23)CCO4
Cc2ccc(NC(=O)Nc1ccc(Cl)cc1Cl)cc2	ZINC000000042500	O=C(Nc1ccccc1)Nc2ccccc2
FC(F)(F)COc1ccc(C(F)(F)F)cc1NN=C(C#N)C#N	ZINC000000110325	c1ccccc1
N[C@@H](Cc1ccc(O)c(I)c1)C(O)=O	ZINC000000001575	c1ccccc1
COc3c1OCOc1cc2CC[N+](C)(C)[C@H](CC(=O)C(C)C)c23	ZINC000000487511	C3Cc2cc1OCOc1cc2CN3
CCc2c(C)sc(NC(=O)c1ccncc1)c2C(=O)OC	ZINC000000027960	O=C(Nc1cccs1)c2ccncc2
COc2cc(C(=O)NC(=S)Nc1ccccc1)cc(OC)c2OC	ZINC000000309572	O=C(NC(=S)Nc1ccccc1)c2ccccc2
O=C(Oc3ccc(Nc1ncnc2ccccc12)cc3)C4CCCCC4	ZINC000000132694	O=C(Oc3ccc(Nc1ncnc2ccccc12)cc3)C4CCCCC4
C[C@@H]1CCc2c(C1)scc2C(=O)Nc4ccc3ccccc3c4	ZINC000000543221	O=C(Nc2ccc1ccccc1c2)c4csc3CCCCc34
Fc3ccc(N2CCN(C(=O)c1cccs1)CC2)cc3	ZINC000000029361	O=C(N2CCN(c1ccccc1)CC2)c3cccs3
CCOC(=O)c2cnc1cc(=O)[nH]n1c2C	ZINC000000027938	O=c2cc1ncccn1[nH]2
Cc5nc(Oc2ccc1OCOc1c2)c4cc(c3ccccc3)sc4n5	ZINC000000628258	C5Oc4ccc(Oc2ncnc3sc(c1ccccc1)cc23)cc4O5
CC(=C)COc3ccc2c(=O)c(c1ccc(Cl)cc1)c(C)oc2c3	ZINC000000521259	O=c2c(c1ccccc1)coc3ccccc23
COC(=O)[C@@H]2C[C@]1(C(O)=O)C[C@@](C(O)=O)(C[C@@H](C(=O)OC)C1=O)C2=O	ZINC000004368431	O=C1CCC2CC1CCC2=O
OC(=O)c1cc(Br)ccc1NC(=O)COCC(=O)Nc2ccc(Br)cc2C(O)=O	ZINC000026579161	O=C(COCC(=O)Nc1ccccc1)Nc2ccccc2
Oc4ccc(Cn2c(c1ccc(O)cc1)nc3ccccc23)cc4	ZINC000000210926	C(c1ccccc1)n3c(c2ccccc2)nc4ccccc34
FC(F)(F)c5cccc(N4CCN(CCc2nnc3[C@H]1CCC[C@H]1Cn23)CC4)c5	ZINC000000537940	C5CC4Cn3c(CCN2CCN(c1ccccc1)CC2)nnc3C4C5
CNC(=O)Oc2ccc(c1ccccc1)cc2	ZINC000000001892	c2ccc(c1ccccc1)cc2
Cc3nc(C1CCCCC1)c(c2ccc(S(N)(=O)=O)c(F)c2)o3	ZINC000000006662	C3CCC(c1ncoc1c2ccccc2)CC3
S=C(CC(=S)N1CCOCC1)N2CCOCC2	ZINC000000027759	S=C(CC(=S)N1CCOCC1)N2CCOCC2
CC1(C)CC(=O)C3=C(C1)Nc2ncnn2[C@@H]3c4ccccc4Cl	ZINC000000067036	O=C1CCCC4=C1C(c2ccccc2)n3ncnc3N4
CCc3nc2sc(C(=O)c1cccc(Cl)c1)c(N)c2cc3C	ZINC000000093863	O=C(c1ccccc1)c3cc2cccnc2s3
COc2ccc(CNC(=O)N1CCOCC1)cc2	ZINC000000030247	O=C(NCc1ccccc1)N2CCOCC2
COc2ccc(c1csnn1)cc2S(=O)(=O)Nc3ccccc3	ZINC000000173305	O=S(=O)(Nc1ccccc1)c3cccc(c2csnn2)c3
CC(=O)c4ccc(NC(=O)C2c1ccccc1Oc3ccccc23)cc4	ZINC000000030242	O=C(Nc1ccccc1)C3c2ccccc2Oc4ccccc34
OC(=O)c3ccc(N2C(=O)C[C@H](N1CCCC1)C2=O)cc3	ZINC000000050867	O=C2CC(N1CCCC1)C(=O)N2c3ccccc3
Cc2nc(N1CCCC1)[nH]c(=O)c2C	ZINC000000006285	O=c2ccnc(N1CCCC1)[nH]2
C[C@H](Oc1ccccc1OC(C)=O)c2nn(C(C)=O)c3ccccc23	ZINC000000048806	C(Oc1ccccc1)c2n[nH]c3ccccc23
COc2ccc(NC(=O)CC[N@@](C)Cc1ccccc1)c(OC)c2	ZINC000000455059	O=C(CCNCc1ccccc1)Nc2ccccc2
CN(C)CCN(Cc1cccs1)C(=S)Nc2ccc(C)c(C)c2	ZINC000000212619	S=C(NCc1cccs1)Nc2ccccc2
COc2ccc(CC(=O)N1CCCC1)cc2	ZINC000000029160	O=C(Cc1ccccc1)N2CCCC2
CCN3CCN(c2cc(=O)n(c1ccc(OC)cc1)c(=O)[nH]2)CC3	ZINC000000252560	O=c2cc(N1CCNCC1)[nH]c(=O)n2c3ccccc3
CCc1ccccc1NC(=O)c2ccccc2C	ZINC000000029162	O=C(Nc1ccccc1)c2ccccc2
Cc2ccc1ccccc1c2NC(=O)COc3cccc4ccccc34	ZINC000000411593	O=C(COc1cccc2ccccc12)Nc3cccc4ccccc34
Cc2cccc(NC(=O)Cc1cccs1)n2	ZINC000000030808	O=C(Cc1cccs1)Nc2ccccn2
COc1ccccc1n2c(CCC(O)=O)ccc2c3ccccc3	ZINC000000095943	c3ccc(c1cccn1c2ccccc2)cc3
Clc2cccc3CC[C@]1(COC(=N)N1)Cc23	ZINC000000006263	N=C3NC2(CCc1ccccc1C2)CO3
CC(C)CCNC1=NS(=O)N=C1Nc2cc(Cl)cc(Cl)c2	ZINC000000006269	O=S2N=CC(Nc1ccccc1)=N2
COC(=O)CCC(=O)Nc2nc(c1ccccc1)cs2	ZINC000000038860	c2ccc(c1cscn1)cc2
Cn3cnc(S(=O)(=O)N(Cc1ccccc1)Cc2cccs2)c3	ZINC000000146175	O=S(=O)(N(Cc1ccccc1)Cc2cccs2)c3c[nH]cn3
Cc2ccnc(NS(=O)(=O)c1cc(C)c(Cl)cc1C)c2	ZINC000000384748	O=S(=O)(Nc1ccccn1)c2ccccc2
O=C(CCN1CCCCC1)NC[C@@H]2OCCc3ccccc23	ZINC000000108691	O=C(CCN1CCCCC1)NCC2OCCc3ccccc23
Cc3cc(C)c2c(N)c(C(=O)N1CCOCC1)sc2n3	ZINC000000032669	O=C(N1CCOCC1)c3cc2cccnc2s3
CN(C)c3ccc(\C=N\c2c(C)n(C)n(c1ccccc1)c2=O)cc3	ZINC000000061141	O=c2c(N=Cc1ccccc1)c[nH]n2c3ccccc3
Clc1ccccc1NC(=O)C3CCN(C(=O)c2cccs2)CC3	ZINC000000269522	O=C(Nc1ccccc1)C3CCN(C(=O)c2cccs2)CC3
CN(Cc1ccccc1)C(=O)c3cccn4c(=O)c2sccc2nc34	ZINC000000422905	O=C(NCc1ccccc1)c3cccn4c(=O)c2sccc2nc34
Clc4ccc3oc(C(=O)C1CC1)c(NC(=O)CN2CCCC2)c3c4	ZINC000000034766	O=C(CN1CCCC1)Nc3c(C(=O)C2CC2)oc4ccccc34
Cc2nc1sccn1c2c4csc(Nc3ccccn3)n4	ZINC000000034767	N(c1ccccn1)c4nc(c2cnc3sccn23)cs4
CC2=NN([C@@H](C#N)c1cccc(N(=O)=O)c1)C(C)(C)C2	ZINC000000032662	C2CN(Cc1ccccc1)N=C2
COc3ccc(CN2CCN(c1ccccc1)CC2)c(OC)c3	ZINC000000293635	C2CN(c1ccccc1)CCN2Cc3ccccc3
Clc3ccc(n2c(=O)c(Cl)c(NCc1ccco1)c2=O)cc3	ZINC000000076949	O=c2cc(NCc1ccco1)c(=O)n2c3ccccc3
COc1ccc(C=O)cc1COc2ccccc2N(=O)=O	ZINC000000035787	C(Oc1ccccc1)c2ccccc2
COc4ccc(\C=C1/Cc2cccc3c(N(=O)=O)ccc1c23)cc4	ZINC000000033090	C2C(=Cc1ccccc1)c3cccc4cccc2c34
CC(C)(C)NC(=O)c2ccc1[nH]ccc1c2	ZINC000000024398	c2ccc1[nH]ccc1c2
COc2ccc(OCC(=O)O[C@@H](C)CN1CCCCC1)cc2	ZINC000000249830	O=C(COc1ccccc1)OCCN2CCCCC2
Fc1ccccc1NC(=O)COc2cc(Cl)c(Cl)cc2Cl	ZINC000000398827	O=C(COc1ccccc1)Nc2ccccc2
Nc2cc(S(O)(=O)=O)cc3cc(S(O)(=O)=O)cc(OS(=O)(=O)c1ccccc1)c23	ZINC000001848667	O=S(=O)(Oc1cccc2ccccc12)c3ccccc3
Cc3cc(C)nc(NS(=O)(=O)c2ccc(NS(=O)(=O)c1ccccc1C)cc2)n3	ZINC000000683130	O=S(=O)(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c3ccccc3
CCn1c(C)nnc1SCc2ccccc2	ZINC000000034367	C(Sc1nnc[nH]1)c2ccccc2
O=C(Cc1ccc(N(=O)=O)cc1)Nc3ccc(Oc2ccccc2)cc3	ZINC000000168494	O=C(Cc1ccccc1)Nc3ccc(Oc2ccccc2)cc3
COC(=O)c2sc1ccccc1c2O	ZINC000000152829	c2ccc1sccc1c2
CC(=O)Nc2nc1ccc(C(O)=O)cc1s2	ZINC000000175326	c2ccc1scnc1c2
COc1ccc(S(N)(=O)=O)cc1C(=O)NC2CCN(C)CC2	ZINC000000347658	O=C(NC1CCNCC1)c2ccccc2
OC(=O)C[C@@H](NC(=O)C(F)(F)F)C(=O)N[C@@H](Cc1ccc(O)cc1)C(O)=O	ZINC000001642793	c1ccccc1
CN(Cc1ccccc1)C(=O)N2CCOCC2	ZINC000000030265	O=C(NCc1ccccc1)N2CCOCC2
COC(=O)c3sc2nc1CC[C@H](C)Cc1cc2c3N	ZINC000000035140	C3CCc2nc1sccc1cc2C3
CC[n+]1c(C)scc1c3c(C)oc2cc(OC(C)=O)ccc2c3=O	ZINC000000487600	O=c2c(c1cscn1)coc3ccccc23
C[N@]3CCC(\C=C\c2ccc1OCOc1c2)=CC3	ZINC000000201225	C3CC(C=Cc2ccc1OCOc1c2)=CCN3
Cc2ccc(C(=O)Nc1ccc(C(F)(F)F)cc1Cl)cc2	ZINC000000041697	O=C(Nc1ccccc1)c2ccccc2
N[C@H]2[C@@H](CO)COc3ccc1ccccc1c23	ZINC000000167384	C3COc2ccc1ccccc1c2C3
Clc3cccc(NC(=O)c2ccc(Cn1cc(Cl)cn1)cc2)c3	ZINC000000096561	O=C(Nc1ccccc1)c3ccc(Cn2cccn2)cc3
CO[C@H](C)[C@](O)(C(C)C)C(=O)OCC2=CC[N@]1CC[C@@H](O)[C@H]12	ZINC000000338200	C2CC1C=CCN1C2
CC[C@H]2OC(c1ccc(N(=O)=O)cc1)=Nc3ccccc23	ZINC000000032796	C2OC(c1ccccc1)=Nc3ccccc23
CCN(CC)C(=S)SCc1csc(C)n1	ZINC000000032794	c1cscn1
OC(=O)CNS(=O)(=O)c1ccc(C#N)o1	ZINC000308851181	c1ccoc1
O=C1CCCN1S(=O)(=O)c2ccccc2	ZINC000000010405	O=C1CCCN1S(=O)(=O)c2ccccc2
COC(=O)c2cnc(Sc1ccc(Cl)cc1)nc2C(F)(F)F	ZINC000000082384	S(c1ccccc1)c2ncccn2
Cc2ccc(C(=O)NC[C@@H]1CCCO1)cc2C	ZINC000000029942	O=C(NCC1CCCO1)c2ccccc2
Cc1ccc(C(=O)N(CC#N)CC#N)cc1C	ZINC000000029940	c1ccccc1
Cc3cc(NC=c2nc(c1ccccc1Br)oc2=O)no3	ZINC000000198360	O=c2oc(c1ccccc1)nc2=CNc3ccon3
C/C(CC(O)=O)=C/C(O)=O	ZINC000004278207	nonring
O=C(COc1cccc2ccccc12)N4CCN(c3ccccc3)CC4	ZINC000000052792	O=C(COc1cccc2ccccc12)N4CCN(c3ccccc3)CC4
CCOc2ccc(N1CC(=O)SC1=S)cc2	ZINC000000032403	O=C2CN(c1ccccc1)C(=S)S2
COC[C@@H](C)NC(=O)c1c(Cl)cccc1Cl	ZINC000000031685	c1ccccc1
O=c2nc(N1CCCCC1)s/c2=C/c3ccccn3	ZINC000000032401	O=c2nc(N1CCCCC1)sc2=Cc3ccccn3
FC(F)(F)c4cccc(N3CCN(CCc2ccc1[nH]c(=O)sc1c2)CC3)c4	ZINC000000604739	O=c4[nH]c3ccc(CCN2CCN(c1ccccc1)CC2)cc3s4
COc2ccc1c(Cl)c(C(N)=O)sc1c2	ZINC000000045997	c2ccc1sccc1c2
CCc4ccc(c3nc2cc(NC(=O)c1ccccc1)ccc2o3)cc4	ZINC000000348267	O=C(Nc3ccc2oc(c1ccccc1)nc2c3)c4ccccc4
COc2ccc(OC)c(NC(=O)c1ccc(C)cc1)c2	ZINC000000038712	O=C(Nc1ccccc1)c2ccccc2
FC(F)(F)c2cccc(NC(=O)\C=C\c1ccc(Cl)cc1)c2	ZINC000000063999	O=C(Nc1ccccc1)C=Cc2ccccc2
Nc2ccc(NC(=O)c1ccccc1O)cc2	ZINC000000072666	O=C(Nc1ccccc1)c2ccccc2
Clc4ccc(NS(=O)(=O)c3ccc(NC(=O)c2ccc1OCOc1c2)cc3)cc4Cl	ZINC000000672073	O=C(Nc2ccc(S(=O)(=O)Nc1ccccc1)cc2)c4ccc3OCOc3c4
COc3ccc(Cc2nc(c1ccc(Br)cc1)no2)cc3	ZINC000000070350	C(c1ccccc1)c3nc(c2ccccc2)no3
CCN(CC2CCN(C1CCN(C)CC1)CC2)C(=O)c3n[nH]c(=O)c4ccccc34	ZINC000011817900	O=C(NCC2CCN(C1CCNCC1)CC2)c3n[nH]c(=O)c4ccccc34
COc1cccc3c1sn4c2ccccc2c(=O)cc34	ZINC000000016688	O=c3cc2c1ccccc1sn2c4ccccc34
C[C@H]1CCCCN1C(=O)c2ccc(F)cc2	ZINC000000029777	O=C(N1CCCCC1)c2ccccc2
Cc3ccc(O)c([C@@H](CC(=O)N1CCNCC1)c2ccccc2)c3	ZINC000000538720	O=C(CC(c1ccccc1)c2ccccc2)N3CCNCC3
CC(=O)N2N=C(c1ccc(Cl)c(Cl)c1)OC23CCCC3	ZINC000000039271	C1CCC3(C1)NN=C(c2ccccc2)O3
Cc2cc(c1cc(C)c(N)c(S(O)(=O)=O)c1)cc(S(O)(=O)=O)c2N	ZINC000001681803	c2ccc(c1ccccc1)cc2
OC(=O)c1ccncc1C(O)=O	ZINC000000105344	c1ccncc1
CCOc3ccc([C@@H]1S[C@@H](C)C(=O)N1c2ccc(Cl)cc2)cc3	ZINC000000035029	O=C2CSC(c1ccccc1)N2c3ccccc3
CC(=O)Nc3ccc2c(=O)n(c1cccc(F)c1)c(=O)c2c3	ZINC000000032514	O=c2n(c1ccccc1)c(=O)c3ccccc23
Brc1ccccc1NS(=O)(=O)c2ccccc2	ZINC000000032086	O=S(=O)(Nc1ccccc1)c2ccccc2
Cc4ccc(c2[nH]c1ccccc1c2[C@@H](CN(=O)=O)c3ccco3)cc4	ZINC000000086118	C(c1ccco1)c3c(c2ccccc2)[nH]c4ccccc34
CCOC(=O)[C@@H](C)Oc3ccc2c(oc(=O)c1ccccc12)c3C	ZINC000000046573	O=c2oc1ccccc1c3ccccc23
O/N=C/c1non(=O)c1\C=N\O	ZINC000016136207	O=n1ccno1
Oc5cccc(c4cc(c1ccccc1)c3c(ccc2ncccc23)n4)c5	ZINC000000087758	c5ccc(c4cc(c1ccccc1)c3c(ccc2ncccc23)n4)cc5
CC2CCN(C[C@@H](O)COc1cc(C)ccc1C(C)C)CC2	ZINC000000124619	C2CCN(CCCOc1ccccc1)CC2
NNc2nn1c(C(F)(F)F)nnc1c3ccccc23	ZINC000000032537	c1ccc2c(c1)cnn3cnnc23
CC[N@@]1CCC[C@H]1CNC(=O)c2cc(S(N)(=O)=O)ccc2OC	ZINC000000057008	O=C(NCC1CCCN1)c2ccccc2
CCC(=O)Nc2nnc(CSCc1ccccc1)s2	ZINC000000033336	C(SCc1nncs1)c2ccccc2
Cc3cc(n2nc1ccc(Cl)cc1n2)c(O)c(C(C)(C)C)c3	ZINC000000056954	c3ccc(n2nc1ccccc1n2)cc3
CC(C)(C)c3ccc(c1nnnn1c2ccccc2C(F)(F)F)cc3	ZINC000000077835	c3ccc(c1nnnn1c2ccccc2)cc3
Cc4ccc(C)c(NC(=O)COc3ccc2oc1CCCCc1c2c3)c4	ZINC000000348653	O=C(COc3ccc2oc1CCCCc1c2c3)Nc4ccccc4
COc1ccccc1\C=N\c3nc2ccc(Br)cc2s3	ZINC000000050184	C(=Nc2nc1ccccc1s2)c3ccccc3
CSc2nc1ccccc1n2Cc3ccccn3	ZINC000000003833	C(c1ccccn1)n2cnc3ccccc23
Cc4ccc(S(=O)(=O)Nn3c(SCC(=O)Nc1nccs1)nc2ccccc2c3=O)cc4	ZINC000002974051	O=C(CSc2nc1ccccc1c(=O)n2NS(=O)(=O)c3ccccc3)Nc4nccs4
CC(C)N[C@@H](C)Cc1ccc(I)cc1	ZINC000000003834	c1ccccc1
Fc3ccc(c1n[nH]cc1c2ccc(F)c(C(F)(F)F)c2)cc3	ZINC000000027354	c3ccc(c1c[nH]nc1c2ccccc2)cc3
CCc1ccccc1Nc3nc(c2ccc(Cl)cc2)cs3	ZINC000000073624	N(c1ccccc1)c3nc(c2ccccc2)cs3
CC(=O)O/N=C/c1n[nH]cc1Br	ZINC000000077948	c1cn[nH]c1
O=c2onc(c1ccco1)/c2=C/c3ccco3	ZINC000000032283	O=c2onc(c1ccco1)c2=Cc3ccco3
CC(C)(C)OC(=O)N2Cc1ccccc1C[C@@H]2C(O)=O	ZINC000000057554	C2Cc1ccccc1CN2
Cc1c(Cl)cccc1NC(=O)c3ccc(c2cccc(Cl)c2)o3	ZINC000000459710	O=C(Nc1ccccc1)c3ccc(c2ccccc2)o3
COc3ccc(C(=O)N1CCc2ccccc12)cc3OC	ZINC000000029922	O=C(N1CCc2ccccc12)c3ccccc3
COC(=O)c4cc(c1ccccc1)c3c(=O)n(c2ccccc2)nc3[nH]4	ZINC000000408341	O=c3n(c1ccccc1)nc4[nH]ccc(c2ccccc2)c34
Cc2c(C(N)=O)sc3ncn(CC(=O)OC1CCCCC1)c(=O)c23	ZINC000000149887	O=C(Cn2cnc1sccc1c2=O)OC3CCCCC3
Nc3nc2n(\C=C1\C[C@@H]1CO)cnc2c(=O)[nH]3	ZINC000000022952	O=c2[nH]cnc3n(C=C1CC1)cnc23
Cc1ccccc1C(=O)Nc3cccc(NC(=O)c2ccccc2C)n3	ZINC000000052709	O=C(Nc2cccc(NC(=O)c1ccccc1)n2)c3ccccc3
COc2cc1CC(C)(C)NC(=C(CCC(C)C)C(N)=O)c1cc2OC	ZINC000000090403	C=C1NCCc2ccccc12
CCOC(=O)[C@@H]2CN(Cc1ccccc1)C(=O)C2=O	ZINC000000004960	O=C2CCN(Cc1ccccc1)C2=O
Cc1c(Cl)cccc1NC(=O)C3c2ccccc2Oc4ccccc34	ZINC000000117245	O=C(Nc1ccccc1)C3c2ccccc2Oc4ccccc34
CC(C)(C)OC(=O)CSc1ccc(C(F)(F)F)cc1N(=O)=O	ZINC000000072211	c1ccccc1
Cc1[nH]c(=O)[nH]c(=O)c1Br	ZINC000000032330	O=c1cc[nH]c(=O)[nH]1
Cc3ccc(Nc1nc(C#N)c(C#N)nc1Nc2ccc(C)cc2)cc3	ZINC000000055951	N(c1ccccc1)c2nccnc2Nc3ccccc3
OC(=O)C(CC1CC1)C(O)=O	ZINC000002505327	C1CC1
Cc3ccc(/N=C/c2cc1OCOc1cc2N(=O)=O)c(C)c3	ZINC000000062731	C3Oc2ccc(C=Nc1ccccc1)cc2O3
Clc1ccccc1\C=c3\sc2ccccc2c3=O	ZINC000000033202	O=c2c(=Cc1ccccc1)sc3ccccc23
C3CN=C(NC(C1CC1)C2CC2)O3	ZINC000000009708	C3CN=C(NC(C1CC1)C2CC2)O3
CCN2CC(=O)N(c1ccccc1C)C2=S	ZINC000000022391	O=C1CNC(=S)N1c2ccccc2
CC(=O)Nc3ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)Nc1ccccc1Cl)cc2)cc3	ZINC000001161997	O=S(=O)(Nc2ccc(S(=O)(=O)Nc1ccccc1)cc2)c3ccccc3
Cc2cc(C)c(C#N)c(SCc1c(Cl)cccc1Cl)n2	ZINC000000303480	C(Sc1ccccn1)c2ccccc2
NC(=N)c3cccc(NC(=O)c2ccc(C(=O)Nc1cccc(C(N)=N)c1)cc2)c3	ZINC000001685584	O=C(Nc1ccccc1)c3ccc(C(=O)Nc2ccccc2)cc3
Fc4ccc(c2csc3ncnc(Nc1ccccc1F)c23)cc4	ZINC000000137156	N(c1ccccc1)c3ncnc4scc(c2ccccc2)c34
Clc3ccc(\C=N\c1ccccc1C(=O)Nc2ccccc2)cc3	ZINC000000065649	O=C(Nc1ccccc1)c2ccccc2N=Cc3ccccc3
Nc2ncnc3n(C1CC(CO)C1)cnc23	ZINC000000011594	C3CC(n1cnc2cncnc12)C3
CCOC(=O)c1c[nH]c(=NNC)nc1C(F)(F)F	ZINC000000116078	N=c1nccc[nH]1
Cc4ccc(C(=O)N2C(=O)[C@@H](c1ccccc1)Oc3ccccc23)cc4	ZINC000000069379	O=C3C(c1ccccc1)Oc2ccccc2N3C(=O)c4ccccc4
CCOC(=O)c1c(C)[nH]c(C)c1c2ccccc2OC	ZINC000000028947	c2ccc(c1cc[nH]c1)cc2
CSc1nccc2ccccc12	ZINC000000023550	c2ccc1cnccc1c2
COC(=O)c4ccc([C@@H]2Nc1c(C)cc(C)cc1c3cc(C)nn23)cc4	ZINC000000382414	N3C(c1ccccc1)n2nccc2c4ccccc34
Cc3cc(C)c2nc(SCC(=O)c1ccc(F)cc1)c(C)cc2c3	ZINC000000411907	O=C(CSc2ccc1ccccc1n2)c3ccccc3
C[C@H]3CC(=C)C[C@H](c1ccccc1OC[C@@H](O)CN2CCCCC2)O3	ZINC000000348466	C=C3CCOC(c1ccccc1OCCCN2CCCCC2)C3
CC3(C)CC(NSc2nc1ccccc1s2)CC(C)(C)N3	ZINC000000027633	C3CC(NSc2nc1ccccc1s2)CCN3
CN(C)CCNC(=O)C2CCN(S(=O)(=O)N1CCCC1)CC2	ZINC000000219506	O=S(=O)(N1CCCCC1)N2CCCC2
Cc4cc(c3ccc2OC(C)(C)[C@@H](O)[C@H](NC(=O)c1cccnc1)c2c3)ccn4	ZINC000000538384	O=C(NC2CCOc3ccc(c1ccncc1)cc23)c4cccnc4
Cc4cccc(OC(=O)c2cc(c1ccccc1)nc3ccccc23)c4	ZINC000000527559	O=C(Oc1ccccc1)c3cc(c2ccccc2)nc4ccccc34
Clc2ncnc3c(C#N)c1CCCCn1c23	ZINC000000005160	C1CCn2c(C1)cc3ncncc23
CCOC(=O)c2ccc(/N=C/c1ccc(Br)cc1)cc2	ZINC000000061350	C(=Nc1ccccc1)c2ccccc2
Fc1ccccc1C(=O)Nc2ccccc2C(=O)NCc3ccccc3	ZINC000000130209	O=C(NCc1ccccc1)c2ccccc2NC(=O)c3ccccc3
CN(C)C(=O)Oc1cccnc1	ZINC000000013539	c1ccncc1
COc3ccc(C(=O)c2nc1ccccc1n2C(C)C)cc3OC	ZINC000000034812	O=C(c1ccccc1)c3nc2ccccc2[nH]3
Clc3ccc(CSCc2ccc(c1csnn1)cc2)cc3	ZINC000000106136	C(SCc2ccc(c1csnn1)cc2)c3ccccc3
CN(C)CC[C@@](C)(O)Cc1ccccc1	ZINC000000034810	c1ccccc1
Clc2ccc(N1CNC(=NN(=O)=O)NC1)cc2	ZINC000000033112	N=C2NCN(c1ccccc1)CN2
Cc4cc3CCN(C(=O)Nc2ccc(Oc1cccnc1C)nc2)c3cc4Cl	ZINC000000602170	O=C(Nc2ccc(Oc1cccnc1)nc2)N3CCc4ccccc34
Cc1c(Cl)cccc1NC(=O)c2ccccc2Br	ZINC000000061688	O=C(Nc1ccccc1)c2ccccc2
Clc3ccc([C@H](CC(=O)c1ccc(Br)cc1)[C@@H]2CCCCC2=O)cc3	ZINC000000624360	O=C1CCCCC1C(CC(=O)c2ccccc2)c3ccccc3
FC(F)(F)c2nc1ccccc1c(=O)n2c3ccccc3	ZINC000000004739	O=c2n(c1ccccc1)cnc3ccccc23
Clc1ccccc1C(=O)NCc2cccnc2	ZINC000000029566	O=C(NCc1cccnc1)c2ccccc2
COc3ccc([C@H]2[C@H]1CSCC=C1C(C#N)(C#N)C(N)=C2C#N)cc3	ZINC000000377688	C3SCC2C(c1ccccc1)C=CCC2=C3
Cc2ccc(S(=O)(=O)N(CC=C)CC(=O)Nc1cc(C)on1)cc2	ZINC000000326213	O=C(CNS(=O)(=O)c1ccccc1)Nc2ccon2
CCc2cc(=O)oc3cc(C)cc(OCC(=O)c1ccc(F)cc1)c23	ZINC000000082587	O=C(COc1cccc2oc(=O)ccc12)c3ccccc3
Cc2cccc(NC(=O)CNC(=O)c1ccc(Br)cc1)c2	ZINC000000255663	O=C(CNC(=O)c1ccccc1)Nc2ccccc2
CCN3C(=O)C[C@H](N2CCC(Cc1ccccc1)CC2)C3=O	ZINC000000053073	O=C3CC(N2CCC(Cc1ccccc1)CC2)C(=O)N3
CC(C)OC(=O)C4[C@H](c1cccc2ccccc12)n3ncnc3N=C4C	ZINC000000147870	C2C=Nc1ncnn1C2c3cccc4ccccc34
CCN(CC)CCn2c(NC(=O)c1cccc(F)c1)nc3ccccc23	ZINC000000754658	O=C(Nc2nc1ccccc1[nH]2)c3ccccc3
COc1ccc(O)c(C(C)(C)C)c1	ZINC000000001080	c1ccccc1
COC(=O)c2cnn3cccc(OCc1ccccc1)c23	ZINC000000015553	C(Oc1cccn2nccc12)c3ccccc3
Clc2cc(=N/C(=O)c1ccccc1)\cc/c2=N/C(=O)c3ccccc3	ZINC000000055555	O=C(N=c2ccc(=NC(=O)c1ccccc1)cc2)c3ccccc3
OC(=O)CCn3c2CC[C@H](NS(=O)(=O)c1ccc(F)cc1)Cc2c4ccccc34	ZINC000000538278	O=S(=O)(NC3CCc2[nH]c1ccccc1c2C3)c4ccccc4
Clc3ccc2sc(S/C=C/C(=O)c1ccccc1)nc2c3	ZINC000000068406	O=C(C=CSc2nc1ccccc1s2)c3ccccc3
CCOc3cc(\C=c2\[nH]c(=O)n(Cc1ccccc1)c2=O)c(Br)c(Br)c3O	ZINC000001408318	O=c2[nH]c(=Cc1ccccc1)c(=O)n2Cc3ccccc3
CN(C)CC[C@](O)(c1ccccc1)c3nc2ccccc2n3C	ZINC000000228820	C(c1ccccc1)c3nc2ccccc2[nH]3
CC(C)(C)c2ccc(C(=O)C[C@H](N1CCCC1)C(O)=O)cc2	ZINC000000044552	O=C(CCN1CCCC1)c2ccccc2
Cc2ccc(C(=O)COC(=O)c1c(C)cc(=O)oc1C)cc2N(=O)=O	ZINC000000083615	O=C(COC(=O)c1ccc(=O)oc1)c2ccccc2
CC(C)(C)c3ccc(NCc2cc1OCOc1cc2N(=O)=O)cc3	ZINC000000049034	C3Oc2ccc(CNc1ccccc1)cc2O3
CCNC(=O)NCc1cccc(Cl)c1	ZINC000000001640	c1ccccc1
COC(=O)CN(c1cc(C)ccc1OC)S(=O)(=O)c2ccccc2	ZINC000000379914	O=S(=O)(Nc1ccccc1)c2ccccc2
COc2cc(/N=C/c1ccc(Cl)cc1Cl)c(OC)cc2Cl	ZINC000000051397	C(=Nc1ccccc1)c2ccccc2
O=c3c(c1ccccc1)n(=O)c2ccccc2n3OCc4ccccc4	ZINC000000102115	O=c3c(c1ccccc1)n(=O)c2ccccc2n3OCc4ccccc4
Oc3ccc(/N=C/c1ccccc1OCc2ccccc2Cl)cc3	ZINC000000226092	C(Oc1ccccc1C=Nc2ccccc2)c3ccccc3
COc1ccccc1NC(=O)Oc3ccc(OCc2ccccc2)cc3	ZINC000000399186	O=C(Nc1ccccc1)Oc3ccc(OCc2ccccc2)cc3
CC[C@@H](C)[C@H](C(=O)OC1CCN(C)CC1)c2ccccc2	ZINC000000000594	O=C(Cc1ccccc1)OC2CCNCC2
N#Cc3c(SCc1ccccc1)nc(C2CC2)cc3c4cccs4	ZINC000000067515	C1CC1c4cc(c2cccs2)cc(SCc3ccccc3)n4
C/C=C/c2c(F)c(F)c(Oc1cccc(C(C)=O)c1)c(F)c2F	ZINC000000471746	O(c1ccccc1)c2ccccc2
CCOc2ccc(C(=O)Nc1cc(C)ccc1C)cc2Br	ZINC000000293831	O=C(Nc1ccccc1)c2ccccc2
NC2=NC(=O)[C@H](c1ccccc1)O2	ZINC000000000591	O=C1N=COC1c2ccccc2
CN(C)c2nc1[nH]c(=O)c(C(O)=O)nc1c(=O)[nH]2	ZINC000584658733	O=c2cnc1c(=O)[nH]cnc1[nH]2
CC(C)(C)C1CCC(CN)(CC(O)=O)CC1	ZINC000000022774	C1CCCCC1
O=C(Cn2c(=O)c1ccccc1c2=O)NCCc4nc3ccccc3[nH]4	ZINC000000044630	O=C(Cn2c(=O)c1ccccc1c2=O)NCCc4nc3ccccc3[nH]4
SC(=S)NCNC(S)=S	ZINC000005829417	nonring
O=C1OCc4c1cc3cc2OCOc2cc3c4c6ccc5OCOc5c6	ZINC000000005988	O=C1OCc4c1cc3cc2OCOc2cc3c4c6ccc5OCOc5c6
CC2=CC[C@@H](C(O)=O)[C@@H](c1ccc(F)cc1)C2	ZINC000000038180	C2CC(c1ccccc1)CC=C2
COc3ccc(\C=N\c1ccccc1C(=O)c2ccccc2)cc3O	ZINC000000066105	O=C(c1ccccc1)c2ccccc2N=Cc3ccccc3
CN(C)c3ccc(NC(=O)Nc1cc(C)nc2ccccc12)cc3	ZINC000000026077	O=C(Nc1ccccc1)Nc2ccnc3ccccc23
Nc2ncc([S@](=O)c1ccccn1)s2	ZINC000000013664	O=S(c1ccccn1)c2cncs2
CC(=O)NCCn1c(C)cc(C=O)c1C	ZINC000000004107	c1cc[nH]c1
CC(=O)Nc2ccc(C(=O)Nc1c(C)cc(C)cc1C)cc2	ZINC000000030386	O=C(Nc1ccccc1)c2ccccc2
COc1ccccc1Oc3cccc(N(Cc2cccnc2)S(=O)(=O)CC(F)(F)F)c3	ZINC000000591610	C(Nc2cccc(Oc1ccccc1)c2)c3cccnc3
COc2cc(C=c1c(=O)[nH]c(=O)[nH]c1=O)c(Br)cc2OCC(O)=O	ZINC000004918568	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)[nH]2
O=C(NCc1ccccc1)C(=C/c2c[nH]c3ccccc23)\C#N	ZINC000000020550	O=C(NCc1ccccc1)C=Cc2c[nH]c3ccccc23
Cc2cc(C(=O)NC1CC(C)(C)NC(C)(C)C1)ccc2N(=O)=O	ZINC000000315802	O=C(NC1CCNCC1)c2ccccc2
Cc3ccc(n2c(=O)c(Cl)c(Nc1ccccc1)c2=O)cc3Cl	ZINC000000098264	O=c2cc(Nc1ccccc1)c(=O)n2c3ccccc3
ClC3=C(N1CCOCC1)c2ccc(Cl)cc2S3(=O)=O	ZINC000000049051	O=S3(=O)C=C(N1CCOCC1)c2ccccc23
CSc4ccc(c3nc(c1ccc(F)cc1)c(c2ccncc2)o3)cc4	ZINC000000600953	c4ccc(c3nc(c1ccccc1)c(c2ccncc2)o3)cc4
Cc3cc(Cl)c(c2nc1cc(Cl)ccc1o2)c(Cl)c3N	ZINC000000569862	c3ccc(c2nc1ccccc1o2)cc3
Cc1ncc(CO)c(C)c1O	ZINC000000001264	c1ccncc1
CC2(C)OC(=O)N(Cc1ccco1)[C@]2(C)O	ZINC000000051250	O=C1OCCN1Cc2ccco2
NC(=O)c2oc1ccccc1c2NC(=O)CSc3ccccc3	ZINC000000034967	O=C(CSc1ccccc1)Nc2coc3ccccc23
Clc1ncccc1C(=O)Nc2ccc(CC#N)cc2	ZINC000000037238	O=C(Nc1ccccc1)c2cccnc2
Brc3cccc(c2csc(Nc1cccnc1)n2)c3	ZINC000000108853	N(c1cccnc1)c3nc(c2ccccc2)cs3
COC(=O)c2sc1cc(N(=O)=O)cc(SCC(C)C)c1c2N	ZINC000000036892	c2ccc1sccc1c2
COC(=O)CSc2cc(N(=O)=O)cc3onc(C1OCCO1)c23	ZINC000000036893	C3COC(c1noc2ccccc12)O3
OC(=O)c1ccccc1C(=O)NC(CC=C)(CC=C)c2ccccc2	ZINC000000038690	O=C(NCc1ccccc1)c2ccccc2
CC(C)c4ccc3oc(=O)cc(c2oc1ccc(F)cc1c2C)c3c4	ZINC000000534712	O=c4cc(c2cc1ccccc1o2)c3ccccc3o4
OC(=O)[C@H]1CCCC(C(O)=O)=N1	ZINC000001529812	C1CCN=CC1
Brc3ccc(c1csc2ncn(CC=C)c(=O)c12)cc3	ZINC000000098799	O=c2[nH]cnc3scc(c1ccccc1)c23
CCOC(=O)c1ccsc1NC(=O)c2ccc(C(F)(F)F)cc2	ZINC000000116210	O=C(Nc1cccs1)c2ccccc2
C[C@@H](NC(=O)NC(=O)c1ccc(F)cc1)C2C(C)(C)C2(C)C	ZINC000000044121	O=C(NCC1CC1)NC(=O)c2ccccc2
C[C@H](N(O)C(N)=O)c2ccc(c1ccccc1)o2	ZINC000000010347	c2ccc(c1ccco1)cc2
COc4cccc([C@@H]3CC(c1ccccc1)=Nc2ccccc2S3)c4	ZINC000000085056	C3C(c1ccccc1)Sc2ccccc2N=C3c4ccccc4
COc2cc(C(=O)NCc1ccco1)cc(OC)c2OC	ZINC000000035962	O=C(NCc1ccco1)c2ccccc2
CC(C)CC(=O)Nc1ccc(Cl)cn1	ZINC000000030490	c1ccncc1
NC(=O)N(O)C/C=C/c1ccoc1	ZINC000000010348	c1ccoc1
Nc3oc2cc1ccccc1cc2c(=O)c3c5nc4ccccc4s5	ZINC000000044897	O=c4c(c2nc1ccccc1s2)coc5cc3ccccc3cc45
COc3ccc(CSc1nnnn1c2ccccc2)cc3N(=O)=O	ZINC000000063046	C(Sc1nnnn1c2ccccc2)c3ccccc3
O=C(Nn3c(=S)s\c(=C/c2ccc(c1ccc(N(=O)=O)cc1)o2)c3=O)c4ccccc4N(=O)=O	ZINC000001781284	O=C(Nn3c(=S)sc(=Cc2ccc(c1ccccc1)o2)c3=O)c4ccccc4
Cc2ccc(S(=O)(=O)N=C(O)NC1CCCCCCC1)cc2	ZINC000000001516	O=S(=O)(N=CNC1CCCCCCC1)c2ccccc2
O[C@@H]3C=C5CCN4Cc2cc1OCOc1cc2[C@H]([C@H]3O)[C@@H]45	ZINC000000000024	C5Oc4cc3CN1CCC2=CCCC(C12)c3cc4O5
Cc3nc(c1ccccn1)nc(SCc2ccccc2)c3Cl	ZINC000000074843	C(Sc2ccnc(c1ccccn1)n2)c3ccccc3
COc4ccc([C@H](O)c3c(CN1CCCCC1)c2ccccc2n3C)cc4	ZINC000000633503	C4CCN(Cc2c(Cc1ccccc1)[nH]c3ccccc23)CC4
COC(=O)C3=C(C)NC(C)=C(C(=O)OCc2ccc(CN1CCCCC1)o2)[C@H]3c4ccccc4F	ZINC000000587097	O=C(OCc2ccc(CN1CCCCC1)o2)C3=CNC=CC3c4ccccc4
NCC(=O)Nc1ccc(Cl)cc1C(=O)c2ccc[nH]2	ZINC000000021557	O=C(c1ccccc1)c2ccc[nH]2
Cc2ccc(C(C)(C)C)c(OCC(=O)Nc1ccc(F)cc1)c2	ZINC000000037942	O=C(COc1ccccc1)Nc2ccccc2
Cc3ccc2nc(NC(=O)c1ccc(Cl)cc1N(=O)=O)sc2c3	ZINC000000068312	O=C(Nc2nc1ccccc1s2)c3ccccc3
OC(=O)[C@@H]1C=CC=C[C@H]1C(O)=O	ZINC000004962652	C1CC=CC=C1
CCOC(=O)c2ccc(NC(=S)NCCN1CCC(C)CC1)cc2	ZINC000000614286	S=C(NCCN1CCCCC1)Nc2ccccc2
OC(=O)CNc1ccc(O)c(S(O)(=O)=O)c1	ZINC000004532224	c1ccccc1
Cc4ccc3nc(c1ccc(O)cc1)c(NC2CCCC2)n3c4	ZINC000000417893	C4CCC(Nc2c(c1ccccc1)nc3ccccn23)C4
Nc3nc(c2ccc1NC(=O)CCc1c2)cs3	ZINC000000132599	O=C3CCc2cc(c1cscn1)ccc2N3
O=C(Nc1cccc(N(=O)=O)c1)c2ccco2	ZINC000000040244	O=C(Nc1ccccc1)c2ccco2
C[C@@H]1CCCCN1CCNC(=O)[C@@H]3C[C@@H]2CCC[N@]2[C@]35C(=O)Nc4ccccc45	ZINC000006894709	O=C(NCCN1CCCCC1)C3CC2CCCN2C35C(=O)Nc4ccccc45
Clc1ccccc1OC(=O)C(c2ccccc2)c3ccccc3	ZINC000000038642	O=C(Oc1ccccc1)C(c2ccccc2)c3ccccc3
COC12CCCC(C(O)=O)(CCC1)C2	ZINC000000040488	C1CC2CCCC(C1)C2
CNc2oc(c1ccc(Cl)cc1)nc2S(=O)(=O)c3ccccc3	ZINC000000192203	O=S(=O)(c1ccccc1)c3coc(c2ccccc2)n3
Cc1cc(C)c(S(N)(=O)=O)c(Cl)n1	ZINC000000051733	c1ccncc1
CCCC(=O)Nc2nnc(COc1ccc(C(C)(C)C)cc1)s2	ZINC000000052488	C(Oc1ccccc1)c2nncs2
COc1ccc(Cl)cc1NS(=O)(=O)N(C)C	ZINC000000030650	c1ccccc1
CC[C@@H](C)C(=O)Nc1cc(Cl)ccc1OC	ZINC000000030651	c1ccccc1
CC(C)(C)N(NC(=O)c1ccccc1)C(=O)c2ccccc2	ZINC000000006382	O=C(NNC(=O)c1ccccc1)c2ccccc2
CC4=C(C(=O)Nc1cccnc1)[C@@H](c2ccccc2)n3ncnc3N4	ZINC000000065458	O=C(Nc1cccnc1)C3=CNc2ncnn2C3c4ccccc4
Fc3ccc(CSc1ncnc2[nH]cnc12)c4ccccc34	ZINC000000031876	C(Sc1ncnc2[nH]cnc12)c3cccc4ccccc34
Cc2nn(Cc1ccccc1)c(C)c2\C=c4\sc3ccccc3c4=O	ZINC000000095057	O=c3c(=Cc2cnn(Cc1ccccc1)c2)sc4ccccc34
O=S(=O)(NCc1cccc2ccccc12)c3ccccc3	ZINC000000036082	O=S(=O)(NCc1cccc2ccccc12)c3ccccc3
Cc3cc(OCC(=O)N[C@@H](CC(O)=O)C(O)=O)c2c1CCCc1c(=O)oc2c3	ZINC000004037603	O=c3oc1ccccc1c2CCCc23
OCc3coc(O)c(C[N@]2CCc1ccccc1C2)c3=O	ZINC000000031879	O=c1ccocc1CN3CCc2ccccc2C3
Cc3cc(C)n2nc(S(=O)(=O)NC1CCCCC1)nc2n3	ZINC000000110912	O=S(=O)(NC1CCCCC1)c3nc2ncccn2n3
Cc4cccc(NC(=O)c2cc(c1cccs1)nc3ccccc23)c4	ZINC000000434013	O=C(Nc1ccccc1)c3cc(c2cccs2)nc4ccccc34
CC(C)NC(=O)OCc3cnc2c(=O)c1ncccc1c(=O)c2c3	ZINC000000007456	O=c2c1cccnc1c(=O)c3ncccc23
Clc4ccc(NC(=O)c3cc2sc1ccccc1c2s3)nc4	ZINC000000521373	O=C(Nc1ccccn1)c4cc3sc2ccccc2c3s4
CC[C@@H](C)C(=O)NCCc1ccc(O)cc1	ZINC000000007458	c1ccccc1
Clc2cn(=O)c1[nH]c(=O)c(=O)[nH]c1c2	ZINC000000006450	O=c2[nH]c1cccn(=O)c1[nH]c2=O
CC3(C)Cc2c(C#N)c(/N=C/N1CCCCC1)sc2C(C)(C)N3	ZINC000000181700	C3CCN(C=Nc2cc1CCNCc1s2)CC3
C(c2ncc(c1ccccc1)s2)c4ncc(c3ccccc3)s4	ZINC000000328264	C(c2ncc(c1ccccc1)s2)c4ncc(c3ccccc3)s4
CCN(CC)c3ccc(\C=c2\c(=O)[nH]c(=O)n(c1cccc(C(F)(F)F)c1)c2=O)c(O)c3	ZINC000000706532	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)n2c3ccccc3
COc3ccc(Cc2cnc(NC(=O)c1ccc(C)cc1)s2)cc3	ZINC000000121084	O=C(Nc2ncc(Cc1ccccc1)s2)c3ccccc3
CCSc4nc3c1ccccc1CC2(CCCCC2)c3c(=O)n4C	ZINC000000060424	O=c4[nH]cnc3c1ccccc1CC2(CCCCC2)c34
COc1cccc(O)c1C(=O)NCC(O)=O	ZINC000000163956	c1ccccc1
COc2cccc(C(=O)N1CCC[C@@H](C)C1)c2	ZINC000000030018	O=C(N1CCCCC1)c2ccccc2
CN(C)CCO[C@H](NC(=O)OCCN(C)C)C(Cl)(Cl)Cl	ZINC000003167902	nonring
COC(=O)c2ccc(NC(=S)NC(=O)C=Cc1cccs1)cc2	ZINC000000353947	O=C(NC(=S)Nc1ccccc1)C=Cc2cccs2
CC(=O)Nc2ccc(S(=O)(=O)NC1CCCCC1)cc2	ZINC000000028412	O=S(=O)(NC1CCCCC1)c2ccccc2
COc4ccc(n3c(=O)c(Cl)c(Nc2ccc(S(=O)(=O)Nc1nc(C)cc(C)n1)cc2)c3=O)cc4	ZINC000000936521	O=c3cc(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c(=O)n3c4ccccc4
Nc4nc(CSc2nc1ccccc1[nH]2)nc(N3CCOCC3)n4	ZINC000000033458	C4CN(c3ncnc(CSc2nc1ccccc1[nH]2)n3)CCO4
NNc2ccc(C(=O)ON1C(=O)CCC1=O)cc2	ZINC000000012618	O=C1CCC(=O)N1OC(=O)c2ccccc2
Nc3cc(=O)nc(SCc2nc1ccccc1[nH]2)n3c4ccccc4	ZINC000000029016	O=c4ccn(c1ccccc1)c(SCc3nc2ccccc2[nH]3)n4
Nc3ncnc4nc(Sc1ncnc2ccccc12)[nH]c34	ZINC000000029018	S(c2nc1ncncc1[nH]2)c3ncnc4ccccc34
CCN(c1ccc(CC)cc1)S(=O)(=O)c2cccc3nsnc23	ZINC000000213016	O=S(=O)(Nc1ccccc1)c2cccc3nsnc23
CSc2nc1ccc(C)cc1c(=O)n2c4ccc3OCCOc3c4	ZINC000000098888	O=c3n(c2ccc1OCCOc1c2)cnc4ccccc34
C[C@H](NC(=O)c2sc1ccccc1c2Cl)c3ccccc3	ZINC000000043048	O=C(NCc1ccccc1)c3cc2ccccc2s3
Cc2nc(COc1ccccc1Cl)sc2c3cc[nH]c(=S)n3	ZINC000000131265	S=c3nc(c2cnc(COc1ccccc1)s2)cc[nH]3
OCc3cc(=O)c(O)c([C@@H](Nc1ncccn1)c2ccc(F)cc2)o3	ZINC000000038255	O=c3ccoc(C(Nc1ncccn1)c2ccccc2)c3
CCOc3c(CNc2nc1ccc(Cl)cc1s2)cccc3OC	ZINC000000360436	C(Nc2nc1ccccc1s2)c3ccccc3
Clc1ccccc1Cn3cc2[nH]cccc2c3=O	ZINC000000003002	O=c2n(Cc1ccccc1)cc3[nH]cccc23
COC(=O)CNC(=O)c1c(C)onc1c2c(Cl)cccc2Cl	ZINC000000116992	c2ccc(c1ccon1)cc2
CC(=O)Nc3ncc(CN2CCC(c1ccccc1)CC2)s3	ZINC000000269683	C2CN(Cc1cncs1)CCC2c3ccccc3
CCC(=O)Nc2ccc1c(C)cc(=O)[nH]c1c2	ZINC000000039065	O=c2ccc1ccccc1[nH]2
CC(C)(C)c3ccc(CC[C@H]2OC[C@H](CN1CCCC1)O2)cc3	ZINC000000313346	C3CCN(CC2COC(CCc1ccccc1)O2)C3
COc1c(N)c(Cl)ncc1Cl	ZINC000000039063	c1ccncc1
O=C3CC[C@@H]2NC(=O)[C@@H](Cc1ccccc1)N23	ZINC000000010968	O=C3CCC2NC(=O)C(Cc1ccccc1)N23
CC(=O)Nc2ccc(OC(=O)c1cccs1)cc2	ZINC000000001884	O=C(Oc1ccccc1)c2cccs2
CCCC(=O)N3CCN(c2nc(N)c1cc(OC)c(OC)cc1n2)CC3	ZINC000000638562	C3CN(c2ncc1ccccc1n2)CCN3
Cc1ncc(N(=O)=O)n1CCc2ccncc2	ZINC000000001882	C(Cn1ccnc1)c2ccncc2
O=C(Oc3ccc(Nc1ncnc2ccccc12)cc3)c4cccs4	ZINC000000132697	O=C(Oc3ccc(Nc1ncnc2ccccc12)cc3)c4cccs4
O=c3n(CNc2ccc(Oc1ccccc1)cc2)c(=O)c4ccccc34	ZINC000000096806	O=c3n(CNc2ccc(Oc1ccccc1)cc2)c(=O)c4ccccc34
CC[C@@H](NS(=O)(=O)c3ccc2c(Cc1cc(S(=O)(=O)N[C@H](CC)C(O)=O)ccc12)c3)C(O)=O	ZINC000009640596	C2c1ccccc1c3ccccc23
COc2ccc(S(=O)(=O)N1CCCCC1)cc2NS(=O)(=O)c3cc(/C=C/C(O)=O)ccc3OC	ZINC000014092822	O=S(=O)(Nc2cccc(S(=O)(=O)N1CCCCC1)c2)c3ccccc3
OCCN2COc1ccccc1C2=O	ZINC000000006296	O=C1NCOc2ccccc12
CC[C@H]4N(c1ccccc1)C(N)=C(c3nc2ccccc2[nH]3)C4=O	ZINC000000044691	O=C2CN(c1ccccc1)C=C2c4nc3ccccc3[nH]4
FC(F)(F)C(=O)Nc2ccc(C(=O)Nc1ccccn1)cc2	ZINC000000035234	O=C(Nc1ccccn1)c2ccccc2
Cc1ccccc1NC(=O)CSc2ncnc3sc(C)c(C)c23	ZINC000000102760	O=C(CSc1ncnc2sccc12)Nc3ccccc3
CCOC(=O)[C@@]2(C#N)[C@@H](c1ccccc1)C(OC)(OC)C2(OC)OC	ZINC000000340800	C2CC(c1ccccc1)C2
CCOC(=O)[C@@H](C#N)[C@@]2(Cc1ccccc1)C[C@H](C)[N@@](C)C[C@@H]2C	ZINC000000341244	C2CC(Cc1ccccc1)CCN2
O=Cc3ccc(c2ccc(c1cccs1)s2)s3	ZINC000000009880	c3csc(c2ccc(c1cccs1)s2)c3
CN2C(=O)c1cc(Cl)ccc1[C@@]23CC(=O)NC3=O	ZINC000000012729	O=C3CC2(NC(=O)c1ccccc12)C(=O)N3
Cc3nc(c2ccc(S(=O)(=O)N1CCCCCC1)s2)cs3	ZINC000000066259	O=S(=O)(N1CCCCCC1)c3ccc(c2cscn2)s3
COc2ccc(C(=O)Nc1ccc(C)cn1)cc2	ZINC000000030279	O=C(Nc1ccccn1)c2ccccc2
OC(=O)c1ccccc1C(=O)N2CCCC2	ZINC000000142147	O=C(N1CCCC1)c2ccccc2
OS(=O)(=O)CC1(CS(O)(=O)=O)COC1	ZINC000001725633	C1COC1
COc3ccc(/C=C/C=c2\c(=O)[nH]c(=S)n(c1cccc(F)c1)c2=O)cc3	ZINC000000642056	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=CC=Cc3ccccc3
COc1ccccc1NC(=O)c3ccc(CSc2ccccc2)cc3	ZINC000000567520	O=C(Nc1ccccc1)c3ccc(CSc2ccccc2)cc3
COC(=O)C1=C(C)NC4=C([C@@H]1c3ccc(c2ccc(Cl)cc2)o3)C(=O)CC(C)(C)C4	ZINC000000628588	O=C1CCCC4=C1C(c3ccc(c2ccccc2)o3)C=CN4
CCOc2ccc(/C=C/C(=O)\C=C\c1ccc(OCC)cc1)cc2	ZINC000000028155	O=C(C=Cc1ccccc1)C=Cc2ccccc2
COc4ccc3c(CCc2sc(NC(=O)c1ccco1)nc23)c4	ZINC000000081603	O=C(Nc3nc2c(CCc1ccccc12)s3)c4ccco4
O=c4n(CC#CCN1CCCCC1)c(=O)c5cc3c(=O)n(CC#CCN2CCCCC2)c(=O)c3cc45	ZINC000001582351	O=c4n(CC#CCN1CCCCC1)c(=O)c5cc3c(=O)n(CC#CCN2CCCCC2)c(=O)c3cc45
Cc3cc(C)c2nc(NC(=O)c1ccc(C(C)(C)C)cc1)sc2c3	ZINC000000440509	O=C(Nc2nc1ccccc1s2)c3ccccc3
Cc3cn2c1ccccc1[nH]c(=O)c2n3	ZINC000000013054	O=c2[nH]c1ccccc1n3ccnc23
CCOc3ccc(C(=O)N2CCN(c1cccc(Cl)c1)CC2)cc3	ZINC000000035686	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
O[C@@H](Cc1ccc(F)cc1)[C@@H](c2ccc(C#N)cc2)n3cncn3	ZINC000000006079	C(Cc1ccccc1)C(c2ccccc2)n3cncn3
O=c2[nH]c1ccccc1n3ccnc23	ZINC000000013053	O=c2[nH]c1ccccc1n3ccnc23
Cc2cc(NC(=O)c1ccccc1)no2	ZINC000000039011	O=C(Nc1ccon1)c2ccccc2
CCSc3nc2=NC(C)=C(C(N)=O)[C@@H](c1ccc(Cl)cc1)n2[nH]3	ZINC000000151873	C3=CC(c1ccccc1)n2[nH]cnc2=N3
C[C@H]3CN(Cc2c(C)[nH]c1c(C)cccc1c2=O)C[C@H](C)O3	ZINC000000142544	O=c2c(CN1CCOCC1)c[nH]c3ccccc23
O=C(CSc2nc1ccccc1[nH]2)NCCN3CCCCC3	ZINC000000203532	O=C(CSc2nc1ccccc1[nH]2)NCCN3CCCCC3
COc3ccc(S(=O)(=O)N2Cc1ccccc1C[C@H]2C(=O)N[C@@H](CCC(O)=O)C(O)=O)cc3OC	ZINC000026647618	O=S(=O)(N2CCc1ccccc1C2)c3ccccc3
Clc1ccc(N(=O)=O)cc1C(=O)N2CCc3ccccc23	ZINC000000043171	O=C(N1CCc2ccccc12)c3ccccc3
OS(=O)(=O)c2ccc(C=NNc1ccc(N(=O)=O)cc1)c(S(O)(=O)=O)c2	ZINC000022058240	N(N=Cc1ccccc1)c2ccccc2
CC(=NNC1=NCCN1Cc2ccccc2)c3ccc(C)cc3	ZINC000000150289	C3CN(Cc1ccccc1)C(NN=Cc2ccccc2)=N3
O=C(C=C3NC[C@H]1N(CCc2ccccc12)C3=O)c4ccccc4	ZINC000000034484	O=C(C=C3NCC1N(CCc2ccccc12)C3=O)c4ccccc4
COc2cc(O)c1ccccc1c2OC	ZINC000000024657	c2ccc1ccccc1c2
O=C2Nc1ccccc1C23OCC4(CO3)C[C@H]5C[C@@H]4C=C5	ZINC000000032587	O=C2Nc1ccccc1C23OCC4(CO3)CC5CC4C=C5
Cn2c(c1ccccc1)nnc2S(C)(=O)=O	ZINC000000024658	c2ccc(c1nnc[nH]1)cc2
Cc4c(\N=C/c2c1ccccc1cc3ccccc23)cccc4N(=O)=O	ZINC000000524562	C(=Nc1ccccc1)c3c2ccccc2cc4ccccc34
O=C(NCc1ccccc1)Nc3nc2ccccc2[nH]3	ZINC000000003130	O=C(NCc1ccccc1)Nc3nc2ccccc2[nH]3
FC(F)(F)c1ccccc1NS(=O)(=O)c3ccc2OCCc2c3	ZINC000000157660	O=S(=O)(Nc1ccccc1)c3ccc2OCCc2c3
CCOc3ccc(\C=c2/nc(/C=C/c1ccccc1)oc2=O)cc3OC	ZINC000000444612	O=c2oc(C=Cc1ccccc1)nc2=Cc3ccccc3
CC2CCN(C(=O)COc1ccc(Br)cc1)CC2	ZINC000000041537	O=C(COc1ccccc1)N2CCCCC2
C[C@@H](Cc1ccccc1)NC(O)=NS(=O)(=O)c2ccc(C)cc2	ZINC000000002199	O=S(=O)(N=CNCCc1ccccc1)c2ccccc2
C[C@H](Sc1ncnc2[nH]cnc12)c3ccccc3Cl	ZINC000000060952	C(Sc1ncnc2[nH]cnc12)c3ccccc3
OC(=O)CC[S@@](=O)c1ccccc1C(O)=O	ZINC000000174861	c1ccccc1
COc2ccc([C@@]1(C)SC(NC(C)=O)=NN1C(C)=O)cc2	ZINC000000041532	N1N=CSC1c2ccccc2
CC(=O)C(C)(C)C(C(O)=O)C(O)=O	ZINC000000236553	nonring
Oc1cc(N(=O)=O)ccc1Cl	ZINC000000078157	c1ccccc1
COC(=O)c2cc(NC(=O)c1cc(OC)cc(OC)c1)ccc2Cl	ZINC000000581262	O=C(Nc1ccccc1)c2ccccc2
CCOc3ccc2[nH]c(=NN=C1C(=O)CC(C)(C)CC1=O)sc2c3	ZINC000000125870	O=C1CCCC(=O)C1=NN=c3[nH]c2ccccc2s3
CCOC(=O)[C@@H]1CC1(C(O)=O)C(O)=O	ZINC000142653836	C1CC1
O=C(NC2CCN(Cc1ccccc1)CC2)c3ccco3	ZINC000000087347	O=C(NC2CCN(Cc1ccccc1)CC2)c3ccco3
O[C@H](C(O)=O)c1cccc(O)c1N(=O)=O	ZINC000238684289	c1ccccc1
Cc2ccc(C(=O)NCCc1ccccc1)cc2C	ZINC000000029950	O=C(NCCc1ccccc1)c2ccccc2
Cc3cc(c2csc(Nc1ccc(C(O)=O)cc1)n2)ccc3F	ZINC000000070729	N(c1ccccc1)c3nc(c2ccccc2)cs3
Cc3cc(NC(=O)CN(C1CC1)C(=O)Nc2ccc(Cl)cc2)no3	ZINC000000326128	O=C(CN(C1CC1)C(=O)Nc2ccccc2)Nc3ccon3
CC(=O)N(CC(=O)Cn2cnc1ccccc1c2=O)c3ccc(C)cc3	ZINC000000406622	O=C(CNc1ccccc1)Cn3cnc2ccccc2c3=O
Nc1no[nH]c1=NN=CC(O)=O	ZINC000004486252	N=c1cno[nH]1
COc1ccccc1c2nnc(SC)o2	ZINC000000035518	c2ccc(c1nnco1)cc2
O=S(=O)(NCc1ccccn1)c2ccccc2	ZINC000000029395	O=S(=O)(NCc1ccccn1)c2ccccc2
CCN3CCN(c2oc(COc1ccccc1)nc2C#N)CC3	ZINC000000108334	C3CN(c2cnc(COc1ccccc1)o2)CCN3
OC([C@@H]1CN2CCC1CC2)(c3cccs3)c4cccs4	ZINC000000038074	C1CN4CCC1C(C(c2cccs2)c3cccs3)C4
Cc4cc(C)c3n(Cc1ccccc1)c(=O)n(Cc2ccccc2)c3c4	ZINC000000035515	O=c3n(Cc1ccccc1)c2ccccc2n3Cc4ccccc4
Cc2nc1ccccc1c(=O)n2NCc3ccc(Br)cc3	ZINC000000102837	O=c2n(NCc1ccccc1)cnc3ccccc23
Cc3cc(N1CCOCC1)nc(NCc2ccccc2)n3	ZINC000000123002	C3CN(c2ccnc(NCc1ccccc1)n2)CCO3
CCc3ccc(NC(=O)c2ccc(c1ccccc1Cl)o2)cc3	ZINC000000385970	O=C(Nc1ccccc1)c3ccc(c2ccccc2)o3
ON1CC(=O)N[C@@H](CC(O)=O)C1=O	ZINC000039115323	O=C1CNC(=O)CN1
NC[C@H](CC(O)=O)Cc1ccco1	ZINC000000008912	c1ccoc1
CC1(C)CC(NS(C)(=O)=O)CC(C)(C)N1O	ZINC000000036458	C1CCNCC1
CCCc2cc([C@H]1CCCN1C)on2	ZINC000000008088	C2CNC(c1ccno1)C2
CCOc4ccc([C@H]2CC(c1cccc(OC)c1)=Nc3nnnn23)cc4	ZINC000000522226	C3C(c1ccccc1)n2nnnc2N=C3c4ccccc4
Cc3ccc2c(Cl)c(C(=O)Nc1nc(C)c(C)s1)sc2c3	ZINC000000068360	O=C(Nc1nccs1)c3cc2ccccc2s3
COC(=O)C1=C(C)Nc3c([C@@H]1c2ccc(C)cc2)c(=O)c4ccccc34	ZINC000000090431	O=c3c2C(c1ccccc1)C=CNc2c4ccccc34
CCS(=O)(=O)c2ccc(O)c(NC(=O)COc1ccccc1)c2	ZINC000000045236	O=C(COc1ccccc1)Nc2ccccc2
C[N@]1CCCC[C@@H]1Cc2c[nH]cn2	ZINC000000016606	C2CCC(Cc1c[nH]cn1)NC2
CCOC(=O)c1ccccc1NC(=O)COc2ccc(C)c(C)c2	ZINC000000045234	O=C(COc1ccccc1)Nc2ccccc2
O=N(=O)c3cccc([C@@H]1NCCc2nc[nH]c12)c3	ZINC000000197248	C3Cc1nc[nH]c1C(c2ccccc2)N3
O=C(NCc1cccnc1)[C@@H]2CC2(c3ccccc3)c4ccccc4	ZINC000000049201	O=C(NCc1cccnc1)C2CC2(c3ccccc3)c4ccccc4
CCN(C)C(=O)Oc1nsnc1c2c(Cl)cccc2Cl	ZINC000000006647	c2ccc(c1cnsn1)cc2
C1CCC2(CC1)NCCc3c2[nH]c4ccccc34	ZINC000000083421	C1CCC2(CC1)NCCc3c2[nH]c4ccccc34
CC[N@]1CCC[C@@H]1CNC(=O)c2c(OC)ccc(Br)c2OC	ZINC000000597536	O=C(NCC1CCCN1)c2ccccc2
COc2ccc(S(=O)(=O)Nc1ccccn1)c3ccccc23	ZINC000000179535	O=S(=O)(Nc1ccccn1)c2cccc3ccccc23
OC(=O)[C@@H]([C@@H]1NCCS1)n3c(=O)c2ccccc2c3=O	ZINC000001707359	O=c2n(CC1NCCS1)c(=O)c3ccccc23
COc4ccc3cc(O)c(C(=O)Nc2nc1c(Cl)cccc1s2)cc3c4	ZINC000000588024	O=C(Nc2nc1ccccc1s2)c4ccc3ccccc3c4
C[C@H](Sc1ccc(Cl)cc1)C(=O)Nc2c(C)cc(C)cc2C	ZINC000000470517	O=C(CSc1ccccc1)Nc2ccccc2
CC(=O)Oc1c(Cl)c(=O)c(O)c(Cl)c1=O	ZINC000000349623	O=c1ccc(=O)cc1
NS(=O)(=O)c4ccc(O)c(n1c(=O)c3cccc2c(C(O)=O)ccc(c1=O)c23)c4	ZINC000008426080	O=c2n(c1ccccc1)c(=O)c4cccc3cccc2c34
Clc4ccc(COc2ccc1ccccc1c2C=c3c(=O)[nH]c(=S)[nH]c3=O)cc4	ZINC000000656824	O=c1[nH]c(=S)[nH]c(=O)c1=Cc3c(OCc2ccccc2)ccc4ccccc34
CC(C)c3ccc(c2nc1c(Cl)c(N)c(Cl)cc1o2)cc3	ZINC000000570163	c3ccc(c2nc1ccccc1o2)cc3
Cc3ccc(C(=O)[C@@H](OC(=O)c1ccc(F)cc1)c2ccccc2)cc3	ZINC000000477771	O=C(OC(C(=O)c1ccccc1)c2ccccc2)c3ccccc3
O=C2CCC(NCc1ccccc1)=C2	ZINC000000018991	O=C2CCC(NCc1ccccc1)=C2
Nc3nc2nc(c1ccccc1)cc(C(F)(F)F)n2n3	ZINC000000035355	c3ccc(c2ccn1ncnc1n2)cc3
CCOC(=O)c1[nH]c(=O)[nH]c1COC(=O)CNC(=O)c2ccccc2	ZINC000000033435	O=C(CNC(=O)c1ccccc1)OCc2c[nH]c(=O)[nH]2
COc2ccc(c1c(NS(C)(=O)=O)n(C)nc1C(F)(F)F)cc2	ZINC000000118073	c2ccc(c1cn[nH]c1)cc2
Cc3ccc(C)c(NC(=O)c1sc(Cl)nc1c2ccccc2)c3	ZINC000000385371	O=C(Nc1ccccc1)c2scnc2c3ccccc3
Cc4ccc(\C=N\c3ccc2oc(c1ccccc1)nc2c3)s4	ZINC000000361201	C(=Nc3ccc2oc(c1ccccc1)nc2c3)c4cccs4
COC(=O)c1ccc(C=O)cc1	ZINC000000016592	c1ccccc1
CC(=O)Nc3ccc(Sc2nc1ccccc1s2)c(Cl)c3	ZINC000000053669	S(c1ccccc1)c3nc2ccccc2s3
N=C3N(CC(=O)c2ccc1OCCOc1c2)Cc4ccccc34	ZINC000000179475	N=C3N(CC(=O)c2ccc1OCCOc1c2)Cc4ccccc34
COc1ccccc1C[N@]2CCC[C@@H](O)C2	ZINC000000200169	C2CCN(Cc1ccccc1)CC2
CCCc1[nH]c(=O)c(C#N)cc1C(O)=O	ZINC000015830032	O=c1cccc[nH]1
Fc3ccc(n2c(=S)[nH]c(=O)c(=Cc1ccc(Cl)s1)c2=O)cc3	ZINC000000658423	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc3cccs3
COc3ccc(c2nnn(CC(=O)Nc1ccc(F)cc1)n2)cc3	ZINC000000054495	O=C(Cn2nnc(c1ccccc1)n2)Nc3ccccc3
Cc2c(OCC(=O)OC(C)(C)C)ccc3c1CCCCc1c(=O)oc23	ZINC000000083516	O=c3oc1ccccc1c2CCCCc23
O=C(Nc2ccc(c1cc[nH]n1)cc2)c3ccccc3	ZINC000000008714	O=C(Nc2ccc(c1cc[nH]n1)cc2)c3ccccc3
O=C(Nc3nc2c(Cc1ccccc12)s3)c4cccs4	ZINC000000083045	O=C(Nc3nc2c(Cc1ccccc12)s3)c4cccs4
CC[N@]1CCC[C@@H]1CNC(=O)CCC4CCN(Cc3ccc2nonc2c3)CC4	ZINC000012196967	O=C(CCC3CCN(Cc2ccc1nonc1c2)CC3)NCC4CCCN4
C(Sc2nnc(c1ccco1)n2c3ccccc3)c4ccccc4	ZINC000000036151	C(Sc2nnc(c1ccco1)n2c3ccccc3)c4ccccc4
COCC(=O)N(C2CCN(CCc1ccccc1)CC2)c3ccccc3	ZINC000000585304	C2CN(CCc1ccccc1)CCC2Nc3ccccc3
CCSC1=NCC(=O)N1c2ccc(Cl)cc2C	ZINC000000022385	O=C1CN=CN1c2ccccc2
Cc3ccc(Oc2ccc(C(=O)Nc1ccccc1)cc2)cc3C	ZINC000000392303	O=C(Nc1ccccc1)c3ccc(Oc2ccccc2)cc3
O=C2C[C@H](N1CCSCC1)C(=O)N2CCc3ccccc3	ZINC000000033217	O=C2CC(N1CCSCC1)C(=O)N2CCc3ccccc3
COc4ccc3c(C)cc(Sc1nnnn1c2ccccc2)nc3c4	ZINC000000127904	S(c2ccc1ccccc1n2)c3nnnn3c4ccccc4
CSc2nc(N)n(c1c(Cl)cc(C(F)(F)F)cc1Cl)n2	ZINC000000110942	c2ccc(n1cncn1)cc2
CCSC1=NCC(=O)N1c2ccccc2	ZINC000000022380	O=C1CN=CN1c2ccccc2
OC(=O)CCCNC(=O)C(F)(F)F	ZINC000001732852	nonring
NC(=O)N(O)CC1CCCC1	ZINC000000018578	C1CCCC1
CC(C)[C@@H](NC(=O)COc2cc1ccccc1cc2NS(=O)(=O)C(F)(F)F)C(=O)N[C@H]3CC(=O)O[C@@H]3O	ZINC000026747941	O=C(CNC(=O)COc2ccc1ccccc1c2)NC3COC(=O)C3
O=C4Cc1c([nH]c2ccc(N(=O)=O)cc12)c3ccccc3N4	ZINC000000023894	O=C4Cc1c([nH]c2ccccc12)c3ccccc3N4
Clc3ccc(c1c[nH]nc1N2CCOCC2)cc3	ZINC000000023895	C3CN(c1n[nH]cc1c2ccccc2)CCO3
CC(C)(C)N(Cc1ccccc1)C(=O)CSc2nc(N)cc(N)n2	ZINC000000417999	O=C(CSc1ncccn1)NCc2ccccc2
Cc2noc(c1ccccc1)c2NC(=O)Nc4ccc3sccc3c4	ZINC000000129749	O=C(Nc2ccc1sccc1c2)Nc3cnoc3c4ccccc4
Cc1ccc(O)c2ncccc12	ZINC000000002171	c2ccc1ncccc1c2
COc3ccc(CCN[C@@H]2CC(=O)N(c1ccccc1)C2=O)cc3	ZINC000000182016	O=C2CC(NCCc1ccccc1)C(=O)N2c3ccccc3
Cc2c(NC(=O)Nc1ccccc1)sc(S(C)(=O)=O)c2C=C	ZINC000000125896	O=C(Nc1ccccc1)Nc2cccs2
C3CN=C(Sc1c[nH]c2ccccc12)N3	ZINC000000002177	C3CN=C(Sc1c[nH]c2ccccc12)N3
CC(C)(C)n3ncc(OCc2ccc1ccccc1c2)c(Cl)c3=O	ZINC000000020462	O=c3cc(OCc2ccc1ccccc1c2)cn[nH]3
COc4ccc(c2cc(Oc1ccccc1)nnc2c3ccc(OC)cc3)cc4	ZINC000000594029	O(c1ccccc1)c4cc(c2ccccc2)c(c3ccccc3)nn4
Cc3ccc([C@H]2COc1cc(O)c(O)cc1C2)cc3	ZINC000000002772	C2Oc1ccccc1CC2c3ccccc3
Nc4cc(N2CCc1ccccc1C2)c3ccccc3n4	ZINC000000026869	C2Cc1ccccc1CN2c3ccnc4ccccc34
CCCc2ncc(C[n+]1ccccc1C)c(N)n2	ZINC000000000934	C(c1cncnc1)[n+]2ccccc2
CC(C)c2nnc(SCC(=O)Nc1sc(C)c(C)c1C#N)n2C	ZINC000000410466	O=C(CSc1nnc[nH]1)Nc2cccs2
CCOC(=O)c3nnn(c1nonc1c2ccccc2)c3C	ZINC000000035152	c3ccc(c1nonc1n2ccnn2)cc3
Clc4ccc3oc1ccccc1nc(N2CCNCC2)c3c4	ZINC000000000931	C4CN(c2nc1ccccc1oc3ccccc23)CCN4
Cc1cccc(C)c1NC(=O)c3cnc2ccccc2c3O	ZINC000000043499	O=C(Nc1ccccc1)c3cnc2ccccc2c3
COc3cc2C(=O)N1[C@@H](O)CC[C@@H]1C=Nc2cc3O	ZINC000000000534	O=C2N1CCCC1C=Nc3ccccc23
Cc2ccc(S(=O)(=O)NCc1ccccc1)cc2	ZINC000000028306	O=S(=O)(NCc1ccccc1)c2ccccc2
Oc3ccc(C[C@@H]1NCCc2cc(O)c(O)cc12)cc3	ZINC000000000857	C3Cc1ccccc1C(Cc2ccccc2)N3
COc2ccc1[nH]c(C)c(CC(=O)NO)c1c2	ZINC000000001251	c2ccc1[nH]ccc1c2
COc1c(Cl)cc(Cl)cc1\C=c3/s/c(=N/c2ccc(C(O)=O)cc2)n(C)c3=O	ZINC000001007653	O=c2[nH]c(=Nc1ccccc1)sc2=Cc3ccccc3
COc3ccc(\C=C(\C(=O)Nc1ccccc1F)c2ccccc2)cc3	ZINC000000319053	O=C(Nc1ccccc1)C(=Cc2ccccc2)c3ccccc3
COc3ccc(NC(=O)c1ccccc1NC(=O)c2ccccc2)cc3	ZINC000000037336	O=C(Nc1ccccc1C(=O)Nc2ccccc2)c3ccccc3
NC(=O)CN3c1cccc2cccc(c12)S3(=O)=O	ZINC000000094082	O=S1(=O)Nc2cccc3cccc1c23
OC(=O)Cc2ccc1OCOc1c2	ZINC000000058276	C2Oc1ccccc1O2
Cn1nc(C(O)=O)c2ccccc12	ZINC000000058277	c2ccc1[nH]ncc1c2
O=c2[nH]c1CCCc1n3ccnc23	ZINC000000020519	O=c2[nH]c1CCCc1n3ccnc23
FC(F)(F)c2cc(NC(=O)Nc1ccc(Cl)cc1)ccc2Cl	ZINC000000001188	O=C(Nc1ccccc1)Nc2ccccc2
Clc2c(C(=O)NC(=S)Nc1ccccc1)sc3ccccc23	ZINC000000095273	O=C(NC(=S)Nc1ccccc1)c3cc2ccccc2s3
Cc3ccc(NC(=O)CSc1nnc(C)c2ccccc12)cc3	ZINC000000085267	O=C(CSc1nncc2ccccc12)Nc3ccccc3
C[C@@H]1CCc3c(C1)sc(NC(=O)c2ccco2)c3C(=O)N(C)C	ZINC000000061475	O=C(Nc2cc1CCCCc1s2)c3ccco3
CC(=O)C3=NN(c1ccccc1)[C@@H](c2cccs2)N3C(C)(C)C	ZINC000000051838	N2C=NN(c1ccccc1)C2c3cccs3
Cc2coc1ccccc1c2=O	ZINC000000001707	O=c1ccoc2ccccc12
CCn4cc(C(O)=O)c(=O)c5cc(F)c(N3CCN(Cn1c(=O)/c(=N\NC(=S)NOC)c2cc(C)ccc12)CC3)cc45	ZINC000066078315	N=c4c(=O)n(CN3CCN(c2ccc1c(=O)cc[nH]c1c2)CC3)c5ccccc45
COc1ccccc1NS(=O)(=O)c4ccc(N3C(=O)CC2(CCCC2)C3=O)c(Cl)c4	ZINC000001048465	O=C2CC1(CCCC1)C(=O)N2c4ccc(S(=O)(=O)Nc3ccccc3)cc4
Cc4cc(C)nc(NS(=O)(=O)c3ccc(Nc2nc(c1ccc(F)c(C)c1)cs2)cc3)n4	ZINC000000643763	O=S(=O)(Nc1ncccn1)c4ccc(Nc3nc(c2ccccc2)cs3)cc4
FC(F)(F)Oc2ccc(NC(=O)c1ccc(C(F)(F)F)cc1)cc2	ZINC000000085861	O=C(Nc1ccccc1)c2ccccc2
CS(=O)(=O)c1ncc(CC(O)=O)c(=O)[nH]1	ZINC000040546616	O=c1ccnc[nH]1
Clc3ccc(C(=O)Oc1cccc2ccccc12)cc3N(=O)=O	ZINC000000068140	O=C(Oc1cccc2ccccc12)c3ccccc3
CCOc1ccsc1C(O)=O	ZINC000000082778	c1ccsc1
Oc5n(c2ccc1OCOc1c2)c(=O)c6c(C(=O)CCn4c(=O)c3ccccc3c4=O)[nH][nH]c56	ZINC000018066102	O=C(CCn2c(=O)c1ccccc1c2=O)c5[nH][nH]c6cn(c4ccc3OCOc3c4)c(=O)c56
COC(=O)[C@@H]2[C@@H](O)C=Cc3oc1cc(CO)cc(O)c1c(=O)c23	ZINC000000009082	O=c2c1CCC=Cc1oc3ccccc23
COc2cc(NC(=O)c1nn(C)cc1N(=O)=O)cc(OC)c2OC	ZINC000000037116	O=C(Nc1ccccc1)c2cc[nH]n2
Fc2ccc(Nc1nc(Cl)nc(Cl)n1)c(F)c2	ZINC000000049026	N(c1ccccc1)c2ncncn2
Cc5ccc(Cn3c1ccc(C)cc1c4nc2ccccc2nc34)cc5	ZINC000000205542	C(c1ccccc1)n4c2ccccc2c5nc3ccccc3nc45
CCOC(=O)C(\C#N)=c1\c(=O)[nH]c2ccccc12	ZINC000000075377	C=c1c(=O)[nH]c2ccccc12
COC(=O)c2csc3c(C(F)(F)F)cc(N1CCNCC1)nc23	ZINC000000082952	C3CN(c2ccc1sccc1n2)CCN3
Cc2cc(=O)c1ccccc1c2=O	ZINC000000001677	O=c1ccc(=O)c2ccccc12
Clc2ccc(NC(=O)CN1CCCC1=O)cc2	ZINC000000004826	O=C(CN1CCCC1=O)Nc2ccccc2
Oc3n(c1ccccc1)c(=O)c4c(C(=O)c2cccnc2)[nH][nH]c34	ZINC000003618328	O=C(c1cccnc1)c3[nH][nH]c4cn(c2ccccc2)c(=O)c34
Clc3ccc(C2=NN(CC(=O)NC1CCCCC1)C(=O)CC2)cc3	ZINC000000219396	O=C(CN2N=C(c1ccccc1)CCC2=O)NC3CCCCC3
Oc3c(S(=O)c2c(O)n(Cc1ccccc1)c(=O)[nH]c2=O)c(=O)[nH]c(=O)n3Cc4ccccc4	ZINC000009345168	O=S(c2cn(Cc1ccccc1)c(=O)[nH]c2=O)c4cn(Cc3ccccc3)c(=O)[nH]c4=O
Cc2cn(C[C@@H](OCP(O)(O)=O)Oc1ccccc1)c(=O)[nH]c2=O	ZINC000001658289	O=c2ccn(CCOc1ccccc1)c(=O)[nH]2
C[C@H](CN(C)C)CN2c1ccccc1S(=O)(=O)c3ccccc23	ZINC000000000582	O=S3(=O)c1ccccc1Nc2ccccc23
Cc2[nH]c1ccccc1c2CCNC(=O)c3ccc(C(F)(F)F)cc3	ZINC000000034345	O=C(NCCc1c[nH]c2ccccc12)c3ccccc3
O=C(Cc1cccs1)Nc4ccc(c3nc2ccccc2o3)cc4	ZINC000000051300	O=C(Cc1cccs1)Nc4ccc(c3nc2ccccc2o3)cc4
CCOc3ccc(\C=N\N2CCN(c1ccccc1OC)CC2)cc3	ZINC000000046767	C2CN(c1ccccc1)CCN2N=Cc3ccccc3
CCN(CC)S(=O)(=O)c1ccc(C)cc1	ZINC000000028303	c1ccccc1
CC(C)(C)c2ccc(CSc1nnc(N)s1)cc2	ZINC000000054232	C(Sc1nncs1)c2ccccc2
Cn4c(c1ccccc1)nn(CN2CCC3(CC2)OCCO3)c4=S	ZINC000000054233	S=c2[nH]c(c1ccccc1)nn2CN3CCC4(CC3)OCCO4
Cn2c[n+](C[C@@H](O)COC[C@H]1CCC=CC1)c3ccccc23	ZINC000000098638	C(COCC1CCC=CC1)C[n+]2c[nH]c3ccccc23
O=C4CC[C@@H]([C@H]2N(C(=O)OCc1ccccc1)CCc3ccccc23)O4	ZINC000000589790	O=C4CCC(C2N(C(=O)OCc1ccccc1)CCc3ccccc23)O4
Cn2c(=O)oc3ccc(C(=O)c1ccccc1)cc23	ZINC000000012860	O=C(c1ccccc1)c3ccc2oc(=O)[nH]c2c3
Cn2cnc3c(NC1CCCC1)ncnc23	ZINC000000005203	C3CCC(Nc1ncnc2[nH]cnc12)C3
COC(=O)NS(=O)(=O)c1ccccc1	ZINC000000039692	c1ccccc1
Nc3nncc(C12CCN(CC1)C2)n3	ZINC000000005200	C2CC3(c1cnncn1)CCN2C3
COc3ccc(S(=O)(=O)N[C@H]1CCc2ccccc12)cc3OC	ZINC000000021702	O=S(=O)(NC1CCc2ccccc12)c3ccccc3
OC(=O)CSc1ccccc1C(O)=O	ZINC000000092914	c1ccccc1
CCOc2ccc(CC(=O)Nc1cccc(Cl)c1C)cc2OCC	ZINC000000038600	O=C(Cc1ccccc1)Nc2ccccc2
COC(=O)CSc2ccc(C(=O)N1CCCCC1)cc2N(=O)=O	ZINC000000048130	O=C(N1CCCCC1)c2ccccc2
CC(=O)NS(=O)(=O)c3ccc(c2ccc(C=c1c(=O)[nH]c(=O)[nH]c1=O)o2)cc3	ZINC000002996506	O=c3[nH]c(=O)c(=Cc2ccc(c1ccccc1)o2)c(=O)[nH]3
O=N(=O)c2ccc(C=c1[nH]c(=S)[nH]c1=O)o2	ZINC000000176935	O=c1[nH]c(=S)[nH]c1=Cc2ccco2
C2CSC(c1ccccc1)=CCN2	ZINC000000008444	C2CSC(c1ccccc1)=CCN2
CNC(=S)[C@@]2(c1ccccn1)CCCS2	ZINC000000000617	C2CSC(c1ccccn1)C2
O=C(NCCc2nc(c1ccccc1)cs2)C4(c3ccccc3)CC4	ZINC000000036885	O=C(NCCc2nc(c1ccccc1)cs2)C4(c3ccccc3)CC4
Clc3cc(Cl)cc(NC(=O)c2cnc1SCCn1c2=O)c3	ZINC000000107313	O=C(Nc1ccccc1)c3cnc2SCCn2c3=O
Cc3ccc(NS(=O)(=O)c2ccc(N1C(=O)CCC1=O)cc2)cc3	ZINC000000327646	O=C1CCC(=O)N1c3ccc(S(=O)(=O)Nc2ccccc2)cc3
COc3ccc(CCn2c1CCCc1c(=S)[nH]c2=O)cc3OC	ZINC000000033671	O=c2[nH]c(=S)c1CCCc1n2CCc3ccccc3
CN(C1CC(C)(C)NC(C)(C)C1)C(=O)c2ccco2	ZINC000000036880	O=C(NC1CCNCC1)c2ccco2
OC(=O)Cn2c(=O)c(=C/c1cccc(Cl)c1)/oc3ccccc23	ZINC000000216779	O=c2[nH]c1ccccc1oc2=Cc3ccccc3
CCOc5cc([C@@H]1[C@@H]4[C@H](ON1c2ccccc2)C(=O)N(c3ccc(C(O)=O)cc3)C4=O)cc(Br)c5O	ZINC000001298562	O=C4C3ON(c1ccccc1)C(c2ccccc2)C3C(=O)N4c5ccccc5
COc1cc(C=C(C#N)C#N)ccc1OCC(=O)Nc2ccc(C)cc2	ZINC000000278501	O=C(COc1ccccc1)Nc2ccccc2
COc2cccc3cc(c1ccc(N(=O)=O)cc1)c(=O)oc23	ZINC000000034974	O=c2oc1ccccc1cc2c3ccccc3
CC(C)(C)Sc1cc(N(=O)=O)ccc1C(=O)Nc2ccccc2	ZINC000000092609	O=C(Nc1ccccc1)c2ccccc2
COC(=O)N3Cc2sc1nc(C)cc(C)[n+]1c2CN3C(=O)OC	ZINC000000510175	C1NNCc2c1sc3nccc[n+]23
Fc4ccc(c2nnc3sc(c1ccc(N(=O)=O)cc1)nn23)cc4	ZINC000000048480	c4ccc(c3nn2c(c1ccccc1)nnc2s3)cc4
Cc3ccc(N2CCN(Cc1ccoc1)CC2)cc3	ZINC000000213476	C2CN(c1ccccc1)CCN2Cc3ccoc3
CC(=O)Oc4ccc3c(=O)c(c2nc1ccccc1s2)coc3c4	ZINC000000044150	O=c3c(c2nc1ccccc1s2)coc4ccccc34
O=C1CCN2C(=C1)CCc3ccccc23	ZINC000000022616	O=C1CCN2C(=C1)CCc3ccccc23
Cc3ccc(C#N)c(SCC(=O)c2cc1ccccc1oc2=O)n3	ZINC000000044152	O=C(CSc1ccccn1)c3cc2ccccc2oc3=O
C[C@@H]3[C@@H]2CCc1ccccc1N2CCC3=O	ZINC000000022614	O=C3CCN1C(CCc2ccccc12)C3
CC(=O)Nc1ccccc1CCNC(=O)c3ccc2ccccc2c3O	ZINC000000058128	O=C(NCCc1ccccc1)c3ccc2ccccc2c3
COc2cccc([C@@]1(O)C=C(C(F)(F)F)NN1C(=O)C(C)C)c2	ZINC000000063522	N2NC(c1ccccc1)C=C2
COc4cccc(C2C1=C(CCCC1=O)NC3=C2C(=O)CCC3)c4	ZINC000000088528	O=C1CCCC4=C1C(c2ccccc2)C3=C(CCCC3=O)N4
C[C@@H](Nc1ccccc1C(O)=O)C(O)=O	ZINC000000393206	c1ccccc1
CCOC(=O)N2c1ccccc1S(=O)(=O)c3ccccc23	ZINC000000041816	O=S3(=O)c1ccccc1Nc2ccccc23
OC(=C(C(=O)Nc1ccccc1)S(=O)(=O)c2ccccc2)c3ccccc3	ZINC000000640412	O=C(Nc1ccccc1)C(=Cc2ccccc2)S(=O)(=O)c3ccccc3
Fc4ccc(C(=O)Cn2c1=NCCCn1c3ccccc23)cc4	ZINC000000116373	O=C(Cn2c1=NCCCn1c3ccccc23)c4ccccc4
CSc2oc(c1ccccc1)nc2S(=O)(=O)c3ccccc3	ZINC000000048316	O=S(=O)(c1ccccc1)c3coc(c2ccccc2)n3
C[C@@H](CC(O)=O)[C@@](C)(C#N)C(O)=O	ZINC000001580719	nonring
C[C@@H](CC(C(N)=O)(c1ccccc1)c2ccccc2)N(C)C	ZINC000000000030	C(c1ccccc1)c2ccccc2
O[C@H](C(O)=O)c1c(F)ccc(F)c1O	ZINC000238679898	c1ccccc1
Clc3ccc(SCC(=O)Nc2ccc1OCOc1c2)cc3	ZINC000000037680	O=C(CSc1ccccc1)Nc3ccc2OCOc2c3
CCSC(=O)c1cccc(C(=O)SCC)c1	ZINC000000001324	c1ccccc1
Cc1nc(C(F)(F)F)ccc1C(=O)Nc2ccc(C(F)(F)F)cn2	ZINC000000155590	O=C(Nc1ccccn1)c2cccnc2
CCC(=O)c1c(O)cc(O)cc1O	ZINC000000001454	c1ccccc1
CCOC(=O)c2c(O)[nH]c1ccccc1c2=O	ZINC000103525021	O=c1cc[nH]c2ccccc12
Cc2ccc(C(=O)NC(=S)Nc1ccccc1C(N)=O)cc2	ZINC000000014415	O=C(NC(=S)Nc1ccccc1)c2ccccc2
CCn3c(=C\C=C\c2oc1ccccc1[n+]2CC)/oc4ccccc34	ZINC000000106856	C(=Cc2nc1ccccc1o2)C=c4[nH]c3ccccc3o4
CC2CCN(S(=O)(=O)c1ccc(NN=C(C#N)C(N)=O)cc1)CC2	ZINC000000358169	O=S(=O)(N1CCCCC1)c2ccccc2
COc1ccccc1NC(=O)c3cc2cc(Br)ccc2cc3O	ZINC000000642588	O=C(Nc1ccccc1)c3ccc2ccccc2c3
CC(C)NC(=O)c1cccc(Cl)c1	ZINC000000029717	c1ccccc1
CC(=O)Oc2ccc(C(=O)Nc1cc(Cl)ccc1C)cc2	ZINC000000030314	O=C(Nc1ccccc1)c2ccccc2
CC[C@@H]1CCC[N@]1CNC(=O)c2cc(OC)c(OC)c(OC)c2	ZINC000000192219	O=C(NCN1CCCC1)c2ccccc2
CN(C)c2cccc(C(=O)Nc1cc(Cl)ccc1C)c2	ZINC000000030316	O=C(Nc1ccccc1)c2ccccc2
c5ccc4sc(c3ccc(c2nc1ccccc1s2)o3)nc4c5	ZINC000000408929	c5ccc4sc(c3ccc(c2nc1ccccc1s2)o3)nc4c5
CC(=O)ON=C1CC(C)(C)NC(C)(C)C1	ZINC000000040493	N=C1CCNCC1
OC(=O)CCNC(=O)c2ccc(NN=c1ccc(=O)c(C(O)=O)c1)cc2	ZINC000013863965	O=c2ccc(=NNc1ccccc1)cc2
C[C@H]1CC(=O)NN=C1c3ccc(NC2=C(C)C(=O)CC2)cc3	ZINC000000010961	O=C3CCC(c2ccc(NC1=CC(=O)CC1)cc2)=NN3
CC(C)n3cc(\C=c2\[nH]c(=O)n(c1ccccc1)c2=O)c4ccccc34	ZINC000000095064	O=c3[nH]c(=Cc1c[nH]c2ccccc12)c(=O)n3c4ccccc4
Cc3cc(C)c(C(=O)Nc2ccc(OCc1ccccc1)cc2)c(C)c3	ZINC000000048260	O=C(Nc2ccc(OCc1ccccc1)cc2)c3ccccc3
COc2cc(CN1CCC(C(N)=O)CC1)ccc2OC[C@@H](O)CN3CCSCC3	ZINC000011951628	C3CCN(Cc2ccc(OCCCN1CCSCC1)cc2)CC3
CSc2nc(c1ccc(N(=O)=O)cc1)nn2C(C)=O	ZINC000000033358	c2ccc(c1nc[nH]n1)cc2
COc2cc(C(=O)O/N=C(\C)c1ccc(F)cc1)cc(OC)c2OC	ZINC000000137539	O=C(ON=Cc1ccccc1)c2ccccc2
CCOC(=O)CNS(=O)(=O)c1n[nH]c(=O)[nH]c1=O	ZINC000001916800	O=c1cn[nH]c(=O)[nH]1
Fc3ccc(CNC(=O)Cn2c(=S)[nH]c1ccccc1c2=O)cc3	ZINC000000425380	O=C(Cn2c(=S)[nH]c1ccccc1c2=O)NCc3ccccc3
CSc1ccc(\C=C(/C#N)C(N)=S)cc1	ZINC000000046360	c1ccccc1
Cc3c(Cl)c(C(=O)Nn2c(=S)[nH]c1ccccc1c2=O)nn3C	ZINC000002791574	O=C(Nn2c(=S)[nH]c1ccccc1c2=O)c3cc[nH]n3
CNC(=O)CCCc1cccc2OCCSc12	ZINC000000007449	C2CSc1ccccc1O2
CCOc2cc(C=Cc1nc(O)c(N(=O)=O)c(=O)[nH]1)cc(I)c2OCC	ZINC000013955268	O=c2ccnc(C=Cc1ccccc1)[nH]2
CCN(CC)C[C@H](O)CNc2ncc(C)c3n(C)c1ccc(O)cc1c23	ZINC000005139347	c1ccc3c(c1)[nH]c2ccncc23
O=N(=O)c1ccc2c(c1)[nH]c(=O)c3nncn23	ZINC000000007118	O=c2[nH]c1ccccc1n3cnnc23
Clc2ccc(/N=C/c1ccc(Br)s1)cc2N(=O)=O	ZINC000000096014	C(=Nc1ccccc1)c2cccs2
Fc1ccccc1N3CCN(C(=O)COc2ccc(Cl)cc2)CC3	ZINC000000318682	O=C(COc1ccccc1)N3CCN(c2ccccc2)CC3
C=CCn3c(SCC(=O)c2ccc(NS(=O)(=O)c1ccccc1)cc2)nnc3c4ccncc4	ZINC000001147830	O=C(CSc2nnc(c1ccncc1)[nH]2)c4ccc(NS(=O)(=O)c3ccccc3)cc4
O=c2n(CCSC(=S)N1CCCCCC1)c(=O)c3ccccc23	ZINC000000240861	O=c2n(CCSC(=S)N1CCCCCC1)c(=O)c3ccccc23
Fc1ccccc1Nc4nc(NC[C@H]2CCCO2)c3ccccc3n4	ZINC000000090358	C4COC(CNc2nc(Nc1ccccc1)nc3ccccc23)C4
CC2CCN(S(=O)(=O)c1ccc(SCC(O)=O)c(NCC(O)=O)c1)CC2	ZINC000004668697	O=S(=O)(N1CCCCC1)c2ccccc2
COc2cc(\C=c1\sc(=O)n([C@@H](C)C(O)=O)c1=O)cc(Br)c2OCC(O)=O	ZINC000009262944	O=c2[nH]c(=O)c(=Cc1ccccc1)s2
CCOC(=O)c3cc(C(=O)c2ccc(c1ccccc1)cc2)n4ccc(C)cc34	ZINC000000626867	O=C(c2ccc(c1ccccc1)cc2)c3ccc4ccccn34
Nc2cccc(c1c[nH]c(=S)nc1N)c2	ZINC000000040071	S=c2ncc(c1ccccc1)c[nH]2
O=C(N2CCc1ccccc1C2)c3ccco3	ZINC000000030000	O=C(N2CCc1ccccc1C2)c3ccco3
CC(=O)N3C[C@H]1N(CCc2ccccc12)[C@H]3c4ccccc4	ZINC000000029001	C3NC(c1ccccc1)N4CCc2ccccc2C34
CCOC(=O)C3[C@@H](c1ccccc1OCC)n2nnnc2N=C3C	ZINC000000070953	C2C=Nc1nnnn1C2c3ccccc3
Brc2ccc(COC(=O)CNC(=O)c1ccccc1)cc2	ZINC000000332341	O=C(CNC(=O)c1ccccc1)OCc2ccccc2
Cc2sc(NC(=O)c1ccncc1)c(C#N)c2C	ZINC000000048793	O=C(Nc1cccs1)c2ccncc2
CCOc3ccc(Nc2c(Cl)c(=O)n(C1CCCCC1)c2=O)cc3	ZINC000000122059	O=c2cc(Nc1ccccc1)c(=O)n2C3CCCCC3
S=C(N1CCOCC1)c2ccco2	ZINC000000034013	S=C(N1CCOCC1)c2ccco2
Cc4ccc3nc(NC(=O)c1c(C)onc1c2ccccc2)sc3c4	ZINC000000081340	O=C(Nc2nc1ccccc1s2)c3conc3c4ccccc4
Cn2c(=O)c(=CNc1ccc(F)cc1)c(=O)n(C)c2=S	ZINC000000034011	O=c1[nH]c(=S)[nH]c(=O)c1=CNc2ccccc2
C[N@]1[C@H]3CC[C@@H]1CC(NC(=O)CS(=O)(=O)c2ccccc2)C3	ZINC000000136077	O=C(CS(=O)(=O)c1ccccc1)NC2CC3CCC(C2)N3
Clc4ccc(c2csc3ncnc(NC[C@@H]1CCCO1)c23)cc4	ZINC000000145092	C4COC(CNc2ncnc3scc(c1ccccc1)c23)C4
O=C2NCc1cccn1c3sccc23	ZINC000000015072	O=C2NCc1cccn1c3sccc23
CC(C)[C@H](NC(=O)CN1CCN(CC(O)=O)C1=O)C(=O)N2CCC[C@H]2C(=O)N[C@@H](C(C)C)C(=O)C(F)(F)F	ZINC000003993730	O=C(CN1CCNC1=O)NCC(=O)N2CCCC2
CN2C(=O)Cc3cnc(N1CCCCC1)nc23	ZINC000000019961	O=C3Cc2cnc(N1CCCCC1)nc2N3
COC(=O)c2sc(c1ccc(C(C)(C)C)cc1)cc2NC(C)=O	ZINC000000116981	c2ccc(c1cccs1)cc2
COc2ccc(C=CC(=O)NC(=S)N1CCCCCC1)cc2OC	ZINC000000284375	O=C(NC(=S)N1CCCCCC1)C=Cc2ccccc2
Cc2c(CN1CCOCC1)c(O)[nH]c(=O)c2C#N	ZINC000082312116	O=c2ccc(CN1CCOCC1)c[nH]2
CN3CCC(N(C)[C@@H]2CC(=O)N(c1ccccc1)C2=O)CC3	ZINC000000077141	O=C2CC(NC1CCNCC1)C(=O)N2c3ccccc3
CC(C)N(Cc1nccn1C)S(=O)(=O)c2ccc(C)cc2	ZINC000000039077	O=S(=O)(NCc1ncc[nH]1)c2ccccc2
COc3ccc(\C=c1\oc(=O)c2ccccc12)cc3OC	ZINC000000043092	O=c2oc(=Cc1ccccc1)c3ccccc23
Cc3cc(=O)n(c2cc(S(O)(=O)=O)c1cccc(S(O)(=O)=O)c1c2)[nH]3	ZINC000022867680	O=c1cc[nH]n1c3ccc2ccccc2c3
CC(C)Cc3ccc([C@@H](C)C(=O)Nc2cccc(c1cnco1)c2)cc3	ZINC000000117873	O=C(Cc1ccccc1)Nc3cccc(c2cnco2)c3
CC(C)COC(=O)c2cc(c1ccccc1)nc3c(Cl)cccc23	ZINC000000482383	c3ccc(c2ccc1ccccc1n2)cc3
COc2cc(NCCNC(=N)NC(=N)NC(C)C)c1ncccc1c2	ZINC000001687493	c2ccc1ncccc1c2
Cc3ccc(C)c(NC(=O)Cn2nc(C)c1ccccc1c2=O)c3	ZINC000000045625	O=C(Cn2ncc1ccccc1c2=O)Nc3ccccc3
O=C(Nc2cccc(NC(=O)c1nn[nH]n1)n2)c3nn[nH]n3	ZINC000001583585	O=C(Nc2cccc(NC(=O)c1nn[nH]n1)n2)c3nn[nH]n3
OC(=O)Cc2cc1NC(=O)CCc1cc2/C=C/C(O)=O	ZINC000003844944	O=C2CCc1ccccc1N2
Cc1ccccc1N3CCN(C(=O)c2ccc(C(F)(F)F)cc2)CC3	ZINC000000139877	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
CCCN3C(=O)[C@@H](Cc2nc1ccccc1c(=O)n2C)c4ccccc34	ZINC000000103089	O=C2Nc1ccccc1C2Cc4nc3ccccc3c(=O)[nH]4
OCC2N(c1ccccc1)CCN2c3ccccc3	ZINC000000034168	C2CN(c1ccccc1)CN2c3ccccc3
CCN(CC)c3ccc([C@@H]2NC(=O)c1c(C)c(C)sc1N2)c(O)c3	ZINC000000043414	O=C2NC(c1ccccc1)Nc3sccc23
Cn1cnnc1c3cccc(NC(=O)\C=C\c2ccc(F)cc2)c3	ZINC000000032594	O=C(Nc2cccc(c1nnc[nH]1)c2)C=Cc3ccccc3
Clc1ccc(N(=O)=O)cc1c2ccc(C=O)o2	ZINC000000035782	c2ccc(c1ccco1)cc2
CC2(C)N(C(=O)c1ccccc1)C(=O)NC2=O	ZINC000000199217	O=C2CN(C(=O)c1ccccc1)C(=O)N2
C[C@@H](CN(C)C)Oc2ccc(O[C@@H](C)CN(C)C)c3c(=O)c1ccccc1c(=O)c23	ZINC000004783347	O=c2c1ccccc1c(=O)c3ccccc23
COc2cc(\C=N\c1nonc1NC(C)=O)ccc2OC(C)C	ZINC000000042417	C(=Nc1cnon1)c2ccccc2
CCOC(=O)C2CCN(C(=O)N1CCOCC1)CC2	ZINC000000030264	O=C(N1CCCCC1)N2CCOCC2
CC(=O)c5ccc(N4CCN(C(=O)CCCn3c(=S)[nH]c2cc1OCOc1cc2c3=O)CC4)cc5	ZINC000004004768	O=C(CCCn3c(=S)[nH]c2cc1OCOc1cc2c3=O)N5CCN(c4ccccc4)CC5
Clc4ccc3nc(c1ccccc1)c(NC(=O)c2ccccc2)n3c4	ZINC000000283786	O=C(Nc2c(c1ccccc1)nc3ccccn23)c4ccccc4
O=C(N1CCOCC1)N2CCc3ccccc23	ZINC000000030262	O=C(N1CCOCC1)N2CCc3ccccc23
COc3ccc(NS(=O)(=O)c2ccc(NS(=O)(=O)c1ccccc1N(=O)=O)cc2)nn3	ZINC000002208273	O=S(=O)(Nc2ccc(S(=O)(=O)Nc1cccnn1)cc2)c3ccccc3
Cc2nc1ccccn1c2C(=O)NC3CCCCC3	ZINC000000047301	O=C(NC1CCCCC1)c2cnc3ccccn23
COc2ccc([C@@H]1NNC(=S)S1)cc2	ZINC000000114492	S=C2NNC(c1ccccc1)S2
COc2ccc(Oc1ccccc1N(=O)=O)cc2	ZINC000000028149	O(c1ccccc1)c2ccccc2
COC(=O)c4cc3nc2c(CCc1ccccc12)c(C(F)(F)F)n3n4	ZINC000000084080	C3Cc2cn1nccc1nc2c4ccccc34
OC(=O)CNS(=O)(=O)CC(F)(F)F	ZINC000261530234	nonring
Cc4c(\C=c2\c(=O)[nH]c(=O)n(c1cccc(Cl)c1)c2=O)c3ccccc3n4C	ZINC000000654844	O=c3[nH]c(=O)c(=Cc1c[nH]c2ccccc12)c(=O)n3c4ccccc4
O[C@H]1CC[C@@H](COP(O)(O)=O)O1	ZINC000013521903	C1CCOC1
Cc3nnc(SCc2nnc(c1ccccc1)o2)n3c4ccccc4	ZINC000000422539	C(Sc1nncn1c2ccccc2)c4nnc(c3ccccc3)o4
O=C(N[C@@H](C(=O)c1ccccc1)n2ccc(=O)[nH]c2=O)c3ccccc3	ZINC000000081632	O=C(NC(C(=O)c1ccccc1)n2ccc(=O)[nH]c2=O)c3ccccc3
NC(=O)C5(N1CCCCC1)CCN(CCCN3c2ccccc2CCc4ccc(Cl)cc34)CC5	ZINC000000608266	C5CCN(C4CCN(CCCN2c1ccccc1CCc3ccccc23)CC4)CC5
COc2cccc(\C=c1/c(=O)[nH]c(=O)n(C)c1=O)c2	ZINC000000100683	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)[nH]2
CN(C)CCNC(=O)NC2(C(F)(F)F)Oc1ccccc1O2	ZINC000000212686	C2Oc1ccccc1O2
CCNC(=O)c3cc(S(=O)(=O)Nc2ccc(S(=O)(=O)Nc1ccccn1)cc2)ccc3OC	ZINC000020035710	O=S(=O)(Nc2ccc(S(=O)(=O)Nc1ccccn1)cc2)c3ccccc3
Nc3nc(c1ccccc1)c(C(=O)Nc2ccccc2)s3	ZINC000000042308	O=C(Nc1ccccc1)c2scnc2c3ccccc3
CCOC(=O)c1c(N)scc1c2ccc(C(C)C)cc2	ZINC000000087428	c2ccc(c1ccsc1)cc2
Nc2nc1CC[N@](CC=C)CCc1s2	ZINC000000006644	C2Cc1ncsc1CCN2
Cc3ccc(NC(=O)Oc1ccc(Cl)c2cccnc12)c(C)c3	ZINC000000396772	O=C(Nc1ccccc1)Oc2cccc3cccnc23
OC(=O)c2cc1sccc1s2	ZINC000000107891	c2cc1sccc1s2
Cc4c(NC(=O)c2cccc(NS(=O)(=O)c1ccc(C(O)=O)cc1)c2)c(=O)n(c3ccccc3)n4C	ZINC000012694072	O=C(Nc2c[nH]n(c1ccccc1)c2=O)c4cccc(NS(=O)(=O)c3ccccc3)c4
COC(=O)c4ccc(NC(=O)c2cc1c(CO)cnc(C)c1o\c2=N/c3cccc(C(O)=O)c3)cc4	ZINC000002954497	O=C(Nc1ccccc1)c3cc2ccncc2oc3=Nc4ccccc4
OC(C(=O)OCCN1CCCCC1)(c2ccccc2)c3ccccc3	ZINC000000188746	O=C(OCCN1CCCCC1)C(c2ccccc2)c3ccccc3
Nc3cccc4[C@@H]1CCC[C@@H]1[C@@H](c2ccc(Cl)cc2)Nc34	ZINC000000035168	C1CC3C(C1)c2ccccc2NC3c4ccccc4
Cc2cccc(NN=c1c(=O)[nH]c(=S)[nH]c1=O)c2	ZINC000000180469	O=c1[nH]c(=S)[nH]c(=O)c1=NNc2ccccc2
CC(=C)CN4CCN(c2ncnc3scc(c1ccc(Cl)cc1)c23)CC4	ZINC000000639706	C4CN(c2ncnc3scc(c1ccccc1)c23)CCN4
COc3cc2[C@@H](C)N(C(=O)CN1CCCCC1)CCc2cc3O	ZINC000000525714	O=C(CN1CCCCC1)N3CCc2ccccc2C3
Cc5c(n3c(=S)s/c(=c1\c(=O)n(CC(O)=O)c2ccccc12)c3=O)c(=O)n(c4ccccc4)n5C	ZINC000001799921	O=c2[nH]c1ccccc1c2=c5sc(=S)n(c4c[nH]n(c3ccccc3)c4=O)c5=O
O=C4CCCC5=Nc2nc(c1ccccc1)nn2[C@@H](c3ccccc3)C45	ZINC000000065668	O=C4CCCC5=Nc2nc(c1ccccc1)nn2C(c3ccccc3)C45
Cc4ccc3nc(c1ccncc1)cc(C(=O)NC2=NCCS2)c3c4	ZINC000000477181	O=C(NC1=NCCS1)c3cc(c2ccncc2)nc4ccccc34
OC(=O)c1ccccc1NS(=O)(=O)c2cc(N(=O)=O)ccc2N=NCc3ccc(O)cc3O	ZINC000012530644	O=S(=O)(Nc1ccccc1)c2ccccc2N=NCc3ccccc3
CC(C)[C@@H]1CC[C@@H](C)C[C@H]1N(Cc2ccccc2)C(=O)c3ccco3	ZINC000000160481	O=C(N(Cc1ccccc1)C2CCCCC2)c3ccco3
CC(C)(C)OC(=O)NCCCC[C@@H](C(=O)N1CCN(C(=O)OC(C)(C)C)CC1)n2cc(CCC(O)=O)nn2	ZINC000013478011	O=C(Cn1ccnn1)N2CCNCC2
O=C(N4CCN(C2C1CC3CC(C1)CC2C3)CC4)c5ccncc5	ZINC000000317072	O=C(N4CCN(C2C1CC3CC(C1)CC2C3)CC4)c5ccncc5
O=CN1CCCc2ccccc12	ZINC000000028036	C2CNc1ccccc1C2
Oc2ccc1sc(=O)oc1c2	ZINC000000002181	O=c2oc1ccccc1s2
Sc2cc(Cl)c(C(=O)Nc1ccccc1)cc2S(=O)(=O)Nc3n[nH]c(=O)n3c4ccccc4	ZINC000001859530	O=C(Nc1ccccc1)c4cccc(S(=O)(=O)Nc2n[nH]c(=O)n2c3ccccc3)c4
CCOC(=O)c1c[nH]nc1S(=O)(=O)Nc3ccc(OC)c(NS(=O)(=O)c2ccc(F)cc2)c3	ZINC000012539214	O=S(=O)(Nc2cccc(NS(=O)(=O)c1cc[nH]n1)c2)c3ccccc3
Cc2c(N(=O)=O)cc1[nH]c(=O)c(=O)[nH]c1c2CN3CCCC3	ZINC000000017349	O=c3[nH]c2cccc(CN1CCCC1)c2[nH]c3=O
COc3ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)Nc1nc(C)cc(C)n1)cc2)cc3F	ZINC000019932840	O=S(=O)(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c3ccccc3
COc1ccc(C)cc1NS(=O)(=O)c4ccc(NC(=O)CN3C(=O)c2ccccc2S3(=O)=O)cc4	ZINC000008815805	O=C(CN2C(=O)c1ccccc1S2(=O)=O)Nc4ccc(S(=O)(=O)Nc3ccccc3)cc4
COc2cccc(\C=c1/[nH]c(=S)[nH]c1=O)c2OCC(O)=O	ZINC000002978198	O=c1[nH]c(=S)[nH]c1=Cc2ccccc2
Brc3ccc(C(=O)c2ccc1OCCOc1c2)cc3	ZINC000000041696	O=C(c1ccccc1)c3ccc2OCCOc2c3
OC(=O)CC(F)(F)CC(O)=O	ZINC000003227121	nonring
Cc4ccc(C(=O)N/C(=C/c1cccs1)C(=O)NC3CCN(Cc2ccccc2)CC3)cc4C	ZINC000000689394	O=C(NC2CCN(Cc1ccccc1)CC2)C(NC(=O)c3ccccc3)=Cc4cccs4
Cc4ccc(n3c(SCC(=O)N/N=C/c1ccccc1OCC(O)=O)nc2ccccc2c3=O)cc4	ZINC000000949905	O=C(CSc2nc1ccccc1c(=O)n2c3ccccc3)NN=Cc4ccccc4
Fc4ccc(c3cc(c1c[nH]nc1c2ccccn2)ccn3)cc4	ZINC000000003586	c4ccc(c3cc(c1c[nH]nc1c2ccccn2)ccn3)cc4
C1CCc3c(C1)nc4[nH]c2ccccc2n34	ZINC000000127798	C1CCc3c(C1)nc4[nH]c2ccccc2n34
CC(=O)Oc2cc(S(=O)(=O)Nc1nc(N)n[nH]1)c(S)cc2Cl	ZINC000001642336	O=S(=O)(Nc1ncn[nH]1)c2ccccc2
OC(=C3[C@@H](c2ccc(c1ccccc1N(=O)=O)o2)NC(=O)N[C@]3(O)C(F)(F)F)c4ccc(F)cc4	ZINC000001464508	O=C4NCC(=Cc1ccccc1)C(c3ccc(c2ccccc2)o3)N4
COc2cc(C=c1c(=O)[nH]c(=S)[nH]c1=O)ccc2OC(=O)c3cccc(F)c3	ZINC000000658124	O=C(Oc2ccc(C=c1c(=O)[nH]c(=S)[nH]c1=O)cc2)c3ccccc3
CCOC(=O)c2oc1ccccc1c2CN3CCC(C(N)=O)CC3	ZINC000000118667	C3CCN(Cc1coc2ccccc12)CC3
C[C@@H](Sc1n[nH]c(=O)[nH]c1=O)C(=O)Nc2cccc(Cl)c2C	ZINC000000115623	O=C(CSc1n[nH]c(=O)[nH]c1=O)Nc2ccccc2
CCOC(=O)N=S(O)(=O)c1ccccc1Cl	ZINC000000095858	c1ccccc1
OCC3(c1ccccc1)C(=O)c2ccccc2C3=O	ZINC000000001853	O=C2C(c1ccccc1)C(=O)c3ccccc23
Cc4c(c1ccccc1)oc3c(C(=O)OCCN2CCCCC2)cccc3c4=O	ZINC000000608382	O=C(OCCN1CCCCC1)c3cccc4c(=O)cc(c2ccccc2)oc34
COc4cccc(n3c(=O)[nH]c(=O)c(=CN[C@@H](Cc1c[nH]c2ccccc12)C(O)=O)c3=O)c4	ZINC000020567468	O=c3[nH]c(=O)c(=CNCCc1c[nH]c2ccccc12)c(=O)n3c4ccccc4
Cc3ccc(c2nc(c1ccc(N(=O)=O)cc1)no2)cc3Cl	ZINC000000070398	c3ccc(c2noc(c1ccccc1)n2)cc3
CCCc2cc(=O)oc3cc(OCc1ccccc1)ccc23	ZINC000000044694	O=c3ccc2ccc(OCc1ccccc1)cc2o3
Cc3ccc(\C=c2\c(C)nn(c1cccc(C(O)=O)c1)c2=O)cc3	ZINC000000097435	O=c2n(c1ccccc1)ncc2=Cc3ccccc3
O=C(c1ccccc1)c3cc(S(=O)(=O)N2CCOCC2)cs3	ZINC000000053676	O=C(c1ccccc1)c3cc(S(=O)(=O)N2CCOCC2)cs3
CCOC(=O)[C@@H]1CCCN(C(=O)CC(C)(C)C)C1	ZINC000000031738	C1CCNCC1
Clc1cccc3c1c(=O)cc2ccccn23	ZINC000000017725	O=c2cc1ccccn1c3ccccc23
CC(=O)NS(=O)(=O)c2ccc(OCCOc1ccc(S(=O)(=O)NC(C)=O)cc1)cc2	ZINC000001664666	C(COc1ccccc1)Oc2ccccc2
COc4cc3C[C@H](Cc2cc[n+](Cc1ccccc1)cc2)C(=O)c3cc4OC	ZINC000000603084	O=C3C(Cc2cc[n+](Cc1ccccc1)cc2)Cc4ccccc34
COC(=O)c2ccc(Cl)c(NC(=O)COc1c(C)cccc1C)c2	ZINC000000365602	O=C(COc1ccccc1)Nc2ccccc2
CN(C)CCN(Cc1ccccc1)c2ccnc(N(C)C)c2C#N	ZINC000000210132	C(Nc1ccncc1)c2ccccc2
O=C(COCC(=O)c1ccccc1)Sc3nc2ccccc2o3	ZINC000000035239	O=C(COCC(=O)c1ccccc1)Sc3nc2ccccc2o3
O=N(=O)c2cc1OCCOc1cc2CC3CC3	ZINC000000032518	C3COc2cc(CC1CC1)ccc2O3
O/N=C/c1cc(N(=O)=O)cc(N(=O)=O)c1O	ZINC000002572306	c1ccccc1
COc3ccc(C(=O)OC1C[C@@H]2CC[C@H](C1)N2)cc3OC	ZINC000000086170	O=C(OC1CC2CCC(C1)N2)c3ccccc3
Fc1ccccc1C(=O)n2cc(Cl)cn2	ZINC000000037158	O=C(c1ccccc1)n2cccn2
CN(C)CC(=O)Nc4ccc3[C@@H]2C[C@@H](C[N@](C1CCN(C(C)=O)CC1)C2)Cn3c4=O	ZINC000004259185	O=c4cccc3C2CC(CN(C1CCNCC1)C2)Cn34
Cc2cccc3nc(Cn1ccccc1=O)cn23	ZINC000000035230	O=c1ccccn1Cc3cn2ccccc2n3
Cc3[nH]n(c2ncc(c1ccc(Br)cc1)s2)c(=O)c3[C@H](C(C#N)C#N)c4ccccc4	ZINC000000827872	O=c2c(Cc1ccccc1)c[nH]n2c4ncc(c3ccccc3)s4
COc3ccc(Cc2c(N)nc(c1ccccc1)nc2N)cc3	ZINC000000169674	C(c1ccccc1)c3cnc(c2ccccc2)nc3
COC(=O)c1scc(C)c1S(=O)(=O)Nc2ccc(C)cc2	ZINC000000082101	O=S(=O)(Nc1ccccc1)c2ccsc2
COc1cc(N)c(Cl)cc1C(=O)N[C@@H]2CN3CCC2CC3	ZINC000000003961	O=C(NC1CN2CCC1CC2)c3ccccc3
Cc3cc(C(O)=O)cc(S(=O)(=O)Nc2cccc(c1nn[nH]n1)c2)c3C	ZINC000006551887	O=S(=O)(Nc2cccc(c1nn[nH]n1)c2)c3ccccc3
Cc2nc1ccccc1nc2CSc4nnc(c3ccccc3)n4C	ZINC000000109306	C(Sc2nnc(c1ccccc1)[nH]2)c4cnc3ccccc3n4
CCc4ccc([C@H]2Nc1ccccc1NC3=C2C(=O)CC(C)(C)C3)cc4	ZINC000000109543	O=C1CCCC4=C1C(c2ccccc2)Nc3ccccc3N4
Nc3nnc(SCc1ccc(F)c2ccccc12)s3	ZINC000000079987	C(Sc1nncs1)c2cccc3ccccc23
CN(C)CCCn4cc(c3c(c1c[nH]c2ccccc12)c(=O)[nH]c3=O)c5ccccc45	ZINC000000585151	O=c3[nH]c(=O)c(c1c[nH]c2ccccc12)c3c4c[nH]c5ccccc45
Nc1ccccc1Nc3nc2ccccc2[nH]3	ZINC000000033917	N(c1ccccc1)c3nc2ccccc2[nH]3
O=c3[nH]nc4nc(c1ccccc1)c(c2ccccc2)nn34	ZINC000000033912	O=c3[nH]nc4nc(c1ccccc1)c(c2ccccc2)nn34
COc5ccc4[nH]cc(c3c(c1c[nH]c2ccc(OC)cc12)c(=O)[nH]c3=O)c4c5	ZINC000000585159	O=c3[nH]c(=O)c(c1c[nH]c2ccccc12)c3c4c[nH]c5ccccc45
Fc3ccc(c2nc(c1cccnc1)cs2)cc3	ZINC000000003450	c3ccc(c2nc(c1cccnc1)cs2)cc3
C[C@H](NC(=O)CN2N=C(c1ccc(C)cc1)CCC2=O)c3ccccc3	ZINC000000220051	O=C(CN2N=C(c1ccccc1)CCC2=O)NCc3ccccc3
COc2cc(CNn1nnnc1N)ccc2OCC(=O)NC(C)(C)C	ZINC000000359908	C(Nn1cnnn1)c2ccccc2
CCCc1cccc(O)c1O	ZINC000000002504	c1ccccc1
Clc3ccc(NC(=O)Nc2nnc(c1cccc(Cl)c1)o2)cc3	ZINC000000408327	O=C(Nc1ccccc1)Nc3nnc(c2ccccc2)o3
OC(=O)C[C@@H](Cc1ccccc1Cl)C(O)=O	ZINC000001571192	c1ccccc1
CCC3CCC(c2nnc(c1ccc(Br)cc1)o2)CC3	ZINC000000208889	C3CCC(c2nnc(c1ccccc1)o2)CC3
Cc2c(C(O)=O)sc3[nH]c(=S)n(NC(=O)Cc1cccn1C)c(=O)c23	ZINC000017077367	O=C(Cc1ccc[nH]1)Nn3c(=S)[nH]c2sccc2c3=O
CCn3cc(C(=O)N[C@H](C(C)C)C(O)=O)c(=O)c4cc(F)c(N2CCN(C(=O)c1ccco1)CC2)cc34	ZINC000002271012	O=C(N3CCN(c2ccc1c(=O)cc[nH]c1c2)CC3)c4ccco4
CCC[C@@H](C)NS(=O)(=O)c1ccc(C)cc1	ZINC000000030357	c1ccccc1
CCOc3ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)O[C@@H](C)C(=O)Nc1ccc(S(N)(=O)=O)cc1)c2)cc3	ZINC000004522094	O=C(COC(=O)c2cccc(S(=O)(=O)Nc1ccccc1)c2)Nc3ccccc3
Clc5cccc([C@H]3C1C(=O)CCCC1=Nc4nc2ccccc2n34)c5	ZINC000000222681	O=C4CCCC5=Nc2nc1ccccc1n2C(c3ccccc3)C45
Cn2sc(=O)n(Cc1ccccc1)c2=O	ZINC000000027361	O=c1[nH]sc(=O)n1Cc2ccccc2
COc2cccc(n1nnnc1SCC(=O)N(C(C)C)C(C)C)c2	ZINC000000415255	c2ccc(n1cnnn1)cc2
Cc3ccc(Sc2ccc(C1SCCS1)cc2N(=O)=O)cc3	ZINC000000129174	C3CSC(c2ccc(Sc1ccccc1)cc2)S3
Nc4ccc(Oc3ccc2c(=O)n(c1cccc(N)c1)c(=O)c2c3)cc4	ZINC000000050397	O=c3n(c1ccccc1)c(=O)c4cc(Oc2ccccc2)ccc34
OC(=O)C(\NC(=O)c1ccccc1)=C/c3cc2OCOc2cc3Cl	ZINC000000085368	O=C(NC=Cc2ccc1OCOc1c2)c3ccccc3
CC(=O)[C@]26O[C@](C)(c1ccccc1)O[C@H]2C[C@H]5[C@@H]4CCC3=CC(=O)CC[C@]3(C)[C@H]4CC[C@@]56C	ZINC000000607700	O=C6CCC5C4CCC3C(CC2OC(c1ccccc1)OC23)C4CCC5=C6
COC(=O)c3c(c1ccccc1)c(c2ccccc2)c(C(=O)OC)c3=O	ZINC000000068955	O=c3cc(c1ccccc1)c(c2ccccc2)c3
Cc3ccc(S(=O)(=O)NC(=O)Nc1c(C#N)cnn1c2ccccc2)cc3	ZINC000000639814	O=C(Nc1ccnn1c2ccccc2)NS(=O)(=O)c3ccccc3
Cc4ccc(c2nn(CC(=O)N1CCCC1)c(=O)c3ccccc23)cc4	ZINC000000111608	O=C(Cn3nc(c1ccccc1)c2ccccc2c3=O)N4CCCC4
Fc3nc(F)c(F)c(N2C(=O)c1ccccc1S2(=O)=O)c3F	ZINC000000033357	O=C2N(c1ccncc1)S(=O)(=O)c3ccccc23
OC(=O)CSc3cc(NS(=O)(=O)c1ccccc1)c2ccccc2c3O	ZINC000000645676	O=S(=O)(Nc1cccc2ccccc12)c3ccccc3
COc1ccccc1[N+]3=C2CCCCCN2C[C@@]3(O)c4ccc(Br)cc4	ZINC000000622762	C4CCN3CC(c1ccccc1)[N+](c2ccccc2)=C3CC4
COC(=O)c3[nH]c2C[C@H](c1cc(OC)ccc1OC)CC(=O)c2c3C	ZINC000000111605	O=C2CC(c1ccccc1)Cc3[nH]ccc23
Cc4ccc(Nc3nc(c2cc1ccccc1oc2=O)cs3)cc4C	ZINC000000070753	O=c2oc1ccccc1cc2c4csc(Nc3ccccc3)n4
Cc3cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)c1ccc(S(=O)(=O)N(CCC#N)CCC#N)cc1)cc2)n3	ZINC000001769940	O=C(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c3ccccc3
Cc1ccsc1C(=CCC[N@]2CCC[C@H](C(O)=O)C2)c3sccc3C	ZINC000000538450	C3CCN(CCC=C(c1cccs1)c2cccs2)CC3
CC3CCC(N2CCN(c1ncccn1)CC2)CC3	ZINC000000280147	C3CCC(N2CCN(c1ncccn1)CC2)CC3
CCn1c(=O)cc(N)n(CC=C)c1=O	ZINC000000000921	O=c1cc[nH]c(=O)[nH]1
C1CCc4n(CC1)cc(c3ccc2OCCOc2c3)[n+]4c6ccc5OCCOc5c6	ZINC000000622839	C1CCc4n(CC1)cc(c3ccc2OCCOc2c3)[n+]4c6ccc5OCCOc5c6
Clc3ccc(NS(=O)(=O)c2ccc(Cl)c(C(=O)Nc1ccc(Br)cc1)c2)cc3	ZINC000000710978	O=C(Nc1ccccc1)c3cccc(S(=O)(=O)Nc2ccccc2)c3
CCOc2nc1n(C)c(=O)n(C)c(=O)c1n2Cc3ccc(Cl)cc3	ZINC000000378858	O=c3[nH]c(=O)c2n(Cc1ccccc1)cnc2[nH]3
CCCN(CCC)C(=O)c2cc(c1ccc(C)cc1)nc3ccccc23	ZINC000000068224	c3ccc(c2ccc1ccccc1n2)cc3
O=C(Nc1nccs1)c2ccccc2	ZINC000000039994	O=C(Nc1nccs1)c2ccccc2
CC(C)OC(=O)Nc1ccc(NC(=O)OC(C)C)c(C(F)(F)F)c1	ZINC000000232016	c1ccccc1
Cc3cc(C)c(C#N)c(SCC(=O)Nc1cccc2ccccc12)n3	ZINC000000098163	O=C(CSc1ccccn1)Nc2cccc3ccccc23
CN(C1CCCCC1)C(=O)CO/N=C(\c2ccccc2)c5ccc4NC3=NC(=O)CN3Cc4c5	ZINC000000538290	O=C(CON=C(c1ccccc1)c4ccc3NC2=NC(=O)CN2Cc3c4)NC5CCCCC5
Cc3cccc(NC(=O)\C=C\c2ccc(c1ccc(N(=O)=O)cc1)o2)c3	ZINC000000090632	O=C(Nc1ccccc1)C=Cc3ccc(c2ccccc2)o3
COc1c(C)cccc1C(=O)Nc3ccc(N2CCN(C)CC2)cc3	ZINC000000528741	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
CCOc3ccc2c(=O)c(c1ccccc1)coc2c3C	ZINC000000019496	O=c2c(c1ccccc1)coc3ccccc23
OC(=O)c2ccc1cc[nH]c1c2	ZINC000000058267	c2ccc1[nH]ccc1c2
COc3ccc2c(C)nc(NS(=O)(=O)c1ccc(N)cc1)nc2c3	ZINC000000389258	O=S(=O)(Nc2ncc1ccccc1n2)c3ccccc3
Cc2c(c1cc(C(F)(F)F)n(C)n1)sc3ccc(Cl)cc23	ZINC000000114813	c3ccc2sc(c1cc[nH]n1)cc2c3
CN(C(C)=O)c3ccc(N=NC(=C(O)c1ccccc1)C(=O)c2ccccc2)cc3	ZINC000000674802	O=C(C(=Cc1ccccc1)N=Nc2ccccc2)c3ccccc3
Ic4ccc3nc(SCc1n[nH]c(=S)o1)n(Cc2ccccc2)c(=O)c3c4	ZINC000001660376	O=c3n(Cc1ccccc1)c(SCc2n[nH]c(=S)o2)nc4ccccc34
O=N(=O)c4ccc3nc(c1ccco1)c(c2ccco2)nc3c4	ZINC000000058469	c4ccc3nc(c1ccco1)c(c2ccco2)nc3c4
ClC(Cl)(Cl)[C@H](NC(=O)c1cccnc1)Oc2ccccc2	ZINC000000078509	O=C(NCOc1ccccc1)c2cccnc2
CCn2c(=O)c4cccc3c(S(=O)(=O)NC1CCCC1)ccc2c34	ZINC000000079052	O=c2[nH]c3ccc(S(=O)(=O)NC1CCCC1)c4cccc2c34
CNC(=O)c1ccccc1Sc2ccc(N(=O)=O)cc2C(=O)NC	ZINC000000086200	S(c1ccccc1)c2ccccc2
COc2cc(C=c1c(=O)[nH]c(=S)n(CC=C)c1=O)cc(Br)c2OCC(O)=O	ZINC000016195372	O=c1[nH]c(=S)[nH]c(=O)c1=Cc2ccccc2
CCN(CC)c4ccc(\C=c3\sc2nc1ccccc1n2c3=O)cc4	ZINC000000324332	O=c3c(=Cc1ccccc1)sc4nc2ccccc2n34
Oc1ccc(Br)cc1\C=N\Cc2csc3ccccc23	ZINC000000069403	C(N=Cc1ccccc1)c2csc3ccccc23
CCOC(=O)[C@@H]2NN=C(C(=O)c1ccccc1)[C@@H]2c3ccc(C)cc3	ZINC000000052503	O=C(C1=NNCC1c2ccccc2)c3ccccc3
CCN(CC)C(=O)C[S@@](=O)C(c1ccccc1)c2ccccc2	ZINC000000019365	C(c1ccccc1)c2ccccc2
c4ccc(c3cc(c1ccccc1)c2nncn2n3)cc4	ZINC000000035363	c4ccc(c3cc(c1ccccc1)c2nncn2n3)cc4
C[C@H](C(N)=O)[S@@](=O)C(c1ccccc1)c2ccccc2	ZINC000000019367	C(c1ccccc1)c2ccccc2
Clc4cccc(Cc3cn2cc(c1ccccc1)nc2s3)c4	ZINC000000202676	C(c1ccccc1)c4cn3cc(c2ccccc2)nc3s4
CCOC(=O)c2[nH]c1ccccc1c2NC(=O)CN3CCCCC3	ZINC000000117593	O=C(CN1CCCCC1)Nc2c[nH]c3ccccc23
CCOc2cc(CN1CCC(C(=O)NCC(C)C)CC1)ccc2O	ZINC000000236111	C2CCN(Cc1ccccc1)CC2
CN(C)CCN(C1CCN(C)CC1)C(=O)Cc3csc(Nc2ccccc2F)n3	ZINC000012238274	O=C(Cc2csc(Nc1ccccc1)n2)NC3CCNCC3
CN3CCN(c2ccc(NC(=O)c1ccc(F)cc1F)cc2)CC3	ZINC000000128573	O=C(Nc2ccc(N1CCNCC1)cc2)c3ccccc3
NC(=O)N(O)[C@H]1CCCc2c1ccc3ccccc23	ZINC000000005523	C1CCc2c(C1)ccc3ccccc23
COC(=O)C1=CN(C)C=C(C(=O)OC)C1c2ccccc2C	ZINC000000036526	N2C=CC(c1ccccc1)C=C2
OC(=O)CC(F)(F)C(O)=O	ZINC000001845847	nonring
COc1ccc(Cl)cc1P(O)(O)=O	ZINC000001870287	c1ccccc1
CC(=O)Nc2c(C)n(C)n(c1ccccc1)c2=O	ZINC000000041021	O=c1cc[nH]n1c2ccccc2
C[C@@H]4CN(S(=O)(=O)c3ccc(C(=O)Nc2ccc(S(=O)(=O)Nc1nccc(C)n1)cc2)cc3)C[C@@H](C)O4	ZINC000006156043	O=C(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c4ccc(S(=O)(=O)N3CCOCC3)cc4
CCc3ccc(NS(=O)(=O)c2ccc1[nH]c(=O)c(=O)[nH]c1c2)cc3	ZINC000000423436	O=c3[nH]c2ccc(S(=O)(=O)Nc1ccccc1)cc2[nH]c3=O
OC(=O)C[C@@H](NC(=O)c1cncc(O)c1)C(O)=O	ZINC000000352054	c1ccncc1
CN(C)CCNC(=O)C[C@@H]1CCNC[C@@H]1Cc3cc(c2ccccc2)on3	ZINC000008623614	C3CNCC(Cc2cc(c1ccccc1)on2)C3
CCCc2c(Cc1c(F)cccc1Cl)c(=O)oc3cc(O)ccc23	ZINC000000090189	O=c2oc1ccccc1cc2Cc3ccccc3
CCCc2cc(=O)oc3cc(OC(=O)\C=C\c1cccs1)ccc23	ZINC000000090181	O=C(Oc2ccc1ccc(=O)oc1c2)C=Cc3cccs3
Brc2ccc(NC(=S)NCCC1=CCCCC1)nc2	ZINC000000008582	S=C(NCCC1=CCCCC1)Nc2ccccn2
Cc3cc(Sc1ccccc1)c5c(=O)c2ccccc2c4onc3c45	ZINC000000504021	O=c3c1ccccc1c5onc4ccc(Sc2ccccc2)c3c45
Cc5cncc(CN4CCC(=C2c1ccc(Cl)cc1CCc3cccnc23)CC4)c5	ZINC000000598829	C4CC(=C2c1ccccc1CCc3cccnc23)CCN4Cc5cccnc5
Clc3cccc(CSCc2ccc(C(=O)NC1CCCC1)o2)c3	ZINC000000221254	O=C(NC1CCCC1)c3ccc(CSCc2ccccc2)o3
Cc3ccc2[nH]c(c1cc[n+](C)cc1)cc2c3	ZINC000000063339	c3ccc2[nH]c(c1ccncc1)cc2c3
CN3CCN(c2nc1ccccc1o2)CC3	ZINC000000019141	C3CN(c2nc1ccccc1o2)CCN3
Fc3ccc(OCC(=O)Nc2sc1CCCc1c2C#N)cc3	ZINC000000054225	O=C(COc1ccccc1)Nc3cc2CCCc2s3
OC(=O)c2cn(CCn1[nH]c(=O)ccc1=O)nn2	ZINC000020596620	O=c2ccc(=O)n(CCn1ccnn1)[nH]2
Cc3ccc(NC(=O)[C@@H]1CC=CC[C@H]1C(=O)N2CCCCC2)cc3	ZINC000000054228	O=C(Nc1ccccc1)C2CC=CCC2C(=O)N3CCCCC3
Clc1ccccc1CSc2cccc3cccnc23	ZINC000000036131	C(Sc1cccc2cccnc12)c3ccccc3
Cc2cccc(N1CCNCC1)n2	ZINC000000004341	C2CN(c1ccccn1)CCN2
O=S2(=O)Nc1ccccc1N2	ZINC000000009186	O=S2(=O)Nc1ccccc1N2
O[C@H](CNC1CCCCC1)Cn3c2ccccc2c4ccccc34	ZINC000000133758	C4CCC(NCCCn2c1ccccc1c3ccccc23)CC4
Cc2nc(C)c(N1CCN(C(=O)N[C@@H](CCC(O)=O)C(O)=O)CC1)c(=O)[nH]2	ZINC000017256917	O=c1[nH]cncc1N2CCNCC2
FC(F)(F)c2ccc(S(=O)(=O)CC(=O)Nc1ccccc1)nc2	ZINC000000093439	O=C(CS(=O)(=O)c1ccccn1)Nc2ccccc2
Cc1[nH]cnc1Cc3nc(c2ccccc2)cs3	ZINC000000004346	C(c1c[nH]cn1)c3nc(c2ccccc2)cs3
O=C4CN=C(c1ccccc1)c3oc2ccccc2c3N4	ZINC000000036630	O=C4CN=C(c1ccccc1)c3oc2ccccc2c3N4
Nc2nnc(SCc1ccccc1Cl)s2	ZINC000000036137	C(Sc1nncs1)c2ccccc2
COc2cc(NC(=O)CC[N@]1CCC[C@@H](C)C1)cc(OC)c2	ZINC000000176437	O=C(CCN1CCCCC1)Nc2ccccc2
FC(F)(F)c2nccc3n(Cc1ccc(Cl)cc1)ccc(=O)c23	ZINC000000055444	O=c2ccn(Cc1ccccc1)c3ccncc23
Clc1ccccc1CSc3n[nH]c(c2ccccc2N(=O)=O)n3	ZINC000000036136	C(Sc2n[nH]c(c1ccccc1)n2)c3ccccc3
Clc3ccc(OC(=O)c2ccc(N1C(=O)CCC1=O)cc2)cc3	ZINC000000051285	O=C1CCC(=O)N1c3ccc(C(=O)Oc2ccccc2)cc3
COc1ccccc1NC(=O)Nc2c(C(C)C)cccc2C(C)C	ZINC000000398244	O=C(Nc1ccccc1)Nc2ccccc2
Cc1ccc(NS(C)(=O)=O)cc1Cl	ZINC000000029499	c1ccccc1
O=C(Nc1ccccc1)c3ccc[n+](Cc2ccc(N(=O)=O)cc2)c3	ZINC000000307878	O=C(Nc1ccccc1)c3ccc[n+](Cc2ccccc2)c3
Cc2oc1CCCCc1c2C(=O)Nc3ccc(C(O)=O)cc3	ZINC000000034904	O=C(Nc1ccccc1)c3coc2CCCCc23
Cc3cc(C)cc(NC(=O)Cn1c(C(F)(F)F)nc2ccccc12)c3	ZINC000000082650	O=C(Cn1cnc2ccccc12)Nc3ccccc3
Cc1cccc(NS(C)(=O)=O)c1C	ZINC000000029497	c1ccccc1
O=c3n(c2ccc(/C=C/c1ccccc1)cc2)c(=O)c4ccccc34	ZINC000000045144	O=c3n(c2ccc(C=Cc1ccccc1)cc2)c(=O)c4ccccc34
ONC(=O)CCc2nc1ccccc1s2	ZINC000000026458	c2ccc1scnc1c2
Cc3ccc(NC(=O)CSc1nnc2n(N)cnn12)cc3	ZINC000000034902	O=C(CSc1nnc2[nH]cnn12)Nc3ccccc3
Oc1ccccc1C(=O)c2cccs2	ZINC000000006650	O=C(c1ccccc1)c2cccs2
Fc2c(F)c(Oc1ccccc1)c(F)c(F)c2Oc3ccccc3	ZINC000000044146	O(c1ccccc1)c3ccc(Oc2ccccc2)cc3
Fc3ccc(c2nc(c1ccc(Cl)c(N(=O)=O)c1)cs2)cc3	ZINC000000165750	c3ccc(c2csc(c1ccccc1)n2)cc3
C[C@@H](N(Cc1ccco1)C(=O)Nc2ccc(C)c(C)c2)c3ccco3	ZINC000000262764	O=C(Nc1ccccc1)N(Cc2ccco2)Cc3ccco3
COc3ccc(NC(=O)Nc2ccc(OCc1ccccc1)cc2)cn3	ZINC000000157939	O=C(Nc2ccc(OCc1ccccc1)cc2)Nc3cccnc3
c3ccc2oc(c1ncc[nH]1)cc2c3	ZINC000000017887	c3ccc2oc(c1ncc[nH]1)cc2c3
Clc3c(C(=O)Nc2ccc1ccccc1n2)sc4ccccc34	ZINC000000044149	O=C(Nc2ccc1ccccc1n2)c4cc3ccccc3s4
OP(O)(=O)OCC(=O)CBr	ZINC000005112721	nonring
CCc3cc(=O)oc4cc(C)c2c(c1ccc(F)cc1)coc2c34	ZINC000000095455	O=c4ccc3c(ccc2c(c1ccccc1)coc23)o4
COc1ccccc1NS(=O)(=O)c3ccc(NC(=O)c2c(Cl)c(C)nn2C)cc3	ZINC000000696097	O=C(Nc2ccc(S(=O)(=O)Nc1ccccc1)cc2)c3ccn[nH]3
CC(=O)N3CCN(c2[nH]c(=S)c(C#N)c1CC(C)(C)OCc12)CC3	ZINC000000496250	S=c3cc1CCOCc1c(N2CCNCC2)[nH]3
COc2ccc(CC(=O)c1c(O)cc(O)cc1O)cc2	ZINC000000008630	O=C(Cc1ccccc1)c2ccccc2
COc4cccc(NC(=O)Cn2cc(C(=O)C1CC1)c3ccccc23)c4	ZINC000000578901	O=C(Cn2cc(C(=O)C1CC1)c3ccccc23)Nc4ccccc4
NC(=O)OC1(CC#C)CCCCC1	ZINC000000001531	C1CCCCC1
COc1c(Cl)cc(Cl)cc1C(=O)NCc2ccccc2	ZINC000000041800	O=C(NCc1ccccc1)c2ccccc2
Cc2nc1c(C)cccc1c(=O)[nH]2	ZINC000000020442	O=c1[nH]cnc2ccccc12
Cc3ccnc(NS(=O)(=O)c2ccc1ccccc1c2)c3	ZINC000000037582	O=S(=O)(Nc1ccccn1)c3ccc2ccccc2c3
C3CCN(CCN(Cc1ccccc1)c2ccccc2)C3	ZINC000000001534	C3CCN(CCN(Cc1ccccc1)c2ccccc2)C3
Cc3cc(OCC(=O)N1CCc2ccccc12)cc(C)c3Cl	ZINC000000037587	O=C(COc1ccccc1)N2CCc3ccccc23
Brc3cncc(C(=O)Nc2ccc1OCOc1c2)c3	ZINC000000037927	O=C(Nc2ccc1OCOc1c2)c3cccnc3
CNc2ncnc3n(Cc1ccccc1F)nnc23	ZINC000000004127	C(c1ccccc1)n2nnc3cncnc23
Nc2sc1CCCCc1c2C(=O)c3cccc(Cl)c3	ZINC000000004121	O=C(c1ccccc1)c3csc2CCCCc23
Oc2ccc(C(=O)Cn1cnc(N(=O)=O)n1)cc2O	ZINC000000036459	O=C(Cn1cncn1)c2ccccc2
Nn2nc(c1ccccc1)nc2c3ccccc3	ZINC000000036454	c3ccc(c2n[nH]c(c1ccccc1)n2)cc3
Cc4cccc(C(=O)Oc1ccc(C)cc1n3nc2ccccc2n3)c4	ZINC000000055197	O=C(Oc1ccccc1n3nc2ccccc2n3)c4ccccc4
OC[C@@H](O)COc1ccc(Cl)cc1	ZINC000000000135	c1ccccc1
O=c2nc(N1CCOCC1)s/c2=c3/c(=O)[nH]c4ccccc34	ZINC000000036982	O=c2nc(N1CCOCC1)sc2=c3c(=O)[nH]c4ccccc34
NS(=O)(=O)c2ccc1c(C=CS1(=O)=O)c2	ZINC000000026296	O=S2(=O)C=Cc1ccccc12
C[C@@H](CC(O)=O)CC(=O)Nc1nncs1	ZINC000000099756	c1nncs1
CCOc1ccccc1\C=c3\nc(c2cccc(N(=O)=O)c2)oc3=O	ZINC000000070892	O=c2oc(c1ccccc1)nc2=Cc3ccccc3
Cc4ccc3nc(SCc2cn1cc(Cl)ccc1n2)[nH]c3c4	ZINC000000091584	C(Sc2nc1ccccc1[nH]2)c4cn3ccccc3n4
CN3CCN(c2ccc(NC(=O)[C@@H]1CC=CC[C@@H]1C(O)=O)cc2)CC3	ZINC000000386739	O=C(Nc2ccc(N1CCNCC1)cc2)C3CCC=CC3
C[C@@H](O)[C@H]4[C@@H]3[C@@H](C)C(S[C@@H]2N[C@H](C(=O)Nc1cccc(C(O)=O)c1)CS2)=C(C(O)=O)N3C4=O	ZINC000004102292	O=C4CC3CC(SC2NC(C(=O)Nc1ccccc1)CS2)=CN34
COc4c1OCOc1cc3CC[N@@](C)[C@H](c2ccc(O)cc2O)c34	ZINC000000526567	C4Cc2cc1OCOc1cc2C(c3ccccc3)N4
CC4(C)CC(=O)C([C@@H](c1ccccn1)c2c[nH]c3ccccc23)C(=O)C4	ZINC000000072008	O=C1CCCC(=O)C1C(c2ccccn2)c3c[nH]c4ccccc34
CN[C@@H](C)C(=O)c1ccc(OC)cc1	ZINC000000000486	c1ccccc1
CN[C@@H](C)Cc1ccccc1OC	ZINC000000000487	c1ccccc1
Fc1ccccc1[C@H]2NC(=O)CC[C@H]2N(=O)=O	ZINC000000090292	O=C2CCCC(c1ccccc1)N2
COC(=O)c2ccc(OC(=O)COc1cc(C)c(Cl)c(C)c1)cc2	ZINC000000148546	O=C(COc1ccccc1)Oc2ccccc2
Cc3ccc(C)c(NC(=O)CSc2nnc(c1ccccc1)o2)c3	ZINC000000107241	O=C(CSc2nnc(c1ccccc1)o2)Nc3ccccc3
CCn3c(C)c(\C=N\NC(=O)c2ccc1OCOc1c2)c4ccccc34	ZINC000000487278	O=C(NN=Cc1c[nH]c2ccccc12)c4ccc3OCOc3c4
c4cc(n1ccnc1)c3[nH]c(c2ccncc2)nc3c4	ZINC000000012631	c4cc(n1ccnc1)c3[nH]c(c2ccncc2)nc3c4
C[C@@H](Cc1ccc(O)cc1)NC[C@@H](O)c2cc(O)cc(O)c2	ZINC000000057321	C(Cc1ccccc1)NCCc2ccccc2
CC(C)(C)c2csc(NC(=O)c1cccnc1)n2	ZINC000000073288	O=C(Nc1nccs1)c2cccnc2
CCOC(=O)c1cc(C)ccc1NC(=S)Nc2cccc(Cl)c2	ZINC000000067347	S=C(Nc1ccccc1)Nc2ccccc2
Cc2cc(NS(=O)(=O)c1ccc(Cl)s1)no2	ZINC000000095073	O=S(=O)(Nc1ccon1)c2cccs2
Brc3ccc2n(CC(=O)N1CCCCC1)cc(C=O)c2c3	ZINC000000578830	O=C(Cn1ccc2ccccc12)N3CCCCC3
NC(=N)c4ccc3n(CC(=O)c2ccc(c1ccccc1)cc2)cnc3c4	ZINC000000578837	O=C(Cn1cnc2ccccc12)c4ccc(c3ccccc3)cc4
O=C(NCCc2nc1ccccc1[nH]2)[C@@H]4COc3ccccc3O4	ZINC000000031850	O=C(NCCc2nc1ccccc1[nH]2)C4COc3ccccc3O4
CCc3nc2n(c1ccccc1)nc(C)c2c4cc(OC)c(OC)cc34	ZINC000000332955	c4ccc(n1ncc3c1ncc2ccccc23)cc4
COc2cc(\C=N\NC(=S)Nc1ccccc1)cc(OC)c2OC	ZINC000000234589	S=C(NN=Cc1ccccc1)Nc2ccccc2
CC(C)(C)c4cc(N3[C@@H](c1ccccc1F)C(C(=O)c2ccccc2)=C(O)C3=O)no4	ZINC000000708124	O=C3C=C(C(=O)c1ccccc1)C(c2ccccc2)N3c4ccon4
COc3ccc(c2noc(CCC(=O)Nc1cccc(C#N)c1)n2)cc3	ZINC000000428502	O=C(CCc2nc(c1ccccc1)no2)Nc3ccccc3
CNC(=O)c3cccc(NC(=O)Cc2ccc1ccccc1c2)c3	ZINC000000007471	O=C(Cc2ccc1ccccc1c2)Nc3ccccc3
CN(C)c2ccc(\C=N\NC(=S)Nc1cccc(C)c1)cc2	ZINC000000027893	S=C(NN=Cc1ccccc1)Nc2ccccc2
CCN3C(=O)[C@](O)(CC(=O)c2ccc1CCCCc1c2)c4ccccc34	ZINC000000315627	O=C(CC1C(=O)Nc2ccccc12)c4ccc3CCCCc3c4
O=C(N4CCN(C2C1CC3CC(C1)CC2C3)CC4)c5cccs5	ZINC000000239195	O=C(N4CCN(C2C1CC3CC(C1)CC2C3)CC4)c5cccs5
CN2C(=O)N[C@H](c1ccccc1)C2=O	ZINC000000000550	O=C2NC(c1ccccc1)C(=O)N2
C[C@@]4(O)CC[C@H]3[C@@H]2CCC1=CC(=O)C=C[C@]1(C)[C@H]2[C@H](O)C[C@@]34C	ZINC000000000554	O=C4C=CC3C2CCC1CCCC1C2CCC3=C4
Clc3ccc(C[C@H]2C(=O)N=C1SCCN1C2=O)cc3	ZINC000000000555	O=C2N=C1SCCN1C(=O)C2Cc3ccccc3
CC(=O)Nc1ccc(C(O)=O)cc1NC(N)=N	ZINC000000006507	c1ccccc1
O=C(Nc2nc(c1ccccc1)cs2)c4ccc(n3cnnn3)cc4	ZINC000000421273	O=C(Nc2nc(c1ccccc1)cs2)c4ccc(n3cnnn3)cc4
O=c3n(Cc1ccccc1)n(Cc2ccccc2)c(=O)c4ccccc34	ZINC000000072785	O=c3n(Cc1ccccc1)n(Cc2ccccc2)c(=O)c4ccccc34
Cc2cc(O)c(C)c3sc(NCc1cccnc1)nc23	ZINC000000007872	C(Nc2nc1ccccc1s2)c3cccnc3
C[C@@H]3C[N@@](CCC(=O)NCCCN1CCOCC1)Cc2cc(C)ccc2O3	ZINC000012051372	O=C(CCN2CCOc1ccccc1C2)NCCCN3CCOCC3
CCN2CCC(O)(C#Cc1ccccc1)CC2	ZINC000000088469	C2CC(C#Cc1ccccc1)CCN2
Cc2c(C#N)c1ccccc1n2CC(=O)NC[C@@H]3CCCO3	ZINC000000029030	O=C(Cn1ccc2ccccc12)NCC3CCCO3
Cc2c(C#N)c1ccccc1n2CC(=O)NCc3ccco3	ZINC000000029031	O=C(Cn1ccc2ccccc12)NCc3ccco3
Clc3cc(Cl)c2oc(=O)c(C(=O)Oc1ccccc1)cc2c3	ZINC000000058730	O=C(Oc1ccccc1)c3cc2ccccc2oc3=O
CC(=O)c2ccc(NC(=O)c1c(C)cc(=O)oc1C)cc2	ZINC000000028524	O=C(Nc1ccccc1)c2ccc(=O)oc2
COc3ccc(NC(=O)n2ccc(C(=O)N1CCOCC1)n2)cc3	ZINC000000028523	O=C(Nc1ccccc1)n3ccc(C(=O)N2CCOCC2)n3
COc1ccccc1NC(=O)c2cc[nH]n2	ZINC000000028521	O=C(Nc1ccccc1)c2cc[nH]n2
CN1CCCN=C1COC(=O)[C@](O)(C2CCCCC2)c3ccccc3	ZINC000000020260	O=C(OCC1=NCCCN1)C(C2CCCCC2)c3ccccc3
O=C2Nc1ccccc1[C@]24Nc3ccccc3C(=O)N4C5CCCCC5	ZINC000000088726	O=C2Nc1ccccc1C24Nc3ccccc3C(=O)N4C5CCCCC5
COc1nccnc1NS(=O)(=O)c4ccc(NC=c3c(=O)[nH]c(=O)n(c2ccc(C)c(C)c2)c3=O)cc4	ZINC000008442886	O=c3[nH]c(=O)c(=CNc2ccc(S(=O)(=O)Nc1cnccn1)cc2)c(=O)n3c4ccccc4
Cc3ccc(c2nc(c1ccc(Cl)cc1Cl)no2)cc3C	ZINC000000461916	c3ccc(c2noc(c1ccccc1)n2)cc3
Nc2ncnc3n([C@H]1C[C@H](O)[C@@H](COP(O)(O)=O)[S@@]1=O)cnc23	ZINC000013797201	O=S1CCCC1n2cnc3cncnc23
CC2CCN(CC[C@@H](C)N(C)S(=O)(=O)c1cccc(C)c1)CC2	ZINC000000007275	O=S(=O)(NCCCN1CCCCC1)c2ccccc2
O=N(=O)c4ccc(COc1ccc3c(c1)oc(=O)c2ccccc23)cc4	ZINC000000045386	O=c3oc2cc(OCc1ccccc1)ccc2c4ccccc34
Nc1ccc(S(O)(=O)=O)c(NCCC(O)=O)c1	ZINC000021992231	c1ccccc1
C3Sc1ccccc1c4[nH]c2ccccc2c34	ZINC000000006892	C3Sc1ccccc1c4[nH]c2ccccc2c34
OCCN(CCO)Cc1ccccc1Sc2cccc3ccccc23	ZINC000000690112	S(c1ccccc1)c2cccc3ccccc23
COc1c(Cl)cc(Cl)cc1C(=O)Nc2c(C)nn(C)c2C	ZINC000000064659	O=C(Nc1cn[nH]c1)c2ccccc2
C[N@]1[C@H]3CC[C@@H]1CC(NS(=O)(=O)c2cccc(C(F)(F)F)c2)C3	ZINC000000135928	O=S(=O)(NC1CC2CCC(C1)N2)c3ccccc3
Cc2cc(C)cc(S(=O)(=O)c1cccc(N)c1C#N)c2	ZINC000000006471	O=S(=O)(c1ccccc1)c2ccccc2
CNC(=O)c1ccc(C(C)(C)C)cc1	ZINC000000030109	c1ccccc1
Cc2cc(S(=O)(=O)Nc1cc(Cl)ccc1O)ccc2F	ZINC000000081753	O=S(=O)(Nc1ccccc1)c2ccccc2
Fc1ccccc1c3nc2ccccc2s3	ZINC000000019638	c3ccc(c2nc1ccccc1s2)cc3
OP(O)(=O)c2ccc(C(=O)Nc1ccccc1)cc2	ZINC000001684238	O=C(Nc1ccccc1)c2ccccc2
Nc2cc(=O)c1ccccc1[nH]c2=O	ZINC000000017866	O=c2ccc(=O)c1ccccc1[nH]2
CCCc1cc(=O)n4c(n1)sc3c(=O)n(c2ccccc2)c(=O)c34	ZINC000000031988	O=c3ccnc4sc2c(=O)n(c1ccccc1)c(=O)c2n34
O=c2oc1ccccc1cc2C5=NO[C@@H](c4ccc3OCOc3c4)C5	ZINC000000031985	O=c2oc1ccccc1cc2C5=NOC(c4ccc3OCOc3c4)C5
CCOC(=O)c2c(c1ccccc1)oc3cc(Br)c(OCC)cc23	ZINC000000623901	c3ccc(c2cc1ccccc1o2)cc3
CC1(C)CCC(NC(=O)[C@@H](N)CCC(O)=O)CC1	ZINC000000006138	C1CCCCC1
CC3(C)c1ccccc1N2CCC(=O)N[C@@]23/C=C/c4cccnc4	ZINC000000031981	O=C4CCN2c1ccccc1CC2(C=Cc3cccnc3)N4
CC(C)(CO)CNc1nc(N)nc(Cl)c1N	ZINC000000021006	c1cncnc1
CN(Cn1c(=O)oc2ccccc12)C3CCCCC3	ZINC000000034170	O=c2oc1ccccc1n2CNC3CCCCC3
Cc2cc(NCc1cccnc1)nc(N)n2	ZINC000000073355	C(Nc1ccncn1)c2cccnc2
CCOc3cc(\C=N\c2sc1CCCCc1c2C#N)ccc3O	ZINC000000047317	C3CCc2sc(N=Cc1ccccc1)cc2C3
COC(=O)NC(=O)c1ccc(Cl)cc1	ZINC000000108048	c1ccccc1
OC(=O)[C@@H]2CCN(C(=O)c1nn[nH]n1)C2	ZINC000087440238	O=C(N1CCCC1)c2nn[nH]n2
Nc2nc(c1ccncc1)cc(=O)[nH]2	ZINC000000025651	O=c2cc(c1ccncc1)nc[nH]2
COc2ccc(S(=O)(=O)Nc1ccc(C#N)cc1)cc2	ZINC000000030295	O=S(=O)(Nc1ccccc1)c2ccccc2
CNC(=O)[C@@H]2CN(c1ccc(F)cc1)C(=O)C2	ZINC000000054506	O=C1CCCN1c2ccccc2
CCOC(=O)NCc2ccc1OCOc1c2	ZINC000000032088	C2Oc1ccccc1O2
CC4(C)CN(c3cc(=O)c2ccc1ccccc1c2o3)CCO4	ZINC000000003117	O=c2cc(N1CCOCC1)oc4c2ccc3ccccc34
Cc3ccc(Sc1ncccc1NC(=O)c2ccco2)cc3	ZINC000000084091	O=C(Nc1cccnc1Sc2ccccc2)c3ccco3
COc2ccc(NC(=S)N1CCC[N@](C(C)C)C1)cc2Cl	ZINC000000260322	S=C(Nc1ccccc1)N2CCCNC2
Cc2ccc(C(O)=O)c(NC(=O)c1ccccc1)c2	ZINC000000061641	O=C(Nc1ccccc1)c2ccccc2
CC(=O)Oc1ccccc1C(=O)Oc2c(C)occc2=O	ZINC000000006255	O=C(Oc1coccc1=O)c2ccccc2
COc1ccc(C)cc1NS(=O)(=O)c4ccc(NS(=O)(=O)c3ccc2OCCOc2c3)cc4	ZINC000000916164	O=S(=O)(Nc1ccccc1)c4ccc(NS(=O)(=O)c3ccc2OCCOc2c3)cc4
Cn1ccnc1S(=O)(=O)C(=C/c2ccc(C(F)(F)F)cc2)/C#N	ZINC000000096351	O=S(=O)(C=Cc1ccccc1)c2ncc[nH]2
CCOC(=O)C(=C/c1ncc(N(=O)=O)n1C)/C(C)=O	ZINC000000001990	c1c[nH]cn1
Oc1ccc(Br)cc1CNc2cc(Cl)cc(Cl)c2	ZINC000000040889	C(Nc1ccccc1)c2ccccc2
Cc3nnc(Nc2ccc(C(=O)N1CCOCC1)cc2)c4ccccc34	ZINC000000447971	O=C(N1CCOCC1)c4ccc(Nc2nncc3ccccc23)cc4
Cn2c(SCC(N)=O)nc1ccccc1c2=O	ZINC000000034755	O=c1[nH]cnc2ccccc12
CS(=O)(=O)Nc3ccc(S(=O)(=O)Nc1cccc2c(Cl)c[nH]c12)cc3	ZINC000000592633	O=S(=O)(Nc1cccc2cc[nH]c12)c3ccccc3
Cc2cccc(C(=O)Nc1cc(N(=O)=O)ccc1C)c2	ZINC000000038668	O=C(Nc1ccccc1)c2ccccc2
Cc2cccc3[C@H](c1c[nH]cn1)CCCc23	ZINC000000006656	C3CC(c1c[nH]cn1)c2ccccc2C3
Nc2nc(SCC(=O)Nc1cc(C(F)(F)F)ccc1Cl)[nH]c(=O)c2NC(=O)c3ccco3	ZINC000002712529	O=C(CSc2ncc(NC(=O)c1ccco1)c(=O)[nH]2)Nc3ccccc3
Nc3noc(C12CCCN(C1)C2)n3	ZINC000000004880	C2CN3CC(c1ncno1)(C2)C3
FC(F)(F)c2cc(c1cccs1)oc(=S)c2C#N	ZINC000000031211	S=c2cccc(c1cccs1)o2
COc2ccc(OC(=O)c1ccc(Br)cc1)c(C(C)=O)c2	ZINC000000262430	O=C(Oc1ccccc1)c2ccccc2
C[C@@H]2Cc1ccccc1N2C(=O)CSc3nc(N)cc(N)n3	ZINC000000420139	O=C(CSc1ncccn1)N2CCc3ccccc23
COc3ccc(CCc2nc(c1nonc1N)no2)cc3	ZINC000000034357	C(Cc2nc(c1cnon1)no2)c3ccccc3
COc3ccc(\C=C/c2cc(OC)c1OCOc1c2)cc3O	ZINC000000024633	C3Oc2ccc(C=Cc1ccccc1)cc2O3
C1C=NN[C@@H]1c2ccccc2	ZINC000000025100	C1C=NNC1c2ccccc2
Clc2cc(Cl)c1cccnc1c2OC(=O)Nc3ccccc3	ZINC000000396572	O=C(Nc1ccccc1)Oc2cccc3cccnc23
OP(O)(=O)c2cc1ccccc1oc2=O	ZINC000001674638	O=c2ccc1ccccc1o2
CN([C@@H]1CCS(=O)(=O)C1)C(=O)CSc3nc2cc(C(O)=O)ccc2c(=O)n3Cc4ccccc4	ZINC000003382477	O=C(CSc2nc1ccccc1c(=O)n2Cc3ccccc3)NC4CCS(=O)(=O)C4
Cc3ccc(N2CCN(S(=O)(=O)c1ccc(F)c(C)c1)CC2)cc3	ZINC000000094436	O=S(=O)(N2CCN(c1ccccc1)CC2)c3ccccc3
O/N=c1\c(=O)ccc2cc(S(O)(=O)=O)ccc12	ZINC000012358857	N=c1c(=O)ccc2ccccc12
CCn2c(=C\C=C1C(=O)OC(C)(C)OC1=O)/sc3ccccc23	ZINC000000028044	O=C1OCOC(=O)C1=CC=c3[nH]c2ccccc2s3
CCOC(=O)c1cc(CC)sc1NC(=O)c2ccc(N(=O)=O)o2	ZINC000000090980	O=C(Nc1cccs1)c2ccco2
O=C(OCC2c1ccccc1c3ccccc23)ON4C(=O)CCC4=O	ZINC000000039226	O=C(OCC2c1ccccc1c3ccccc23)ON4C(=O)CCC4=O
ClC1=CC[C@@H]3[C@H](C1)C(=O)N(CCN2CCCCC2)C3=O	ZINC000000139734	O=C2C1CC=CCC1C(=O)N2CCN3CCCCC3
OC(=O)[C@H](Cc1ccc(N(=O)=O)cc1)NC(=O)[C@@H]2CCCN2S(=O)(=O)c3cc(Cl)cc(Cl)c3	ZINC000013438729	O=C(NCCc1ccccc1)C2CCCN2S(=O)(=O)c3ccccc3
Cc3ccc(NC(=O)[C@@H]2C=C(O)NC(Nc1cccc(C)c1)=N2)cc3	ZINC000000528866	O=C(Nc1ccccc1)C3C=CNC(Nc2ccccc2)=N3
Clc2ccc(C(=O)Nc1ccc(Br)cn1)cc2Cl	ZINC000000066664	O=C(Nc1ccccn1)c2ccccc2
CSc2ncc(Cl)c(C(=O)Nc1ccccc1C#N)n2	ZINC000000040866	O=C(Nc1ccccc1)c2ccncn2
OC(=O)\C=C\c2ccc(c1ccc(Cl)cc1)o2	ZINC000000040867	c2ccc(c1ccco1)cc2
C[C@H]2Cc1ccccc1N2C(=O)COc4ccc3c(C)cc(=O)oc3c4	ZINC000000419830	O=C(COc2ccc1ccc(=O)oc1c2)N3CCc4ccccc34
Oc2nc(C=Cc1ccco1)[nH]c(=O)c2N(=O)=O	ZINC000008157022	O=c2ccnc(C=Cc1ccco1)[nH]2
CCCN(CCC)C(=O)c1cc(OC)cc(OC)c1	ZINC000000029930	c1ccccc1
Cc3cc(OCc2nc(c1cccc(N(=O)=O)c1)no2)ccc3Cl	ZINC000000080713	C(Oc1ccccc1)c3nc(c2ccccc2)no3
O=C(N2CCN(c1ccccc1)CC2)c4scc3CCCCc34	ZINC000000034599	O=C(N2CCN(c1ccccc1)CC2)c4scc3CCCCc34
CCOc4cc([C@H]1CC(=O)Nc2c1ccc3ccccc23)ccc4O	ZINC000000124202	O=C4CC(c1ccccc1)c3ccc2ccccc2c3N4
O=C(Cc1ccccc1)N2CSC[C@@H]2C(=O)N3CCCC3	ZINC000000025344	O=C(Cc1ccccc1)N2CSCC2C(=O)N3CCCC3
C[N@]1CCCC[C@@H]1C(C)(C)OC(=O)C(c2ccccc2)c3ccccc3	ZINC000000608026	O=C(OCC1CCCCN1)C(c2ccccc2)c3ccccc3
COc1ccccc1NC(=O)C(C)C	ZINC000000029800	c1ccccc1
CCOC(=O)c1ccccc1NC(=O)C(C)C	ZINC000000029806	c1ccccc1
CN2CCN(\C=N\c1ncc(C(F)(F)F)cc1Cl)CC2	ZINC000000133240	C2CN(C=Nc1ccccn1)CCN2
CCOC(=O)c3csc(c2ccc(C1SCCS1)cc2)n3	ZINC000000121466	C3CSC(c2ccc(c1nccs1)cc2)S3
CNc1nccn2c(Br)cnc12	ZINC000000003750	c2cn1ccnc1cn2
Brc1cscc1Cc2c[nH]cn2	ZINC000000008936	C(c1ccsc1)c2c[nH]cn2
COc2cc([C@@H](C#N)N1N=C(C)CC1(C)C)ccc2O	ZINC000000034908	C2CN(Cc1ccccc1)N=C2
S=C(NCc1ccco1)Nc2nccs2	ZINC000000008935	S=C(NCc1ccco1)Nc2nccs2
CC(C)C(C(O)=O)C(O)=O	ZINC000000394950	nonring
Brc4ccc(n3c(=O)[nH]c(=O)/c(=C/c2ccc(OCc1ccccc1C#N)cc2)c3=O)cc4	ZINC000000852800	O=c3[nH]c(=O)c(=Cc2ccc(OCc1ccccc1)cc2)c(=O)n3c4ccccc4
OC(=O)C3(C(O)=O)C[C@@H]2[C@H]1C[C@H](C=C1)[C@H]2C3	ZINC000004722719	C3CC2C1CC(C=C1)C2C3
CCn2c(SCC(=O)c1cc(OC)ccc1OC)nnc2C3CC3	ZINC000000410394	O=C(CSc2nnc(C1CC1)[nH]2)c3ccccc3
CCOC(=O)c2cccc(NC(=O)Cc1cccs1)c2	ZINC000000031726	O=C(Cc1cccs1)Nc2ccccc2
CCOC(=O)C1=C(C)N(C)C(=S)N[C@@H]1c2ccccc2N(=O)=O	ZINC000000071171	S=C2NC=CC(c1ccccc1)N2
Cc1ccc(S(=O)(=O)NCC(O)=O)c2nsnc12	ZINC000000192197	c2ccc1nsnc1c2
Cc2ccc(C(=O)NS(=O)(=O)c1ccc(N)cc1)cc2C	ZINC000000002089	O=C(NS(=O)(=O)c1ccccc1)c2ccccc2
CC(=O)c3cccc(NS(=O)(=O)c2cccc(C(=O)Nc1ccc(Br)cc1)c2)c3	ZINC000000797269	O=C(Nc1ccccc1)c3cccc(S(=O)(=O)Nc2ccccc2)c3
Cc2[nH]c(=O)c(c1ccccc1)c(O)c2C#N	ZINC000000087703	O=c1[nH]cccc1c2ccccc2
COC(N)=NS(=O)(=O)c3ccc(NC(=O)[C@@H]1CCCN1C(O)=NS(=O)(=O)c2ccc(C)cc2)cc3	ZINC000013808137	O=C(Nc1ccccc1)C2CCCN2C=NS(=O)(=O)c3ccccc3
CC(=O)c2c(NN1CCOCC1)oc(C)cc2=O	ZINC000000033582	O=c2ccoc(NN1CCOCC1)c2
Oc5ccc(NS(=O)(=O)c2cc(S(=O)(=O)Nc1ccc(O)cc1)c4sc(=O)c3cccc2c34)cc5	ZINC000001795682	O=c3sc5c(S(=O)(=O)Nc1ccccc1)cc(S(=O)(=O)Nc2ccccc2)c4cccc3c45
CC[C@H](C)[C@@H](NC(=O)CNC(=O)Cc2c(C)c1ccc(O)cc1oc2=O)C(O)=O	ZINC000011865614	O=c2ccc1ccccc1o2
Brc2ccc(C1CC1)c(N(=O)=O)c2	ZINC000000032563	C1CC1c2ccccc2
Nc2cccc(CC(=S)N1CCOCC1)c2	ZINC000000078084	S=C(Cc1ccccc1)N2CCOCC2
CC[C@@H](O)c2ccc(OC[C@@H](O)CN1CCCCC1)c(OC)c2	ZINC000000238695	C2CCN(CCCOc1ccccc1)CC2
O=C(N1CCOCC1)c3ccc(NS(=O)(=O)c2ccccc2)cc3	ZINC000000179315	O=C(N1CCOCC1)c3ccc(NS(=O)(=O)c2ccccc2)cc3
CC(C)CCSc3nc(N)c2c1CC(C)(C)OCc1sc2n3	ZINC000000102961	C1Cc2c(CO1)sc3ncncc23
C(Sc1ncnc2ccccc12)c3ccccc3	ZINC000000024749	C(Sc1ncnc2ccccc12)c3ccccc3
CCN(CC)C(=O)C2CCN(Cc1ccc(OC)c(OC)c1)CC2	ZINC000000299610	C2CCN(Cc1ccccc1)CC2
OC(=O)c2ccc(S(=O)(=O)c1ccc(O)cc1)cc2	ZINC000000289893	O=S(=O)(c1ccccc1)c2ccccc2
CC3CCN(Cn2cnn(CN1CCC(C)CC1)c2=S)CC3	ZINC000000102969	S=c2n(CN1CCCCC1)cnn2CN3CCCCC3
COc1ccccc1N4CCN(c2nnnn2c3ccccc3)CC4	ZINC000000038129	C3CN(c1nnnn1c2ccccc2)CCN3c4ccccc4
Oc3c(C(=O)NCCNC(=O)c2c(O)c1ccccc1oc2=O)c(=O)oc4ccccc34	ZINC000003154716	O=C(NCCNC(=O)c2cc1ccccc1oc2=O)c4cc3ccccc3oc4=O
CCOC(=O)C(C(C)N)=C2CC(=O)N(c1ccccc1)C2=O	ZINC000000067619	C=C2CC(=O)N(c1ccccc1)C2=O
Cc1ccccc1Oc2cc(C#N)c(C#N)cc2Oc3ccccc3C	ZINC000000045146	O(c1ccccc1)c2ccccc2Oc3ccccc3
CC/C(=C(/c1ccc(OCC(O)=O)cc1)c2cccc(O)c2)c3ccccc3	ZINC000000538602	C(=C(c1ccccc1)c2ccccc2)c3ccccc3
C[C@@H](NC(=O)CN2C(=O)c1ccccc1S2(=O)=O)c3ccccc3	ZINC000000037605	O=C(CN2C(=O)c1ccccc1S2(=O)=O)NCc3ccccc3
C(c1ccccc1)[n+]2csc3ccccc23	ZINC000000041240	C(c1ccccc1)[n+]2csc3ccccc23
COc3ccc(S(=O)(=O)Nc2ccc(N1CCOCC1)cc2)cc3	ZINC000000210657	O=S(=O)(Nc2ccc(N1CCOCC1)cc2)c3ccccc3
Clc2ccc(SCC(=O)Nc1cc(Cl)ccc1Cl)cc2	ZINC000000402131	O=C(CSc1ccccc1)Nc2ccccc2
OC(=O)C[C@H]1N(C(O)=O)CCC1=O	ZINC000039126005	O=C1CCNC1
O=C(c1ccccc1)c2ccccc2OCc4nc3ccccc3s4	ZINC000000035284	O=C(c1ccccc1)c2ccccc2OCc4nc3ccccc3s4
CC(C)[C@@H](C(=O)Nc1nccs1)n3c(=O)c2ccccc2c3=O	ZINC000000047684	O=C(Cn2c(=O)c1ccccc1c2=O)Nc3nccs3
Cc1csc(C(O)=O)c1NC(=O)C(F)(F)F	ZINC000000082000	c1ccsc1
CCOc2ccc([C@@H](CC(=O)c1ccccc1)C(C#N)C#N)cc2OC	ZINC000000377304	O=C(CCc1ccccc1)c2ccccc2
Cc3cc(c1ccccc1)nc(SCc2ccc(Cl)cc2)n3	ZINC000000574024	C(Sc2nccc(c1ccccc1)n2)c3ccccc3
Cc2ncc(Cn1c(C)c(CCO)sc1=O)c(N)n2	ZINC000000002152	O=c1sccn1Cc2cncnc2
Cn2cc(S(=O)(=O)Nc1cc(F)ccc1C(O)=O)c(=O)n(C)c2=O	ZINC000013313253	O=c2[nH]cc(S(=O)(=O)Nc1ccccc1)c(=O)[nH]2
CCc2n[n+]1c(C)cc(C)nc1s2	ZINC000000124254	c2cnc1scn[n+]1c2
Cc3ccc(Sc2c(C)nn(S(=O)(=O)c1c(C)cc(C)cc1C)c2C)cc3	ZINC000000625359	O=S(=O)(c1ccccc1)n3cc(Sc2ccccc2)cn3
CSc3ccc(\C=c2/c(=O)nc1snc(SC)n1c2=N)cc3	ZINC000000214080	N=c2c(=Cc1ccccc1)c(=O)nc3sncn23
CC(=O)Nc4ccc3c(CCC2CCN(Cc1ccccc1)CC2)noc3c4	ZINC000000606711	C2CN(Cc1ccccc1)CCC2CCc3noc4ccccc34
COc5c1OCOc1cc4CCN(C)[C@H](CNC=c3c(=O)[nH]c(=O)n(c2cccc(F)c2)c3=O)c45	ZINC000002106865	O=c4[nH]c(=O)c(=CNCC2NCCc3cc1OCOc1cc23)c(=O)n4c5ccccc5
Fc4ccc(n3[nH]c(=O)\c(=C/c2cccc(OC(=O)c1cccs1)c2)c3=O)cc4Cl	ZINC000000666902	O=C(Oc3cccc(C=c2c(=O)[nH]n(c1ccccc1)c2=O)c3)c4cccs4
CC2=CC(C)(C)Nc3ccc(OC(=O)c1cccs1)cc23	ZINC000000075725	O=C(Oc2ccc1NCC=Cc1c2)c3cccs3
OC(=O)c2ccc(NC(=O)c1ccc(Br)cc1)cc2	ZINC000000207784	O=C(Nc1ccccc1)c2ccccc2
COC(=O)c2ccc(N(=O)=O)c(OC(=O)c1cccs1)c2	ZINC000000040885	O=C(Oc1ccccc1)c2cccs2
CCCN(C#N)c1nc(NCC)nc(NC(C)C)n1	ZINC000000027640	c1ncncn1
Cc4ccc(C)c(c3nc2ccc(NC(=O)C1CCCCC1)cc2[nH]3)c4	ZINC000000120458	O=C(Nc3ccc2nc(c1ccccc1)[nH]c2c3)C4CCCCC4
OC(=O)[C@@H]2Cc1ccccc1CN2S(=O)(=O)c3ccc(F)cc3	ZINC000000090560	O=S(=O)(N2CCc1ccccc1C2)c3ccccc3
C[C@@H](Cc1c[nH]c2ccc(Cl)cc12)/N=C/c3ccc(N(C)C)cc3	ZINC000000053115	C(Cc1c[nH]c2ccccc12)N=Cc3ccccc3
OC(=O)c1cc(O)[nH]c(=O)c1	ZINC000019202599	O=c1cccc[nH]1
Cc2cc(C)nc(NS(=O)(=O)c1ccc(NC(=O)CCC(O)=O)cc1)n2	ZINC000000833230	O=S(=O)(Nc1ncccn1)c2ccccc2
Cc3ccc(S(=O)(=O)n1nc(C(F)(F)F)c2cnccc12)cc3	ZINC000000105654	O=S(=O)(c1ccccc1)n2ncc3cnccc23
COc3cccc(Oc2c(Cl)c(=O)n(c1ccc(C)cc1)c2=O)c3	ZINC000000090623	O=c2cc(Oc1ccccc1)c(=O)n2c3ccccc3
CC[C@@H](C)Cn1c(=O)n(C)c(=O)c2nc(C)[nH]c12	ZINC000000000831	O=c2[nH]c(=O)c1nc[nH]c1[nH]2
CC(=O)C2=C(O)C(=O)N(CCc1ccccc1)[C@@H]2c3ccc(F)cc3	ZINC000000076909	O=C2C=CC(c1ccccc1)N2CCc3ccccc3
O=C(CSc2nc(c1ccncc1)ccc2C#N)NC3CC3	ZINC000000033166	O=C(CSc2cccc(c1ccncc1)n2)NC3CC3
CCN3CCN(c1c(Cl)cccc1NC(=O)COc2ccccc2)CC3	ZINC000000680147	O=C(COc1ccccc1)Nc2ccccc2N3CCNCC3
CC(C)c1cccc(C(C)C)c1NC(=O)NC[C@@]3(O)CCCc2ccccc23	ZINC000000603985	O=C(NCC1CCCc2ccccc12)Nc3ccccc3
COC(=O)[C@H](CC(C)C)NC(=O)C(c1ccccc1)c2ccccc2	ZINC000000054605	C(c1ccccc1)c2ccccc2
CCC[N@]1CCC[C@H]2[C@H]1CCc3cccc(O)c23	ZINC000000009463	C3CNC2CCc1ccccc1C2C3
Cc3ccc(\C=N\N2CCN(c1ccccc1)CC2)s3	ZINC000000028635	C2CN(c1ccccc1)CCN2N=Cc3cccs3
CCn2c(C)[n+](CC)c3cc(S(=O)(=O)Nc1ccccc1)ccc23	ZINC000000078515	O=S(=O)(Nc1ccccc1)c3ccc2[nH]cnc2c3
Fc5ccc(n3cc(C2CCN(CCN1CCNC1=O)CC2)c4cc(Cl)ccc34)cc5	ZINC000000538337	O=C1NCCN1CCN5CCC(c3cn(c2ccccc2)c4ccccc34)CC5
Oc2ccc3C[C@H]5[N@@](CC1CC1)CC[C@@]46[C@@H](Oc2c34)C(=C)CC[C@@]56O	ZINC000000403529	C=C1CCC2C3Cc5cccc6OC1C2(CCN3CC4CC4)c56
NC(=S)CN1CCCC1=S	ZINC000000017885	S=C1CCCN1
COC(=O)C3=CC[C@@]12CC[C@@H]([C@](C)(/C=C/C=C(/C)C(O)=O)OC1=O)[C@@]2(OC(C)=O)CC3	ZINC000000689749	O=C1OCC2CCC13CC=CCCC23
COC(=O)C1=CN(C)C=C(C(=O)OC)C1c2cccc(C)c2	ZINC000000036511	N2C=CC(c1ccccc1)C=C2
CC(C)(C)NS(=O)(=O)c1ccc(F)cc1	ZINC000000029553	c1ccccc1
Nc1cc(C(O)=O)cc(C(O)=O)c1	ZINC000002504354	c1ccccc1
CC(=O)n3c(c1ccc(C)cc1)cc(c2ccc(C)cc2)c(C#N)c3=O	ZINC000000068940	O=c3cc(c1ccccc1)cc(c2ccccc2)[nH]3
Cc2c(C#N)c1ccccc1n2CCOc3ccc(C(C)(C)C)cc3	ZINC000000555452	C(Cn1ccc2ccccc12)Oc3ccccc3
CC(C)c2ncc(Cc1ccccc1)[nH]c2=O	ZINC000000018551	O=c2cncc(Cc1ccccc1)[nH]2
Cn3c(=O)c(=Cc2ccc(c1cccc(F)c1)o2)c(=O)n(C)c3=S	ZINC000000093253	O=c1[nH]c(=S)[nH]c(=O)c1=Cc3ccc(c2ccccc2)o3
Cc1c(O)ccc2c(CC(N)=O)cc(=O)oc12	ZINC000000082392	O=c2ccc1ccccc1o2
OCCn3c(=O)c2ccc(Oc1ccc(N(=O)=O)cc1)cc2c3=O	ZINC000000059324	O=c2[nH]c(=O)c3cc(Oc1ccccc1)ccc23
COC(=O)C3=NN(C(=O)c1ccccc1F)[C@@](O)(c2ccccc2)C3	ZINC000000062932	O=C(N1N=CCC1c2ccccc2)c3ccccc3
COC(=O)c3ccc(NC(=O)c2cc[n+](Cc1ccccc1)cc2)cc3	ZINC000000437692	O=C(Nc1ccccc1)c3cc[n+](Cc2ccccc2)cc3
COc1ccc(N(=O)=O)cc1NCc2cc(OC)c(OC)c(OC)c2	ZINC000000243101	C(Nc1ccccc1)c2ccccc2
CC1=C(C(=O)N[C@@H](CCC(O)=O)C(O)=O)N3[C@H](SC1)[C@H](NC(=O)Cc2ccccc2)C3=O	ZINC000012654785	O=C(Cc1ccccc1)NC3C2SCC=CN2C3=O
Clc1cc(N(=O)=O)ccc1C(=O)Oc3ccc2ccccc2c3	ZINC000000068120	O=C(Oc2ccc1ccccc1c2)c3ccccc3
Fc3ccc([C@H](CC(=O)c1cccs1)SCc2ccco2)cc3	ZINC000000055527	O=C(CC(SCc1ccco1)c2ccccc2)c3cccs3
CC(C)CCn2c(NC1CCCCC1)nc3n(C)c(=O)[nH]c(=O)c23	ZINC000000067642	O=c3[nH]c(=O)c2[nH]c(NC1CCCCC1)nc2[nH]3
Fc3ccc(Oc2cc1c(=O)[nH]c(=O)c1cc2N(=O)=O)c(F)c3	ZINC000000093538	O=c2[nH]c(=O)c3cc(Oc1ccccc1)ccc23
Cc1cccc(C)c1OC(=O)Cn3c(=O)c2ccccc2c3=O	ZINC000000044230	O=C(Cn2c(=O)c1ccccc1c2=O)Oc3ccccc3
CCC(=O)c2cn(Cc1ccc(Cl)cc1Cl)c3ccccc23	ZINC000000560718	C(c1ccccc1)n2ccc3ccccc23
COc1cc(C(=O)N(CC#N)CC#N)cc(OC)c1OC	ZINC000000030223	c1ccccc1
O=N(=O)c3ccc(S(=O)(=O)NCCc2nc1ccccc1[nH]2)cc3	ZINC000000048463	O=S(=O)(NCCc2nc1ccccc1[nH]2)c3ccccc3
Cc1cccc(C)c1N(CC(=O)NC2CCCC2)S(C)(=O)=O	ZINC000000036538	O=C(CNc1ccccc1)NC2CCCC2
C[C@@H]2CC(=O)Nc1c(Br)cc(Br)cc1N2	ZINC000000052420	O=C2CCNc1ccccc1N2
CC(C)/C(=C/C(O)=O)C(O)=O	ZINC000004095899	nonring
OC(=O)\C(=C/c2ccc(c1ccc(Br)cc1)o2)c3ccccc3	ZINC000000836617	C(=Cc2ccc(c1ccccc1)o2)c3ccccc3
CC(=O)Oc1cc(C(=O)NC(C)(C)C)cc(C(=O)NC(C)(C)C)c1	ZINC000000051862	c1ccccc1
Cc2ccc(S(=O)(=O)NCCc1ccccc1)c3nsnc23	ZINC000000033018	O=S(=O)(NCCc1ccccc1)c2cccc3nsnc23
CCC(=O)Nc2sc1C[C@H](C)CCc1c2C(=O)N3CCCCC3	ZINC000000061456	O=C(N1CCCCC1)c3csc2CCCCc23
CC(C)N3C(=O)[C@H]2Cc1nc[nH]c1CN2C3=O	ZINC000000009515	O=C3NC(=O)N2Cc1[nH]cnc1CC23
O=C(CSCC(=O)c1ccc(N(=O)=O)cc1)Nc2ccccc2	ZINC000000036149	O=C(CSCC(=O)c1ccccc1)Nc2ccccc2
COc2cc(S(=O)(=O)N1CCC(C)CC1)ccc2Cl	ZINC000000036383	O=S(=O)(N1CCCCC1)c2ccccc2
CN2CCN(c1nccs1)CC2	ZINC000000022036	C2CN(c1nccs1)CCN2
Cc2ccc(NC(=O)c1ccccc1Br)nc2	ZINC000000036065	O=C(Nc1ccccn1)c2ccccc2
COc3cc(c1c(Cl)ncn1c2ccc(S(N)(=O)=O)cc2)ccc3F	ZINC000000592944	c3ccc(c1cncn1c2ccccc2)cc3
CCN3CCCc4cccc(C[S@](=O)c2nc1ccccc1[nH]2)c34	ZINC000000004243	O=S(Cc2cccc1CCCNc12)c4nc3ccccc3[nH]4
Fc1cccc(F)c1CCNC(=O)Nc2ccc(Cl)cn2	ZINC000000019731	O=C(NCCc1ccccc1)Nc2ccccn2
COc2ccc1c(C)c(C)c(=O)oc1c2I	ZINC000000033741	O=c2ccc1ccccc1o2
CCOC(=O)c1c(NC(=O)COC)scc1c2ccc(C)c(C)c2	ZINC000000149502	c2ccc(c1ccsc1)cc2
C[C@@H](C(O)=O)n2c(=O)c1ccccc1c2=O	ZINC000000122247	O=c1[nH]c(=O)c2ccccc12
O[C@H]2c1ccccc1C[N+](=O)C23CCCCC3	ZINC000000021721	O=[N+]2Cc1ccccc1CC23CCCCC3
Cc2c(CNC(=O)c1ccc(C(F)(F)F)cc1)sc3ccccc23	ZINC000000172503	O=C(NCc2cc1ccccc1s2)c3ccccc3
Oc1ccc(Cl)cc1NC=c2c(=O)[nH]c(=S)[nH]c2=O	ZINC000000059283	O=c1[nH]c(=S)[nH]c(=O)c1=CNc2ccccc2
O=C(Cc1ccccc1)Sc2nc[nH]n2	ZINC000000035243	O=C(Cc1ccccc1)Sc2nc[nH]n2
OC(=O)c2ccc1C(O)=CS(=O)(=O)Nc1c2	ZINC000096517030	O=S2(=O)Nc1ccccc1C=C2
COC(=O)c1c(Br)cnn1C	ZINC000000035730	c1cn[nH]c1
COc1ccccc1CNS(=O)(=O)c2cc(Cl)ccc2Cl	ZINC000000029485	O=S(=O)(NCc1ccccc1)c2ccccc2
COc4ccc3[C@@H]2COc1cc(O)ccc1[C@@H]2Oc3c4	ZINC000000011544	C3Oc1ccccc1C4Oc2ccccc2C34
OC([C@@H]1CCCCN1)(c2ccccc2)c3ccccc3	ZINC000000000633	C3CCC(C(c1ccccc1)c2ccccc2)NC3
COc2nc(N(C)C)nc(N(C#N)S(=O)(=O)c1ccc(C)cc1)n2	ZINC000000366109	O=S(=O)(Nc1ncncn1)c2ccccc2
CCN(CC)C(=O)c1ccccc1F	ZINC000000029735	c1ccccc1
COc3cccc(\C=c2/nc(c1ccc(Br)o1)oc2=O)c3	ZINC000000430006	O=c2oc(c1ccco1)nc2=Cc3ccccc3
Fc1ccccc1C(=O)NCc2ccccn2	ZINC000000029733	O=C(NCc1ccccn1)c2ccccc2
CC(C)c3c(C)c(C#N)c2nc1ccccc1n2c3N4CCCCC4	ZINC000000085711	C4CCN(c2cccc3nc1ccccc1n23)CC4
COc3cc(c2oc(c1ccc(O)c(OC)c1)c(C)c2C)ccc3O	ZINC000000019047	c3ccc(c2ccc(c1ccccc1)o2)cc3
C[C@]34CC[C@H]1C(=CCc2cc(O)ccc12)[C@@H]3CC[C@H]4O	ZINC000000026299	C4CC3CCC1C(=CCc2ccccc12)C3C4
CC3(C)OC(c1ccc(S(C)(=O)=O)cc1)=C(c2cc(F)cc(F)c2)C3=O	ZINC000000589680	O=C2COC(c1ccccc1)=C2c3ccccc3
Cc4ccc([C@@H](O)Cn2c1=NCCCn1c3ccccc23)cc4	ZINC000000315384	C1CN=c3n(C1)c2ccccc2n3CCc4ccccc4
Cc1cccc(C(O)=O)c1O	ZINC000000001548	c1ccccc1
CCOc3ccc([C@@H]2CC(=O)Nc1ccccc1S2)cc3OC	ZINC000000086477	O=C3CC(c1ccccc1)Sc2ccccc2N3
C[C@H](C(O)=O)n3cnc2scc(c1ccc(C)c(C)c1)c2c3=O	ZINC000000098761	O=c2[nH]cnc3scc(c1ccccc1)c23
CN(C)Cc1nccn1c6ccc(N5CCc4c(C(F)(F)F)nn(c3cccc(c2n[nH]c(=O)[nH]2)c3)c4C5=O)cc6	ZINC000001494455	O=C5N(c2ccc(n1ccnc1)cc2)CCc6cnn(c4cccc(c3n[nH]c(=O)[nH]3)c4)c56
Oc3cccc(\C=c2\c(=O)[nH]c(=O)n(Cc1ccc(F)cc1)c2=O)c3	ZINC000000502468	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)n2Cc3ccccc3
Cc2cc(C)c(C(=O)Nc1cccc(Br)c1)c(C)c2	ZINC000000037864	O=C(Nc1ccccc1)c2ccccc2
CC(C)c3ccc(C)c(S(=O)(=O)NCc2ccc1OCOc1c2)c3	ZINC000000310154	O=S(=O)(NCc2ccc1OCOc1c2)c3ccccc3
O=S(=O)(Cc1ccccc1)c3cc(Oc2ccccc2)ccc3C#N	ZINC000000036356	O=S(=O)(Cc1ccccc1)c3cccc(Oc2ccccc2)c3
C[C@@H](NC(=O)C(O)=O)c1nn[nH]n1	ZINC000044976715	c1nn[nH]n1
COc3ccc(C(=O)N2C[C@@H](c1ccccc1)CC2=O)cc3	ZINC000000020524	O=C2CC(c1ccccc1)CN2C(=O)c3ccccc3
CCOC(=O)Nc3cc2N[C@@H](C)C(c1ccccc1)=Nc2c(N)n3	ZINC000000004088	C2Nc1ccncc1N=C2c3ccccc3
Cc4nc3ccc(c2ccc1nc(C)n(N)c(=O)c1c2)cc3c(=O)n4N	ZINC000000033618	O=c3[nH]cnc4ccc(c2ccc1nc[nH]c(=O)c1c2)cc34
Cc1ccccc1N2C(=O)CS/C2=C(/C#N)C(=O)Nc3ccccc3	ZINC000000527684	O=C2CSC(=CC(=O)Nc1ccccc1)N2c3ccccc3
Fc2cccc(C(=O)N1CCOCC1)c2F	ZINC000000036446	O=C(N1CCOCC1)c2ccccc2
C[C@@H](SC(C)=O)C(O)=O	ZINC000000007992	nonring
CCOC(=O)c1c(C)c(C(C)=O)sc1NC(=O)c2ccco2	ZINC000000037916	O=C(Nc1cccs1)c2ccco2
CO[C@@]23C[C@H](COC(=O)c1cncc(Br)c1)C[N@@](C)[C@H]2Cc4cn(C)c5cccc3c45	ZINC000000538071	O=C(OCC2CNC1Cc3c[nH]c4cccc(C1C2)c34)c5cccnc5
COC(=O)Nc1c(Cl)nsc1S(=O)(=O)Cc2ccccc2	ZINC000000140577	O=S(=O)(Cc1ccccc1)c2ccns2
OC(=O)[C@@H]1C[C@@H](C(O)=O)S1(=O)=O	ZINC000606303709	O=S1(=O)CCC1
CSc3nc(C)cc(Oc2ccc(OCc1ccccc1)nn2)n3	ZINC000000099750	C(Oc2ccc(Oc1ccncn1)nn2)c3ccccc3
CN2C(=O)CN(C(N)=O)[C@H](c1ccccc1)c3cc(Cl)ccc23	ZINC000000000123	O=C3CNC(c1ccccc1)c2ccccc2N3
CN(C)CCO[C@@H](c1ccc(Cl)cc1)c2ccccn2	ZINC000000000122	C(c1ccccc1)c2ccccn2
COc2cccc(NC(=O)N1CCCN(C(=O)OC(C)(C)C)CC1)c2	ZINC000000158330	O=C(Nc1ccccc1)N2CCCNCC2
CCOC(=O)c1cnn(C)c1S(=O)(=O)NC(=O)c2ccccn2	ZINC000000036987	O=C(NS(=O)(=O)c1ccn[nH]1)c2ccccn2
CN(C)C(=O)Oc2nc(c1ccc(F)c(Cl)c1)nc(C)c2CC=C	ZINC000000089258	c2ccc(c1ncccn1)cc2
CCN3CCN(c2ccc(NC(=O)c1cccnc1)cc2Cl)CC3	ZINC000000587321	O=C(Nc2ccc(N1CCNCC1)cc2)c3cccnc3
Cc4oc3cc2oc(=O)c1CCCCc1c2cc3c4c5ccccc5	ZINC000000095190	O=c5oc3cc2occ(c1ccccc1)c2cc3c4CCCCc45
Cc1cccc(C)c1OCc2cncn2C	ZINC000000004150	C(Oc1ccccc1)c2cnc[nH]2
O=c3ccc2cccc(N1CCNCC1)c2o3	ZINC000000004465	O=c3ccc2cccc(N1CCNCC1)c2o3
CC(=O)Nc2ccc(C(=O)Oc1ccccc1)cc2	ZINC000000028514	O=C(Oc1ccccc1)c2ccccc2
CSC3=NC(=O)C(C(c1ccc(C(O)=O)cc1)c2c(O)nc(SC)[nH]c2=O)C(=O)N3	ZINC000016214102	O=C1NC=NC(=O)C1C(c2ccccc2)c3cnc[nH]c3=O
Fc4ccc(C(=O)C[C@H]3CC[N@@](CCOc2cccc1OCCOc12)C3)cc4	ZINC000000600676	O=C(CC3CCN(CCOc2cccc1OCCOc12)C3)c4ccccc4
COC(=O)CSc2nc1ccccc1c(=O)n2CC=C	ZINC000000028519	O=c1[nH]cnc2ccccc12
CN(Cc2ccc1nc(C)[nH]c(=O)c1c2)c3ccc(C(=O)N[C@@H](CCC(O)=O)C(O)=O)s3	ZINC000003832372	O=c2[nH]cnc3ccc(CNc1cccs1)cc23
Cc4ccc(n3nc(C)c(\C=c2\sc1ccccc1c2=O)c3C)cc4	ZINC000000095001	O=c3c(=Cc2cnn(c1ccccc1)c2)sc4ccccc34
COc3ccc(CN2CCN(c1ccccc1C)CC2)cc3O	ZINC000000239345	C2CN(c1ccccc1)CCN2Cc3ccccc3
COc3cc2CC[C@H](N)c1cc(=O)c(N)ccc1c2c(OC)c3OC	ZINC000000265532	O=c3cccc2c(CCCc1ccccc12)c3
CC(=O)c2nnn(c1ccccc1)c2Nc3ccccc3	ZINC000000027889	N(c1ccccc1)c2cnnn2c3ccccc3
NON3[C@@H](c1ccccc1)CC(c2ccccc2)C[C@@H]3c4ccccc4	ZINC000000046821	C3C(c1ccccc1)CC(c2ccccc2)NC3c4ccccc4
O=C(N1CCCCC1)c3ccc2nonc2c3	ZINC000000007461	O=C(N1CCCCC1)c3ccc2nonc2c3
CCc3ccc2nc(SCC(=O)Nc1ccccc1)c(C#N)cc2c3	ZINC000000410921	O=C(CSc2ccc1ccccc1n2)Nc3ccccc3
OC(=O)c1ccccc1C(=O)OCC(Cl)=C(Cl)Cl	ZINC000000271033	c1ccccc1
CNC(=NC)c3cccc(NC(=O)c2ccc(C(=O)Nc1cccc(C(\NC)=N\C)c1)cc2)c3	ZINC000001685580	O=C(Nc1ccccc1)c3ccc(C(=O)Nc2ccccc2)cc3
Cc4noc(NS(=O)(=O)c3ccc(NC(=O)[C@@H]2[C@@H]1O[C@@H](C=C1)[C@@H]2C(O)=O)cc3)c4C	ZINC000020343105	O=C(Nc2ccc(S(=O)(=O)Nc1ccno1)cc2)C3CC4OC3C=C4
O[C@H](CNc1ncccn1)c2ccccc2	ZINC000000000306	C(Cc1ccccc1)Nc2ncccn2
OC(=O)CN(CC(O)=O)[C@@H]1CCS(=O)(=O)C1	ZINC000004013002	O=S1(=O)CCCC1
CCC[S@](=O)c2ccc1nc(NC(=O)OC)[nH]c1c2	ZINC000000000017	c2ccc1[nH]cnc1c2
CSc1nsc(SC)c1C(=O)Nc2ccc(C)cc2	ZINC000000051241	O=C(Nc1ccccc1)c2cnsc2
CCC[N@]1[C@H]3CC[C@@H]1CC(OC(=O)c2ccc(OC)c(OC)c2)C3	ZINC000000488024	O=C(OC1CC2CCC(C1)N2)c3ccccc3
CC1(C)[C@H](C(O)=O)[C@@H]1C(=O)Nc2nn[nH]n2	ZINC000563209976	O=C(Nc1nn[nH]n1)C2CC2
CCOC(=O)c2oc1ccccc1c2NC(=O)CCN(CC)CC	ZINC000000051444	c2ccc1occc1c2
COc3cccc(NC(=O)[C@H]2CN(c1ccc(C)cc1)C(=O)C2)c3	ZINC000000044784	O=C2CC(C(=O)Nc1ccccc1)CN2c3ccccc3
COc2ccc(NS(=O)(=O)c1ccc(C(O)=O)cc1)cc2NS(=O)(=O)c3ccc(F)cc3	ZINC000013265075	O=S(=O)(Nc2cccc(NS(=O)(=O)c1ccccc1)c2)c3ccccc3
OC(=O)C(=O)C=C(O)c1ccsc1	ZINC000013674023	c1ccsc1
CCc2cnc(NS(=O)(=O)c1cc(Cl)sc1Cl)nc2c3c(F)cccc3F	ZINC000001023973	O=S(=O)(Nc2nccc(c1ccccc1)n2)c3ccsc3
OC(=O)c1c(O)ccc(O)c1C(O)=O	ZINC000004829199	c1ccccc1
O=C(Nc2sc1CCCc1c2C#N)\C=C\c3cccc(N(=O)=O)c3	ZINC000000038722	O=C(Nc2cc1CCCc1s2)C=Cc3ccccc3
CN4CCN(C(=O)c3ccc(C[N@]2CCc1ccccc1C2)cc3)CC4	ZINC000000532340	O=C(N1CCNCC1)c4ccc(CN3CCc2ccccc2C3)cc4
OC(=O)C[C@H](N1C(=O)CSC1=S)C(O)=O	ZINC000002205346	O=C1CSC(=S)N1
CN(Cc1ccccc1)C(=O)C3CCN(Cc2cccnc2)CC3	ZINC000000299286	O=C(NCc1ccccc1)C3CCN(Cc2cccnc2)CC3
CCOC(=O)c2ccc(NC(=O)c1ccc(NC(C)=O)cc1)cc2	ZINC000000030061	O=C(Nc1ccccc1)c2ccccc2
Cc4cccc([N+]3=C1SCCCN1[C@@](O)(c2ccccc2)C3)c4C	ZINC000000425725	C4CSC3=[N+](c1ccccc1)CC(c2ccccc2)N3C4
O=c2[nH]ccc1NCCCc12	ZINC000000018291	O=c2[nH]ccc1NCCCc12
O=C(N2CCc1ccccc1C2)C(=C/c3c[nH]c4ccccc34)/C#N	ZINC000000029025	O=C(C=Cc1c[nH]c2ccccc12)N4CCc3ccccc3C4
Clc3cccc(S(=O)(=O)Nc2ccc(C(=O)Nc1ccncc1)cc2)c3	ZINC000000631179	O=C(Nc1ccncc1)c3ccc(NS(=O)(=O)c2ccccc2)cc3
CCc1cccc(CC)c1NC(=O)c2cc(SC)ccc2Cl	ZINC000000472261	O=C(Nc1ccccc1)c2ccccc2
OC(=O)c3csc(S(=O)(=O)Nc1ccccc1N2CCOCC2)c3	ZINC000012532568	O=S(=O)(Nc1ccccc1N2CCOCC2)c3cccs3
COc2ccc1C(=O)C[C@](O)(C(F)F)Oc1c2	ZINC000000062765	O=C1CCOc2ccccc12
CCOc3ccc(OCC)c(Cc2oc(c1ccccc1)nc2O)c3	ZINC000000042471	C(c1ccccc1)c3cnc(c2ccccc2)o3
COc4ccc3n(c1cccc2ccccc12)c(C)c(C(C)=O)c3c4	ZINC000000551729	c4ccc3c(n1ccc2ccccc12)cccc3c4
Cc1ccc(C)n1n4cnc3scc(c2ccco2)c3c4=O	ZINC000000038261	O=c3n(n1cccc1)cnc4scc(c2ccco2)c34
CCOC(=O)Cc2csc(NC(=O)Cc1ccccc1N(=O)=O)n2	ZINC000000457007	O=C(Cc1ccccc1)Nc2nccs2
Cc2ccc(NS(=O)(=O)c1ccc(N(=O)=O)cc1)cc2F	ZINC000000180201	O=S(=O)(Nc1ccccc1)c2ccccc2
CCOc1ccccc1Nc3c(Cl)c(=O)c2ccccc2c3=O	ZINC000000087491	O=c2cc(Nc1ccccc1)c(=O)c3ccccc23
CCc3ccc(NC(=O)Nc1ccc(C)c(C)c1n2cccc2)cc3	ZINC000000264011	O=C(Nc1ccccc1)Nc2ccccc2n3cccc3
CN(C)C(=O)Oc3ccc(OCc2n(C)c1ccccc1[n+]2C)cc3	ZINC000000387384	C(Oc1ccccc1)c3nc2ccccc2[nH]3
Cc3cc(C2=C(/C=C/[C@H]1C[C@H](O)CC(=O)O1)C(C)(C)CC(C)(C)C2)ccc3F	ZINC000000597504	O=C3CCCC(C=CC2=C(c1ccccc1)CCCC2)O3
Cc1ccsc1\C=c3/c(=O)[nH]c(=S)n(c2ccccc2C)c3=O	ZINC000000478895	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc3cccs3
COc4ccc3cc2c1cc(O)c(O)cc1CC[n+]2cc3c4OC	ZINC000000338118	C3C[n+]2cc1ccccc1cc2c4ccccc34
Cc2nnc(Nc1ccc(OC(F)(F)Cl)cc1)c3ccccc23	ZINC000000039058	N(c1ccccc1)c2nncc3ccccc23
Clc4nc1ccccc1n5c(c3coc2ccccc2c3=O)nnc45	ZINC000000132070	O=c4c(c2nnc3cnc1ccccc1n23)coc5ccccc45
OC(=O)c2ccc1ccccc1n2	ZINC000000084153	c2ccc1ncccc1c2
Nc5nc4cc3N(Cc2ccc(S(=O)(=O)c1ccccc1)cc2)CCCc3cc4[nH]5	ZINC000000605223	O=S(=O)(c1ccccc1)c5ccc(CN3CCCc4cc2[nH]cnc2cc34)cc5
CC(=O)NCc2nc1ccc(C(=O)N[C@H](C[P@](O)(O)=O)C(O)=O)cc1n2C	ZINC000003587269	c2ccc1[nH]cnc1c2
COc1ccc(NC(=O)CC(C)C)c(OC)c1	ZINC000000030449	c1ccccc1
CC4(C)CC(=O)c3c(O)c(c1ccccc1)c(=O)n(c2ccc(Br)cc2)c3C4	ZINC000000707760	O=C1CCCc3c1cc(c2ccccc2)c(=O)n3c4ccccc4
CCC1CCC2(CC1)SCC(=O)N2c3ccc(F)c(Cl)c3	ZINC000000034576	O=C2CSC1(CCCCC1)N2c3ccccc3
CCOC(=O)c4ccc3N[C@H](c1cccnc1)[C@H]2CC=C[C@H]2c3c4	ZINC000000037714	C1C=CC3C1C(c2cccnc2)Nc4ccccc34
CC(C)CC(=O)C2=C(O)C(=O)N(Cc1ccccc1)[C@@H]2c3ccccc3	ZINC000000386561	O=C2C=CC(c1ccccc1)N2Cc3ccccc3
COc3ccc(S(=O)(=O)Nc1ccccc1C(=O)N2CCCC2)c(Cl)c3Cl	ZINC000000802927	O=C(N1CCCC1)c2ccccc2NS(=O)(=O)c3ccccc3
CCN(CC)C(=O)c1cc(Cl)ccc1Cl	ZINC000000030112	c1ccccc1
Cc2cc(C)n(CNc1ccc(I)cc1)n2	ZINC000000040691	C(Nc1ccccc1)n2cccn2
CN(C)Cc3c(O)ccc4cc(c2nc1ccccc1[nH]2)c(=O)oc34	ZINC000000044663	O=c2oc1ccccc1cc2c4nc3ccccc3[nH]4
N[C@H](C(O)=O)c1ccccc1O	ZINC000000006795	c1ccccc1
CC(C)CSc3nc2ccc(NC(=O)c1ccccc1)cc2s3	ZINC000000531477	O=C(Nc2ccc1ncsc1c2)c3ccccc3
NS(=O)(=O)c3ccc(c2ccc(\C=N\n1cnnc1)o2)cc3	ZINC000000034100	C(=Nn1cnnc1)c3ccc(c2ccccc2)o3
CSc2ccc(C=c1c(=O)n(C)c(=S)n(C)c1=O)cc2	ZINC000000037459	O=c1[nH]c(=S)[nH]c(=O)c1=Cc2ccccc2
NS(=O)(=O)c3ccc(n1cccc1\C=N\n2cnnc2)cc3	ZINC000000034102	C(=Nn1cnnc1)c2cccn2c3ccccc3
COc2ccc1ncccc1c2C=c3c(=O)[nH]c(=S)[nH]c3=O	ZINC000000272547	O=c1[nH]c(=S)[nH]c(=O)c1=Cc2cccc3ncccc23
CC[C@@H](C)c3ccc(NC(=O)c2oc1ccc(Cl)cc1c2C)cc3	ZINC000000168902	O=C(Nc1ccccc1)c3cc2ccccc2o3
COc3ccc(c2nnc(SCc1c(F)cccc1F)n2N)cc3	ZINC000000531579	C(Sc2nnc(c1ccccc1)[nH]2)c3ccccc3
Cn2cc(Br)c(NC(=O)c1cc(Cl)cc(Cl)c1)n2	ZINC000000080527	O=C(Nc1cc[nH]n1)c2ccccc2
Cc4ccc(c3nnc(c2sc1cc(F)ccc1c2Cl)o3)o4	ZINC000000412036	c4ccc3sc(c2nnc(c1ccco1)o2)cc3c4
C[C@@H]1CCc2c(C1)sc(N)c2C(=O)Nc3cccc4ccccc34	ZINC000000127315	O=C(Nc1cccc2ccccc12)c4csc3CCCCc34
COc3ccc(Nc2nc1c(C)cc(C)cc1cc2C#N)c(OC)c3	ZINC000000349937	N(c1ccccc1)c3ccc2ccccc2n3
Cc3nc(c2nnc(SCC(=O)c1ccc(F)cc1)n2C)cs3	ZINC000000117928	O=C(CSc2nnc(c1cscn1)[nH]2)c3ccccc3
COc3cc(\C=N\n2cnc1n(C)c(=S)sc1c2=O)ccc3O	ZINC000000156816	O=c2n(N=Cc1ccccc1)cnc3[nH]c(=S)sc23
CCCC(=O)CC(=O)N[C@@H]1CCOC1=O	ZINC000000006220	O=C1CCCO1
CC(C)c3ccc([C@H]2N(C[C@@H]1CCCO1)C(=O)C(O)=C2C(C)=O)cc3	ZINC000000096617	O=C2C=CC(c1ccccc1)N2CC3CCCO3
Cc2ccc1nsnc1c2NC(=O)c3cccc(Br)c3	ZINC000000097743	O=C(Nc1cccc2nsnc12)c3ccccc3
O=C(NCCN1CCCCC1)Nc2cccc3ccccc23	ZINC000000124866	O=C(NCCN1CCCCC1)Nc2cccc3ccccc23
CCc3c(C)[nH]c2nnc(c1ccccc1OC)n2c3=O	ZINC000000034728	O=c2cc[nH]c3nnc(c1ccccc1)n23
CCC(=O)c3ccc(N2CCN(C(=O)c1ccccc1)CC2)c(F)c3	ZINC000000034729	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
OC(=O)CCC(=O)Nc1ccc(F)cc1F	ZINC000000031539	c1ccccc1
COC(=O)C1=C(C)NC(=O)N[C@@H]1c2ccc(OC)cc2	ZINC000000041493	O=C2NC=CC(c1ccccc1)N2
FC(F)(F)C(=O)Nc3ccc2nn(c1ccccc1)nc2c3	ZINC000000034726	c3ccc(n2nc1ccccc1n2)cc3
CC(C)(C)c2ccc(N1C(=O)CCC1=O)cc2	ZINC000000031535	O=C1CCC(=O)N1c2ccccc2
OC(=O)c3cc(NC(=O)Cn2c(=O)c1ccccc1c2=O)cc(C(O)=O)c3	ZINC000004474066	O=C(Cn2c(=O)c1ccccc1c2=O)Nc3ccccc3
CCOC(=O)Nc1scnc1C(=O)Nc2nnc(NS(C)(=O)=O)s2	ZINC000291509093	O=C(Nc1nncs1)c2cscn2
Brc3ccc(C(=O)N(C1CCCCC1)c2ccccn2)o3	ZINC000000101557	O=C(N(C1CCCCC1)c2ccccn2)c3ccco3
O=C(NCCc1ccccc1)c3cc2CCCCc2[nH]c3=O	ZINC000000034618	O=C(NCCc1ccccc1)c3cc2CCCCc2[nH]c3=O
CN3CCC(OC(=O)C(Oc1ccc(Cl)cc1)Oc2ccc(Cl)cc2)CC3	ZINC000000537906	O=C(OC1CCNCC1)C(Oc2ccccc2)Oc3ccccc3
O=C(Oc2ccc(Oc1ccccc1)cc2)N3CCOCC3	ZINC000000014497	O=C(Oc2ccc(Oc1ccccc1)cc2)N3CCOCC3
O=C(NCc1ccco1)c3ccc(S(=O)(=O)c2ccccc2)cc3	ZINC000000049417	O=C(NCc1ccco1)c3ccc(S(=O)(=O)c2ccccc2)cc3
COC(=O)c3cc(c1cccs1)[o+]c(c2cccs2)c3	ZINC000000405034	c3csc(c2cccc(c1cccs1)[o+]2)c3
CCN(CC)C(=O)c1sc(N)c(C#N)c1C	ZINC000000035740	c1ccsc1
C[C@H](N(O)C(N)=O)c2cc1ccccc1o2	ZINC000000024608	c2ccc1occc1c2
OS(=O)(=O)c2ccc(NN=c1c(=O)[nH]c(=S)n(CC=C)c1=O)cc2	ZINC000002334250	O=c1[nH]c(=S)[nH]c(=O)c1=NNc2ccccc2
CC1(C)[C@H](C=C(Cl)Cl)[C@@H]1C(=O)NC2CCCCCC2	ZINC000000036354	O=C(NC1CCCCCC1)C2CC2
Clc2ccc(\C=N\OC(=O)c1ccc(N(=O)=O)cc1)cc2	ZINC000000039187	O=C(ON=Cc1ccccc1)c2ccccc2
CCCn2c(CNS(=O)(=O)c1ccc(C)cc1)nc3ccccc23	ZINC000000108783	O=S(=O)(NCc2nc1ccccc1[nH]2)c3ccccc3
Cc3ccc(C(=O)N2N=C(c1ccccc1)C[C@@]2(O)C(F)(F)F)cc3	ZINC000000355646	O=C(N2CCC(c1ccccc1)=N2)c3ccccc3
Cc2cn([C@@H]1CO[C@H](CO)S1)c(=O)[nH]c2=O	ZINC000000016386	O=c2ccn(C1COCS1)c(=O)[nH]2
CC4=C(COc2c1occc1cc3ccc(=O)oc23)CC(C)(C)CC4	ZINC000000225581	O=c4ccc3cc1ccoc1c(OCC2=CCCCC2)c3o4
Nc3cc(N)nc(SCc2nc(c1ccccc1)no2)n3	ZINC000000092402	C(Sc1ncccn1)c3nc(c2ccccc2)no3
Cc1ccccc1[N+](=O)Cc2ccncc2	ZINC000000084375	O=[N+](Cc1ccncc1)c2ccccc2
CN(C(=O)CSc1nc(N)nn1c2ccccc2)c3ccccc3	ZINC000000111440	O=C(CSc1ncnn1c2ccccc2)Nc3ccccc3
CC(=O)N[C@@H](c1ccccc1)c3cc(N(=O)=O)c2cccnc2c3O	ZINC000000087173	C(c1ccccc1)c3ccc2cccnc2c3
O[C@@H](c1ccccc1)c3ccc(C(=O)OCC(=O)c2ccccc2)cc3	ZINC000000062312	O=C(COC(=O)c2ccc(Cc1ccccc1)cc2)c3ccccc3
NS(=O)(=O)c2ccc(CNC(=O)COc1ccccc1)cc2	ZINC000000030935	O=C(COc1ccccc1)NCc2ccccc2
CC(=O)c3ccc(N2CCN(Cc1ccc(C(F)(F)F)cc1)CC2)cc3	ZINC000000753341	C2CN(c1ccccc1)CCN2Cc3ccccc3
C[C@@H](N(O)C(N)=O)c1ccc(Cl)cc1	ZINC000000013399	c1ccccc1
CC(=O)c3ccc(N2CCN(C(=O)c1cccs1)CC2)c(F)c3	ZINC000000034434	O=C(N2CCN(c1ccccc1)CC2)c3cccs3
CS(=O)(=O)c3ccc2nc(NC(=O)[C@@H]1CCCO1)sc2c3	ZINC000000046878	O=C(Nc2nc1ccccc1s2)C3CCCO3
CCc3ccc([C@@H](C)NC(=O)COc2ccc1ccccc1c2)cc3	ZINC000000032753	O=C(COc2ccc1ccccc1c2)NCc3ccccc3
FC(F)(F)c4cccc(S(=O)(=O)N[C@H](Cc2ccc([C@@H]1CC(=O)NS1(=O)=O)cc2)c3ncc[nH]3)c4	ZINC000028977357	O=C4CC(c3ccc(CC(NS(=O)(=O)c1ccccc1)c2ncc[nH]2)cc3)S(=O)(=O)N4
Cc2nc(SCc1ccc(N(=O)=O)cc1)c(C#N)c(C)c2Cl	ZINC000000032750	C(Sc1ccccn1)c2ccccc2
CC3=C(C(=O)Nc1cccc(C)c1C)[C@@H](c2ccc(C)cc2)NC(=O)N3	ZINC000000070711	O=C3NC=C(C(=O)Nc1ccccc1)C(c2ccccc2)N3
Cn2ncc(NC(=O)O/N=C/c1ccccc1Cl)c2n3cccc3	ZINC000000080705	O=C(Nc1cn[nH]c1n2cccc2)ON=Cc3ccccc3
Clc3cc(/N=C/c2ccc1OCOc1c2)ccc3Br	ZINC000000046403	C3Oc2ccc(C=Nc1ccccc1)cc2O3
COc1cc(/C=C/C(O)=O)ccc1O	ZINC000000058258	c1ccccc1
O=C(N[C@@H]2CCc1ccccc1C2)c3ccncc3	ZINC000000003560	O=C(NC2CCc1ccccc1C2)c3ccncc3
CCc1nccn1S(=O)(=O)c2cc(Br)ccc2OC	ZINC000000077183	O=S(=O)(c1ccccc1)n2ccnc2
C[C@H]1CC(=O)NN=C1c3ccc2OCCN(C(C)=O)c2c3	ZINC000000024515	O=C3CCC(c2ccc1OCCNc1c2)=NN3
Cc3ccc(C)c(NC(=O)CSc1nnnn1c2ccccc2)c3	ZINC000000125905	O=C(CSc1nnnn1c2ccccc2)Nc3ccccc3
COc4cc3ncc(N[C@H]1C[C@@H]2CC[C@H]1C2)nc3cc4OC	ZINC000000025828	C1CC2CC1CC2Nc4cnc3ccccc3n4
CNC(=S)Sc1ccc(F)cc1F	ZINC000000077187	c1ccccc1
OC(=O)c1c(Cl)c(Cl)c(Cl)c(Cl)c1C(=O)Nc2cnccn2	ZINC000000641028	O=C(Nc1cnccn1)c2ccccc2
COc3nc(Cl)nc(Nc1ccccc1c2ccccc2)n3	ZINC000000053634	N(c1ccccc1c2ccccc2)c3ncncn3
Cc1cc([C@@H](N)C(O)=O)c(C)s1	ZINC000000028297	c1ccsc1
OC(=O)CCC1=CCOC1=O	ZINC000000003769	O=C1OCC=C1
COc4cc(\C=c3/sc2nc1cc(C)c(C)cc1n2c3=O)c(Br)cc4OCC(O)=O	ZINC000002983367	O=c3c(=Cc1ccccc1)sc4nc2ccccc2n34
COc1ccccc1c2nnc(SCC(=O)OC(C)C)o2	ZINC000000035522	c2ccc(c1nnco1)cc2
NC(=O)C4CCN(c2nc1ccccc1nc2NS(=O)(=O)c3ccc(Br)cc3)CC4	ZINC000003222200	O=S(=O)(Nc2nc1ccccc1nc2N3CCCCC3)c4ccccc4
O=C(Cn2c(=O)c1ccccc1c2=O)N3CCCc4ccccc34	ZINC000000049323	O=C(Cn2c(=O)c1ccccc1c2=O)N3CCCc4ccccc34
COc2c1C[C@H]([C@@](C)(O)CO)Oc1nc3ccccc23	ZINC000000035529	C3Cc2cc1ccccc1nc2O3
O=C2CCCCc1sccc1N2	ZINC000000028298	O=C2CCCCc1sccc1N2
Clc3ccc(NC(=O)Oc2ccc1ccccc1c2)cc3Cl	ZINC000000503353	O=C(Nc1ccccc1)Oc3ccc2ccccc2c3
COC(=O)c1sc(SC)c(S(=O)(=O)C(C)C)c1N/N=C(\C#N)S(=O)(=O)c2ccccc2	ZINC000002148479	O=S(=O)(C=NNc1ccsc1)c2ccccc2
NCc1nccn1Cc2ccsc2	ZINC000000002910	C(c1ccsc1)n2ccnc2
CC(C)c1ccccc1OCC(=O)Nc2ccc(Cl)c(N(=O)=O)c2	ZINC000000516671	O=C(COc1ccccc1)Nc2ccccc2
CC1(C)OC[C@@H](CS)O1	ZINC000000024916	C1COCO1
O=c4c1ccccc1c5nnc(c3ccc(c2ccccc2)cc3)cc45	ZINC000000062970	O=c4c1ccccc1c5nnc(c3ccc(c2ccccc2)cc3)cc45
Fc1cccc(Cl)c1CSc3nnc(c2ccco2)n3CC=C	ZINC000000530042	C(Sc2nnc(c1ccco1)[nH]2)c3ccccc3
CSCC[C@H](NC(=O)Cc4c(C)c3cc2c(c1ccccc1)c(C)oc2cc3oc4=O)C(O)=O	ZINC000002116702	O=c4ccc3cc2c(c1ccccc1)coc2cc3o4
CCOC(=O)c2cccc(NC(=O)CCc1ccccc1)c2	ZINC000000031718	O=C(CCc1ccccc1)Nc2ccccc2
CC(C)c1ccc(C)cc1OC(=O)c2ccc(Cl)cc2Cl	ZINC000000384123	O=C(Oc1ccccc1)c2ccccc2
COc3ccc2[nH]cc(CCNS(=O)(=O)c1ccc(C)cc1)c2c3	ZINC000000047123	O=S(=O)(NCCc1c[nH]c2ccccc12)c3ccccc3
COc2cc(c1c(C#N)c(N)[nH]c(=S)c1C#N)cc(OC)c2OC	ZINC000000070404	S=c2cc(c1ccccc1)cc[nH]2
O=N(=O)c4ccc(c3ccc2c(=O)n(c1ccccc1)c(=O)c2c3)cc4	ZINC000000032579	O=c3n(c1ccccc1)c(=O)c4cc(c2ccccc2)ccc34
O=C(Cc1ccccc1)SC2=NCCS2	ZINC000000035255	O=C(Cc1ccccc1)SC2=NCCS2
Clc3ccc(S(=O)(=O)Cc2nc(c1ccsc1)no2)cc3	ZINC000000109364	O=S(=O)(Cc2nc(c1ccsc1)no2)c3ccccc3
COC(=O)c2sc1cc(N(=O)=O)ccc1c2N	ZINC000000032573	c2ccc1sccc1c2
Cc1ccc(Br)cc1S(=O)(=O)Nc2cccnc2	ZINC000000179567	O=S(=O)(Nc1cccnc1)c2ccccc2
O=C(Nc2ccc(Cc1ccncc1)cc2)c4ccc3ccccc3n4	ZINC000000050009	O=C(Nc2ccc(Cc1ccncc1)cc2)c4ccc3ccccc3n4
COc3ccc(CC(=O)Sc2nc1ccccc1o2)cc3	ZINC000000035250	O=C(Cc1ccccc1)Sc3nc2ccccc2o3
CCc1ccccc1NC(=O)c2ccc(OC)cc2OC	ZINC000000029903	O=C(Nc1ccccc1)c2ccccc2
Nc1ccc(SCC(O)=O)c(C(O)=O)c1	ZINC000000086717	c1ccccc1
CCC(CC)Sc3nc2cc(N1CCNCC1)c(Cl)cc2[nH]3	ZINC000000003308	C3CN(c2ccc1[nH]cnc1c2)CCN3
Clc4ccc(c3ccc(c2nc1ccccc1o2)o3)cc4	ZINC000000034814	c4ccc(c3ccc(c2nc1ccccc1o2)o3)cc4
CN2CCc3c(N)c1ccccc1nc23	ZINC000000015525	C3Cc2cc1ccccc1nc2N3
COc1ccccc1OCc2ccc(C(=O)NCCN(C)C)o2	ZINC000000115387	C(Oc1ccccc1)c2ccco2
Nc2c1CCNc1nc3ccccc23	ZINC000000015529	C3Cc2cc1ccccc1nc2N3
CNC(=O)[C@@H]3CCCCNC(=O)CC[C@H](C(O)=O)N[C@@H](CCc2ccc(c1ccccc1)cc2)C(=O)N3	ZINC000013779512	O=C3CCCNC(CCc2ccc(c1ccccc1)cc2)C(=O)NCCCCCN3
CN(C)CCNC(=O)Cn2cnc1sc(C)c(C)c1c2=O	ZINC000000109567	O=c1[nH]cnc2sccc12
Cc2cc(C)[n+]1cc(Br)ccc1n2	ZINC000000035416	c2cc[n+]1cccnc1c2
CCCc2sc(NC(=O)c1cccs1)nc2c3ccc(F)cc3	ZINC000000451251	O=C(Nc2nc(c1ccccc1)cs2)c3cccs3
OCCn2c(=O)c3ccc4oc1c(S(O)(=O)=O)cc(S(O)(=O)=O)cc1c5ccc(c2=O)c3c45	ZINC000025540664	O=c2[nH]c(=O)c3ccc5c1ccccc1oc4ccc2c3c45
Cc2cc(C)cc(C(=O)NCc1ccncc1)c2	ZINC000000001942	O=C(NCc1ccncc1)c2ccccc2
NNc2nnc(Cc1ccncc1)c3ccccc23	ZINC000000001943	C(c1ccncc1)c2nncc3ccccc23
CC(C)C[C@H](N[P@@](O)(=O)CNC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc2ccccc2)C(O)=O	ZINC000013651482	O=C(CNP(=O)CNC(=O)OCc1ccccc1)NCCc2ccccc2
COC(=O)c2cc(=O)n1CCSc1c2C(=O)c3ccc(Cl)cc3	ZINC000000068885	O=C(c1ccccc1)c2ccc(=O)n3CCSc23
Cc3ccc(C)c(COc2ccc1c(C)c(C)c(=O)oc1c2)c3	ZINC000000012096	O=c3ccc2ccc(OCc1ccccc1)cc2o3
CCN(CC)CCNc2cc(C)nc3c(N1CCCCC1)cc(=O)c(=O)c23	ZINC000003000171	O=c3cc(N1CCCCC1)c2ncccc2c3=O
C4CO[C@H](CNc2nc1ccccc1n3cncc23)C4	ZINC000000026938	C4COC(CNc2nc1ccccc1n3cncc23)C4
Cc2nn(c1ccccc1)c(C)c2[C@@H]4Nc3ccccc3C(=O)N4O	ZINC000000039424	O=C3NC(c2cnn(c1ccccc1)c2)Nc4ccccc34
Cc3ccc(\C=c2/[nH]c(=S)n(c1ccccc1)c2=O)cc3	ZINC000000043073	O=c2n(c1ccccc1)c(=S)[nH]c2=Cc3ccccc3
CC(C)(C)NC(=O)CSc2nc(c1cccs1)ccc2C#N	ZINC000000050138	c2ccc(c1cccs1)nc2
CCn5cc(C(=O)OCC1=C(C(O)=O)N3[C@H](SC1)[C@H](NC(=O)Cc2cccs2)C3=O)c(=O)c6cc4OCOc4cc56	ZINC000003914064	O=C(Cc1cccs1)NC6C5SCC(COC(=O)c4c[nH]c3cc2OCOc2cc3c4=O)=CN5C6=O
CCOC(=O)c1c(NC(C)=O)sc2c(O)cccc12	ZINC000000033484	c2ccc1sccc1c2
CCc2nc1ccccc1c(=O)n2c3c(Cl)cccc3Cl	ZINC000000001203	O=c2n(c1ccccc1)cnc3ccccc23
OCCN(CCO)C(=O)CSc1nnc3c(n1)[nH]c2ccccc23	ZINC000000050131	c1ccc2c(c1)[nH]c3ncnnc23
CSc2nc(N)nc(SCc1c(F)cccc1Cl)c2C#N	ZINC000000050137	C(Sc1ccncn1)c2ccccc2
Cc2c(NC(=O)c1ccco1)cccc2c4nc3ccccc3s4	ZINC000000262931	O=C(Nc3cccc(c2nc1ccccc1s2)c3)c4ccco4
Cc3ccc(CNc2nc(c1cccs1)c(C#N)c(=O)n2C)cc3	ZINC000000078691	O=c3cc(c1cccs1)nc(NCc2ccccc2)[nH]3
CC4CCN(CCN1CCn2c1nc3ccccc23)CC4	ZINC000000203811	C4CCN(CCN1CCn2c1nc3ccccc23)CC4
CCN(CC)c3ccc(NCn2c(=O)c1ccccc1c2=O)c(C)c3	ZINC000000128679	O=c2n(CNc1ccccc1)c(=O)c3ccccc23
Clc3ccc(NC(=O)c1cccnc1)c(C(=O)c2ccccc2)c3	ZINC000000029330	O=C(Nc1ccccc1C(=O)c2ccccc2)c3cccnc3
CCOc2cc(\C=c1\sc(NC(C)=O)nc1=O)cc(CC=C)c2O	ZINC000000202814	O=c1ncsc1=Cc2ccccc2
O=C2N[C@@H](c1cccs1)Oc3ccccc23	ZINC000000032379	O=C2NC(c1cccs1)Oc3ccccc23
CC(=O)Nc2cccc(OC(=O)c1ccoc1C)c2	ZINC000000032378	O=C(Oc1ccccc1)c2ccoc2
COC(=O)[C@@H](C)NC(=O)C3CCN(C2CCN(CCCc1ccccc1)CC2)CC3	ZINC000011874178	C3CCN(C2CCN(CCCc1ccccc1)CC2)CC3
COC(=O)c1ccc(NC(C)=O)c(NC(C)=O)c1	ZINC000000071448	c1ccccc1
CCOC(=O)C2CCN(Cc1cccc(Br)c1)CC2	ZINC000000239708	C2CCN(Cc1ccccc1)CC2
Clc3ccc(\C=C2/COc1ccc(Cl)cc1C2=O)c(Cl)c3	ZINC000000108799	O=C2C(=Cc1ccccc1)COc3ccccc23
Cc1cccc(C)c1Nc3nc2ccccc2[nH]3	ZINC000000003416	N(c1ccccc1)c3nc2ccccc2[nH]3
CN3Cc1c(C(=O)OC(C)(C)C)ncn1c2ccsc2C3=O	ZINC000000003945	O=C2NCc1cncn1c3ccsc23
COC(=O)n2c(=O)oc3cc(S(=O)(=O)N1CCCCC1)ccc23	ZINC000000035086	O=c3[nH]c2ccc(S(=O)(=O)N1CCCCC1)cc2o3
O=C(c2cc1ccccc1oc2=O)n3cc(N(=O)=O)cn3	ZINC000000033376	O=C(c2cc1ccccc1oc2=O)n3cccn3
C3CC=C(c2nc(C1CC1)no2)CN3	ZINC000000002416	C3CC=C(c2nc(C1CC1)no2)CN3
CN(C)CC(=O)N3c1ccccc1CCc4ccc(NC(=O)c2ccccc2)cc34	ZINC000000755077	O=C(Nc3ccc2CCc1ccccc1Nc2c3)c4ccccc4
CN(C)Cc1ccccc1OC(=O)N(C)C	ZINC000000187893	c1ccccc1
Cc2[nH]c1ccc(F)cc1c2SC3CCNCC3	ZINC000000018495	C3CC(Sc1c[nH]c2ccccc12)CCN3
COc2ccc([C@@H]1OC1(C(N)=O)C(N)=O)cc2	ZINC000000027679	C1OC1c2ccccc2
OS(=O)(=O)CCSc1nnc(SCCS(O)(=O)=O)s1	ZINC000006013677	c1nncs1
COc2ccc(c1cc(=S)ss1)cc2	ZINC000000000949	S=c2cc(c1ccccc1)ss2
COc2ccc(CCNC1=NCCN1)cc2OC	ZINC000000017381	C2CN=C(NCCc1ccccc1)N2
CCCC(=O)Nc3ccc(c2csc(c1ccccc1)n2)cc3	ZINC000000577313	c3ccc(c2csc(c1ccccc1)n2)cc3
OC(=O)CCc2ccc(c1ccccc1)n2c3cc(Cl)ccc3O	ZINC000000470635	c3ccc(c1cccn1c2ccccc2)cc3
CN(C1CCCCC1)C(=O)CSc2ncnc3sc(C)c(C)c23	ZINC000000422600	O=C(CSc1ncnc2sccc12)NC3CCCCC3
CCC(=O)Nc1cc(NC(=O)CC)cc(N(=O)=O)c1	ZINC000000027674	c1ccccc1
Clc2snc(C(=O)N1CCCCC1)c2Cl	ZINC000000027675	O=C(N1CCCCC1)c2ccsn2
CC[C@@H]2SC1=NCCN1[C@@]2(O)c3ccc(Cl)cc3	ZINC000000041000	C3CN2C(c1ccccc1)CSC2=N3
COc3cccc(\C=c2/sc(N1CCC[C@H](C)C1)nc2=O)c3OC	ZINC000000082709	O=c2nc(N1CCCCC1)sc2=Cc3ccccc3
COc1ccccc1NS(=O)(=O)c4cc(NC(=O)Cn2cnc3n(C)c(=O)n(C)c(=O)c23)ccc4C	ZINC000008686232	O=C(Cn1cnc2[nH]c(=O)[nH]c(=O)c12)Nc4cccc(S(=O)(=O)Nc3ccccc3)c4
CSc1nnc(C(C)(C)C)c(=O)n1/N=C/c2ccc(N(=O)=O)cc2	ZINC000000093529	O=c1cnncn1N=Cc2ccccc2
CCC[C@@H](C)NC(=O)N1CCOCC1	ZINC000000030377	C1COCCN1
O=C(NC1CCCCC1)C(\NC(=O)c2ccccc2)=C/c3ccco3	ZINC000000045010	O=C(NC1CCCCC1)C(NC(=O)c2ccccc2)=Cc3ccco3
C[C@H]2COC(=O)C(=NNc1cc(N(=O)=O)ccc1C)N2	ZINC000000075580	O=C1OCCNC1=NNc2ccccc2
COc1ccccc1[C@H]3[C@H]2CCCC[C@@]2(O)CC[N@]3CC(N)=O	ZINC000000490432	C1CCC2C(C1)CCNC2c3ccccc3
NC2=C(C#N)[C@@H](c1ccco1)c3c(O2)n[nH]c3c4ccccn4	ZINC000000036297	O2C=CC(c1ccco1)c3c2n[nH]c3c4ccccn4
COc1ccccc1O[P@](C)(=O)Nc2ccc(Cl)c(Cl)c2	ZINC000000326092	O=P(Nc1ccccc1)Oc2ccccc2
OC(=O)CNC(=O)c1cc(F)ccc1O	ZINC000149951968	c1ccccc1
Cc2nc(NC(=O)c1ccccc1)sc2c3ccc(N(=O)=O)o3	ZINC000000033155	O=C(Nc2ncc(c1ccco1)s2)c3ccccc3
Cc5nc(N2CCN(c1ccc(Cl)c(Cl)c1)CC2)c4c3CCCc3sc4n5	ZINC000000628451	C5Cc4sc3ncnc(N2CCN(c1ccccc1)CC2)c3c4C5
O=c4[nH]c3ccc(C#CCN2CCC(Cc1ccccc1)CC2)cc3[nH]4	ZINC000000023994	O=c4[nH]c3ccc(C#CCN2CCC(Cc1ccccc1)CC2)cc3[nH]4
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c2ccc(Br)o2	ZINC000000046848	O=C2NC=CC(c1ccco1)N2
Clc3ccc(Nc2cc(=O)n(c1ccccc1)c2=O)cc3	ZINC000000046594	O=c2cc(Nc1ccccc1)c(=O)n2c3ccccc3
Brc1ccccc1Sc3nc2ccccc2n4cncc34	ZINC000000583902	S(c1ccccc1)c3nc2ccccc2n4cncc34
OC(=O)[C@H]1CC(=O)C[C@@H](C(O)=O)N1C(=O)Oc2ccccc2	ZINC000001592465	O=C2CCN(C(=O)Oc1ccccc1)CC2
CN(C)S(=O)(=O)N2CCN(c1ncccn1)CC2	ZINC000000023204	C2CN(c1ncccn1)CCN2
O=c3c(C=NN1CCOCC1)c(c2ccccc2)[nH]n3c5nc4ccccc4s5	ZINC000000695569	O=c3c(C=NN1CCOCC1)c(c2ccccc2)[nH]n3c5nc4ccccc4s5
Cn1nnnc1SCC(=O)Nc2cc(C(O)=O)cc(C(O)=O)c2	ZINC000003291081	O=C(CSc1nnn[nH]1)Nc2ccccc2
CC3(C)CC(=O)C=C(Nc2ccc1OCOc1c2)C3	ZINC000000052528	O=C3CCCC(Nc2ccc1OCOc1c2)=C3
CCSc2nc1ccccc1n2Cc3ccc(Cl)cc3Cl	ZINC000000068113	C(c1ccccc1)n2cnc3ccccc23
OC[C@@H]2O[C@H](n1cc(C=CBr)c(=O)[nH]c1=O)C[C@H]2O	ZINC000000001043	O=c2ccn(C1CCCO1)c(=O)[nH]2
CC3=C(C(=O)OC[C@@H]1CCCO1)[C@@H](c2ccccc2C)NC(=O)N3	ZINC000000036509	O=C3NC=C(C(=O)OCC1CCCO1)C(c2ccccc2)N3
NOCc1ccc(Br)c(O)c1	ZINC000000001045	c1ccccc1
CC(C)NC(=O)c3ccc2cc([C@@](O)(C(C)C)c1cnc[nH]1)ccc2c3	ZINC000000591272	C(c2ccc1ccccc1c2)c3cnc[nH]3
CN(C)CCC[C@@H]3C(=O)[C@H](c1ccccc1)N(c2ccccc2)C3=O	ZINC000000394152	O=C2CC(=O)N(c1ccccc1)C2c3ccccc3
Cc2cnc(N1CCNCC1)nc2C	ZINC000000010718	C2CN(c1ncccn1)CCN2
CN(C)C(=O)CCNc1ccc(Br)cc1	ZINC000000001049	c1ccccc1
CC[C@@H](C)OC(=O)C1=C(C)NC(=O)N[C@@H]1c2ccc(OC)c(O)c2	ZINC000000036500	O=C2NC=CC(c1ccccc1)N2
COc2cc(O)c([C@@H](C)c1cc(OC)c(OC)c(OC)c1)cc2O	ZINC000000044517	C(c1ccccc1)c2ccccc2
CC(=O)Nc2ccn([C@H]1CS[C@H](COC(=O)P(O)(O)=O)O1)c(=O)n2	ZINC000026292287	O=c1ncccn1C2CSCO2
COc3cccc(\C=c2\cc(c1cc(C)ccc1C)oc2=O)c3OC	ZINC000000064125	O=c2oc(c1ccccc1)cc2=Cc3ccccc3
Cc2c(C#N)c1ccccc1n2CC(=O)NCc4ccc3OCOc3c4	ZINC000000029033	O=C(Cn1ccc2ccccc12)NCc4ccc3OCOc3c4
Cn2cc(Br)c(C(=O)Nc1ccccn1)n2	ZINC000000031266	O=C(Nc1ccccn1)c2cc[nH]n2
CC4(C)Cc1c(ccc2ccccc12)C(=CC(=O)N3CCCCCC3)N4	ZINC000000210006	O=C(C=C1NCCc2c1ccc3ccccc23)N4CCCCCC4
Cc2ccc(OCC(=O)SCC(=O)Nc1ccc(Cl)cc1)cc2	ZINC000000112087	O=C(CSC(=O)COc1ccccc1)Nc2ccccc2
CC(=O)Oc1ccccc1N(C(C)=O)S(=O)(=O)c2ccc(C)cc2	ZINC000000247766	O=S(=O)(Nc1ccccc1)c2ccccc2
CC(=O)c2ccc(NC(=O)c1cc(=O)[nH]c(=O)[nH]1)cc2	ZINC000000033021	O=C(Nc1ccccc1)c2cc(=O)[nH]c(=O)[nH]2
Cc1c(CC(O)=O)c(=O)oc2cc(O)cc(O)c12	ZINC000019701838	O=c2ccc1ccccc1o2
Cc3cc(=O)n(c2ccc1c(S(O)(=O)=O)cc(S(O)(=O)=O)cc1c2)[nH]3	ZINC000021984230	O=c1cc[nH]n1c3ccc2ccccc2c3
C[C@H]2N(C)OC(c1ccc(S(C)(=O)=O)cc1)=C2c3ccccc3	ZINC000000009032	C2NOC(c1ccccc1)=C2c3ccccc3
CC2(C)OC(=O)N(C[C@@H](O)c1ccccc1)[C@@]2(C)O	ZINC000000089390	O=C1OCCN1CCc2ccccc2
COc4cc3CCN(C(=O)Nc2cc(F)cc(c1cccnc1)c2)c3cc4C(F)(F)F	ZINC000000601841	O=C(Nc2cccc(c1cccnc1)c2)N3CCc4ccccc34
Nc1cc(S(O)(=O)=O)cc(N(=O)=O)c1O	ZINC000001908984	c1ccccc1
C[N+](C)(CC=C)c1ccccc1O	ZINC000000027451	c1ccccc1
CCOc3ccc2nc(SCc1ccc(OC)cc1)sc2c3	ZINC000000068062	C(Sc2nc1ccccc1s2)c3ccccc3
Cc1ccccc1C2(C#N)CCNCC2	ZINC000000022414	C2CC(c1ccccc1)CCN2
CN(C)[C@H](Cn2c(=O)c1ccccc1c2=O)c3cn(C)c4ccccc34	ZINC000000494136	O=c3n(CCc1c[nH]c2ccccc12)c(=O)c4ccccc34
Cc3sc2ncnc(SCc1ccc(Cl)cc1)c2c3C	ZINC000000303191	C(Sc1ncnc2sccc12)c3ccccc3
COc3ccc(S(=O)(=O)N1CCc2ccccc12)cc3OC	ZINC000000021732	O=S(=O)(N1CCc2ccccc12)c3ccccc3
O=C(CCn2c(=O)c1cccc(N(=O)=O)c1c2=O)NC[C@@H]3CCCO3	ZINC000000117401	O=C(CCn2c(=O)c1ccccc1c2=O)NCC3CCCO3
CCc1c(O)c(=O)ccn1CC	ZINC000000001220	O=c1cc[nH]cc1
CC(C)c4ccc(Nc2c(c1ccccn1)nc3ccc(C)cn23)cc4	ZINC000000426772	N(c1ccccc1)c3c(c2ccccn2)nc4ccccn34
CN(C)c1cccc(F)c1C(=O)NC(=O)Nc2ccc(Cl)cc2	ZINC000000001167	O=C(NC(=O)c1ccccc1)Nc2ccccc2
CN(C)CCN2C(=O)C(=O)C(=C(O)c1ccc(S(=O)(=O)N(C)C)cc1)[C@@]24C(=O)N(C)c3ccccc34	ZINC000009110360	O=C4NC2(C(=O)Nc1ccccc12)C(=Cc3ccccc3)C4=O
Cc2ccnc(NS(=O)(=O)c1ccc(NC(=O)C(C)(C)C)cc1)n2	ZINC000000380481	O=S(=O)(Nc1ncccn1)c2ccccc2
Cc1cccc(O)c1/N=C/c2ccc(N(=O)=O)cc2	ZINC000000059996	C(=Nc1ccccc1)c2ccccc2
CNc1ncnc2sc(C)c(C)c12	ZINC000000039883	c2ncc1ccsc1n2
COc2ccc(Cc1cnc(N)nc1N)c(OC)c2	ZINC000000010464	C(c1ccccc1)c2cncnc2
CCn1nc(C)cc1c3nnc(SCC(=O)c2ccc(C)cc2)o3	ZINC000000121431	O=C(CSc2nnc(c1ccn[nH]1)o2)c3ccccc3
Cc2c(NC(=O)c1ccco1)cc3c(c2N(=O)=O)C(C)(C)CC3(C)C	ZINC000000094271	O=C(Nc2ccc1CCCc1c2)c3ccco3
O[P@](=O)(CN3CCN(C[P@](O)(=O)c1ccccc1)CCN(C[P@@](O)(=O)c2ccccc2)CC3)c4ccccc4	ZINC000019372345	O=P(CN3CCN(CP(=O)c1ccccc1)CCN(CP(=O)c2ccccc2)CC3)c4ccccc4
COc2cc(Cc1cnc(N)nc1N)ccc2O	ZINC000000010467	C(c1ccccc1)c2cncnc2
Clc3cccc(/C=C/C(=O)Nc2nc(c1ccccc1)cs2)c3	ZINC000000483488	O=C(Nc2nc(c1ccccc1)cs2)C=Cc3ccccc3
Oc2ccc1ccc(=O)oc1c2	ZINC000000058111	O=c2ccc1ccccc1o2
CCOC(=O)c1c(NC(=O)C(F)(F)F)scc1c2cccs2	ZINC000000472415	c2csc(c1ccsc1)c2
COC(=O)c1ccccc1SC(=O)c3cnc2SCCn2c3=O	ZINC000000107228	O=C(Sc1ccccc1)c3cnc2SCCn2c3=O
CCN2CCC(=O)N(c1c(C)cccc1CC)C2=S	ZINC000000022641	O=C1CCNC(=S)N1c2ccccc2
Cc4ccc(C)c(Cc3c(C)nc2c(C(=O)NC1CC1)cnn2c3C)c4	ZINC000000217858	O=C(NC1CC1)c3cnn4cc(Cc2ccccc2)cnc34
Clc3ccc(\C=N\c2ccc1OCCOc1c2)cc3N(=O)=O	ZINC000000059970	C3COc2cc(N=Cc1ccccc1)ccc2O3
CC[C@@H]3Oc1ccccc1N(CC(=O)NCCN2CCCC2)C3=O	ZINC000000219101	O=C(CN1C(=O)COc2ccccc12)NCCN3CCCC3
O=C(CSc2nc1ccccc1s2)Nc3ccccc3C#N	ZINC000000055245	O=C(CSc2nc1ccccc1s2)Nc3ccccc3
COc1cc(C=O)ccc1OC(=O)c2cccc(Br)c2	ZINC000000059974	O=C(Oc1ccccc1)c2ccccc2
CN(C)CCNc2nc(CN1CCCCC1)nc3sc(C)c(C)c23	ZINC000002630964	C3CCN(Cc2ncc1ccsc1n2)CC3
OC(=O)c1ccc(S(=O)(=O)NCl)cc1	ZINC000008576128	c1ccccc1
C[N+]14CCCC[C@@H]1[C@H](OC(=O)C3(c2ccccc2)CCCC3)CCC4	ZINC000000234102	O=C(OC1CCCN2CCCCC12)C4(c3ccccc3)CCCC4
Cn2c(COc1ccccc1O)nc3ccccc23	ZINC000000041866	C(Oc1ccccc1)c3nc2ccccc2[nH]3
O=C3CCC(c2ccc(n1ccnc1)cc2)=NN3	ZINC000000001553	O=C3CCC(c2ccc(n1ccnc1)cc2)=NN3
C[C@@H]2CN(c1ccccc1)NC(=O)N2	ZINC000000004070	O=C2NCCN(c1ccccc1)N2
OC(=O)CCc2n[nH]c(SCC(=O)Nc1cccc(C(F)(F)F)c1)nc2=O	ZINC000005928278	O=C(CSc1nc(=O)cn[nH]1)Nc2ccccc2
C[C@@H](Sc1ccc(Cl)cc1)C(=O)NC[C@@H]2CCCO2	ZINC000000037679	O=C(CSc1ccccc1)NCC2CCCO2
COc1cc(C)c([S@@](C)=O)cc1OC	ZINC000000000791	c1ccccc1
Cc2[nH]c1ccc(F)cc1c2CCNC(=O)c3cccc(N(=O)=O)c3	ZINC000000105684	O=C(NCCc1c[nH]c2ccccc12)c3ccccc3
OC(=O)\C=C\C(=O)N1CCc2ccccc12	ZINC000000134076	C2Cc1ccccc1N2
COc2ccc(\C=N\c1ccccc1C(O)=O)cc2	ZINC000000061625	C(=Nc1ccccc1)c2ccccc2
CC(C)OC(=O)C2=C(C)Nc1ncnn1[C@@H]2c3ccc(N(=O)=O)cc3	ZINC000000147799	N2C=CC(c1ccccc1)n3ncnc23
CC(=O)c2sc(c1ccccc1)cc2NC(=O)c3cccs3	ZINC000000117157	O=C(Nc2csc(c1ccccc1)c2)c3cccs3
CCCC(=O)c2ccc(N1CCN(C(=O)OCC)CC1)c(F)c2	ZINC000000036279	C2CN(c1ccccc1)CCN2
O=c3[nH]c(=O)c2c(c1ccccc1)csc2[nH]3	ZINC000000037906	O=c3[nH]c(=O)c2c(c1ccccc1)csc2[nH]3
CC(C)C(=O)Nc4nc3N[C@H](C)[C@H](C)N(C(=O)c2ccc[n+](Cc1ccccc1)c2)c3c(=O)[nH]4	ZINC000000719485	O=C(N1CCNc2nc[nH]c(=O)c12)c4ccc[n+](Cc3ccccc3)c4
CCOC(=O)c3nc2cc1C(C)=C(C)[C@H](C)n1c(CC(C)C)c2c3C	ZINC000000053277	C2C=Cc3cc1nccc1cn23
COc4ccc3n(CC1CC1)c(=O)nc(c2ccccc2)c3c4	ZINC000000000154	O=c3nc(c1ccccc1)c2ccccc2n3CC4CC4
Cn4c(SCC(=O)N1CCCC1)nc3sc2CCCc2c3c4=O	ZINC000000419616	O=C(CSc3nc2sc1CCCc1c2c(=O)[nH]3)N4CCCC4
O=C(N1CCc2ccccc12)c3cccnc3	ZINC000000029580	O=C(N1CCc2ccccc12)c3cccnc3
COc4ccc(OC)c(\C=c3\sc2nc1ccccc1n2c3=O)c4	ZINC000000037474	O=c3c(=Cc1ccccc1)sc4nc2ccccc2n34
CC(C)=N/N=c3/[nH]c(c2cc1ccccc1oc2=O)cs3	ZINC000000060594	N=c3[nH]c(c2cc1ccccc1oc2=O)cs3
CC(C)C(=O)Nc2ccc(S(=O)(=O)Nc1nc(C)cc(C)n1)cc2	ZINC000000138948	O=S(=O)(Nc1ncccn1)c2ccccc2
OC(=O)c1nccnc1C(=O)Nc2ccc(Br)cn2	ZINC000000040208	O=C(Nc1ccccn1)c2cnccn2
N3[C@@H]([C@@H]2Nc1ccccc1O2)Oc4ccccc34	ZINC000000135843	N3C(C2Nc1ccccc1O2)Oc4ccccc34
CCCN(Cc1nc(C(=O)OC)co1)C(=O)Nc2cccc(OC)c2	ZINC000000322575	O=C(NCc1ncco1)Nc2ccccc2
FC(F)(F)c2cccc(\C=C(/C#N)C(=O)NC[C@@H]1CCCO1)c2	ZINC000000037472	O=C(NCC1CCCO1)C=Cc2ccccc2
CC(C)(C)c2ccc(c1nc(N)nc(N)n1)cc2	ZINC000000073973	c2ccc(c1ncncn1)cc2
CC(C)N(C(C)C)C(=O)c2ccc(C(=O)Nc1ccccn1)cc2	ZINC000000052649	O=C(Nc1ccccn1)c2ccccc2
OC(=O)c3ccc2c(=O)n(c1c[nH]c(=O)[nH]c1=O)c(=O)c2c3	ZINC000000286243	O=c3[nH]cc(n2c(=O)c1ccccc1c2=O)c(=O)[nH]3
Cc4cccc(Cn2c(=O)n(c1ccccc1)c(=O)c3sccc23)c4	ZINC000000426825	O=c3n(Cc1ccccc1)c2ccsc2c(=O)n3c4ccccc4
Cc3ccc(S(=O)(=O)NC(=O)Oc2ccc(Oc1ccc(C(F)(F)F)cn1)cc2)cc3	ZINC000001046657	O=C(NS(=O)(=O)c1ccccc1)Oc3ccc(Oc2ccccn2)cc3
Clc1ccccc1OCCn4cc(\C=c3\c(=O)[nH]c(=O)n(Cc2ccco2)c3=O)c5ccccc45	ZINC000001088463	O=c4[nH]c(=O)c(=Cc2cn(CCOc1ccccc1)c3ccccc23)c(=O)n4Cc5ccco5
C[C@@H]2C[C@H](OC(=O)c1ccccc1O)CC(C)(C)C2	ZINC000000000370	O=C(OC1CCCCC1)c2ccccc2
COc2ccc(C(=O)COC(=O)c1ccc(Br)cc1)cc2	ZINC000000270581	O=C(COC(=O)c1ccccc1)c2ccccc2
CCOC(=O)[C@@]3(CCOc1ccccc1)CCC[N@](C2CCN(C)CC2)C3	ZINC000011817634	C3CC(CCOc1ccccc1)CN(C2CCNCC2)C3
Fc3ccc(S(=O)(=O)Nc2nnc(Cc1ccccc1)s2)cc3	ZINC000000412269	O=S(=O)(Nc2nnc(Cc1ccccc1)s2)c3ccccc3
O=c2nc(c1ccccc1)[nH]c(=S)[nH]2	ZINC000000164570	O=c2nc(c1ccccc1)[nH]c(=S)[nH]2
COCc3[nH]nc4OC(N)=C(C#N)[C@H](c1cccc2ccccc12)c34	ZINC000000034925	O3C=CC(c1cccc2ccccc12)c4c[nH]nc34
C[C@H](Sc2nc1ccccc1c(=O)n2c3ccccc3)C#N	ZINC000000045741	O=c2n(c1ccccc1)cnc3ccccc23
CCOc1cc(C=O)cc(Cl)c1OC(=O)c2cccc(N(=O)=O)c2	ZINC000000312855	O=C(Oc1ccccc1)c2ccccc2
Clc2ccc(C(=O)NCc1ccco1)s2	ZINC000000035399	O=C(NCc1ccco1)c2cccs2
Clc2cc(NC(=O)c1ccc(N(=O)=O)o1)ccc2N3CCCCC3	ZINC000000452375	O=C(Nc2ccc(N1CCCCC1)cc2)c3ccco3
CC(=O)N3CCc4cc(NC2CCN(Cc1ccccc1)CC2)ccc34	ZINC000000007074	C4Cc3cc(NC2CCN(Cc1ccccc1)CC2)ccc3N4
CCOC(=O)c1cnc(SC)nc1Nc2cc(C(C)(C)C)nn2C	ZINC000000383913	N(c1ccncn1)c2ccn[nH]2
Cc4cccc([N+]3=C1SCCCN1[C@@](O)(c2cccs2)C3)c4	ZINC000000425731	C4CSC3=[N+](c1ccccc1)CC(c2cccs2)N3C4
COC(=O)c3ccc(\C=N\c2ccc(Cc1ccncc1)cc2)cc3	ZINC000000047088	C(c1ccncc1)c3ccc(N=Cc2ccccc2)cc3
O=N(=O)c4cccc(Cc3cn2c(c1ccccc1)cnc2s3)c4	ZINC000000063481	C(c1ccccc1)c4cn3c(c2ccccc2)cnc3s4
CCCN(CCC)C(=O)c1ccc(OC(C)=O)cc1	ZINC000000030051	c1ccccc1
CC(C)(C)OC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H]3CCCN5[C@H]3CC(=O)N(c4cccc(C(O)=O)c4)C5=O	ZINC000026295642	O=C(CCc1c[nH]c2ccccc12)NC3CCCN5C3CC(=O)N(c4ccccc4)C5=O
C[C@H]([C@@H](C)C(O)=O)C(O)=O	ZINC000000388421	nonring
CC3=NN(C(=O)CSc2nnc(c1ccncc1)o2)[C@@](C)(O)C3	ZINC000000034284	O=C(CSc2nnc(c1ccncc1)o2)N3CCC=N3
Cc2ccc(S(=O)(=O)NC1CCCC1)cc2	ZINC000000029132	O=S(=O)(NC1CCCC1)c2ccccc2
COc2cc(\C=c1/sc(=S)n(CCC(O)=O)c1=O)ccc2OCC(O)=O	ZINC000009188434	O=c1[nH]c(=S)sc1=Cc2ccccc2
CCOC(=O)c3c(NC(=O)c1ccccc1)sc2[C@@H](O)CCCc23	ZINC000000062202	O=C(Nc2cc1CCCCc1s2)c3ccccc3
CCN(C(=O)c1ccc(OC)c(OC)c1)c2ccccc2C	ZINC000000029918	O=C(Nc1ccccc1)c2ccccc2
CCOC(=O)c2nnn(c1nonc1N)c2C[N@@](C)C3CCCCC3	ZINC000000110394	C3CCC(NCc1cnnn1c2cnon2)CC3
O=c2[nH]c(c1ccco1)cn3ccnc23	ZINC000000020089	O=c2[nH]c(c1ccco1)cn3ccnc23
C(CN2CCN(c1ncccn1)CC2)Nc4ccc3ccccc3n4	ZINC000000007523	C(CN2CCN(c1ncccn1)CC2)Nc4ccc3ccccc3n4
OC(=O)[C@H]2[C@@H]4O[C@@]3(CN(c1ccccc1Br)C(=O)[C@H]23)C=C4	ZINC000000207874	O=C2C1CC4OC1(CN2c3ccccc3)C=C4
CC[C@@H](C)OC(=O)c3[nH]c2C[C@H](c1ccc(F)cc1)CC(=O)c2c3C	ZINC000000110828	O=C2CC(c1ccccc1)Cc3[nH]ccc23
COC(=O)c1cc(O)c(O)c(O)c1	ZINC000000021789	c1ccccc1
CCOC(=O)C1=CN(C(C)C)C=C(C(=O)OCC)C1c2cccs2	ZINC000000264510	N2C=CC(c1cccs1)C=C2
Fc1cccc(Cl)c1CSC3=CC(=O)C[C@H](c2ccccc2)C3	ZINC000000142729	O=C3CC(c1ccccc1)CC(SCc2ccccc2)=C3
CN(Cc1ccccc1)S(=O)(=O)c3ccc2n(C)c(=O)n(C)c2c3	ZINC000000081732	O=c3[nH]c2ccc(S(=O)(=O)NCc1ccccc1)cc2[nH]3
Fc4ccc(NC(=O)n2c1ccccc1sc3ccccc23)cc4	ZINC000000527231	O=C(Nc1ccccc1)n3c2ccccc2sc4ccccc34
Cc3nc2n(CC(O)=O)c1ccccc1n2n3	ZINC000000266106	c1ccc2c(c1)[nH]c3ncnn23
Clc1ccsc1C(=O)Nc2ccccc2Oc3ccccc3	ZINC000000154121	O=C(Nc1ccccc1Oc2ccccc2)c3cccs3
O=N(=O)c3ccc(c2ccc(S(=O)(=O)N1CCOCC1)cc2)cc3	ZINC000000254812	O=S(=O)(N1CCOCC1)c3ccc(c2ccccc2)cc3
CN(O)C(=O)CCc3ccc2Cc1cccc(O)c1C(=O)c2c3O	ZINC000000006784	O=C2c1ccccc1Cc3ccccc23
CNC(=O)Oc1ccccc1C(=O)Nc2ccccc2	ZINC000000000950	O=C(Nc1ccccc1)c2ccccc2
O=C(Nc1nn[nH]n1)C=Cc3ccc2ccccc2n3	ZINC000000012764	O=C(Nc1nn[nH]n1)C=Cc3ccc2ccccc2n3
CCOc1cc(\C=N\O)c(Br)cc1OCC(=O)Nc2ccccc2OC	ZINC000000668545	O=C(COc1ccccc1)Nc2ccccc2
CSc2ccn(Cc1c(Cl)cccc1Cl)c(=O)n2	ZINC000000048698	O=c1ncccn1Cc2ccccc2
CCOc3cc(\C=c2\c(=O)[nH]c(=O)n(c1ccc(C)cc1)c2=O)cc(Cl)c3OCC	ZINC000000671235	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)n2c3ccccc3
Cc4ccc(c3noc(COc2ccc1OCOc1c2)n3)cc4	ZINC000000034118	C4Oc3ccc(OCc2nc(c1ccccc1)no2)cc3O4
Fc1ccccc1NC(=S)N/N=C/c3ccc(N2CCOCC2)o3	ZINC000000261167	S=C(NN=Cc2ccc(N1CCOCC1)o2)Nc3ccccc3
NS(=O)(=O)c3nnc(NS(=O)(=O)c2ccc(NC(=O)c1c(F)c(F)c(F)c(F)c1F)cc2)s3	ZINC000027522084	O=C(Nc2ccc(S(=O)(=O)Nc1nncs1)cc2)c3ccccc3
Cc1[nH]nc(C(O)=O)c1S(O)(=O)=O	ZINC000404967216	c1cn[nH]c1
Oc4cccc5C(C(=O)c2cc1ccccc1[nH]2)c3cccc(O)c3C(=O)c45	ZINC000000589795	O=C(C2c1ccccc1C(=O)c3ccccc23)c5cc4ccccc4[nH]5
Fc5ccc(Cn3c1ccccc1oc4nc2ccccc2nc34)cc5	ZINC000000480323	C(c1ccccc1)n4c2ccccc2oc5nc3ccccc3nc45
CCOc3ccc(C(=O)Nc1c(C)ccc2nsnc12)cc3Cl	ZINC000000097734	O=C(Nc1cccc2nsnc12)c3ccccc3
Fc3ccc(Cn2cnc1ccc(Cl)cc1c2=O)cc3	ZINC000000041646	O=c2n(Cc1ccccc1)cnc3ccccc23
COc3ccc2cc(c1ccsc1)cnc2c3	ZINC000000008076	c3ccc2ncc(c1ccsc1)cc2c3
CSc1nc(Cl)c(C#N)c(SC)n1	ZINC000000025696	c1cncnc1
O=N(=O)c4ccc(c3ccc(n2c(=O)c1cccnc1c2=O)cc3)cc4	ZINC000000084703	O=c3n(c2ccc(c1ccccc1)cc2)c(=O)c4ncccc34
COC(=O)C=C(O)c1ccc(C(F)(F)F)nc1	ZINC000000154418	c1ccncc1
COCc2cc(C)nc(SCC(=O)c1ccc(O)c(O)c1)c2C#N	ZINC000000085612	O=C(CSc1ccccn1)c2ccccc2
Clc3ccc(c2c[nH]c(SCc1ccccc1Cl)n2)cc3	ZINC000000120142	C(Sc2nc(c1ccccc1)c[nH]2)c3ccccc3
Cc4ccc3c(nc2s\c(=C/c1ccc(F)cc1F)c(=O)n23)c4C	ZINC000000034732	O=c3c(=Cc1ccccc1)sc4nc2ccccc2n34
CC(C)c1ccccc1OCC(=O)Nc2nccs2	ZINC000000041482	O=C(COc1ccccc1)Nc2nccs2
CN(C)S(=O)(=O)N[C@@H]4C[C@@H]1[C@H](Cc2cn(C)c3cccc1c23)[N@@](C)C4	ZINC000000537983	C2CNC1Cc3c[nH]c4cccc(C1C2)c34
OC(=O)Cc3ccc(=O)n(Cc2nc1cc(C(F)(F)F)ccc1s2)n3	ZINC000000605745	O=c1cccnn1Cc3nc2ccccc2s3
C\C(=N/N=C/c1c[nH]c2ccccc12)c4nnn(c3nonc3N)c4C	ZINC000000061971	C(=NN=Cc1c[nH]c2ccccc12)c4cn(c3cnon3)nn4
Cc2nc1ccccc1nc(C)c2=NOCc3cccc(F)c3	ZINC000000034603	C(ON=c2cnc1ccccc1nc2)c3ccccc3
CC(=O)Nc2[nH]c1CCCCCc1c2C#N	ZINC000000031234	C2CCc1cc[nH]c1CC2
CCOC(=O)c2c(NC(=O)c1ccco1)scc2c3ccccc3	ZINC000000044235	O=C(Nc2cc(c1ccccc1)cs2)c3ccco3
CCn2c[n+](C[C@@H](O)COc1ccc(F)cc1)c3cc(C)c(C)cc23	ZINC000000268775	C(COc1ccccc1)C[n+]2c[nH]c3ccccc23
Nc3nnc(COc2ccc(C1CCCCC1)cc2)s3	ZINC000000077268	C3CCC(c2ccc(OCc1nncs1)cc2)CC3
CC(C)OC(=O)c2c(N)sc1C[C@H](C)CCc12	ZINC000000035883	C2CCc1sccc1C2
Cc3cccc(Oc2ccc(NC(=O)c1ccccc1C(O)=O)cc2)c3C	ZINC000000820912	O=C(Nc2ccc(Oc1ccccc1)cc2)c3ccccc3
OC(=O)c3cc(c2ccc1OCOc1c2)nc4ccccc34	ZINC000000035887	C4Oc3ccc(c2ccc1ccccc1n2)cc3O4
Cc2ccc(C(=O)Nc1cc(C)ccc1C)cc2	ZINC000000029222	O=C(Nc1ccccc1)c2ccccc2
Cc2ccc(C(=O)Nc1cc(C)cc(C)c1)cc2	ZINC000000029220	O=C(Nc1ccccc1)c2ccccc2
CSc3ccc(NC(=O)Nc1ccnc2cccnc12)cc3	ZINC000000024347	O=C(Nc1ccccc1)Nc2ccnc3cccnc23
OC(=O)CCC(=O)N1CCO[C@@H](C(O)=O)C1	ZINC000381285008	C1COCCN1
CSc3n\c(=C/c2ccc(c1ccc(C)c(Cl)c1)o2)c(=O)s3	ZINC000000458351	O=c1scnc1=Cc3ccc(c2ccccc2)o3
Nc3nc2n([C@@H]1CC[C@H](CO)O1)cnc2c(=O)[nH]3	ZINC000000024612	O=c2[nH]cnc3n(C1CCCO1)cnc23
NCCc2cccc3n(S(=O)(=O)c1ccccc1)ccc23	ZINC000000008954	O=S(=O)(c1ccccc1)n2ccc3ccccc23
OC(=O)CN(CC(O)=O)n2c(=O)c1ccccc1c2=O	ZINC000009592348	O=c1[nH]c(=O)c2ccccc12
COc1cc(C)ccc1S(=O)(=O)NC(=O)[C@H](c3ccc2OCOc2c3)c4cn(C)c5cc(F)ccc45	ZINC000001487557	O=C(NS(=O)(=O)c1ccccc1)C(c3ccc2OCOc2c3)c4c[nH]c5ccccc45
Cc4ccc(c3csc(c2csc(c1ccccc1)n2)n3)cc4	ZINC000000387598	c4ccc(c3csc(c2csc(c1ccccc1)n2)n3)cc4
Cc3nccc(N2CCN(C(=O)c1cccnc1)CC2)n3	ZINC000000013142	O=C(N2CCN(c1ccncn1)CC2)c3cccnc3
Cc2cc(N1CCN(S(C)(=O)=O)CC1)ncn2	ZINC000000013147	C2CN(c1ccncn1)CCN2
Cc3ccc(c2cn1cc(C)ccc1n2)cc3	ZINC000000023747	c3ccc(c2cn1ccccc1n2)cc3
NC(=N)c2ccc(OCCCCCOc1ccc(C(N)=N)cc1)cc2	ZINC000001530775	C(CCOc1ccccc1)CCOc2ccccc2
C[C@@H](O)Cn1c(C)cc(C)c(C#N)c1=O	ZINC000000034420	O=c1cccc[nH]1
CC3(C)C[C@@H](n1ccccc1=O)c2cc(C#N)ccc2O3	ZINC000000024980	O=c1ccccn1C2CCOc3ccccc23
COc1ccccc1c4ccc(C[C@H](NC(=O)C3(S(=O)(=O)c2nccn2C)CCCC3)C(O)=O)cc4	ZINC000013488141	O=C(NCCc2ccc(c1ccccc1)cc2)C4(S(=O)(=O)c3ncc[nH]3)CCCC4
CC(C)N2C[C@H](C(=O)Nc1ccc(F)c(N(=O)=O)c1)CC2=O	ZINC000000032769	O=C2CC(C(=O)Nc1ccccc1)CN2
C[S@@](=O)Cc1ccccc1	ZINC000000013561	c1ccccc1
C[C@@H]3S[C@@H](c1ccc(Br)cc1)N(c2ccccc2)C3=O	ZINC000000080607	O=C2CSC(c1ccccc1)N2c3ccccc3
Fc3ccc(c2cc(C(F)(F)F)nc(n1ccnc1)n2)cc3	ZINC000000426657	c3ccc(c2ccnc(n1ccnc1)n2)cc3
COc3ccc2CN(c1cccc(NC(C)=O)c1)C(=O)c2c3OC	ZINC000000047256	O=C2N(c1ccccc1)Cc3ccccc23
Cc4c(NC(=O)c2cc1ccccc1o2)c(=O)n(c3ccccc3)n4C	ZINC000000099192	O=C(Nc2c[nH]n(c1ccccc1)c2=O)c4cc3ccccc3o4
Oc3ccc(\C=c2\sc(N1CCOCC1)nc2=O)cc3	ZINC000000032960	O=c2nc(N1CCOCC1)sc2=Cc3ccccc3
C[N@]1[C@H]4CCC[C@@H]1CC(NC(=O)c2nccc3ccccc23)C4	ZINC000000015188	O=C(NC1CC2CCCC(C1)N2)c3nccc4ccccc34
Cc2cc(C)nc(Oc1ccccc1F)n2	ZINC000000032610	O(c1ccccc1)c2ncccn2
O=C(CSc2nc1cccnc1[nH]2)N3CCOCC3	ZINC000000032611	O=C(CSc2nc1cccnc1[nH]2)N3CCOCC3
COc1ccccc1N(CC(=O)Nc2cccc(C)c2)S(C)(=O)=O	ZINC000000080266	O=C(CNc1ccccc1)Nc2ccccc2
CC(=O)c3ccc2OC1(CC1)C(=O)c2c3	ZINC000000002075	O=C2c1ccccc1OC23CC3
Clc4ccc(c3csc(c2cccc(n1cccc1)c2)n3)cc4	ZINC000000118655	c4ccc(c3csc(c2cccc(n1cccc1)c2)n3)cc4
Fc3ccc(C(=O)Nc1ccccc1Sc2ccccc2)cc3	ZINC000000381860	O=C(Nc1ccccc1Sc2ccccc2)c3ccccc3
CC[C@H]3C[C@@](C)(c2csc(Nc1ccccc1Cl)n2)OC3=O	ZINC000000330705	O=C3CCC(c2csc(Nc1ccccc1)n2)O3
CN(C)CCCc3cc(C(=O)Nc2ccc(c1ccncc1)cc2)ccc3O	ZINC000000599925	O=C(Nc2ccc(c1ccncc1)cc2)c3ccccc3
C[C@@H]2C[C@@H](C)CN(S(=O)(=O)Cc1ccccc1)C2	ZINC000000029829	O=S(=O)(Cc1ccccc1)N2CCCCC2
O=c4n(c1ccc3CCc2cccc1c23)c(=O)c6cccc5cccc4c56	ZINC000000111271	O=c4n(c1ccc3CCc2cccc1c23)c(=O)c6cccc5cccc4c56
FC(F)(F)c4ccn(c2ncnc3scc(c1ccccc1)c23)n4	ZINC000000066442	c4ccc(c2csc3ncnc(n1cccn1)c23)cc4
Cc2cc(C)c(S(=O)(=O)Nc1cccc(C(O)=O)c1C)c(C)c2	ZINC000000258703	O=S(=O)(Nc1ccccc1)c2ccccc2
CCOC(=O)c2[nH]c1ccc(Cl)cc1c2NC(=O)c3nonc3C	ZINC000000525139	O=C(Nc1c[nH]c2ccccc12)c3cnon3
CCOC(=O)C2CCN(Cc1ccc(C(F)(F)F)cc1)CC2	ZINC000000239567	C2CCN(Cc1ccccc1)CC2
Cc2cc(C)nc(NC(=O)Cc1ccc(Cl)cc1)n2	ZINC000000031708	O=C(Cc1ccccc1)Nc2ncccn2
Cn3cc([C@@H]2CC(=O)N(c1cccc(N(=O)=O)c1)C2=O)c4ccccc34	ZINC000000540239	O=C3CC(c1c[nH]c2ccccc12)C(=O)N3c4ccccc4
CN(C)c3ccc(NC(=O)c1c(C)onc1c2ccccc2)cc3	ZINC000000068329	O=C(Nc1ccccc1)c2conc2c3ccccc3
COc2cc(OC)c(\C=N\c1ccc(O)cc1)cc2Br	ZINC000000068328	C(=Nc1ccccc1)c2ccccc2
OC(=O)C[C@]1(C(O)=O)OC(=O)C=C1	ZINC000000895558	O=C1OCC=C1
CC[C@@H](C)C(=O)Nc2nc1ccc(C)cc1s2	ZINC000000045907	c2ccc1scnc1c2
CCOC(=O)c2nc1\C(=N\O)C(C)(C)OCc1n(=O)c2N	ZINC000002112154	N=C1COCc2c1nccn2=O
CCOc5ccc(c4cn(c1ccc(OC)cc1)c3CCc2ccccc2[n+]34)cc5	ZINC000000622951	C4Cc3n(c1ccccc1)cc(c2ccccc2)[n+]3c5ccccc45
Nc3c(C#N)sc4nc(c1ccc(F)cc1)cc(c2ccccc2)c34	ZINC000000405776	c4ccc(c3cc(c1ccccc1)c2ccsc2n3)cc4
Brc3ccc2oc(=O)c(c1csc(CC#N)n1)cc2c3	ZINC000000193102	O=c2oc1ccccc1cc2c3cscn3
COc2nc(Nc1ccc(OC(F)(F)Cl)cc1)nc(OC)n2	ZINC000000035069	N(c1ccccc1)c2ncncn2
O=C(N[C@@H]1CN2CCC1CC2)c3ccco3	ZINC000000010541	O=C(NC1CN2CCC1CC2)c3ccco3
Clc4ccc(NC(=O)C2c1ccccc1Oc3ccccc23)nc4	ZINC000000030292	O=C(Nc1ccccn1)C3c2ccccc2Oc4ccccc34
Cc1nccnc1c2ccnn2C(=O)Nc3cc(Cl)cc(Cl)c3	ZINC000000111388	O=C(Nc1ccccc1)n2nccc2c3cnccn3
Oc2ccc1ccccc1c2\C=N\n3cnnc3	ZINC000000035469	C(=Nn1cnnc1)c2cccc3ccccc23
O[C@H]1CCC[C@H]1n2[nH]cc(C(O)=O)c2=O	ZINC000133086684	O=c1cc[nH]n1C2CCCC2
Fc4ccc(c3cn2c1CCCCc1sc2n3)cc4	ZINC000000023696	C1CCc3c(C1)sc4nc(c2ccccc2)cn34
Cc2cc(N1CCCC1=O)cc(C)c2Cn4c(=O)c3ccccc3c4=O	ZINC000000111381	O=C1CCCN1c4ccc(Cn3c(=O)c2ccccc2c3=O)cc4
Clc3cccc4c(C(=O)Nc2ccc1oc(=O)ccc1c2)cccc34	ZINC000000557365	O=C(Nc2ccc1oc(=O)ccc1c2)c3cccc4ccccc34
O=Cc2ccc1OCOc1c2	ZINC000000001953	C2Oc1ccccc1O2
Cc4cc(NS(=O)(=O)c3ccc(NC(=O)[C@@H]2[C@@H]1CC[C@@H](O1)[C@@H]2C(O)=O)cc3)no4	ZINC000017092648	O=C(Nc2ccc(S(=O)(=O)Nc1ccon1)cc2)C3CC4CCC3O4
CCOC(=O)C2CCN(CCC(=O)Nc1ccc(C)cc1)CC2	ZINC000000256657	O=C(CCN1CCCCC1)Nc2ccccc2
CN(CCO)c3ccc(C=NNc1ccc(N(=O)=O)cc1S(=O)(=O)Nc2ccccc2C(O)=O)cc3	ZINC000012532258	O=S(=O)(Nc1ccccc1)c2ccccc2NN=Cc3ccccc3
COc5ccc(c4nc1ccccc1c(C(=O)N3CCN(Cc2ccccc2)CC3)c4C)cc5	ZINC000000694470	O=C(N2CCN(Cc1ccccc1)CC2)c4cc(c3ccccc3)nc5ccccc45
Cc2ccc(=O)n(c1ccccc1)c2	ZINC000000001958	O=c1ccccn1c2ccccc2
COC(=O)c1nc(Cl)c(Cl)c(Cl)c1Cl	ZINC000000039551	c1ccncc1
Nc3cc(N)nc(SCc2noc(c1ccc(Cl)cc1)n2)n3	ZINC000000460145	C(Sc1ncccn1)c3noc(c2ccccc2)n3
OC(=O)[C@](O)(C(=O)c1ccccc1)[C@](O)(C(O)=O)C(=O)c2ccccc2	ZINC000021298267	O=C(CCC(=O)c1ccccc1)c2ccccc2
OC(=O)c3ccc(N1CCN=C1Sc2ccc(N(=O)=O)cc2)cc3	ZINC000000168317	C3CN(c1ccccc1)C(Sc2ccccc2)=N3
Cc2cc(C)n1c(SCC(O)=O)nnc1n2	ZINC000000090547	c2cnc1nncn1c2
Nc3ccc(S(=O)(=O)N2CC1CCC(CC1)C2)cc3	ZINC000000000974	O=S(=O)(N2CC1CCC(CC1)C2)c3ccccc3
Cn1cccc1\C=c2\c(=O)[nH]c(=O)n(C)c2=O	ZINC000000033498	O=c2[nH]c(=O)c(=Cc1ccc[nH]1)c(=O)[nH]2
OC(=O)C(=Cc1cccs1)C(O)=O	ZINC000002505000	c1ccsc1
CCOc3cc(\C=N\n1c(C)nnc1n2nc(C)cc2C)ccc3O	ZINC000000086526	C(=Nn1cnnc1n2cccn2)c3ccccc3
O=C1NCC\C1=C/c3ccc2OCOc2c3	ZINC000000017607	O=C1NCCC1=Cc3ccc2OCOc2c3
OC(=O)CCCNc1ccc(S(O)(=O)=O)cc1	ZINC000002900708	c1ccccc1
CC(C)c2ccc(\C=N\c1cc(N(=O)=O)ccc1C)cc2	ZINC000000046037	C(=Nc1ccccc1)c2ccccc2
COc1ccccc1[C@@H]3Oc2ccccc2C6=C3[C@@H](c4ccc(N(C)C)cc4)n5[nH]cnc5=N6	ZINC000000638004	O5C(c1ccccc1)C3=C(N=c2nc[nH]n2C3c4ccccc4)c6ccccc56
O=S(=O)(Nc3ccc(c2cn1ccsc1n2)cc3)c4ccc6cccc5CCc4c56	ZINC000000629260	O=S(=O)(Nc3ccc(c2cn1ccsc1n2)cc3)c4ccc6cccc5CCc4c56
CC(=O)CC(=O)Nc1ccccn1	ZINC000000028234	c1ccncc1
OC(=O)c2ccc(\C=c1/sc(=S)n(CCS(O)(=O)=O)c1=O)cc2	ZINC000004291560	O=c1[nH]c(=S)sc1=Cc2ccccc2
N[C@@H](C#CP(O)(O)=O)C(O)=O	ZINC000013650382	nonring
CC(C)NS(=O)(=O)c2ccc(NC(=O)Cc1cccs1)cc2	ZINC000000082027	O=C(Cc1cccs1)Nc2ccccc2
COc2cc(/C=C/C(O)=O)cc(S(=O)(=O)Nc1cccc(S(N)(=O)=O)c1)c2OC	ZINC000012557295	O=S(=O)(Nc1ccccc1)c2ccccc2
Fc1ccccc1NC(=O)\C=C\c3ccc(OCc2ccccc2)cc3	ZINC000000131094	O=C(Nc1ccccc1)C=Cc3ccc(OCc2ccccc2)cc3
Clc3ccc(NC(=O)COc2ccc(C1CCCCC1)cc2)nc3	ZINC000000032547	O=C(COc2ccc(C1CCCCC1)cc2)Nc3ccccn3
Cn2c(=O)[nH]c3cc1nn[nH]c1cc23	ZINC000000002428	O=c3[nH]c2cc1nn[nH]c1cc2[nH]3
CC(=O)c2sc(Nc1ccccc1)nc2N	ZINC000000027063	N(c1ccccc1)c2nccs2
CN1C(=O)[C@@]3(C2=C1CC=CC2)C(C#N)=C(N)OC(C)=C3C(C)=O	ZINC000000033364	O=C2NC1=C(CC=CC1)C23C=COC=C3
CCN(CC)C(=O)N[C@@H]4C[C@@H]1[C@H](Cc2c[nH]c3cccc1c23)[N@@](C)C4	ZINC000000002136	C2CNC1Cc3c[nH]c4cccc(C1C2)c34
Cc1ccc(C(O)(C(F)(F)F)C(F)(F)F)c(O)c1C	ZINC000000033810	c1ccccc1
O=C(N[C@H]1CCN(C#N)C1)c3ccc(c2ccccc2)cc3	ZINC000000027297	O=C(NC1CCNC1)c3ccc(c2ccccc2)cc3
COC(=O)c3ccc(CON=c2c(C)nc1ccccc1nc2C)cc3	ZINC000000033816	C(ON=c2cnc1ccccc1nc2)c3ccccc3
Nc2nn(=O)c1ccc(Cl)cc1n2	ZINC000000018719	O=n1ncnc2ccccc12
Clc4ccc(C(=O)Nc3ccc(OCc2nc1ccccc1s2)cc3)cc4	ZINC000000625338	O=C(Nc3ccc(OCc2nc1ccccc1s2)cc3)c4ccccc4
Cc4c(\C=c2\c(=O)[nH]c(=S)n(c1ccccc1F)c2=O)c3ccccc3n4Cc5ccccc5	ZINC000000631967	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc4cn(Cc3ccccc3)c5ccccc45
CC(=O)N2CCc3cc(NC(=S)Nc1ccccc1Cl)ccc23	ZINC000000080844	S=C(Nc1ccccc1)Nc3ccc2NCCc2c3
Cc3ccc(S(=O)(=O)NCc1c(C)onc1c2ccccc2)cc3	ZINC000000105513	O=S(=O)(NCc1conc1c2ccccc2)c3ccccc3
Cc4ncc(c1nnnn1c2ccccc2)c(c3cccc(Cl)c3)n4	ZINC000000133806	c4ccc(c1ncncc1c2nnnn2c3ccccc3)cc4
CCN3CCN(C(=O)C2CCN(C[C@@H](C)c1ccccc1)CC2)CC3	ZINC000000299497	O=C(C2CCN(CCc1ccccc1)CC2)N3CCNCC3
CN6CCN(c3cc(NCCN1CCCC1)c5c(=O)c2ccccc2c4onc3c45)CC6	ZINC000009641242	O=c4c1ccccc1c6onc5c(N2CCNCC2)cc(NCCN3CCCC3)c4c56
OC(=O)c3ccc2n1CCS(=O)(=O)N=c1sc2c3	ZINC000000093556	O=S1(=O)CCn2c(=N1)sc3ccccc23
CC3([C@@]2(O)C[C@@H](c1ccccc1)ON2)CCCCC3	ZINC000000033380	C3CCC(C2CC(c1ccccc1)ON2)CC3
COc1ccccc1c3nnc4ccc2ccccc2n34	ZINC000000036324	c4ccc(c2nnc3ccc1ccccc1n23)cc4
O=C(NC1CCCCC1)c3ccc4c(=O)c2ccccc2c5onc3c45	ZINC000000033385	O=C(NC1CCCCC1)c3ccc4c(=O)c2ccccc2c5onc3c45
CC(C)c3ccc(OCC(=O)Nc2ccc(S(=O)(=O)Nc1cc(C)nc(C)n1)cc2)cc3	ZINC000000710184	O=C(COc1ccccc1)Nc3ccc(S(=O)(=O)Nc2ccncn2)cc3
CCc3cc2c(=O)c(c1ccccc1)c(C(F)(F)F)oc2cc3OC	ZINC000000178224	O=c2c(c1ccccc1)coc3ccccc23
C[C@H](N2C(=O)c1ccccc1[C@]2(O)Cc3ccccc3)c4ccccc4	ZINC000000036286	O=C3N(Cc1ccccc1)C(Cc2ccccc2)c4ccccc34
COc2cc(C(=O)N1CCOCC1)cc(OC)c2OC	ZINC000000000811	O=C(N1CCOCC1)c2ccccc2
Cc2nc1sccn1c(=O)c2CCN5CCC(=C(c3ccc(F)cc3)c4ccc(F)cc4)CC5	ZINC000000538314	O=c4c(CCN3CCC(=C(c1ccccc1)c2ccccc2)CC3)cnc5sccn45
Fc1cccc(Cl)c1CSCC(=O)NC3Cc2ccccc2C3	ZINC000000171433	O=C(CSCc1ccccc1)NC3Cc2ccccc2C3
CC(C)CCNC(=O)c2cc(c1ccc(C)c(C)c1)nc3ccccc23	ZINC000000218067	c3ccc(c2ccc1ccccc1n2)cc3
Clc3ccc(c2ccc(SCC(=O)N1CCOCC1)nn2)cc3	ZINC000000255251	O=C(CSc2ccc(c1ccccc1)nn2)N3CCOCC3
Cc3noc(c2ccc1OCOc1c2)c3I	ZINC000000033142	C3Oc2ccc(c1ccno1)cc2O3
COc3ccc(c1cscc1c2ccc(S(C)(=O)=O)cc2)cc3	ZINC000000018712	c3ccc(c1cscc1c2ccccc2)cc3
Cc2c(OCc1ccccc1)ccc4c2oc(=O)c3ccccc34	ZINC000000046589	O=c3oc2cc(OCc1ccccc1)ccc2c4ccccc34
CCC(=O)c2ccc(OC(=O)c1ccc(C)c(Br)c1)cc2	ZINC000000357382	O=C(Oc1ccccc1)c2ccccc2
Fc4ccc(C(=O)C3CCN(CCCn1c(=O)[nH]c2cc(Cl)ccc12)CC3)cc4	ZINC000000538006	O=C(C3CCN(CCCn1c(=O)[nH]c2ccccc12)CC3)c4ccccc4
Cc3cc(C)nc(NC(=N)N1CCCc2ccccc12)n3	ZINC000000069457	N=C(Nc1ncccn1)N2CCCc3ccccc23
Oc3cccc4c(=CCCc1ccccc1)c2cccc(O)c2c(=O)c34	ZINC000000019539	O=c3c1ccccc1c(=CCCc2ccccc2)c4ccccc34
COc2ccc(CCNC(=O)c1cccc(Cl)c1)cc2OC	ZINC000000037540	O=C(NCCc1ccccc1)c2ccccc2
CC(C)CN(C#N)c3nc(N1CCOCC1)nc(N2CCOCC2)n3	ZINC000000111498	C3CN(c2ncnc(N1CCOCC1)n2)CCO3
Cc3cc(C)n(c2nc(c1ccc(Br)cc1)cs2)n3	ZINC000000052805	c3ccc(c2csc(n1cccn1)n2)cc3
CC3(C)Oc1ccc(C#N)cc1C(n2ccccc2=O)=C3	ZINC000000001030	O=c1ccccn1C2=CCOc3ccccc23
CN2C(C)(C)CC(=NOC(=O)c1ccccc1)CC2(C)C	ZINC000000053007	O=C(ON=C1CCNCC1)c2ccccc2
Fc4ccc3n(c2nc1cccc(F)c1o2)c(=O)[nH]c3c4	ZINC000000021902	O=c2[nH]c1ccccc1n2c4nc3ccccc3o4
CCOc2cc(\C=c1/[nH]c(=S)[nH]c1=O)cc(Br)c2O	ZINC000000182800	O=c1[nH]c(=S)[nH]c1=Cc2ccccc2
O=C(CCn2c(=O)c1ccccc1c2=O)NC3CCCCCC3	ZINC000000044503	O=C(CCn2c(=O)c1ccccc1c2=O)NC3CCCCCC3
OC(=O)[C@@H](Cc1cccnc1)[P@@](O)(O)=O	ZINC000028866169	c1ccncc1
O[C@@H](CNC1CCCCC1)Cn3cnc2cc(Cl)c(Cl)cc2c3=O	ZINC000000629737	O=c2n(CCCNC1CCCCC1)cnc3ccccc23
Cc1ncc(N(=O)=O)n1Cc2ccc(Cl)cc2	ZINC000000034931	C(c1ccccc1)n2ccnc2
Cc3ccc(NC(=O)Cn2nnc(c1ccccc1)n2)c(C)c3	ZINC000000034932	O=C(Cn2nnc(c1ccccc1)n2)Nc3ccccc3
O=N(=O)c1ccccc1Sc3c(c2ccccc2)nc4ncccn34	ZINC000000189836	S(c1ccccc1)c3c(c2ccccc2)nc4ncccn34
CS(=O)(=O)Nc1cccc(C(N)=O)c1O	ZINC000095721010	c1ccccc1
COc1ccc(Cl)cc1NC(=O)c2ccccc2OC(C)=O	ZINC000000060691	O=C(Nc1ccccc1)c2ccccc2
Nc2nc(NC(=O)c1ccco1)nn2c3ccccc3	ZINC000000085556	O=C(Nc2ncn(c1ccccc1)n2)c3ccco3
CC(=O)Oc1ccccc1C(=O)N3CCN(c2ccc(F)cc2)CC3	ZINC000000060693	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
Nc1ccc3c(=O)[nH]c(=O)c2cccc1c23	ZINC000000008558	O=c1[nH]c(=O)c3cccc2cccc1c23
Clc1ccccc1Cn3cnc2ccc(Br)cc2c3=O	ZINC000000351753	O=c2n(Cc1ccccc1)cnc3ccccc23
FC(F)Oc2ccc(C(=O)Nc1c(Cl)cncc1Cl)cc2OC(F)F	ZINC000000592416	O=C(Nc1ccncc1)c2ccccc2
O=C(Cc1ccccc1)Nc4ccc(c3nnc(c2ccco2)o3)cc4	ZINC000000094605	O=C(Cc1ccccc1)Nc4ccc(c3nnc(c2ccco2)o3)cc4
OC(=O)c4ccc(COC(=O)[C@@H]2[C@H](Cc1ccccc1)C(=O)N2C(=O)Cc3cccc(C(O)=O)c3)cc4	ZINC000013862664	O=C(Cc1ccccc1)N4C(C(=O)OCc2ccccc2)C(Cc3ccccc3)C4=O
OC(=O)C[C@H]1CS(=O)(=O)C[C@H]1CC(O)=O	ZINC000004899356	O=S1(=O)CCCC1
CSc3nc2c1ccccc1n(C(C)=O)c2n3Cc4ccccc4	ZINC000000054277	C(c1ccccc1)n3cnc4c2ccccc2[nH]c34
Clc3ccc(c2noc(C1CCNCC1)n2)cc3	ZINC000000112709	C3CC(c2nc(c1ccccc1)no2)CCN3
Cc2nn(C)c(Oc1cccc(C(F)(F)F)c1)c2C(O)=O	ZINC000000167574	O(c1ccccc1)c2ccn[nH]2
OC(=O)COCc1n[nH]c(=O)[nH]1	ZINC000042040643	O=c1[nH]cn[nH]1
Cc3ccc2ncnc(Oc1ncccc1NC(=O)C(C)(C)C)c2c3	ZINC000000079000	O(c1ccccn1)c2ncnc3ccccc23
Clc4ccc3nc(CSc2nc1ccccc1s2)cn3c4	ZINC000000081017	C(Sc2nc1ccccc1s2)c4cn3ccccc3n4
Cc3cc(N1CCOCC1)c2c(N)c(C)cc(C)c2n3	ZINC000000183367	C3CN(c1ccnc2ccccc12)CCO3
COc2cc(S(=O)(=O)Nc1ccc(C(=O)NCC(O)=O)cc1)ccc2NC(C)=O	ZINC000003888294	O=S(=O)(Nc1ccccc1)c2ccccc2
CC(=O)Nn1cnc(=O)c(C#N)c1	ZINC000000001142	O=c1cc[nH]cn1
Cc2cc(\C=C\c1cccs1)cc(C)c2O	ZINC000000004311	C(=Cc1cccs1)c2ccccc2
FC(F)(F)c2cc(NCC[C@@H]1CCCCN1)cc(C(F)(F)F)c2	ZINC000000068075	C2CCC(CCNc1ccccc1)NC2
Nc3n[nH]c(CC(=O)NC2(C(=O)Nc1ccccc1)CCCCC2)n3	ZINC000000054478	O=C(Cc1ncn[nH]1)NC3(C(=O)Nc2ccccc2)CCCCC3
COc3ccc2[C@@H](Nc1cc(C)ccc1C)OC(=O)c2c3OC	ZINC000000050366	O=C2OC(Nc1ccccc1)c3ccccc23
Cc2ccc(C(=O)\C=C\Sc1cc(Cl)ccc1Cl)cc2	ZINC000000133703	O=C(C=CSc1ccccc1)c2ccccc2
CN1CCc3c(C1)c2ccccc2n3C	ZINC000000036609	C3Cc2[nH]c1ccccc1c2CN3
FC(F)(F)c4cccc(c3noc(c2ccc1n(=O)onc1c2)n3)c4	ZINC000000161247	O=n3onc4cc(c2nc(c1ccccc1)no2)ccc34
COc3cccc(C(=O)Oc2ccc(OCc1ccccc1)cc2)c3	ZINC000000060051	O=C(Oc2ccc(OCc1ccccc1)cc2)c3ccccc3
CC(=O)c2ccc(NC(=O)COc1cc(C)cc(C)c1)cc2	ZINC000000044438	O=C(COc1ccccc1)Nc2ccccc2
OC(=O)Cn2c(=O)c(=C/c1ccccc1F)/sc3ccccc23	ZINC000000216733	O=c2[nH]c1ccccc1sc2=Cc3ccccc3
Cc1ccccc1c4cc(NC(=O)C3Cc2ccccc2C3)n[nH]4	ZINC000000010039	O=C(Nc2cc(c1ccccc1)[nH]n2)C4Cc3ccccc3C4
CCN(CC)C(=O)Cc1ccc(Br)cc1	ZINC000000030607	c1ccccc1
C[N@@](Cc1ccccc1)[C@@H]3CC(=O)N(c2ccc(F)cc2)C3=O	ZINC000000060583	O=C2CC(NCc1ccccc1)C(=O)N2c3ccccc3
Brc2cc(c1ccccn1)sc2Sc3ccccc3	ZINC000000149030	S(c1ccccc1)c3ccc(c2ccccn2)s3
CN(C)S(=O)(=O)N(C)c1ccccc1	ZINC000000030602	c1ccccc1
Cc4ccc3oc(c1ccccc1)c/c(=N\CCN2CCOCC2)c3c4	ZINC000000148576	C4CN(CCN=c2cc(c1ccccc1)oc3ccccc23)CCO4
Cc2nnc3n(N)c(=O)c(C=C(O)c1ccc(F)cc1)nn23	ZINC000000408326	O=c2[nH]c1nncn1nc2C=Cc3ccccc3
COc3ccc(S(=O)(=O)Nc2ccc(S(=O)(=O)Nc1onc(C)c1C)cc2)cc3N	ZINC000019419325	O=S(=O)(Nc2ccc(S(=O)(=O)Nc1ccno1)cc2)c3ccccc3
CS(=O)(=O)Nc1cc(Br)c(O)c(Br)c1	ZINC000000254936	c1ccccc1
Cc1[nH][nH]c(=O)c1[C@H](C(C#N)C#N)c2ccncc2	ZINC000000048735	O=c1[nH][nH]cc1Cc2ccncc2
OC(=O)[C@H]1CC(C(O)=O)=NN1c2ccccc2	ZINC000012732087	C2CN(c1ccccc1)N=C2
CC1(C)CC(=NO)CC(C)(C)N1OC(=O)c2ccco2	ZINC000000036868	N=C2CCN(OC(=O)c1ccco1)CC2
Clc3cc2c1CCCc1c(=O)oc2cc3OC(=O)C4CCCCC4	ZINC000000091074	O=C(Oc3ccc2c1CCCc1c(=O)oc2c3)C4CCCCC4
Cc3cc(=O)n(CCOc2ccc1ccccc1c2)[nH]3	ZINC000000001764	O=c1cc[nH]n1CCOc3ccc2ccccc2c3
COc2cc(NS(=O)(=O)c1ccc(C)cc1)c(C(C)=O)cc2OC	ZINC000000503806	O=S(=O)(Nc1ccccc1)c2ccccc2
Cc2ccc1ccccc1c2CON	ZINC000000001767	c2ccc1ccccc1c2
C3NC[C@]4(c2ccc1ccccc1c2)OC[C@H]3O4	ZINC000000001768	C3NCC4(c2ccc1ccccc1c2)OCC3O4
O=C2OC[C@H](c1ccccc1)N2C(=O)\C=C\c3ccccc3	ZINC000000044217	O=C2OCC(c1ccccc1)N2C(=O)C=Cc3ccccc3
CCc4ccc(N3[C@@H](c1ccc(C)cc1)Nc2ccccc2C3=O)cc4	ZINC000000063567	O=C3N(c1ccccc1)C(c2ccccc2)Nc4ccccc34
OCc2cccc(/N=C/c1cccc(O)c1O)c2	ZINC000000064972	C(=Nc1ccccc1)c2ccccc2
NC(=O)c3cccc(n2c(=O)c1ccccc1c2=O)c3	ZINC000000066045	O=c2n(c1ccccc1)c(=O)c3ccccc23
C[C@@H](NC(=O)Nc1cc(F)cc(F)c1)C2CCCCC2	ZINC000000023542	O=C(NCC1CCCCC1)Nc2ccccc2
Brc2ccc(NC(=O)Cc1ccc(N(=O)=O)cc1)nc2	ZINC000000043535	O=C(Cc1ccccc1)Nc2ccccn2
Cc2cccc(OCC(=O)Nc1ccc(Br)cn1)c2C	ZINC000000036265	O=C(COc1ccccc1)Nc2ccccn2
Nc3nc(N)c2nc(c1ccco1)c(N)nc2n3	ZINC000000001499	c3coc(c2cnc1ncncc1n2)c3
Oc1c(Br)cc(Br)c(O)c1Br	ZINC000000407087	c1ccccc1
O=c2[nH]c(=O)n(N1CCCCC1)cc2C#N	ZINC000000167820	O=c2ccn(N1CCCCC1)c(=O)[nH]2
COc4ccc(C3=[N+]1CCCCN1[C@@](O)(c2ccc(OC)cc2)C3)cc4	ZINC000000637382	C4CC[N+]3=C(c1ccccc1)CC(c2ccccc2)N3C4
CN4CCN(c3nc(NCc1ccco1)c2ccccc2n3)CC4	ZINC000000315706	C4CN(c3nc(NCc1ccco1)c2ccccc2n3)CCN4
CC1(C)CC(=O)C2=C(C1)NC5=C(C2c4ccc(OCc3ccccc3)cc4)C(=O)CC(C)(C)C5	ZINC000000627427	O=C1CCCC5=C1C(c3ccc(OCc2ccccc2)cc3)C4=C(CCCC4=O)N5
CCc3ccc(NC2=NC(=O)C[C@@H](C(=O)c1ccccc1)N2)cc3	ZINC000000528409	O=C3CC(C(=O)c1ccccc1)NC(Nc2ccccc2)=N3
Cc3cc(NS(=O)(=O)c2cc(C(=O)Nc1ccccc1)ccc2Br)no3	ZINC000000990413	O=C(Nc1ccccc1)c3cccc(S(=O)(=O)Nc2ccon2)c3
CCN3CCN(c2nc1n(C)c(=O)[nH]c(=O)c1n2CC(C)=C)CC3	ZINC000000551596	O=c3[nH]c(=O)c2[nH]c(N1CCNCC1)nc2[nH]3
CC(=O)Nc3ccc(N2C(=O)C[C@H](N1CCCC1)C2=O)cc3	ZINC000000121686	O=C2CC(N1CCCC1)C(=O)N2c3ccccc3
O[C@]4(c1cccc(Cl)c1)C2=NCCCN2c3ccccc34	ZINC000000000142	C4CN=C3C(c1ccccc1)c2ccccc2N3C4
CC2=CC(C)(C)N(Cc1ccc(N(=O)=O)cc1)c3ccccc23	ZINC000000044758	C2C=Cc1ccccc1N2Cc3ccccc3
C[C@@H]1CCc3c(C1)sc4ncnc(Nc2ccc(C)c(C)c2)c34	ZINC000000089271	C1CCc3c(C1)sc4ncnc(Nc2ccccc2)c34
COc1ccccc1N3CCN(C(=O)Nc2cc(F)ccc2C)CC3	ZINC000000112380	O=C(Nc1ccccc1)N3CCN(c2ccccc2)CC3
Cn2c(SCCN1CCCCC1)nc3n(C)c(=O)[nH]c(=O)c23	ZINC000000351096	O=c3[nH]c(=O)c2[nH]c(SCCN1CCCCC1)nc2[nH]3
CCOc3ccc(C(=O)OC1C[C@@H]2CCC[C@H](C1)[N+]2(C)C)cc3	ZINC000000526596	O=C(OC1CC2CCCC(C1)N2)c3ccccc3
C[C@H](CCN(C)C)Nc1cc(O)cc2cccnc12	ZINC000000000148	c2ccc1ncccc1c2
O=N(=O)c3ccc(CSc2nc1CCCCCc1cc2C#N)cc3	ZINC000000103134	C3CCc2ccc(SCc1ccccc1)nc2CC3
COc2ccc(c1c(C#N)[nH]c(=O)[nH]c1=O)cc2	ZINC000000058766	O=c2[nH]cc(c1ccccc1)c(=O)[nH]2
CN(C)c3ccc([N+](=O)Cc1cccc2nsnc12)cc3	ZINC000000240910	O=[N+](Cc1cccc2nsnc12)c3ccccc3
CC(C)NC[C@H](O)COc2ccc(\C=C\c1cc(C)no1)cc2	ZINC000000073965	C(=Cc1ccno1)c2ccccc2
C[N@]1CCc3c(C1)sc(NC(=S)Nc2ccccc2)c3C#N	ZINC000000156000	S=C(Nc1ccccc1)Nc3cc2CCNCc2s3
OC(=O)[C@@]1(Cl)C(Cl)=C(Cl)[C@]1(Cl)C(O)=O	ZINC000002518906	C1CC=C1
CCOC(=O)COc2ccc1c(C)c(CCN(CC)CC)c(=O)oc1c2Cl	ZINC000000576842	O=c2ccc1ccccc1o2
Cc3cc(C)nc(NS(=O)(=O)c2ccc(NC(=O)Nc1ccc(C)c(Cl)c1)cc2)n3	ZINC000001033575	O=C(Nc1ccccc1)Nc3ccc(S(=O)(=O)Nc2ncccn2)cc3
COc1ccccc1N5CCN(CCn4cnc3sc2C[N@@](C)CCc2c3c4=O)CC5	ZINC000000591024	O=c4n(CCN2CCN(c1ccccc1)CC2)cnc5sc3CNCCc3c45
Cc3nnc(SCC(=O)Nc2ccc1OCCOc1c2)n(N)c3=O	ZINC000000392204	O=C(CSc1nncc(=O)[nH]1)Nc3ccc2OCCOc2c3
CCn3ccc(C(=O)Nn2c(=S)[nH]c1ccccc1c2=O)n3	ZINC000002793135	O=C(Nn2c(=S)[nH]c1ccccc1c2=O)c3cc[nH]n3
Cc4ccc(n3nc2ccc(NC(=O)c1ccccc1F)cc2n3)cc4	ZINC000000076804	O=C(Nc3ccc2nn(c1ccccc1)nc2c3)c4ccccc4
OC(=O)CCC(=O)N1CC[C@@H](C(O)=O)C1	ZINC000261535799	C1CCNC1
CC1(C)[C@@H]6CC[C@@]1(CS(=O)(=O)N2CCC4(CC2)C=Cc3ccccc34)[C@@](O)(CCNC(=O)Cc5nn[nH]n5)C6	ZINC000027322184	O=C(Cc1nn[nH]n1)NCCC2CC6CCC2(CS(=O)(=O)N3CCC5(CC3)C=Cc4ccccc45)C6
COc1ccccc1CC(=O)Nc2cc(Cl)ccc2C	ZINC000000030315	O=C(Cc1ccccc1)Nc2ccccc2
OC(=O)c1nccnc1NC(=O)c2ccc(Cl)cc2	ZINC000000040508	O=C(Nc1cnccn1)c2ccccc2
Cc4cc3nc(c2cc(NC(=O)Cc1ccc(Cl)cc1)ccc2O)oc3cc4C	ZINC000000722931	O=C(Cc1ccccc1)Nc4cccc(c3nc2ccccc2o3)c4
CC(C)C(=O)Nc1cccc(NC(C)=O)c1	ZINC000000029809	c1ccccc1
C[C@H]2CC(=O)N1CCSC1=N2	ZINC000000000560	O=C1CCN=C2SCCN12
CC2=CC(C)(C)N(S(=O)(=O)c1ccc(C)cc1)c3cc(C)ccc23	ZINC000000055091	O=S(=O)(N1CC=Cc2ccccc12)c3ccccc3
CC(C)c2oc1ccccc1c2C(=O)c3ccncc3	ZINC000000001569	O=C(c1ccncc1)c2coc3ccccc23
CN1CCCCC/C1=N\CCn2cnc3n(C)c(=O)n(C)c(=O)c23	ZINC000000090157	O=c3[nH]c(=O)c2n(CCN=C1CCCCCN1)cnc2[nH]3
COC(=O)[C@@H]2CS[C@@H](c1c(O)c(C)ncc1COP(O)(O)=O)N2	ZINC000001608323	C2CSC(c1ccncc1)N2
O=N(=O)c2cc1OCOc1cc2CN4CCC(N3CCCCC3)CC4	ZINC000000212351	C4CCN(C3CCN(Cc2ccc1OCOc1c2)CC3)CC4
O/N=C/c2ccc1ccccc1c2O	ZINC000000025884	c2ccc1ccccc1c2
CC(C)c2ccc(OCC(=O)c1ccc(O)cc1O)cc2	ZINC000000043984	O=C(COc1ccccc1)c2ccccc2
CC(=O)OCCn2c(C)[n+](c1ccccc1)c3ccc(Cl)cc23	ZINC000000357757	c3ccc([n+]1c[nH]c2ccccc12)cc3
CN(C)c3ccc(C(=O)N1CCCc2ccccc12)cc3	ZINC000000030046	O=C(N1CCCc2ccccc12)c3ccccc3
FC(F)(F)c1cc(N(=O)=O)ccc1SCc2ccc(Cl)cc2	ZINC000000090396	C(Sc1ccccc1)c2ccccc2
CC(=O)Nc4ccc(c3c[n+]2cc(Sc1ccccc1)ccc2n3C)cc4	ZINC000000631626	S(c1ccccc1)c4ccc3[nH]c(c2ccccc2)c[n+]3c4
Cc3ccc(CNC(=O)Nc2ccc(OCc1ccccc1)cc2)n3C	ZINC000000157976	O=C(NCc1ccc[nH]1)Nc3ccc(OCc2ccccc2)cc3
C(Oc1ccccc1c3nc2ccccc2[nH]3)c4cccnc4	ZINC000000011046	C(Oc1ccccc1c3nc2ccccc2[nH]3)c4cccnc4
Fc3ccc(NC(=O)c2ccc1OCOc1c2)cc3Cl	ZINC000000035560	O=C(Nc1ccccc1)c3ccc2OCOc2c3
S=c3[nH]nc(Cn2nnc(c1ccccc1)n2)n3c4ccccc4	ZINC000000029102	S=c3[nH]nc(Cn2nnc(c1ccccc1)n2)n3c4ccccc4
NS(=O)(=O)c3cc([C@]2(O)NC(=O)c1ccccc12)ccc3Cl	ZINC000000020253	O=C2NC(c1ccccc1)c3ccccc23
COc1ccc(C(\C)=N\O)c(OC)c1OC	ZINC000000025880	c1ccccc1
Cc2nnc3[nH]c(c1cc(N(=O)=O)c(Cl)cc1Cl)nn23	ZINC000000036434	c3ccc(c2nn1cnnc1[nH]2)cc3
NC(=O)C(/CCCCC(O)=O)=N\O	ZINC000004361592	nonring
Cc3oc2cc(OCc1ccc(F)cc1)ccc2c(=O)c3c5ccc4OCCCOc4c5	ZINC000000627645	O=c4c(c2ccc1OCCCOc1c2)coc5cc(OCc3ccccc3)ccc45
NC(=S)N/N=C/c1ccc(Cl)c(N(=O)=O)c1	ZINC000000046216	c1ccccc1
Brc2ccc(\C=N\c1ccccc1C#N)cc2N(=O)=O	ZINC000000062180	C(=Nc1ccccc1)c2ccccc2
OC(=O)c5ccc(N4[C@@H](c1cccs1)c2c(n[nH]c2c3ccccc3)C4=O)cc5	ZINC000000626683	O=C3N(c1ccccc1)C(c2cccs2)c4c3n[nH]c4c5ccccc5
COc2ccc(C(=O)Nc1ccncc1)cc2OC3CCCC3	ZINC000000017859	O=C(Nc1ccncc1)c3cccc(OC2CCCC2)c3
CC(C)N(CC(O)=O)C(=O)C(O)=O	ZINC000071780996	nonring
CCOC(=O)CNC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(=O)NCC(=O)OCC	ZINC000008399509	nonring
COc3nc(n1nc(C)cc1C)nc(n2nc(C)cc2C)n3	ZINC000000034359	c3cnn(c2ncnc(n1cccn1)n2)c3
C[C@@H]3CN(C(=O)c2ccc(NS(=O)(=O)c1cc(C)ccc1C)cc2)C[C@@H](C)O3	ZINC000000631024	O=C(N1CCOCC1)c3ccc(NS(=O)(=O)c2ccccc2)cc3
CC(=O)N[C@H]1CCc2ccccc12	ZINC000000006421	C2Cc1ccccc1C2
CN2C(=O)CN=C(c1ccccc1)c3cc(Cl)ccc23	ZINC000000006427	O=C3CN=C(c1ccccc1)c2ccccc2N3
Cc3cccc(n1c(CCC(O)=O)ccc1c2cccs2)c3	ZINC000000037738	c3ccc(n1cccc1c2cccs2)cc3
OC(=O)C[C@@H](C(O)=O)n3c(=S)s/c(=c1\c(=O)[nH]c2ccccc12)c3=O	ZINC000002293258	O=c1[nH]c(=S)sc1=c2c(=O)[nH]c3ccccc23
Cc3ccc(NC(=O)CSc2nc1c(N)ncnc1[nH]2)cc3	ZINC000000034128	O=C(CSc2nc1cncnc1[nH]2)Nc3ccccc3
CCOc2ccc(C(=O)N1C[C@@H](C)O[C@H](C)C1)cc2OCC	ZINC000000030135	O=C(N1CCOCC1)c2ccccc2
CC(C)[C@H](N)C(=O)N1CCN(C(=O)C[C@@H](C)CC(C)(C)C)[C@H](C)C1	ZINC000000252099	C1CNCCN1
Cc1ccsc1\C=N\c3ccc(/N=C/c2sccc2C)cc3	ZINC000000047181	C(=Nc2ccc(N=Cc1cccs1)cc2)c3cccs3
CC(C)[C@@](C)(NC(=O)c1cccnc1Oc2ccc(F)cc2)C(N)=O	ZINC000000052207	O(c1ccccc1)c2ccccn2
CC(C)(C)c2ccc(OC(=O)c1ccc(N(=O)=O)s1)cc2	ZINC000000076217	O=C(Oc1ccccc1)c2cccs2
CC1Cn3n(C1)c(=O)c2ccccc2c3=O	ZINC000000031952	O=c2n1CCCn1c(=O)c3ccccc23
CCOC(=O)c2c(N)n(CCN(C)C)c3nc1ccccc1nc23	ZINC000000148197	c3ccc2nc1[nH]ccc1nc2c3
CCCC(=O)c1cc(F)ccc1OC[C@H](O)CNC(C)(C)C	ZINC000000000112	c1ccccc1
CCCc2ccc(OCC(=O)Nc1nccs1)cc2	ZINC000000031957	O=C(COc1ccccc1)Nc2nccs2
CN3CCC(c1c[nH]c2ccc(O)cc12)CC3	ZINC000000007339	C3CC(c1c[nH]c2ccccc12)CCN3
Cc3ccc(N2C(=O)C[C@H](NCCc1ccc(F)cc1)C2=O)cc3	ZINC000000084266	O=C2CC(NCCc1ccccc1)C(=O)N2c3ccccc3
Cc4sc(NC(=O)c1ccco1)c([C@@H](N2CCCCC2)c3ccccn3)c4C	ZINC000000630637	O=C(Nc1sccc1C(N2CCCCC2)c3ccccn3)c4ccco4
Cc3ccc(S(=O)(=O)N2CCC(N1CCCCCC1)CC2)cc3	ZINC000000317257	O=S(=O)(N2CCC(N1CCCCCC1)CC2)c3ccccc3
CC2(C)N(CC#N)C(=O)N(c1ccc(C#N)c(C(F)(F)F)c1)C2=O	ZINC000000007332	O=C1CNC(=O)N1c2ccccc2
C[C@H](N(C)c1n[nH]c(=O)[nH]c1=O)C(O)=O	ZINC000054054473	O=c1cn[nH]c(=O)[nH]1
COc3ccc(CC1=NCCc2cc(OC)c(OC)cc12)cc3	ZINC000000006201	C3Cc1ccccc1C(Cc2ccccc2)=N3
Fc5ccc4[C@@H]2Sc1ccccc1C(=O)C2=C(c3ccccc3)c4c5	ZINC000000105071	O=C4C3=C(c1ccccc1)c2ccccc2C3Sc5ccccc45
C/C=C(/C)C(=O)O[C@@H]1Cc2c(OC1(C)C)ccc3ccc(=O)oc23	ZINC000000028040	O=c3ccc2ccc1OCCCc1c2o3
CCOC(=O)C1=C(C)NC(=O)N[C@@H]1c2ccc(Cl)c(Cl)c2	ZINC000000064590	O=C2NC=CC(c1ccccc1)N2
Cc3cccn4c(NC(=O)c1ccc(F)cc1)c(c2ccccc2)nc34	ZINC000000064520	O=C(Nc2c(c1ccccc1)nc3ccccn23)c4ccccc4
COC(=O)c2cc(NS(=O)(=O)c1ccccc1)cc(C(=O)OC)c2	ZINC000000102623	O=S(=O)(Nc1ccccc1)c2ccccc2
CC(C)CC(=O)N2CCN(c1ccc(F)cc1)CC2	ZINC000000030550	C2CN(c1ccccc1)CCN2
Nc1cc([S@](O)=O)ccc1S(O)(=O)=O	ZINC000165342054	c1ccccc1
C[C@@H]3CN(S(=O)(=O)CCNC(=O)c2cc(NS(=O)(=O)c1cccc(N(=O)=O)c1)ccc2O)C[C@@H](C)O3	ZINC000102798372	O=C(NCCS(=O)(=O)N1CCOCC1)c3cccc(NS(=O)(=O)c2ccccc2)c3
NC(=O)CCNC23CC1CC(CC(C1)C2)C3	ZINC000000034638	C1C2CC3CC1CC(C2)C3
COC(=O)c1c(C)[nH]c(C)c1c2ccc(OC)cc2	ZINC000000050977	c2ccc(c1cc[nH]c1)cc2
CCNC(=S)NCc1ccc(C(O)=O)cc1	ZINC000000034634	c1ccccc1
Cc1nn(C(C)(C)C)c(C)c1C=NOC(=O)Nc2ccc(Cl)cc2	ZINC000000139949	O=C(Nc1ccccc1)ON=Cc2cn[nH]c2
OC3CCN(C[C@@H](O)COc2cccc(CN1CCSCC1)c2)CC3	ZINC000011880093	C3CCN(CCCOc2cccc(CN1CCSCC1)c2)CC3
COCCn1c(O)c(F)c(=O)[nH]c1=O	ZINC000159066912	O=c1cc[nH]c(=O)[nH]1
CN(C(=O)c1ccccc1)c2ccccc2	ZINC000000029212	O=C(Nc1ccccc1)c2ccccc2
CC(=O)Oc3cccc(\C=c2/nc(c1ccc(Cl)cc1)oc2=O)c3	ZINC000000047451	O=c2oc(c1ccccc1)nc2=Cc3ccccc3
CCOc2ccc(S(=O)(=O)NCc1ccco1)c3ccccc23	ZINC000000051407	O=S(=O)(NCc1ccco1)c2cccc3ccccc23
Cc2n(C)c1ccccc1[n+]2C[C@@H](O)COC3CCCCC3	ZINC000000110086	C3CCC(OCCC[n+]1c[nH]c2ccccc12)CC3
Cc3c(OC(=O)c1ccco1)ccc4c(c2ccccc2)cc(=O)oc34	ZINC000000090979	O=C(Oc3ccc2c(c1ccccc1)cc(=O)oc2c3)c4ccco4
C3COc2cnc1ccccc1c2N3	ZINC000000002542	C3COc2cnc1ccccc1c2N3
NC(=O)N(O)[C@H]1CCn2c1cc3ccccc23	ZINC000000016418	C3Cc2cc1ccccc1n2C3
CCO[C@H]1CCC(=O)N1S(=O)(=O)c2ccccc2	ZINC000000002308	O=C1CCCN1S(=O)(=O)c2ccccc2
Fc3ccc(c2nnc(SCC(=O)NCc1cccs1)o2)cc3	ZINC000000415881	O=C(CSc2nnc(c1ccccc1)o2)NCc3cccs3
Fc3ccc(Nc2nc(=O)c(=Cc1ccc(N(=O)=O)cc1)s2)cc3	ZINC000000101371	O=c2nc(Nc1ccccc1)sc2=Cc3ccccc3
Cc1ccccc1NC(=O)c2cc(N(=O)=O)n[nH]2	ZINC000000031170	O=C(Nc1ccccc1)c2ccn[nH]2
COc4ccc([C@H]2N(c1ccccn1)C(=O)C(O)=C2C(=O)c3ccc(Cl)cc3)cc4	ZINC000000836256	O=C3C=C(C(=O)c1ccccc1)C(c2ccccc2)N3c4ccccn4
Cc2nc1C(=C)CSCc1c(=O)[nH]2	ZINC000000025974	C=C1CSCc2c1nc[nH]c2=O
O=c2[nH]cnc1CCSCc12	ZINC000000025972	O=c2[nH]cnc1CCSCc12
Cc2nnc(SCC(=O)Nc1ccc(F)cc1)s2	ZINC000000031556	O=C(CSc1nncs1)Nc2ccccc2
COc1ccc(Cl)cc1NC(=O)Cn2nc(C(F)(F)F)cc2C	ZINC000000103663	O=C(Cn1cccn1)Nc2ccccc2
C[N@]1CCc2c(C1)nnn2c3ccccc3	ZINC000000034254	C1Cc2c(CN1)nnn2c3ccccc3
O=C(COC(=O)C2c1ccccc1Oc3ccccc23)c4ccccc4	ZINC000000066507	O=C(COC(=O)C2c1ccccc1Oc3ccccc23)c4ccccc4
CCOC(=O)CSc2c(c1ccc(Cl)cc1)[nH]c3ccccc23	ZINC000000054910	c3ccc(c2cc1ccccc1[nH]2)cc3
CCOc1ccc(C)cc1S(=O)(=O)Nc2ccc(F)cc2	ZINC000000384723	O=S(=O)(Nc1ccccc1)c2ccccc2
CCOc1ccc(C(F)(F)F)cc1NS(=O)(=O)c2ccc(NC(C)=O)cc2	ZINC000000643482	O=S(=O)(Nc1ccccc1)c2ccccc2
Cc1ccccc1NC(=O)c4sc3nc2CCCCc2cc3c4N	ZINC000000099195	O=C(Nc1ccccc1)c4cc3cc2CCCCc2nc3s4
Cn2ncc3c(=NN1C(=O)CCC1=O)[nH]cnc23	ZINC000000116964	O=C1CCC(=O)N1N=c2[nH]cnc3[nH]ncc23
OC(=O)[C@H](CS)NC(=O)C(O)=O	ZINC000005131762	nonring
Fc4ccc(C(=O)n1nccc1c3csc(c2ccccc2)n3)cc4	ZINC000000122588	O=C(c1ccccc1)n2nccc2c4csc(c3ccccc3)n4
Cc3n[nH]c(SCC(=O)Nc2nc(c1ccccc1)cs2)n3	ZINC000000051943	O=C(CSc1ncn[nH]1)Nc3nc(c2ccccc2)cs3
Brc3ccc(c2noc(c1ccc(N(=O)=O)cc1)n2)cc3	ZINC000000080665	c3ccc(c2noc(c1ccccc1)n2)cc3
COc1ccccc1[C@@H](Nc2ccccc2)c3c(C)[nH]c4ccccc34	ZINC000000506054	N(C(c1ccccc1)c2c[nH]c3ccccc23)c4ccccc4
Cc2ccc(NC(=O)C(=S)N1CCOCC1)cc2	ZINC000000053556	O=C(Nc1ccccc1)C(=S)N2CCOCC2
CCNc1cc(S(=O)(=O)C(F)(F)F)ccc1N	ZINC000000065754	c1ccccc1
OC(=O)Cc1cnc(NC#N)[nH]c1=O	ZINC000072324064	O=c1ccnc[nH]1
CC3CCN(c2oc(c1ccc(Cl)cc1)nc2C#N)CC3	ZINC000000065759	C3CCN(c2cnc(c1ccccc1)o2)CC3
C[C@]12CCCC(=C)[C@@H]1C[C@@H]3[C@H](C2)OC(=O)C3=C	ZINC000000028276	C=C3CCCC2CC1OC(=O)C(=C)C1CC23
CNc1ccc(S(O)(=O)=O)cc1C(O)=O	ZINC000005318852	c1ccccc1
CC(=O)Nc3cc2[nH]c1nc(=O)[nH]c(=O)c1nc2cc3C	ZINC000000208308	O=c3nc2[nH]c1ccccc1nc2c(=O)[nH]3
CN(C)CCNC(=O)N2CCN(c1ccccc1Cl)CC2	ZINC000000024590	C2CN(c1ccccc1)CCN2
CC3(C)CCC(C)(C)c2cc(NC(=O)c1ccc(C(O)=O)cc1)ccc23	ZINC000000538415	O=C(Nc2ccc1CCCCc1c2)c3ccccc3
Nn2c(SCC(O)=O)nc1ccccc1c2=O	ZINC000001861404	O=c1[nH]cnc2ccccc12
Cc4ccc([C@H]1SCCN1C(=O)c3ccc2ccccc2c3)c(C)c4	ZINC000000328943	O=C(N1CCSC1c2ccccc2)c4ccc3ccccc3c4
COC(=O)C=C(O)c1ccc(Cl)cc1	ZINC000000153862	c1ccccc1
CCN(CC)S(=O)(=O)c2csc(C(=O)Nc1ccccc1)c2	ZINC000000060877	O=C(Nc1ccccc1)c2cccs2
CC(=O)c2cccc(NC(=O)COc1cc(C)c(Cl)c(C)c1)c2	ZINC000000063635	O=C(COc1ccccc1)Nc2ccccc2
O[C@]3([C@H]1CCCCCC1=O)C(=O)Nc2ccccc23	ZINC000000042016	O=C1CCCCCC1C2C(=O)Nc3ccccc23
CC(C)(C(=O)c1cccnc1)c2cccnc2	ZINC000000001728	O=C(Cc1cccnc1)c2cccnc2
COc1ccccc1c2cc(CC(C)C)nc(C#N)c2N	ZINC000000033554	c2ccc(c1ccncc1)cc2
CSc1ncc(C(O)=O)c(=O)[nH]1	ZINC000005012407	O=c1ccnc[nH]1
Nc2ncc(Br)c(N1CCOCC1)n2	ZINC000000015508	C2CN(c1ccncn1)CCO2
Clc4ccc(\C=C3/COc2ccc1ccccc1c2C3=O)cc4	ZINC000000367424	O=C3C(=Cc1ccccc1)COc4ccc2ccccc2c34
COc4ccc(C(=O)Nc3cccc(c2nc1ccccc1o2)c3)cc4	ZINC000000072570	O=C(Nc3cccc(c2nc1ccccc1o2)c3)c4ccccc4
CCc2nc(SCC(=O)OCc1ccccc1)c(C#N)cc2C	ZINC000000049870	O=C(CSc1ccccn1)OCc2ccccc2
OC(=O)Cc3ccc(NC=c2c(=O)[nH]c(=O)n(Cc1ccco1)c2=O)cc3	ZINC000004486173	O=c2[nH]c(=O)c(=CNc1ccccc1)c(=O)n2Cc3ccco3
Cn2c(=O)[nH]c(=O)/c(=C\C=C\c1ccco1)c2=O	ZINC000000086733	O=c2[nH]c(=O)c(=CC=Cc1ccco1)c(=O)[nH]2
Nc4nc(N)nc(C23CC1CC(CC(C1)C2)C3)n4	ZINC000000023808	C1C3CC4CC1CC(c2ncncn2)(C3)C4
Fc5ccc4[nH]c3c(N2CCN(c1ccccn1)CC2)ncnc3c4c5	ZINC000000536890	C4CN(c2ncnc3c1ccccc1[nH]c23)CCN4c5ccccn5
Brc3ccc2c(=O)n(c1cccc(N(=O)=O)c1)c(=O)c2c3	ZINC000000362419	O=c2n(c1ccccc1)c(=O)c3ccccc23
CNC(=O)c4ccc3cc([C@]2(O)CCn1cncc12)ccc3c4	ZINC000000003322	C2Cn1cncc1C2c4ccc3ccccc3c4
CCc1ccccc1NC(=O)c2cnccn2	ZINC000000035385	O=C(Nc1ccccc1)c2cnccn2
C[C@H](Sc1ncnc2sc(C)c(C)c12)C(O)=O	ZINC000000084919	c2ncc1ccsc1n2
CC(C)(Oc1ccc(Cl)cc1)C(=O)OCc2cccc(CO)n2	ZINC000000001960	O=C(COc1ccccc1)OCc2ccccn2
COc3cc(OC)c(CN2CCC(Cc1ccccc1)CC2)cc3Br	ZINC000000752236	C2CN(Cc1ccccc1)CCC2Cc3ccccc3
Cc3sc2[nH]c(=O)n(C1CCCCC1)c(=O)c2c3C	ZINC000000023359	O=c2[nH]c1sccc1c(=O)n2C3CCCCC3
C2CN(c1ccccc1)CCN2Cc3ccco3	ZINC000000239231	C2CN(c1ccccc1)CCN2Cc3ccco3
O=C(CSc2nnc3sc1ccccc1n23)NCc4ccco4	ZINC000000125910	O=C(CSc2nnc3sc1ccccc1n23)NCc4ccco4
CC1(C)CCC[C@@]2(C)[C@H]1CC=C(C=O)[C@H]2C=O	ZINC000000001969	C2CCC1CC=CCC1C2
CC(C)CO[P@](=O)([C@@H](O)c1cccnc1)c2ccc(N(C)C)cc2	ZINC000000527532	O=P(Cc1cccnc1)c2ccccc2
Clc1ccccc1\C=N\c3c(c2ccco2)nc4ccccn34	ZINC000000047993	C(=Nc2c(c1ccco1)nc3ccccn23)c4ccccc4
COc3ccc(OC)c(NC(=O)\C=C\c1cccc2ccccc12)c3	ZINC000000046466	O=C(Nc1ccccc1)C=Cc2cccc3ccccc23
CCOc2ccc(OCC(=O)Nc1cc(C)c(Cl)cc1OC)cc2	ZINC000000147180	O=C(COc1ccccc1)Nc2ccccc2
CSc1nc(C)cc(C)c1CNC(=O)c2cccc(N(=O)=O)c2C	ZINC000000091821	O=C(NCc1cccnc1)c2ccccc2
Cc3noc(COc1ccccc1OCC[N+]2(C)CCOCC2)c3Cl	ZINC000000622053	C3CN(CCOc1ccccc1OCc2ccno2)CCO3
Oc1ccc(Br)cc1C(=O)c4cnc3c(COc2ccccc23)c4	ZINC000000688089	O=C(c1ccccc1)c4cnc3c(COc2ccccc23)c4
O=C(Nc2ccc(S(=O)(=O)N1CCCCC1)cc2)c3ccccn3	ZINC000000082039	O=C(Nc2ccc(S(=O)(=O)N1CCCCC1)cc2)c3ccccn3
O=c2n(/N=C/c1ccc[nH]1)c(=O)c3ccccc23	ZINC000000062488	O=c2n(N=Cc1ccc[nH]1)c(=O)c3ccccc23
OC(=O)c2ccc(C=c1c(=O)[nH]c(=O)[nH]c1=O)o2	ZINC000069593590	O=c2[nH]c(=O)c(=Cc1ccco1)c(=O)[nH]2
Clc1ccc(NC=C(C#N)C#N)nc1	ZINC000000032394	c1ccncc1
FC(F)(F)c2cccc(CN1CCCCC1)c2	ZINC000000002941	C2CCN(Cc1ccccc1)CC2
COc1ccc(Cl)c2c(O)c(C(O)=O)cnc12	ZINC000000151640	c2ccc1ncccc1c2
CC(=O)Oc1ccccc1OCc2nn(C(C)=O)c3ccccc23	ZINC000000035277	C(Oc1ccccc1)c2n[nH]c3ccccc23
CC(C)CCN([C@H](C)c1ccco1)C(=S)Nc2ccc(C)c(F)c2	ZINC000000263138	S=C(NCc1ccco1)Nc2ccccc2
COc2ccc([C@@H]1C[C@@](O)(C(C)(C)O)ON1)cc2	ZINC000000032807	C2CC(c1ccccc1)NO2
CN(C)CCNC(=O)c2cccc3ccc(c1ccncc1)nc23	ZINC000000024932	c3ccc2nc(c1ccncc1)ccc2c3
CN(C)S(=O)(=O)c2cccc(C(=O)NC(=S)NNS(=O)(=O)c1ccc(Br)cc1)c2	ZINC000003262418	O=C(NC(=S)NNS(=O)(=O)c1ccccc1)c2ccccc2
C1CCc2c(C1)cccc2CC3=NCCN3	ZINC000000002128	C1CCc2c(C1)cccc2CC3=NCCN3
Nc1ccccc1C(=O)NN2CCOCC2	ZINC000000037279	O=C(NN1CCOCC1)c2ccccc2
O=C(c2ccc(S(=O)(=O)c1ccccc1)cc2)n4c3ccccc3sc5ccccc45	ZINC000000625651	O=C(c2ccc(S(=O)(=O)c1ccccc1)cc2)n4c3ccccc3sc5ccccc45
NC(=O)C2CCN(C[C@@H](O)COc1ccc(F)cc1)CC2	ZINC000000118412	C2CCN(CCCOc1ccccc1)CC2
CC(=O)Nc1cc(O)ccc1O	ZINC000000014819	c1ccccc1
C[C@H]4Cc2cc1OCOc1cc2C(c3ccc(N)cc3)=NN4C(C)=O	ZINC000000002121	C4Cc2cc1OCOc1cc2C(c3ccccc3)=NN4
O[C@@H](c1cc(Br)ccc1OCc2ccccc2)c3c(O)[nH]c(=S)[nH]c3=O	ZINC000000687983	O=c1[nH]c(=S)[nH]cc1Cc2ccccc2OCc3ccccc3
COc3ccc(CCNC(=O)c2ccc1ccccc1n2)cc3OC	ZINC000000038351	O=C(NCCc1ccccc1)c3ccc2ccccc2n3
CC(=O)Nc2ccc1c(C)ccnc1c2	ZINC000000002435	c2ccc1ncccc1c2
CCc2c(C)sc(NC(=O)Cc1ccc(N(=O)=O)cc1)c2C(N)=O	ZINC000000375510	O=C(Cc1ccccc1)Nc2cccs2
OC(=O)C4=C(CSc1n[nH]c(=O)s1)CS[C@H]3[C@H](NC(=O)Cn2cnnn2)C(=O)N34	ZINC000010494680	O=C(Cn1cnnn1)NC4C3SCC(CSc2n[nH]c(=O)s2)=CN3C4=O
Nc1nonc1c3noc(Cc2ccc(N(=O)=O)cc2)n3	ZINC000000032734	C(c1ccccc1)c3nc(c2cnon2)no3
C[N@]1[C@H]4CCC[C@@H]1CC(NC(=O)c3cc(C)n(c2ccccc2)n3)C4	ZINC000000005650	O=C(NC1CC2CCCC(C1)N2)c4ccn(c3ccccc3)n4
CCc3cc(=O)oc4cc(C)c2c(c1ccccc1)c(C)oc2c34	ZINC000000489345	O=c4ccc3c(ccc2c(c1ccccc1)coc23)o4
Cc1c(Cl)cccc1NS(=O)(=O)c3ccc(NC(=O)c2ccc(C(C)(C)C)cc2)cc3	ZINC000000658959	O=C(Nc2ccc(S(=O)(=O)Nc1ccccc1)cc2)c3ccccc3
COc2cccc3ccc1c(C#N)cc(N(=O)=O)cc1oc23	ZINC000000034458	c3ccc2oc1ccccc1ccc2c3
CNC3=Nc1ccc(Cl)cc1C(c2ccc[nH]2)=NC3	ZINC000000005304	C3C=Nc1ccccc1C(c2ccc[nH]2)=N3
O=c3cccc2[C@@H]1CNC[C@@H](C1)Cn23	ZINC000000049583	O=c3cccc2C1CNCC(C1)Cn23
C3CN(c2nc(c1ccccc1)cs2)C[C@@H]3c4ccccc4	ZINC000000038352	C3CN(c2nc(c1ccccc1)cs2)CC3c4ccccc4
CCNC(=O)NC(=O)[C@@H](C)OC(=O)CNS(=O)(=O)c1c(Cl)cc(Br)cc1Cl	ZINC000003380246	c1ccccc1
COc3ccc(N(CC(=O)Nc2ccc(S(=O)(=O)Nc1ccc(Br)cc1)cc2)S(C)(=O)=O)c(OC)c3	ZINC000000659869	O=C(CNc1ccccc1)Nc3ccc(S(=O)(=O)Nc2ccccc2)cc3
CC[N+]1(C)[C@H]3CC[C@@H]1CC(OC(=O)[C@H](CO)c2ccccc2)C3	ZINC000000526108	O=C(Cc1ccccc1)OC2CC3CCC(C2)N3
COc2cc(S(=O)(=O)N1CCCCC1)ccc2NC=c4c(=O)[nH]c(=O)n(c3ccc(C)cc3)c4=O	ZINC000008440466	O=c3[nH]c(=O)c(=CNc2ccc(S(=O)(=O)N1CCCCC1)cc2)c(=O)n3c4ccccc4
COc2cc(/C=C/C(=O)Nc1c(C)cccc1C)cc(OC)c2OC	ZINC000000113396	O=C(Nc1ccccc1)C=Cc2ccccc2
COc3ccc(C(=O)c2c1CCNCc1sc2NC(C)=O)cc3	ZINC000000156239	O=C(c1ccccc1)c3csc2CNCCc23
CCn2cc(C(O)=O)c(=O)c3cnc(N1CCCC1)nc23	ZINC000000057461	O=c2cc[nH]c3nc(N1CCCC1)ncc23
COC(=O)CN3[C@@H](c1ccccc1)c2cc(Cl)ccc2N=C3C	ZINC000000069847	N2C=Nc1ccccc1C2c3ccccc3
Cc2cc(C)c(OCC(=O)Nc1cccc(C)c1C)c(C)c2	ZINC000000044845	O=C(COc1ccccc1)Nc2ccccc2
COC(=O)c1c(C)oc4c1cc(NS(=O)(=O)c2cccs2)c3ccccc34	ZINC000000645706	O=S(=O)(Nc2cc1ccoc1c3ccccc23)c4cccs4
COc3ccc(NC(=O)c2c[nH]c1CCCC(=O)c12)cc3	ZINC000000019985	O=C2CCCc3[nH]cc(C(=O)Nc1ccccc1)c23
COC(=O)c3cn(CC(=O)N2CCc1ccccc1C2)c4ccccc34	ZINC000000555262	O=C(Cn1ccc2ccccc12)N4CCc3ccccc3C4
Nc1nc(SCC(O)=O)[nH]c(=O)c1NS(=O)(=O)c2ccccc2	ZINC000008651773	O=c1[nH]cncc1NS(=O)(=O)c2ccccc2
Cc2cc(=O)oc3cc(O[C@@H](C(O)=O)c1ccccc1)ccc23	ZINC000000409113	O=c3ccc2ccc(OCc1ccccc1)cc2o3
CC(=O)NC(=O)c1ccccc1O	ZINC000000002051	c1ccccc1
C=CCc2ccc1OCOc1c2	ZINC000000002050	C2Oc1ccccc1O2
CS(=O)(=O)c1ccc(C(=O)CCC(O)=O)cc1	ZINC000000156343	c1ccccc1
COC(=O)c3cc(\C=C2/CSc1ccc(Cl)cc1C2=O)cn3C	ZINC000000112803	O=C2C(=Cc1cc[nH]c1)CSc3ccccc23
C[N@@](Cc1ccccc1N)C2CCCCC2	ZINC000000057065	C2CCC(NCc1ccccc1)CC2
Cc2noc(c1ccc(Cl)cc1)c2C(=O)Nc3ccccc3Cl	ZINC000000120880	O=C(Nc1ccccc1)c2cnoc2c3ccccc3
Cc1c(Cl)c(N(=O)=O)nn1CC(=O)Nc2cc(Cl)ccc2O	ZINC000000196074	O=C(Cn1cccn1)Nc2ccccc2
Nc2ccn(C1CC(CO)C1)c(=O)n2	ZINC000000011599	O=c1ncccn1C2CCC2
O=N(=O)c2cc1OCOc1cc2C=c3[nH]c(=S)[nH]c3=O	ZINC000000076571	O=c1[nH]c(=S)[nH]c1=Cc3ccc2OCOc2c3
CN(C)C(=O)C#CBr	ZINC000000019853	nonring
Cc3cccc(CN2CCN(Cc1ccccc1N(=O)=O)CC2)c3	ZINC000000121063	C2CN(Cc1ccccc1)CCN2Cc3ccccc3
COc2ccc(CCNC(=O)Cc1ccc(N(=O)=O)cc1)cc2OC	ZINC000000075329	O=C(Cc1ccccc1)NCCc2ccccc2
Cc3ccc([C@@H](O)C#CC(O)(c1ccccc1)c2ccccc2)o3	ZINC000000058341	C(C#CC(c1ccccc1)c2ccccc2)c3ccco3
Cc3ccc(OC(=O)c2sc1ccccc1c2Cl)c(N(=O)=O)n3	ZINC000000092897	O=C(Oc1cccnc1)c3cc2ccccc2s3
OS(=O)(=O)NS(O)(=O)=O	ZINC000247664325	nonring
Oc2ccc(NS(=O)(=O)c1ccccc1)c3ccccc23	ZINC000000068466	O=S(=O)(Nc1cccc2ccccc12)c3ccccc3
Cc3ccc2nc(c1ccc(Br)s1)cc(C(O)=O)c2c3	ZINC000000373466	c3ccc2nc(c1cccs1)ccc2c3
Cc2cc(N1CC[C@@H](N)C1)cnc2Cl	ZINC000000026491	C2CCN(c1cccnc1)C2
CCOc2c(Br)cc(\C=c1\sc(=S)n(CC(O)=O)c1=O)cc2Br	ZINC000002121674	O=c1[nH]c(=S)sc1=Cc2ccccc2
N#Cc3c(/N=C/c1ccc[nH]1)oc(c2ccccc2)c3c4ccccc4	ZINC000000573318	C(=Nc3cc(c1ccccc1)c(c2ccccc2)o3)c4ccc[nH]4
Clc1ccc(N(=O)=O)cc1C(=O)N3CCN(c2ccccc2)CC3	ZINC000000101968	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
O=C(CSc2nc1ccccc1o2)Nc4nc3ccccc3s4	ZINC000000051638	O=C(CSc2nc1ccccc1o2)Nc4nc3ccccc3s4
Cc2cc(=O)oc3ccc(Oc1ccc(C#N)cc1N(=O)=O)cc23	ZINC000000034141	O=c3ccc2cc(Oc1ccccc1)ccc2o3
Cc2cc(N)n(c1ccc(OC(F)(F)Cl)cc1)n2	ZINC000000036388	c2ccc(n1cccn1)cc2
COc1cccc(OC)c1C(=O)NC(=O)Oc2c(F)cccc2F	ZINC000000092498	O=C(NC(=O)c1ccccc1)Oc2ccccc2
CC(C)C\C(=C/C(O)=O)C(O)=O	ZINC000004536698	nonring
CC[C@@H](C)NS(=O)(=O)c1ccc(NC(C)=O)cc1	ZINC000000029698	c1ccccc1
CCN(CC)c2ccc(\C=N\n1c(C)cc(C)cc1=O)cc2	ZINC000000038932	O=c1ccccn1N=Cc2ccccc2
CC(=O)Nc3cccc(c2cc(c1c(Cl)cccc1Cl)no2)c3	ZINC000000076310	c3ccc(c2cc(c1ccccc1)on2)cc3
Cc2cc(C)nc(SCC[S@@](=O)c1ccc(C(C)(C)C)cc1)n2	ZINC000000038920	O=S(CCSc1ncccn1)c2ccccc2
Cc2ccc(n1nc(C(O)=O)c(=O)cc1O)cc2	ZINC000019946616	O=c2ccn(c1ccccc1)nc2
Oc1ccccc1c3cc(=O)c2ccccc2o3	ZINC000000038938	O=c2cc(c1ccccc1)oc3ccccc23
Nc3cccc4[nH]c(Cc2nc1ccccc1[nH]2)nc34	ZINC000000008920	C(c2nc1ccccc1[nH]2)c4nc3ccccc3[nH]4
CN(c1ccccc1)S(=O)(=O)c2ccc(NC(C)=O)cc2	ZINC000000029696	O=S(=O)(Nc1ccccc1)c2ccccc2
CN(c1ccccc1)C3(O)C(=O)c2ccccc2C3=O	ZINC000000051089	O=C2C(Nc1ccccc1)C(=O)c3ccccc23
CCN(CC)CCn2c1ccccc1n3c(C(=O)OC)c(C)nc23	ZINC000000305213	c1ccc2c(c1)[nH]c3nccn23
Clc4ccc(c2nnc(c1ccccc1)n2c3ccccc3)cc4	ZINC000000321225	c4ccc(c2nnc(c1ccccc1)n2c3ccccc3)cc4
O=C(Cc1ccccc1)Nc4ccc3oc(c2ccncc2)nc3c4	ZINC000000053301	O=C(Cc1ccccc1)Nc4ccc3oc(c2ccncc2)nc3c4
CCOc2cccc(OCC)c3c(C)[n+](C[C@@H]1CCCO1)c(C)c23	ZINC000000198839	C3COC(C[n+]2cc1cccccc1c2)C3
COc1cc(/C=C/C(N)=O)cc(OC)c1OC	ZINC000000001157	c1ccccc1
Fc2cccc(/C=C/C(=O)NC1CC1)c2	ZINC000000001156	O=C(NC1CC1)C=Cc2ccccc2
CCOc4ccc(NC(=S)N3CCN(c2cc1n(CC)cc(C(O)=O)c(=O)c1cc2F)CC3)cc4	ZINC000001049589	O=c3cc[nH]c4cc(N2CCN(C(=S)Nc1ccccc1)CC2)ccc34
Cc1cccc(C)c1[C@@H](C=O)C#N	ZINC000000026128	c1ccccc1
Clc3cccc(n2c(=O)c1cccc(N(=O)=O)c1c2=O)c3	ZINC000000041111	O=c2n(c1ccccc1)c(=O)c3ccccc23
Clc1ccc(N(=O)=O)cc1n3c(=O)c2ccccc2c3=O	ZINC000000041110	O=c2n(c1ccccc1)c(=O)c3ccccc23
CN(\C=C\c3sc2ccc1ccccc1c2[n+]3C)c4ccccc4	ZINC000000352705	N(C=Cc3nc2c(ccc1ccccc12)s3)c4ccccc4
CCOC(=O)c2cnc1ccc(F)cc1c2NCCN(C)C	ZINC000000145926	c2ccc1ncccc1c2
CCc2ccc(OC(=O)COc1ccc(Br)cc1C)cc2	ZINC000000038625	O=C(COc1ccccc1)Oc2ccccc2
COC(=O)c2ccc(OC(=O)c1cccc(C)c1)c(Br)c2	ZINC000000354159	O=C(Oc1ccccc1)c2ccccc2
COc3ccc([C@@H]1SCC(=O)N1c2cccc(C(O)=O)c2)cc3	ZINC000000076070	O=C2CSC(c1ccccc1)N2c3ccccc3
C3CCN(Nc1ncnc2ccsc12)CC3	ZINC000000116566	C3CCN(Nc1ncnc2ccsc12)CC3
CCO[C@]3(C1=NCCN1)COc2ccccc2O3	ZINC000000005879	C3CN=C(C2COc1ccccc1O2)N3
Nc2ncnc3n([C@@H]1O[C@@H](CO[P@@](O)(=O)C[P@](O)(O)=O)[C@@H](O)[C@@H]1O)cnc23	ZINC000003873855	C3COC(n1cnc2cncnc12)C3
Cc3cc(C)nc(SCc2cn1cc(Br)ccc1n2)n3	ZINC000000081061	C(Sc1ncccn1)c3cn2ccccc2n3
COc1ccccc1OC(=O)c2ccccc2OC(C)=O	ZINC000000000348	O=C(Oc1ccccc1)c2ccccc2
CSc2c(c1ccccc1)c(N)nn2S(=O)(=O)c3ccccc3	ZINC000000069209	O=S(=O)(c1ccccc1)n3cc(c2ccccc2)cn3
CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(O)=O)C(O)=O	ZINC000026667896	c2ccc1[nH]ccc1c2
N2C(c1cccnc1)Nc3cccc4cccc2c34	ZINC000000028671	N2C(c1cccnc1)Nc3cccc4cccc2c34
Oc1ccc(Br)cc1Cl	ZINC000000064966	c1ccccc1
CSCC[C@@H](NC=c2c(=O)[nH]c(=O)n(c1ccc(F)cc1)c2=O)C(O)=O	ZINC000002428287	C=c2c(=O)[nH]c(=O)n(c1ccccc1)c2=O
CN(C)CCc2[nH]c1ccc(C)cc1c2CN3CCOCC3	ZINC000000098712	C3CN(Cc1c[nH]c2ccccc12)CCO3
OS(=O)(=O)c2cccc(S(=O)(=O)c1cccc(S(O)(=O)=O)c1)c2	ZINC000002527949	O=S(=O)(c1ccccc1)c2ccccc2
CCc3ccc(c2cc(C(=O)NC(C)C)c1ccccc1n2)cc3	ZINC000000068302	c3ccc(c2ccc1ccccc1n2)cc3
OC(=O)c3ccc(N2C(=O)C[C@H](Nc1cccc(C(O)=O)c1)C2=O)cc3	ZINC000009372388	O=C2CC(Nc1ccccc1)C(=O)N2c3ccccc3
CCOc2ccc(NC(=O)N1CCC([N@@](C)C(C)C)CC1)cc2	ZINC000000260982	O=C(Nc1ccccc1)N2CCCCC2
C[N@]4CCC[C@H](C(=O)n2c1ccccc1[nH]c(=O)c3cccnc23)C4	ZINC000000004265	O=C(C1CCCNC1)n3c2ccccc2[nH]c(=O)c4cccnc34
Cc4c2occ(c1ccc(F)cc1)c2cc5c3CCCc3c(=O)oc45	ZINC000000095258	O=c5oc3cc2occ(c1ccccc1)c2cc3c4CCCc45
CCOC(=O)c2cnc1n(CC)ncc1c2N=NC(C)C	ZINC000000001379	c2cnc1[nH]ncc1c2
CCCC(=O)NOCc1cccc2ccc(OC)cc12	ZINC000000021040	c2ccc1ccccc1c2
CC(=O)Nc1ccc(C)c(C(O)(C(F)(F)F)C(F)(F)F)c1	ZINC000000048057	c1ccccc1
CCN(CC)CC[C@@H]1SCC(=O)N1Cc2ccccc2N(=O)=O	ZINC000000034643	O=C1CSCN1Cc2ccccc2
Cc1ccc(F)cc1NC2=NCCN2	ZINC000000001480	C2CN=C(Nc1ccccc1)N2
Cc4ccc(C(=O)c2c(C)[n+](c1ccccc1)c3scc(C)n23)cc4	ZINC000000245799	O=C(c1ccccc1)c3c[n+](c2ccccc2)c4sccn34
CCOc1ccc(Br)cc1S(=O)(=O)Nc3ccc(S(=O)(=O)Nc2ncccn2)cc3	ZINC000015910518	O=S(=O)(Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c3ccccc3
Cc1c(Cl)cccc1Nc2ncccc2C(=O)OC[C@H](O)CO	ZINC000000000171	N(c1ccccc1)c2ccccn2
Cc2onc(c1ccccc1)c2c4ccnc(c3ccc(Cl)cc3)n4	ZINC000000124066	c4ccc(c3nccc(c1conc1c2ccccc2)n3)cc4
COC(=O)c2ccc(n1nnnc1SCC(=O)NC(C)(C)C)cc2	ZINC000000045616	c2ccc(n1cnnn1)cc2
Nc1ccc(Br)cc1	ZINC000000013614	c1ccccc1
Cc3ccc(C)c(S(=O)(=O)N(C[C@@H]1CCCO1)Cc2ccco2)c3	ZINC000000221707	O=S(=O)(N(CC1CCCO1)Cc2ccco2)c3ccccc3
CN(/N=C/c1cccc(N(=O)=O)c1)C2=NS(=O)(=O)c3ccccc23	ZINC000000088932	O=S3(=O)N=C(NN=Cc1ccccc1)c2ccccc23
COc3ccc(Cc1nccc2cc(OC)c(OC)cc12)cc3OC	ZINC000000056555	C(c1ccccc1)c2nccc3ccccc23
Clc3c(N1CCOCC1)c(=O)c2ccccc2c3=O	ZINC000000021268	O=c2cc(N1CCOCC1)c(=O)c3ccccc23
CC(C)[C@H]2OC(=O)[C@H](Cc1ccccc1)N(C)C2=O	ZINC000000005908	O=C2COC(=O)C(Cc1ccccc1)N2
Cc3ccc(S(=O)(=O)n2nc(c1ccc(Cl)cc1)nc2N)cc3	ZINC000000350099	O=S(=O)(c1ccccc1)n3cnc(c2ccccc2)n3
OC(=O)c1ccccc1n5c(=O)c4cc3c(=O)n(c2ccccc2C(O)=O)c(=O)c3cc4c5=O	ZINC000002462030	O=c4n(c1ccccc1)c(=O)c5cc3c(=O)n(c2ccccc2)c(=O)c3cc45
CC2(C)C(C(=O)N[C@H](C(N)=O)c1ccccc1)C2(C)C	ZINC000000020318	O=C(NCc1ccccc1)C2CC2
CC(C)CN2[C@@H](N(O)C(=O)Nc1ccccc1)C(C)(C)SC2=S	ZINC000000850727	O=C(NC1CSC(=S)N1)Nc2ccccc2
Cn2cc(OC[C@H](O)CNC(C)(C)C)c1ccccc1c2=O	ZINC000000004698	O=c1[nH]ccc2ccccc12
Cn2cc(NS(=O)(=O)c1c[nH]c(C(O)=O)c1)nn2	ZINC000359558063	O=S(=O)(Nc1c[nH]nn1)c2cc[nH]c2
Clc2ccc(NC(=O)Cn1cnc(N(=O)=O)c1)cc2Cl	ZINC000000035919	O=C(Cn1ccnc1)Nc2ccccc2
OC(=O)c4cccc(N3COc2ccc1ccccc1c2C3)c4	ZINC000000064819	C3Oc2ccc1ccccc1c2CN3c4ccccc4
Cc4ccc(n2cnc3cc(C(=O)NC[C@@H]1CCCO1)ccc23)c(C)c4	ZINC000000216272	O=C(NCC1CCCO1)c4ccc3n(c2ccccc2)cnc3c4
CCOC(O)=NC(=O)N=c1[nH]cn[nH]1	ZINC000005830209	N=c1[nH]cn[nH]1
CS(=O)(=O)Nc1ccc(Br)cc1	ZINC000000093613	c1ccccc1
CNc3nc(c1ccccc1)[n+](c2ccccc2)s3	ZINC000000041847	c3ccc(c1ncs[n+]1c2ccccc2)cc3
CC(=O)c3ccc(OCCn1cnc2ccccc12)cc3	ZINC000000037811	C(Cn1cnc2ccccc12)Oc3ccccc3
CC[N@]3CCC[C@H](NC1=CC(=O)OC12CCCCC2)C3	ZINC000000140231	O=C3OC1(CCCCC1)C(NC2CCCNC2)=C3
CC(C)NNC(=O)c1ccncc1	ZINC000000001579	c1ccncc1
Cc3nc(c2cccc(NC(=O)c1ccc(N(=O)=O)cc1)c2)cs3	ZINC000000062519	O=C(Nc2cccc(c1cscn1)c2)c3ccccc3
Clc2cc(Cl)c(NC(=O)NCc1ccco1)c(Cl)c2	ZINC000000040530	O=C(NCc1ccco1)Nc2ccccc2
OP(O)(=O)OCC(Cl)(Cl)Cl	ZINC000003831574	nonring
COC(=O)C1=C(N)OC3=C([C@@H]1c2ccc(OC)cc2)C(=O)CCC3	ZINC000000043623	O=C1CCCC3=C1C(c2ccccc2)C=CO3
COC(=O)C1=C(C)OC(N)=C(C#N)[C@@H]1c2c(C)cc(C)cc2C	ZINC000000043620	O2C=CC(c1ccccc1)C=C2
COc4cc(OC)cc(N3CCN(C(=O)c1ccnc2ccccc12)CC3)c4	ZINC000000593839	O=C(N2CCN(c1ccccc1)CC2)c3ccnc4ccccc34
Cc2nc1cc(CCO)ccc1s2	ZINC000000040085	c2ccc1scnc1c2
Cn1cncc1CN2OCCC2=O	ZINC000000005245	O=C1CCON1Cc2cnc[nH]2
O=C(CCN1C(=O)CCC1=O)OC[C@H]2CCC[N@]3CCCC[C@@H]23	ZINC000000035433	O=C(CCN1C(=O)CCC1=O)OCC2CCCN3CCCCC23
Cc3ccc(N2CCN(Cc1cccc(C(F)(F)F)c1)CC2)cc3	ZINC000000276872	C2CN(c1ccccc1)CCN2Cc3ccccc3
OC(=O)c1nnc(C(O)=O)[nH][nH]1	ZINC000002519530	c1nnc[nH][nH]1
COc3ccc(COC[C@@H](O)CNC2Cc1ccccc1C2)cc3	ZINC000000119013	C(CNC2Cc1ccccc1C2)COCc3ccccc3
CN3CCN(C(=O)c2ccc(CNS(=O)(=O)c1cccc(Cl)c1)cc2)CC3	ZINC000000630924	O=C(N1CCNCC1)c3ccc(CNS(=O)(=O)c2ccccc2)cc3
COc3cc(CNCc1ccc(OC)c2ccccc12)cc(OC)c3	ZINC000000172243	C(NCc1cccc2ccccc12)c3ccccc3
Nc3c(C#N)c1CCCCc1c(c2ccc(O)cc2)c3C#N	ZINC000000029116	C1CCc2c(C1)cccc2c3ccccc3
OC(=O)c4cn(C1CC1)c3cc(N2CCNCC2)c(F)cc3c4=O	ZINC000000020220	O=c3ccn(C1CC1)c4cc(N2CCNCC2)ccc34
Cc4ccc3nc(NS(=O)(=O)c1ccc(Cl)cc1)c(Nc2c(C)n[nH]c2C)nc3c4	ZINC000000678327	O=S(=O)(Nc2nc1ccccc1nc2Nc3cn[nH]c3)c4ccccc4
Cn4c(Sc2c1CCCc1nc3ncnn23)nnc4c5ccccc5	ZINC000000154589	C5Cc4nc1ncnn1c(Sc3nnc(c2ccccc2)[nH]3)c4C5
CCc2c(C)nc(SCC(=O)c1ccc(Cl)cc1)c(C#N)c2C	ZINC000000079954	O=C(CSc1ccccn1)c2ccccc2
CN(C)CCn2ccc(=O)c3cc1c(=O)ccn(CCN(C)C)c1c(C)c23	ZINC000001629464	O=c2cc[nH]c3cc1[nH]ccc(=O)c1cc23
CCCC(=O)N[C@@H](c1ccco1)c3cc(Cl)c2cccnc2c3O	ZINC000000092414	C(c2ccc1cccnc1c2)c3ccco3
Cc4cccc(n2c(C)nc3cc(C(=O)NC[C@H]1CCCO1)ccc23)c4	ZINC000000216307	O=C(NCC1CCCO1)c4ccc3n(c2ccccc2)cnc3c4
C[C@@H](NC[C@H](O)Cn2c1ccccc1c3ccccc23)c4ccccc4	ZINC000000406582	C(CNCc1ccccc1)Cn3c2ccccc2c4ccccc34
O=CN3CC\C(=C/c2ccc1OCOc1c2)C3=O	ZINC000000007508	O=C1NCCC1=Cc3ccc2OCOc2c3
CC(C)c2ccc(NC(=O)N1CCOCC1)cc2	ZINC000000030382	O=C(Nc1ccccc1)N2CCOCC2
Cc2nc1ccccc1n2S(C)(=O)=O	ZINC000000030383	c2ccc1[nH]cnc1c2
Fc3ccc(N2[C@@H](c1ccc(Cl)c(Cl)c1)SCC2=O)cc3	ZINC000000067287	O=C2CSC(c1ccccc1)N2c3ccccc3
CN(C)CCNC(C)=c2c(=O)[nH]c(=O)n(Cc1ccccc1)c2=O	ZINC000000529587	C=c2c(=O)[nH]c(=O)n(Cc1ccccc1)c2=O
CN(C(=O)Cc1ccccc1)c2ccccc2	ZINC000000029273	O=C(Cc1ccccc1)Nc2ccccc2
COc1ccc(Cl)cc1C(=O)N3CCN(c2ccccc2)CC3	ZINC000000030413	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
Clc2ccc(OCC(=O)Oc1ccc(C=O)cc1)cc2	ZINC000000031948	O=C(COc1ccccc1)Oc2ccccc2
COc1cc(C(C)=O)ccc1OC(=O)c2ccc(N(=O)=O)cc2Cl	ZINC000000073814	O=C(Oc1ccccc1)c2ccccc2
CC(C)(C)c2cc(c1csc(CC#N)n1)cc(C(C)(C)C)c2O	ZINC000000113895	c2ccc(c1cscn1)cc2
C3CN=C(NCC(c1ccccc1)c2ccccc2)N3	ZINC000000012989	C3CN=C(NCC(c1ccccc1)c2ccccc2)N3
COC(=O)C1=CN(C)C=C(C(=O)OC)C1c2ccc(C)c(N(=O)=O)c2	ZINC000000089072	N2C=CC(c1ccccc1)C=C2
Clc4ccc(Sc3ccc2nnc(c1ccccc1)n2n3)cc4	ZINC000000078837	S(c1ccccc1)c4ccc3nnc(c2ccccc2)n3n4
Oc1c(Cl)cc(Cl)cc1\C=N\c2ccccc2N3CCCCC3	ZINC000000521805	C3CCN(c1ccccc1N=Cc2ccccc2)CC3
FC(F)(F)c3cccc(NC(=O)C2(c1ccccc1)CCOCC2)c3	ZINC000000056324	O=C(Nc1ccccc1)C3(c2ccccc2)CCOCC3
C[N@]1[C@H]3CC[C@@H]1CC(=NOC(=O)C2CCCCC2)C3	ZINC000000135873	O=C(ON=C1CC2CCC(C1)N2)C3CCCCC3
CN2OCC(=O)N(c1ccc(C(C)(C)C)cc1)C2=S	ZINC000000003158	O=C1CONC(=S)N1c2ccccc2
CCc1ccc(NS(C)(=O)=O)cc1	ZINC000000029207	c1ccccc1
Clc2c[nH]c3ncnc(N1CCCCC1)c23	ZINC000000024366	C3CCN(c1ncnc2[nH]ccc12)CC3
Fc2ccc(NC(=O)c1ccccc1)cc2	ZINC000000029209	O=C(Nc1ccccc1)c2ccccc2
C[C@@H](C[N+](C)(C)C)OC(=O)c1ccc(S(=O)(=O)N(C)C)o1	ZINC000000180497	c1ccoc1
Cn1nccc1NC(=O)c2nccnc2C(O)=O	ZINC000001033329	O=C(Nc1ccn[nH]1)c2cnccn2
Clc3cc1COCOc1c(COc2ccc(N(=O)=O)cc2C=O)c3	ZINC000000152856	C3OCc2cccc(COc1ccccc1)c2O3
CC(C)(C)C(=O)Nc2ccc(S(=O)(=O)Nc1nccs1)cc2	ZINC000000053943	O=S(=O)(Nc1nccs1)c2ccccc2
CCC(=O)c4cc3c2nc1ccccc1cc2Cn3c(=O)c4C	ZINC000000016249	O=c4cccc3c2nc1ccccc1cc2Cn34
CC(=O)N2CCN(NC(=O)c1ccc(F)cc1)CC2	ZINC000000006740	O=C(NN1CCNCC1)c2ccccc2
OC(=O)c2nnn(c1ccc(F)cc1F)c2c3ccccc3	ZINC000000139399	c3ccc(c1cnnn1c2ccccc2)cc3
NC(=O)c2cc(c1ccncc1)nnc2Cl	ZINC000000006213	c2cnnc(c1ccncc1)c2
CC(C)(S)[C@@H](NC(=O)C(F)(F)F)C(O)=O	ZINC000005497090	nonring
OC(=O)CC[C@@H](NC(=S)Nc1ccccc1)C(O)=O	ZINC000002290467	c1ccccc1
Oc1ccccc1\C=c3/c(=O)[nH]c(=S)n(c2ccccc2F)c3=O	ZINC000000566124	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=Cc3ccccc3
COc3ccc(n2c(C)nc1ccc(Br)cc1c2=O)cc3	ZINC000000051891	O=c2n(c1ccccc1)cnc3ccccc23
OC(=O)CC2(C(=O)Nc1nn[nH]n1)CCC2	ZINC000576230497	O=C(Nc1nn[nH]n1)C2CCC2
Cc2cccc(NC(=O)CSc1nnc(C(F)(F)F)n1C)c2C	ZINC000000049118	O=C(CSc1nnc[nH]1)Nc2ccccc2
CC(C)(C)c3ccc(NC(=O)Nc1sccc1n2cccc2)cc3	ZINC000000148035	O=C(Nc1ccccc1)Nc2sccc2n3cccc3
Cc3ccc2nc(NC(=O)[C@@H]1CC=CC[C@@H]1C(O)=O)sc2c3	ZINC000000441653	O=C(Nc2nc1ccccc1s2)C3CCC=CC3
COc3cc(OC)cc(c2nnc(SCC(=O)N1CCCC1)o2)c3	ZINC000000415505	O=C(CSc2nnc(c1ccccc1)o2)N3CCCC3
Cc3ccc(C)c([C@@H]1C(C#N)=C(N)Oc2n[nH]c(C)c12)c3	ZINC000000042571	O2C=CC(c1ccccc1)c3c[nH]nc23
C/C(=C/c1ccccc1OCc2ccc(Cl)cc2Cl)N(=O)=O	ZINC000000312727	C(Oc1ccccc1)c2ccccc2
Cc1c(C)c(\C=N\O)c(C)c(C)c1\C=N\O	ZINC000000042573	c1ccccc1
NS(=O)(=O)c1ccc(Cl)cc1Sc2ccccc2C(O)=O	ZINC000000162315	S(c1ccccc1)c2ccccc2
Cn3c(=O)c(C(N=Nc1ccc(N(=O)=O)cc1N(=O)=O)c2nnn[nH]2)c(O)c4ccccc34	ZINC000008384810	O=c2[nH]c1ccccc1cc2C(N=Nc3ccccc3)c4nnn[nH]4
Clc1ccccc1NC(=O)N2CCCCC2	ZINC000000028360	O=C(Nc1ccccc1)N2CCCCC2
CCc1nc(C)cn1S(=O)(=O)c2cc(Cl)c(OC)cc2Cl	ZINC000000308204	O=S(=O)(c1ccccc1)n2ccnc2
Cc2onc(c1ccccc1)c2c3ccc(S(N)(=O)=O)cc3	ZINC000000006694	c3ccc(c1conc1c2ccccc2)cc3
CCCC(=O)NCc1ccccc1	ZINC000000028304	c1ccccc1
O[C@@H](COc1cccc2ccccc12)C[N+]3(CC=C)CCOCC3	ZINC000000309672	C(COc1cccc2ccccc12)CN3CCOCC3
Clc3ccc(Cl)c(S(=O)(=O)n1cnc2ccccc12)c3	ZINC000000051410	O=S(=O)(c1ccccc1)n2cnc3ccccc23
Oc1ccccc1C(=O)Oc2ccccc2	ZINC000000038545	O=C(Oc1ccccc1)c2ccccc2
CC[C@@H]1CCCCN1C(=O)CSc3nnc(c2ccc(F)cc2)o3	ZINC000000415873	O=C(CSc2nnc(c1ccccc1)o2)N3CCCCC3
CCOC(=O)c1c(C)csc1NC(=O)c2ccc(C(C)(C)C)cc2	ZINC000000080445	O=C(Nc1cccs1)c2ccccc2
CC(C)Oc2ccc([C@@](O)(CC[N+](C)(C)C)C1CCCCC1)cc2	ZINC000000492679	C2CCC(Cc1ccccc1)CC2
CC(C)c2[nH]c1ccccc1c2C(=O)c3cccnc3	ZINC000000001801	O=C(c1cccnc1)c2c[nH]c3ccccc23
CCOc1ccccc1NC(=O)c4cc3c(ccc2ccccc23)o4	ZINC000000361009	O=C(Nc1ccccc1)c4cc3c(ccc2ccccc23)o4
CN3CCC([N@@](C)C2CCN(CCc1ccccc1)CC2)CC3	ZINC000000220725	C3CC(NC2CCN(CCc1ccccc1)CC2)CCN3
COC(=O)c2ccc(NC(=O)c1cc(N(=O)=O)n[nH]1)cc2	ZINC000000031169	O=C(Nc1ccccc1)c2ccn[nH]2
O=c3n1CCCSc1nc4oc2ccccc2c(=O)c34	ZINC000000025784	O=c3n1CCCSc1nc4oc2ccccc2c(=O)c34
C(Cc1ccccc1)Nc2nccc3ccccc23	ZINC000000013167	C(Cc1ccccc1)Nc2nccc3ccccc23
CCc2ccc1scc(CCNC(C)=O)c1c2	ZINC000000006676	c2ccc1sccc1c2
Cc4nc3cc(NC(=O)c2ccc1OCCOc1c2)ccc3s4	ZINC000000067575	O=C(Nc2ccc1scnc1c2)c4ccc3OCCOc3c4
Cc4cc(C(=O)OCc2ccc1nonc1c2)c3ccccc3n4	ZINC000000034403	O=C(OCc2ccc1nonc1c2)c3ccnc4ccccc34
FC(F)(F)c3ccc2n(C1CCNCC1)nnc2c3	ZINC000000161651	C3CC(n1nnc2ccccc12)CCN3
CNC2(COc1cccnc1)CC2	ZINC000000009156	C1CC1COc2cccnc2
Cc2nn(C(=O)c1ccco1)c(C)c2Br	ZINC000000034715	O=C(c1ccco1)n2cccn2
Cc3ncc(CO)c([C@@H]1N[C@H](C(O)=O)Cc2nc[nH]c12)c3O	ZINC000002130261	C3Cc1nc[nH]c1C(c2ccncc2)N3
CC[C@@H](Oc1ccccc1)C(=O)Nc2ccc(OC)cc2	ZINC000000035665	O=C(COc1ccccc1)Nc2ccccc2
CCOC(=O)C1=C(C)NC(=O)C[C@@H]1c2ccc(OC(F)(F)F)cc2	ZINC000000042710	O=C2CC(c1ccccc1)C=CN2
OCc4ccc[n+](CC(=O)c3ccc(c2ccc(C(=O)C[n+]1cccc(CO)c1)cc2)cc3)c4	ZINC000001559948	O=C(C[n+]1ccccc1)c4ccc(c3ccc(C(=O)C[n+]2ccccc2)cc3)cc4
Cc2cccn3C(c1ccco1)=NC(C(F)(F)F)(C(F)(F)F)N=c23	ZINC000000032940	C3N=C(c1ccco1)n2ccccc2=N3
Cc2ccc(OC[C@@H](O)CN1CCC(C(N)=O)CC1)c(N(=O)=O)c2	ZINC000000119233	C2CCN(CCCOc1ccccc1)CC2
CCOC(=O)c1c(NC(C)=O)sc(Cl)c1c2ccccc2	ZINC000000124556	c2ccc(c1ccsc1)cc2
Clc1ccc(N(=O)=O)cc1c3n/c(=C/c2ccco2)c(=O)o3	ZINC000000027944	O=c2oc(c1ccccc1)nc2=Cc3ccco3
COc2cccc(C(=O)NC(=S)Nc1ccc(OC)cc1OC)c2	ZINC000000361386	O=C(NC(=S)Nc1ccccc1)c2ccccc2
O=C(c1ccccc1)c3cc[n+](Cc2ccccn2)cc3	ZINC000000028248	O=C(c1ccccc1)c3cc[n+](Cc2ccccn2)cc3
O=S(=O)(Cc1ccccc1)NCc2ccccc2	ZINC000000029840	O=S(=O)(Cc1ccccc1)NCc2ccccc2
OCCc4ccc(N3[C@H](c1cccnc1)C(C(=O)c2ccco2)=C(O)C3=O)cc4	ZINC000000626103	O=C3C=C(C(=O)c1ccco1)C(c2cccnc2)N3c4ccccc4
Fc1cccc(Cl)c1Cn4nnc(c3ccc2OCOc2c3)n4	ZINC000000053548	C4Oc3ccc(c2nnn(Cc1ccccc1)n2)cc3O4
CCOc2cc(NS(=O)(=O)c1ccc(F)cc1)c(OCC)cc2NC(=O)c3cccc(OC)c3	ZINC000001324603	O=C(Nc2ccc(NS(=O)(=O)c1ccccc1)cc2)c3ccccc3
COc3ccc(S(=O)(=O)Nc2cc1OCOc1cc2C(C)=O)cc3	ZINC000000414577	O=S(=O)(Nc2ccc1OCOc1c2)c3ccccc3
CCC(=O)NCCC2=CCc3ccc1OCCc1c23	ZINC000000022929	C1Cc3c(O1)ccc2CC=Cc23
NC(=O)Oc1ccc(I)cc1	ZINC000000096675	c1ccccc1
Brc1ccccc1n3c(=O)c2cccc(N(=O)=O)c2c3=O	ZINC000000362440	O=c2n(c1ccccc1)c(=O)c3ccccc23
COc1ccccc1N3CCN(C2CCN(C(C)C)CC2)CC3	ZINC000000207672	C3CC(N2CCN(c1ccccc1)CC2)CCN3
COc3ccc([C@H]2COc1cc(O)cc(O)c1C2=O)cc3	ZINC000000016665	O=C2C(c1ccccc1)COc3ccccc23
COc4ccc(c3nc2S[C@H](c1ccco1)CC(=O)n2n3)cc4	ZINC000000067862	O=C3CC(c1ccco1)Sc4nc(c2ccccc2)nn34
CCC(CC)(NC(=O)COc1cc(Cl)c(Cl)cc1Cl)C#C	ZINC000000145683	c1ccccc1
CC(C)c1nccn1S(=O)(=O)c2cccc(Cl)c2Cl	ZINC000000049264	O=S(=O)(c1ccccc1)n2ccnc2
O=c3n(c1ccccn1)nc(c2ccccc2)c4ccccc34	ZINC000000049267	O=c3n(c1ccccn1)nc(c2ccccc2)c4ccccc34
Cc3cc(C)cc(OCC(=O)NCCc2nc1ccccc1[nH]2)c3	ZINC000000032015	O=C(COc1ccccc1)NCCc3nc2ccccc2[nH]3
COc3ccc(C(=O)Nc2ccc(N1CCOCC1)cc2)cc3OC	ZINC000000032017	O=C(Nc2ccc(N1CCOCC1)cc2)c3ccccc3
Brc3cc2c(=O)n(c1ccccc1)c(=O)c2cc3N(=O)=O	ZINC000000194791	O=c2n(c1ccccc1)c(=O)c3ccccc23
COc1ccccc1C(=O)NC(=S)Nc2cc(N(=O)=O)ccc2F	ZINC000000309491	O=C(NC(=S)Nc1ccccc1)c2ccccc2
Cc1ccccc1n3cc2ccc(N(=O)=O)cc2n3	ZINC000000032700	c3ccc(n2cc1ccccc1n2)cc3
COC(=O)c2c(C)oc3cc(Br)c(OCc1ccc(C)cc1)cc23	ZINC000000623881	C(Oc2ccc1occc1c2)c3ccccc3
Cc2nc1cnccc1n2c5ccc(Cn3c(=O)sc4ccccc34)cc5	ZINC000000591635	O=c2sc1ccccc1n2Cc5ccc(n3cnc4cnccc34)cc5
FC(F)(F)[C@]2(c1ccccc1)NC(=O)n3c(S2)nc4ccccc34	ZINC000000083932	O=C3NC(c1ccccc1)Sc4nc2ccccc2n34
COc2ccc1ccccc1c2\C=c3/c(=O)[nH]c(=O)n(C)c3=O	ZINC000000086722	O=c3[nH]c(=O)c(=Cc1cccc2ccccc12)c(=O)[nH]3
CC(C)(C)CC(C)(C)NC(N)=N	ZINC000000000356	nonring
C[C@@H](N)Cc1c[nH]c2ccc(F)cc12	ZINC000000057323	c2ccc1[nH]ccc1c2
O=C(COC[C@@H]1CCC[N@]2CCCC[C@@H]12)N3CCOCC3	ZINC000000035447	O=C(COCC1CCCN2CCCCC12)N3CCOCC3
COc1ccccc1N3CCN(\N=C(\C)c2ccccc2)CC3	ZINC000000046716	C2CN(c1ccccc1)CCN2N=Cc3ccccc3
COC(=O)C1=C(C)NC(=O)N[C@@H]1c2cc(Cl)c(O)c(OC)c2	ZINC000000041440	O=C2NC=CC(c1ccccc1)N2
Cc3c2C(c1ccccc1)=NCC(=O)Nc2cn3C	ZINC000000001975	O=C3CN=C(c1ccccc1)c2c[nH]cc2N3
Cc3nn2c(SCc1n[nH]c(=O)[nH]1)n[nH]c2nc3=O	ZINC000353203025	O=c3cnn2c(SCc1n[nH]c(=O)[nH]1)n[nH]c2n3
Fc4ccc(C(=O)C3CCN(CCn2c(=O)nc1CCCCn1c2=O)CC3)cc4	ZINC000000597570	O=C(C3CCN(CCn2c(=O)nc1CCCCn1c2=O)CC3)c4ccccc4
O=S(=O)(NNC(=S)Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c3ccccc3	ZINC000020530116	O=S(=O)(NNC(=S)Nc2ccc(S(=O)(=O)Nc1ncccn1)cc2)c3ccccc3
CN(C)CC/C=c2/c1ccc(F)cc1sc3ccc(Cl)cc23	ZINC000000346577	C=c2c1ccccc1sc3ccccc23
CN(C)N3Cc1c([nH]c2ccccc12)C3=O	ZINC000000040669	O=C1NCc2c1[nH]c3ccccc23
Fc3ccc(N2CCN(C(=O)\C=C\c1ccc(Cl)cc1)CC2)cc3	ZINC000000031616	O=C(C=Cc1ccccc1)N3CCN(c2ccccc2)CC3
O=c2oc(c1cccs1)nc3ccccc23	ZINC000000031615	O=c2oc(c1cccs1)nc3ccccc23
COc2ccc(OC)c(S(=O)(=O)Nc1ccc(C(O)=O)cc1O)c2	ZINC000005516304	O=S(=O)(Nc1ccccc1)c2ccccc2
OC(=O)c2cc1nc(C(F)F)cc(C(F)F)n1n2	ZINC000000039414	c2cnc1ccnn1c2
CC(C)(C)n3c(=O)c2ccc(C(=O)Nc1nccs1)cc2c3=O	ZINC000000036787	O=C(Nc1nccs1)c3ccc2c(=O)[nH]c(=O)c2c3
Clc3ccc2oc(=O)c(c1ccc(N(=O)=O)cc1)cc2c3	ZINC000000070520	O=c2oc1ccccc1cc2c3ccccc3
COc4ccc3cc([C@H](C)c2nc1ccccc1n2CC=C)ccc3c4	ZINC000000561754	C(c2ccc1ccccc1c2)c4nc3ccccc3[nH]4
CN(C)Cc2cc(C(C)(C)c1cc(CN(C)C)c(O)c(CN(C)C)c1)cc(CN(C)C)c2O	ZINC000004257717	C(c1ccccc1)c2ccccc2
Fc1cccc(F)c1c3nn(c2ccc(C(F)(F)F)cn2)c(=O)o3	ZINC000000077935	O=c2oc(c1ccccc1)nn2c3ccccn3
CCn1cc(C(=O)NC)c(C(=O)NC)n1	ZINC000000001400	c1cn[nH]c1
Cc3cc(C)n2nc(S(=O)(=O)NCc1ccccc1)nc2n3	ZINC000000091838	O=S(=O)(NCc1ccccc1)c3nc2ncccn2n3
CCSc2nnc(NC(=O)[C@@H](C)c1ccc(CC(C)C)cc1)s2	ZINC000000363646	O=C(Cc1ccccc1)Nc2nncs2
Cc3cc(=O)c(c1ccc(Cl)cc1)c(c2ccc(S(C)(=O)=O)cc2)o3	ZINC000000588134	O=c2ccoc(c1ccccc1)c2c3ccccc3
CCc1nccn1S(=O)(=O)c2cc(Cl)ccc2Br	ZINC000000208692	O=S(=O)(c1ccccc1)n2ccnc2
CC3=C(C(=O)Nc1ccccc1)[C@@H](c2ccc(F)cc2)NC(=S)N3	ZINC000000044262	O=C(Nc1ccccc1)C2=CNC(=S)NC2c3ccccc3
Cc3cccc(COn2cccc(C(=O)Nc1ccccc1C)c2=O)c3	ZINC000000254098	O=C(Nc1ccccc1)c3cccn(OCc2ccccc2)c3=O
OC(=O)CCC(=O)Nc2cccc(C(=O)Nc1cccc(Cl)c1)c2	ZINC000000125581	O=C(Nc1ccccc1)c2ccccc2
C[C@H](c2cccc(C(=O)c1ccccc1)c2)c3nc(N(C)C)no3	ZINC000000002932	O=C(c1ccccc1)c3cccc(Cc2ncno2)c3
O=C(N1CCOCC1)c3ccc(SCc2ccoc2)c(N(=O)=O)c3	ZINC000000033548	O=C(N1CCOCC1)c3ccc(SCc2ccoc2)cc3
CCOC(=O)c1cccc(C(=O)OCC)n1	ZINC000000018737	c1ccncc1
CCOC(=O)c2cc1cc(F)ccc1[nH]2	ZINC000000018736	c2ccc1[nH]ccc1c2
C[N@]1CCC[C@H]1Cc3c[nH]c4ccc(CCS(=O)(=O)c2ccccc2)cc34	ZINC000000607845	O=S(=O)(CCc3ccc2[nH]cc(CC1CCCN1)c2c3)c4ccccc4
CC(=O)c4c(c1ccccc1)nc5n(CCN2CCCCC2)c3ccccc3n45	ZINC000000727373	C5CCN(CCn3c1ccccc1n4cc(c2ccccc2)nc34)CC5
Cc3cc(NS(=O)(=O)c1ccc(N)cc1)n(c2ccccc2)n3	ZINC000000002112	O=S(=O)(Nc1ccnn1c2ccccc2)c3ccccc3
C[C@@H](C(O)=O)S(=O)(=O)Nc1cnn(C)c1	ZINC000042522476	c1cn[nH]c1
OC(=O)c1cc(=O)cc(C(O)=O)[nH]1	ZINC000006523946	O=c1cc[nH]cc1
O=C(NC3CCN(Cc2ccc1ccccc1c2)CC3)NC(=O)c4ccccc4	ZINC000000538150	O=C(NC3CCN(Cc2ccc1ccccc1c2)CC3)NC(=O)c4ccccc4
OC[C@H](Cc1ccccc1)Nc3ncnc4n(c2ccccc2)ncc34	ZINC000000012959	C(Cc1ccccc1)Nc3ncnc4n(c2ccccc2)ncc34
CCC(C)(S(=O)(=O)CC)S(=O)(=O)CC	ZINC000000002115	nonring
COc2cccc(OC[C@@H](O)CN1C(C)(C)CC(O)CC1(C)C)c2	ZINC000000240321	C2CCN(CCCOc1ccccc1)CC2
O=c2oc1cccnc1n2CCN4CCN(c3ccccc3)CC4	ZINC000000005314	O=c2oc1cccnc1n2CCN4CCN(c3ccccc3)CC4
COc4ccc(OC)c(S(=O)(=O)Nc1cc(C(O)=O)ccc1N3CCN(c2ccccn2)CC3)c4	ZINC000032961882	O=S(=O)(Nc1ccccc1N3CCN(c2ccccn2)CC3)c4ccccc4
COc1ccccc1n4c(C)nc3n(c2ccccc2)ncc3c4=O	ZINC000000061454	O=c3n(c1ccccc1)cnc4n(c2ccccc2)ncc34
Fc1ccccc1n4c(=S)[nH]c(=O)c(=CNc3ccc(N2CCOCC2)cc3)c4=O	ZINC000000638441	O=c2[nH]c(=S)n(c1ccccc1)c(=O)c2=CNc4ccc(N3CCOCC3)cc4
CC[C@H](C)c2ccc(NC(=O)CSc1nc(C)cc(C)n1)cc2	ZINC000000044521	O=C(CSc1ncccn1)Nc2ccccc2
Cc4ccc(NC(=O)C[C@@H]1Nc2cccc3cccc(NC1=O)c23)cc4	ZINC000000082197	O=C(CC1Nc2cccc3cccc(NC1=O)c23)Nc4ccccc4
COc1ccccc1Oc3ncnc4sc(c2ccccc2)cc34	ZINC000000091723	O(c1ccccc1)c3ncnc4sc(c2ccccc2)cc34
Nc2ncc(S(=O)(=O)c1ccccn1)s2	ZINC000000004842	O=S(=O)(c1ccccn1)c2cncs2
COc3ccc(C(=O)CSc2cc(C)c1ccccc1n2)cc3C	ZINC000000076442	O=C(CSc2ccc1ccccc1n2)c3ccccc3
Cc3ccc(S(=O)(=O)NC(=O)Nc2c(c1ccc(F)cc1)c(C(F)(F)F)nn2C)cc3	ZINC000001030365	O=C(Nc1[nH]ncc1c2ccccc2)NS(=O)(=O)c3ccccc3
Cc2onc(c1c(Cl)cccc1Cl)c2C(=O)Oc3ccccc3	ZINC000000140756	O=C(Oc1ccccc1)c2conc2c3ccccc3
COC(=O)c1ccc(NC(=O)C(C)(C)C)cc1	ZINC000000041056	c1ccccc1
CCc3ccc(n2n(O)c1cc(Cl)c(Cl)cc1[nH]c2=O)cc3	ZINC000000184605	O=c2[nH]c1ccccc1[nH]n2c3ccccc3
Cc1ccccc1[N+](=O)Cc2cccs2	ZINC000000116170	O=[N+](Cc1cccs1)c2ccccc2
CN2C(=O)N[C@H](c1ccccc1)C4=C2CN(c3ccc(C)c(C)c3)C4=O	ZINC000000082971	O=C4NC(c1ccccc1)C3=C(CN(c2ccccc2)C3=O)N4
CC[C@@]3(c1ccccc1)C(=O)NC(=O)N([C@@H]2O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]2O)C3=O	ZINC000038797653	O=C2NC(=O)N(C1CCCCO1)C(=O)C2c3ccccc3
Brc3ccc(COn1nnc2ccc(N(=O)=O)cc12)cc3	ZINC000000078556	C(On1nnc2ccccc12)c3ccccc3
COc2ccc(OC)c(NC(=O)CC[N@]1C[C@@H](C)C[C@@H](C)C1)c2	ZINC000000212027	O=C(CCN1CCCCC1)Nc2ccccc2
Oc3cc(O)c2C(=O)C[C@H](c1ccccc1)Oc2c3	ZINC000000004935	O=C2CC(c1ccccc1)Oc3ccccc23
COC(=O)C2(C(=O)OC)[C@@H](c1ccccc1)[C@@]2(C#N)C(=O)OC	ZINC000000033614	C1CC1c2ccccc2
COc3cc(\C=C2/CCc1ccccc1C2=O)cc(OC)c3OC	ZINC000000069878	O=C2C(=Cc1ccccc1)CCc3ccccc23
Cc3ccc(OCc2nn(CN1CCCC1)c(=S)n2C)cc3C	ZINC000000069879	S=c2[nH]c(COc1ccccc1)nn2CN3CCCC3
O=C2NC1(CCCCC1)C(=O)N2c3nccs3	ZINC000000022325	O=C2NC1(CCCCC1)C(=O)N2c3nccs3
COC(=O)c1sc(NC(=O)CCC(O)=O)nc1C	ZINC000000114344	c1cscn1
FC(F)(F)c3cc(N1CCNCC1)c2ccccc2n3	ZINC000000170653	C3CN(c1ccnc2ccccc12)CCN3
COC(=O)c2c(C)nn(C(=O)c1cccs1)c2c3snnc3C	ZINC000000120196	O=C(c1cccs1)n2nccc2c3cnns3
FC(F)(F)c3nnc(NC(=O)[C@@H]1C[C@@H]1c2ccc(Cl)cc2)s3	ZINC000000374407	O=C(Nc1nncs1)C2CC2c3ccccc3
CN3CCN(c1ccccc1Cc2ccccc2)CC3	ZINC000000002068	C3CN(c1ccccc1Cc2ccccc2)CCN3
CN(\N=N\N(C)c1ccccc1)c2ccccc2	ZINC000000002069	N(N=NNc1ccccc1)c2ccccc2
COc3ccc(c2csc(N1CCOCC1)n2)cc3OC	ZINC000000038362	C3CN(c2nc(c1ccccc1)cs2)CCO3
OC(=O)c2ccc(NC(=O)c1ccccc1)cc2O	ZINC000000001018	O=C(Nc1ccccc1)c2ccccc2
Nc2ccc(N1CCCC1)c(C(O)=O)c2	ZINC000000073863	C2CCN(c1ccccc1)C2
O=C(NCCN1CCNC1=O)Nc2ccccc2	ZINC000000005006	O=C(NCCN1CCNC1=O)Nc2ccccc2
CCOc3cc(\C=c2\c(=O)[nH]c(=O)n(c1ccc(C)c(Cl)c1)c2=O)c(Br)cc3O	ZINC000001116599	O=c2[nH]c(=O)c(=Cc1ccccc1)c(=O)n2c3ccccc3
CCOC(=O)c2c(C)nc1cc(C(O)=O)nn1c2C	ZINC000000121073	c2cnc1ccnn1c2
OC(=O)c2[nH]c1ccccc1c2CC(=O)N[C@@H]3CCCc4ccccc34	ZINC000000201620	O=C(Cc1c[nH]c2ccccc12)NC3CCCc4ccccc34
CC1(C)NC(=N)NC(=N)N1c2c(Cl)cccc2Cl	ZINC000000071371	N=C2NCN(c1ccccc1)C(=N)N2
CC(=NNC(=O)COc1ccc(Cl)cc1)c2ccc(N(=O)=O)cc2	ZINC000000060072	O=C(COc1ccccc1)NN=Cc2ccccc2
CN(Cc2cnc1nc(N)nc(N)c1n2)c3ccc(C(=O)N[C@H](CCC(=O)OC(C)(C)C)C(O)=O)cc3	ZINC000001590742	C(Nc1ccccc1)c3cnc2ncncc2n3
CCCn2c(=O)c1ccccc1oc3ccccc23	ZINC000000014020	O=c2[nH]c1ccccc1oc3ccccc23
C[N@]3CCC[C@@H](OC(=O)C(O)(c1ccccc1)c2ccccc2)C3	ZINC000000390424	O=C(OC1CCCNC1)C(c2ccccc2)c3ccccc3
Nc2cc(N)nc(SCc1ccc(Cl)cc1Cl)n2	ZINC000000287603	C(Sc1ncccn1)c2ccccc2
Oc2ccc1ccccc1c2CN3CCCCC3	ZINC000000129274	C3CCN(Cc1cccc2ccccc12)CC3
CCN(CC)CCNc3ncc2Cc1ccccc1Nc2c3C#N	ZINC000000537068	C2c1ccccc1Nc3ccncc23
CCN(CC)c2ccc(NC(=O)c1ccccc1Br)cc2	ZINC000000129271	O=C(Nc1ccccc1)c2ccccc2
CC(C)C[C@H](NC(=O)\C=C(/C)c1ccc(OP(O)(O)=O)cc1)C(=O)N3C[C@H]2C[C@H]2[C@H]3C(=O)NCCNC(N)=O	ZINC000071318363	O=C(NCC(=O)N2CC1CC1C2)C=Cc3ccccc3
CCOC(=O)c3ccc(OCCC2CCN(c1ccc(C)nn1)CC2)cc3	ZINC000000538202	C(CC2CCN(c1cccnn1)CC2)Oc3ccccc3
C[C@@H]1CN(S(C)(=O)=O)C[C@@H](C)O1	ZINC000000029689	C1COCCN1
COc3cc(c2cc(=O)c1ccccc1o2)ccc3O	ZINC000000038941	O=c2cc(c1ccccc1)oc3ccccc23
CN(C)CCCc1c(N(=O)=O)ccc(N(=O)=O)c(CCCN(C)C)n1C(F)(F)F	ZINC000005258424	c1ccc[nH]cc1
Cc1ncc(COP(O)(O)=O)c(N)n1	ZINC000001529994	c1cncnc1
CS(=O)(=O)Nc1ccc(F)cc1F	ZINC000000029685	c1ccccc1
C[N+]2(C)CCc1cc(Br)ccc12	ZINC000000021672	C2Cc1ccccc1N2
Cc1cc(C)c(C(O)=O)c(C(O)=O)c1	ZINC000001758083	c1ccccc1
CCc4nnc(NS(=O)(=O)c3ccc(NC=c2c(=O)[nH]c(=O)n(c1ccc(Cl)cc1)c2=O)cc3)s4	ZINC000017414006	O=c3[nH]c(=O)c(=CNc2ccc(S(=O)(=O)Nc1nncs1)cc2)c(=O)n3c4ccccc4
Oc2ccc(c1cn[nH]n1)cc2	ZINC000000027319	c2ccc(c1cn[nH]n1)cc2
CC5(C)Cc4nc3sc1c(ncn2c(=S)[nH]nc12)c3cc4CO5	ZINC000000327593	S=c4[nH]nc5c3sc2nc1CCOCc1cc2c3ncn45
COc4ccc(Oc2nnc(c1ccc(C)cc1)c3ccccc23)cc4	ZINC000000098828	O(c1ccccc1)c3nnc(c2ccccc2)c4ccccc34
C[C@H]2CCc1cc(F)ccc1N2C(=O)c3ccc(Cl)cc3N(=O)=O	ZINC000000376501	O=C(N1CCCc2ccccc12)c3ccccc3
OC/C=C2\O[C@@H]1CC(=O)N1[C@@H]2C(O)=O	ZINC000000001169	C=C2CN1C(CC1=O)O2
COc1cc(C[C@@H](C)N)c(OC)cc1Br	ZINC000000000092	c1ccccc1
COc5ccc3c(cn(C)c4c2cc1OCOc1cc2ccc34)c5=O	ZINC000000004996	O=c1cccc2c1c[nH]c5c2ccc4cc3OCOc3cc45
Cn4c(=O)c(Cc1ccccc1)c(O)c5c(=O)n(c2ccccc2)c(=O)n(c3ccccc3)c45	ZINC000000704365	O=c4[nH]c3n(c1ccccc1)c(=O)n(c2ccccc2)c(=O)c3cc4Cc5ccccc5
NC(=O)C2c1ccccc1C=Cc3ccccc23	ZINC000000001162	C2c1ccccc1C=Cc3ccccc23
CC(=O)Nc2cccc(c1cn[nH]n1)c2	ZINC000000027314	c2ccc(c1cn[nH]n1)cc2
Cc1ccccc1c2cn[nH]n2	ZINC000000027316	c2ccc(c1cn[nH]n1)cc2
Fc2ccc(NC(=O)N1CCC=CC1)cc2	ZINC000000026154	O=C(Nc1ccccc1)N2CCC=CC2
Cn2c(NC(=O)c1ccccc1)nc(=O)c3ccccc23	ZINC000000005264	O=C(Nc2nc(=O)c1ccccc1[nH]2)c3ccccc3
COC(=O)CCC(=O)c2cc1cc(Br)ccc1o2	ZINC000000036664	c2ccc1occc1c2
C[C@](O)([C@@H](NC(=O)c1ccccc1)C(O)=O)C(O)=O	ZINC000001737916	c1ccccc1
OC(=O)c2ccc(n1cnnn1)cc2	ZINC000000036461	c2ccc(n1cnnn1)cc2
CC(C)[C@H]1CC[C@@H](C)C[C@@H]1OC(=O)CSc2nc(C)cc(C)n2	ZINC000000051664	O=C(CSc1ncccn1)OC2CCCCC2
Clc3ccc(c2csc(Nc1ccccc1)n2)c(Cl)c3	ZINC000000452903	N(c1ccccc1)c3nc(c2ccccc2)cs3
O[C@@H]2CCC[N@@](Cc1cc(Br)cs1)C2	ZINC000000200666	C2CCN(Cc1cccs1)CC2
O[C@@H](c2ccc(c1ccccc1)cc2)c4cc3cc(N(=O)=O)ccc3o4	ZINC000000083750	C(c2ccc(c1ccccc1)cc2)c4cc3ccccc3o4
Cc1cc3c(o1)c(C)cc2c(CO)cc(=O)n(C)c23	ZINC000000009179	O=c3ccc2ccc1occc1c2[nH]3
CC(=O)c2cc1ccc(O)cc1oc2=O	ZINC000000047516	O=c2ccc1ccccc1o2
CCOc3ccc(NC(=O)[C@@H]2CN(c1ccc(F)cc1)C(=O)C2)cc3	ZINC000000044730	O=C2CC(C(=O)Nc1ccccc1)CN2c3ccccc3
CNc2nc1cccnc1s2	ZINC000000014135	c2cnc1scnc1c2
COc2ccc1nc(C)c(C(N)=O)cc1c2	ZINC000000054877	c2ccc1ncccc1c2
NC3=C(C#N)[C@@H](c1cccnc1)C2=C(CCCC2=O)N3c4ccccc4	ZINC000000063297	O=C1CCCC3=C1C(c2cccnc2)C=CN3c4ccccc4
Fc1cccc(Cl)c1C(=O)Nc3ccc(c2csnn2)cc3	ZINC000000106348	O=C(Nc2ccc(c1csnn1)cc2)c3ccccc3
CC[C@@H](C(=O)NCc1cccnc1)c2ccccc2	ZINC000000030620	O=C(Cc1ccccc1)NCc2cccnc2
CC(C)(C)[N@@](C[C@@H](O)COc1ccccc1)Cc2ccc(N(=O)=O)cc2	ZINC000000753782	C(CNCc1ccccc1)COc2ccccc2
O=c2n(N1CCOCC1)nnc3ccccc23	ZINC000000001746	O=c2n(N1CCOCC1)nnc3ccccc23
Cc1cc(Br)ccc1OCC(=O)NCCc2ccccc2	ZINC000000079201	O=C(COc1ccccc1)NCCc2ccccc2
CC(=O)Nc2ccc(S(=O)(=O)N[C@@H](CSc1ccc(C(O)=O)cc1N(=O)=O)C(O)=O)cc2	ZINC000003025095	O=S(=O)(NCCSc1ccccc1)c2ccccc2
Cc2c(C(=O)Nc1ccc(Cl)cc1Cl)oc3ccccc23	ZINC000000458619	O=C(Nc1ccccc1)c3cc2ccccc2o3
Cc1nccnc1N2CCCCC2	ZINC000000001742	C2CCN(c1cnccn1)CC2
CC1=CC(C)(C)[C@@H](C(O)=O)[C@@H](C(O)=O)C1	ZINC000000054321	C1CCC=CC1
Fc3cccc(CNC(=O)c2c[nH]c1ccccc1c2=O)c3	ZINC000000026375	O=C(NCc1ccccc1)c3c[nH]c2ccccc2c3=O
O=C3C[C@@H](n2nnn(C1CCCCC1)c2=S)[C@@H]4CO[C@H]3O4	ZINC000000036805	O=C3CC(n2nnn(C1CCCCC1)c2=S)C4COC3O4
CCOc3ccc2ncc(C(=O)NCc1cccnc1)c(O)c2c3	ZINC000000026377	O=C(NCc1cccnc1)c3cnc2ccccc2c3
CCC[C@H](C)C(=O)Nc1cccc(C(=O)OCC)c1	ZINC000000031763	c1ccccc1
Fc4ccc(n1cccc1C=c3[nH]c(=O)n(c2ccccc2)c3=O)cc4	ZINC000000095629	O=c3[nH]c(=Cc1cccn1c2ccccc2)c(=O)n3c4ccccc4
C[C@H]3NC(=O)[C@H]2C[C@H]1CCC[C@H]1N2C3=O	ZINC000000004517	O=C3CNC(=O)C2CC1CCCC1N23
CCc3ccc(NC(=O)CSc1cccc2ccc(C)nc12)cc3	ZINC000000036248	O=C(CSc1cccc2cccnc12)Nc3ccccc3
C[N+]3(CC[C@](O)(c1ccccc1)c2cccs2)CCOCC3	ZINC000000000769	C3CN(CCC(c1ccccc1)c2cccs2)CCO3
Cc3cccc(\C=c2/nc(c1cccc(Br)c1)oc2=O)c3	ZINC000000055308	O=c2oc(c1ccccc1)nc2=Cc3ccccc3
Cc3cc(S(=O)(=O)n1nnc2cc(Cl)ccc12)ccc3Cl	ZINC000000053204	O=S(=O)(c1ccccc1)n2nnc3ccccc23
CN4CCN(c2nsc3nc1ccccc1n23)CC4	ZINC000000022789	C4CN(c2nsc3nc1ccccc1n23)CCN4
COc4ccc(OC)c(NS(=O)(=O)c3ccc2nc(C)n(NS(=O)(=O)c1cc(OC)ccc1OC)c(=O)c2c3)c4	ZINC000001651091	O=c3n(NS(=O)(=O)c1ccccc1)cnc4ccc(S(=O)(=O)Nc2ccccc2)cc34
CN4CCN(CCC(=O)N[C@H]3[C@@H]2Oc1cc(C)ccc1[C@]2(C)CCC3=O)CC4	ZINC000000538425	O=C(CCN1CCNCC1)NC4C3Oc2ccccc2C3CCC4=O
Fc4ccc(c3nc(C#N)c(N2CCN(c1ccccc1)CC2)o3)cc4	ZINC000000468545	C3CN(c2cnc(c1ccccc1)o2)CCN3c4ccccc4
COC(=O)C1=C(N)OC3=C([C@@H]1c2cccs2)C(=O)CC(C)(C)C3	ZINC000000036715	O=C1CCCC3=C1C(c2cccs2)C=CO3
Cc3ccc(C)c(NC(=O)[C@H]2CN(c1ccccc1)C(=O)C2)c3	ZINC000000044753	O=C2CC(C(=O)Nc1ccccc1)CN2c3ccccc3
CC(=O)n2[nH]c(=O)n(c1ccccc1)c2=O	ZINC000000004194	O=c1[nH][nH]c(=O)n1c2ccccc2
Cc1ccc(N(=O)=O)cc1NC(=O)COc2ccccc2C	ZINC000000038897	O=C(COc1ccccc1)Nc2ccccc2
CC\C(=C\C)C(=O)NC(N)=O	ZINC000000001340	nonring
CCOC(=O)CCc3c(C)c(C#N)c2nc1ccccc1n2c3C	ZINC000000045608	c1ccc3c(c1)nc2ccccn23
CCOC(=O)c2c(C)[nH]c(=Cc1ccc(Br)cc1)c2=O	ZINC000000037622	O=c1cc[nH]c1=Cc2ccccc2
CCn2cc(C(N)=O)c(=O)c3ccc(c1ccncc1)cc23	ZINC000000013626	O=c2cc[nH]c3cc(c1ccncc1)ccc23
COc3ccc(CN2CCN(c1ccc(Cl)cc1)CC2)c(C)c3C	ZINC000000293936	C2CN(c1ccccc1)CCN2Cc3ccccc3
Oc1ccc(CC(F)=C)cc1	ZINC000000013623	c1ccccc1
COc5ccc(c3coc4cc2oc(=O)c1CCCCc1c2cc34)cc5	ZINC000000095284	O=c5oc3cc2occ(c1ccccc1)c2cc3c4CCCCc45
CC(C)CC(=O)N1CCc2ccccc12	ZINC000000030712	C2Cc1ccccc1N2
C4COC(c3nc(c1ccccc1)c(c2ccccc2)[nH]3)OC4	ZINC000000014233	C4COC(c3nc(c1ccccc1)c(c2ccccc2)[nH]3)OC4
c3csc(c2cc1nccn1[nH]2)c3	ZINC000000004424	c3csc(c2cc1nccn1[nH]2)c3
C[C@@H](CN1CCCCC1)OC(=O)c3ccc2OCCOc2c3	ZINC000000073940	O=C(OCCN1CCCCC1)c3ccc2OCCOc2c3
COC(=O)c2c(C)n(c1ccc(C)cc1)c4c2cc(O)c3ccccc34	ZINC000000095533	c4ccc(n2ccc3ccc1ccccc1c23)cc4
COc3cc(Cl)cc(\C=c2\sc(c1ccccc1)nc2=O)c3O	ZINC000000115738	O=c2nc(c1ccccc1)sc2=Cc3ccccc3
CC(=O)c2cc(C#N)c(SCc1ccc(C(C)(C)C)cc1)nc2C	ZINC000000059301	C(Sc1ccccn1)c2ccccc2
Cc1c(C(O)=O)c(C(O)=O)c2SCCn12	ZINC000000149964	C2Cn1cccc1S2
COC(=O)c3ccc2CN(c1ccc(Br)cc1)Cc2c3	ZINC000000036933	C2N(c1ccccc1)Cc3ccccc23
COC4=C[C@H]2[C@@H]3Cc1ccc(OC)c(O)c1[C@]2(CC[N@]3C)CC4=O	ZINC000000000181	O=C4CC23CCNC(Cc1ccccc12)C3C=C4
COc3cc(CNc2nc1ccccc1[nH]2)cc(OC)c3OC	ZINC000000240912	C(Nc2nc1ccccc1[nH]2)c3ccccc3
COc3c1OCOc1cc2CCN(C)[C@H](O)c23	ZINC000000000186	C3Cc2cc1OCOc1cc2CN3
CCOc1ccccc1CN3CCC(C(=O)N2CCCC2)CC3	ZINC000000236163	O=C(C2CCN(Cc1ccccc1)CC2)N3CCCC3
CCNc2nc1n(C)c(=O)[nH]c(=O)c1n2Cc3ccc(Cl)cc3	ZINC000000041945	O=c3[nH]c(=O)c2n(Cc1ccccc1)cnc2[nH]3
COc4cccc(NC(=O)Cn2ncc3c(=O)oc1ccccc1c23)c4	ZINC000000429315	O=C(Cn2ncc3c(=O)oc1ccccc1c23)Nc4ccccc4
CCC(C(O)=O)(C(O)=O)c1ccccc1	ZINC000001681313	c1ccccc1
CN4CCN(c3ccc(c2nc1ccc(I)cc1s2)cc3)CC4	ZINC000000591049	C4CN(c3ccc(c2nc1ccccc1s2)cc3)CCN4
CCn3cnc2sc(C(=O)Nc1ccccc1OC)c(C)c2c3=O	ZINC000000132459	O=C(Nc1ccccc1)c3cc2c(=O)[nH]cnc2s3
S=C(NC1CCCCC1)NN2CCOCC2	ZINC000000037285	S=C(NC1CCCCC1)NN2CCOCC2
CC(C)C[C@@H]1CNC[C@H]1C(O)=O	ZINC000000008681	C1CCNC1
CC(C)c1ncc(N(=O)=O)n1C	ZINC000000001580	c1c[nH]cn1
Oc3c([C@H](Nc1ccccc1)c2ccccc2)ccc4cccnc34	ZINC000000037823	N(C(c1ccccc1)c3ccc2cccnc2c3)c4ccccc4
O[C@H]1C[C@@H](C(O)=O)N=C(C(O)=O)C1	ZINC000013509255	C1CCN=CC1
Cc2nn(c1ccccc1)nc2C(=O)Oc3c(Cl)cccc3Cl	ZINC000000166237	O=C(Oc1ccccc1)c3cnn(c2ccccc2)n3
CC(C)COC(=O)c1ccc(N)cc1	ZINC000000001586	c1ccccc1
Cc3ccc(OC(=O)c2ccc(c1ccc(Cl)cc1)o2)cc3C	ZINC000000359279	O=C(Oc1ccccc1)c3ccc(c2ccccc2)o3
COc1ccc(CNC(N)=N)cc1OC	ZINC000000016573	c1ccccc1
Cc2ccc(S(=O)(=O)Nc1cccc(F)c1)cc2	ZINC000000029665	O=S(=O)(Nc1ccccc1)c2ccccc2
c3ccc(c1ccnc2scc[n+]12)cc3	ZINC000000040528	c3ccc(c1ccnc2scc[n+]12)cc3
COc4ccc([C@@H]2C(C(O)=O)=C(C)Oc3cc1OCOc1cc23)cc4	ZINC000000044642	C4Oc3cc2OC=CC(c1ccccc1)c2cc3O4
COc3ccc(/N=C/c2ccc(Sc1ccccn1)o2)cc3	ZINC000000050570	S(c1ccccn1)c3ccc(C=Nc2ccccc2)o3
Nc2nc(c1ccccc1)nc(C(F)(F)F)c2C#N	ZINC000000040505	c2ccc(c1ncccn1)cc2
C[N@]1CC[C@H]3[C@@H](C1)c2cc(C)ccc2N3C(=O)C4CC4	ZINC000000052225	O=C(C1CC1)N3C2CCNCC2c4ccccc34
Cn2cnc3c(NCCc1ccccc1)ncnc23	ZINC000000025175	C(Cc1ccccc1)Nc2ncnc3[nH]cnc23
O=C(Nc1nn[nH]n1)C=Cc2ccc[nH]2	ZINC000000012756	O=C(Nc1nn[nH]n1)C=Cc2ccc[nH]2
COCc3cc(C)nc(N2CCN(Cc1ccccc1)CC2)c3C#N	ZINC000000350608	C2CN(c1ccccn1)CCN2Cc3ccccc3
CCOC(=O)c2sc1cccc(F)c1c2N	ZINC000000111034	c2ccc1sccc1c2
CCCn2c(N1CCNCC1)nc3n(C)c(=O)n(CCC)c(=O)c23	ZINC000000042960	O=c3[nH]c(=O)c2[nH]c(N1CCNCC1)nc2[nH]3
C[C@@]1(C(O)=O)CCC[C@@H]1C(O)=O	ZINC000001661337	C1CCCC1
NS(=O)(=O)c3ccc(NC(=O)[C@@H]1C[C@@H]1c2ccccc2)cc3	ZINC000000028428	O=C(Nc1ccccc1)C2CC2c3ccccc3
OC(=O)c2cccc(n1nn[nH]c1=S)c2	ZINC000005731065	S=c1[nH]nnn1c2ccccc2
Fc3ccc(COc1ccnc2cc(C(F)(F)F)ccc12)cc3	ZINC000000042969	C(Oc1ccnc2ccccc12)c3ccccc3
Cc2ccc(c1csc(C)n1)cc2	ZINC000000006592	c2ccc(c1cscn1)cc2
COc3ccc(OCC1=NCCc2ccccc12)cc3	ZINC000000001674	C3Cc1ccccc1C(COc2ccccc2)=N3
COc4cccc5C=C2CCCC3=Cc1cccc(OC)c1OC23Oc45	ZINC000000154869	C5CC2=Cc1ccccc1OC24Oc3ccccc3C=C4C5
CC(C)(C)Nc4c(n1nnc2ccccc12)c(=O)c3ccccc3c4=O	ZINC000000091666	O=c3cc(n1nnc2ccccc12)c(=O)c4ccccc34
C[C@H]2Oc1ccc(Cl)cc1N(C[C@H](O)CO)C2=O	ZINC000000000235	O=C2COc1ccccc1N2
CC(C)OC(=O)C2=C(C)N=C1SCCC(=O)N1[C@@H]2c3ccccc3	ZINC000000075269	O=C2CCSC3=NC=CC(c1ccccc1)N23
CC(=O)N2CCC(Cc1ccccc1)CC2	ZINC000000030087	C2CC(Cc1ccccc1)CCN2
C[N+]3(C)CC[C@H](OC(=O)[C@@](O)(C1CCCC1)c2ccccc2)C3	ZINC000000000346	O=C(OC1CCNC1)C(C2CCCC2)c3ccccc3
Cc1cc(C)c(OC[C@H](O)CO)c(C)c1	ZINC000000000437	c1ccccc1
C[C@H](C(O)=O)c2ccc(C[C@H]1CCCC1=O)cc2	ZINC000000000435	O=C1CCCC1Cc2ccccc2
C[C@H]1CC(=O)NN=C1c2ccc(NN=C(C#N)C#N)cc2	ZINC000000004689	O=C2CCC(c1ccccc1)=NN2
COC(=O)C1=C(C)NC(=O)C[C@@H]1c2ccccc2	ZINC000000081277	O=C2CC(c1ccccc1)C=CN2
COc1ccccc1OC(=O)c2ccccc2	ZINC000000000349	O=C(Oc1ccccc1)c2ccccc2
C2[C@@H](c1ccccc1)N=c3sccn23	ZINC000000000044	C2C(c1ccccc1)N=c3sccn23
CC(C)Sc1nnc(N)s1	ZINC000000017831	c1nncs1
CC(=O)c2ccc(c1ccccc1)[nH]c2=O	ZINC000000006911	O=c2cccc(c1ccccc1)[nH]2
CCc1cccc(C)c1NC(=O)Cc2ccccc2OC	ZINC000000030157	O=C(Cc1ccccc1)Nc2ccccc2
On2c1CCCCc1c4c2ccc3nonc34	ZINC000000035911	C1CCc3c(C1)[nH]c4ccc2nonc2c34
O=C(CC(c1ccccc1)c2ccccc2)Nc3cccnc3	ZINC000000030155	O=C(CC(c1ccccc1)c2ccccc2)Nc3cccnc3
COC(=O)c/1c(C)n(C)c(=O)c\1=C/c3cccc(Oc2ccccc2)c3	ZINC000000573206	O=c1[nH]ccc1=Cc3cccc(Oc2ccccc2)c3
Ic3ccc2ncnc(Nc1ccccc1)c2c3	ZINC000000131519	N(c1ccccc1)c2ncnc3ccccc23
CC(C)NC(=O)CC(c1ccccc1)c2ccccc2	ZINC000000030150	C(c1ccccc1)c2ccccc2
Cc3ccc(Cl)c(Nc1ccccc1C2NC(=S)N=N2)c3Cl	ZINC000000586274	S=C3NC(c1ccccc1Nc2ccccc2)N=N3
Clc4ccc(n3c(=O)[nH]c(=O)c(=Cc2ccc(c1cccc(Cl)c1)o2)c3=O)cc4	ZINC000000843279	O=c3[nH]c(=O)c(=Cc2ccc(c1ccccc1)o2)c(=O)n3c4ccccc4
CCOc3ccc2nc(NC(=O)Cn1cc(N(=O)=O)cn1)sc2c3	ZINC000000371777	O=C(Cn1cccn1)Nc3nc2ccccc2s3
Fc3ccc(C(=O)C2CCN(CCc1ccccn1)CC2)cc3	ZINC000000011267	O=C(C2CCN(CCc1ccccn1)CC2)c3ccccc3
Nc1ccccc1C(=O)N2NC(C(F)(F)F)=C[C@@]2(O)c3ccccc3	ZINC000000062657	O=C(N1NC=CC1c2ccccc2)c3ccccc3
CCNC(=O)c2ccc1ccc(OC)cc1c2OC(C)C	ZINC000000020124	c2ccc1ccccc1c2
CCN(CC)CCSc3nnc2c1ccccc1n(C)c2n3	ZINC000000175632	c1ccc2c(c1)[nH]c3ncnnc23
C[C@@H]2CCCN(C(=O)Cc1ccccc1)C2	ZINC000000029278	O=C(Cc1ccccc1)N2CCCCC2
Cc2cc(C(F)(F)F)nc(NC(=O)NC(=O)c1cccc(F)c1)n2	ZINC000000056318	O=C(NC(=O)c1ccccc1)Nc2ncccn2
COCC[N@@](CC2CCN(Cc1ccccc1F)CC2)Cc3cc(OC)ccc3O	ZINC000011753907	C2CN(Cc1ccccc1)CCC2CNCc3ccccc3
Cc1cc(Cl)nc(Cl)c1C(=O)NC(=O)Nc2ccc(F)cc2	ZINC000000081500	O=C(NC(=O)c1cccnc1)Nc2ccccc2
Cc2nc1CCCCn1c(=O)c2CCN5CCC(c3noc4cc(F)ccc34)CC5	ZINC000000538312	O=c5c(CCN3CCC(c1noc2ccccc12)CC3)cnc4CCCCn45
CC4(C)O[C@@H](c1cccn1c2ccc(N(=O)=O)cc2)Nc3ccccc34	ZINC000000105056	C3OC(c1cccn1c2ccccc2)Nc4ccccc34
COc2cc(CNC(=O)c1cccs1)cc(OC)c2OC	ZINC000000031375	O=C(NCc1ccccc1)c2cccs2
Nc4nc(N)c3CN(C(=O)c1cccc2ccccc12)Cc3n4	ZINC000000043148	O=C(N2Cc1cncnc1C2)c3cccc4ccccc34
O[C@H]1COCO[C@H]1c2ccc(N(=O)=O)cc2	ZINC000000031377	C2CC(c1ccccc1)OCO2
Clc3ccc(C2=NN=C(N1CCCC1)SC2)cc3	ZINC000000028371	C3CCN(C2=NN=C(c1ccccc1)CS2)C3
CCC(C)(C)n2c(=O)[nH]c1CCCc1c2=O	ZINC000000067149	O=c2[nH]c1CCCc1c(=O)[nH]2
COc3cc2CCN(CCc1ccc(N)cc1)CCc2cc3OC	ZINC000000000830	C(Cc1ccccc1)N3CCc2ccccc2CC3
CC(C)[C@@](O)(CC(O)=O)C(O)=O	ZINC000000389562	nonring
O=C(Nc1ccccc1)C2SCSCS2	ZINC000000114466	O=C(Nc1ccccc1)C2SCSCS2
O=C(Nc2sc1CCCCc1c2C#N)[C@@H]3CCCO3	ZINC000000035709	O=C(Nc2cc1CCCCc1s2)C3CCCO3
Cc2cc(S(=O)(=O)Nc1cccc(N(=O)=O)c1)c(C)s2	ZINC000000111103	O=S(=O)(Nc1ccccc1)c2ccsc2
CC(C)c2ncc(S(=O)(=O)c1ccc(C(F)(F)F)cn1)c(N)n2	ZINC000000149255	O=S(=O)(c1cncnc1)c2ccccn2
Cn1ncc(C(O)=O)c1C(=O)N2CCCC[C@@H]2C(O)=O	ZINC000012397500	O=C(N1CCCCC1)c2ccn[nH]2
CN(N[C@@H]1OC(=O)c2ccccc12)c3cc(C(F)(F)F)cc(C)n3	ZINC000000142869	O=C2OC(NNc1ccccn1)c3ccccc23
O=C(NC1CCCC1)[C@H](Sc2ccccc2)c3ccccc3	ZINC000000035700	O=C(NC1CCCC1)C(Sc2ccccc2)c3ccccc3
CCOC(=O)c1c(C)oc(C)c1S(=O)(=O)Nc2ccccc2	ZINC000000114468	O=S(=O)(Nc1ccccc1)c2ccoc2
Clc2ccc([C@H](CC#N)[C@@H](C#N)c1c(Cl)cccc1Cl)cc2	ZINC000000401068	C(Cc1ccccc1)c2ccccc2
Cc2c(C(O)=O)sc3ncn(CC(=O)Nc1ccccc1C(O)=O)c(=O)c23	ZINC000031773456	O=C(Cn2cnc1sccc1c2=O)Nc3ccccc3
S=C(NC2CCN(Cc1ccccc1)CC2)Nc3cccnc3	ZINC000000066436	S=C(NC2CCN(Cc1ccccc1)CC2)Nc3cccnc3
N=c1ccccn1Cc2ccccn2	ZINC000000028252	N=c1ccccn1Cc2ccccn2
COC(=O)c2cccc(NS(=O)(=O)c1ccc(N(=O)=O)cc1)c2	ZINC000000047701	O=S(=O)(Nc1ccccc1)c2ccccc2
COc1c(Br)scc1C(N)=O	ZINC000000095837	c1ccsc1
Cc4ccc(c2n[nH]c(=S)c3c[nH]c1ccccc1n23)cc4	ZINC000000031287	S=c2[nH]nc(c1ccccc1)n4c2c[nH]c3ccccc34
CC(C)(C)OC(=O)N2Cc1[nH]nc(N)c1C2	ZINC000000009194	C1NCc2[nH]ncc12
Fc2c(F)c(F)c1c(=O)ccoc1c2F	ZINC000000033162	O=c1ccoc2ccccc12
CSc1sc(SC)c(Br)c1Br	ZINC000000042383	c1ccsc1
CCSc1sc(CN(C)C)cc1\C=N\O	ZINC000000042380	c1ccsc1
COc4ccc(c2c1C(=O)CC(C)(C)Cc1nn2c3ccccc3)cc4	ZINC000000090957	O=C3CCCc4nn(c1ccccc1)c(c2ccccc2)c34
S(C(c1ccccc1)c2ccccc2)c4nnc(c3ccco3)o4	ZINC000000063857	S(C(c1ccccc1)c2ccccc2)c4nnc(c3ccco3)o4
Cc1ccccc1NS(=O)(=O)c3ccc(N2CCCC2=O)cc3	ZINC000000139748	O=C1CCCN1c3ccc(S(=O)(=O)Nc2ccccc2)cc3
CCc4ccc([C@@H]3C[C@@H](c1ccccc1OC)n2nc(N)nc2N3)cc4	ZINC000000531442	C3C(c1ccccc1)Nc2ncnn2C3c4ccccc4
Fc4ccc(N3CCN(CCCn1c(=O)[nH]c2ccccc12)CC3)cc4	ZINC000000605896	O=c2[nH]c1ccccc1n2CCCN4CCN(c3ccccc3)CC4
COc1cc(Br)c(O)c(C=O)c1	ZINC000000153448	c1ccccc1
OC(=O)c2ccc(n1ccc(=O)cc1C(O)=O)cc2	ZINC000006506033	O=c2ccn(c1ccccc1)cc2
Cc3cc(C)c(S(=O)(=O)N2CCN(c1ccccc1)CC2)c(C)c3	ZINC000000101517	O=S(=O)(N2CCN(c1ccccc1)CC2)c3ccccc3
COc3ccc([C@H](O)c1nccn1Cc2ccccc2)cc3OC	ZINC000000034273	C(c1ccccc1)c2nccn2Cc3ccccc3
Cn2ccc(\C=c1\sc(=S)n([C@@H](CCC(O)=O)C(O)=O)c1=O)c2	ZINC000005374005	O=c1[nH]c(=S)sc1=Cc2cc[nH]c2
Clc3ccc(NC(=O)CN1CCCc2ccccc12)cc3Cl	ZINC000000031570	O=C(CN1CCCc2ccccc12)Nc3ccccc3
COc4ccc(n2nnc3c(=O)n(Cc1ccc(C)cc1)cnc23)cc4	ZINC000000252835	O=c3n(Cc1ccccc1)cnc4n(c2ccccc2)nnc34
CC(N=Nc1ccc(N(=O)=O)cc1N(=O)=O)C(C)(C)C(C(O)=O)C(O)=O	ZINC000008829824	c1ccccc1
CC(C)[C@@H]2NC(=O)N(c1ccccc1)C2=O	ZINC000000036418	O=C1CNC(=O)N1c2ccccc2
Cc2nnc(SCC(=O)Nc1ccc(Cl)c(Cl)c1)n2N	ZINC000000032953	O=C(CSc1nnc[nH]1)Nc2ccccc2
CC(C)(C)C(=O)Nc2ccc(NS(=O)(=O)c1ccccc1)c(O)c2	ZINC000000396454	O=S(=O)(Nc1ccccc1)c2ccccc2
COc2ccc(c1nnc(SCC(=O)N(C(C)C)C(C)C)o1)cc2	ZINC000000415791	c2ccc(c1nnco1)cc2
COc3ccc(C(=O)N2CCN(c1ccc(C)cc1)CC2)cc3OC	ZINC000000099858	O=C(N2CCN(c1ccccc1)CC2)c3ccccc3
Cc3ccc(S(=O)(=O)Nc2ccn(c1ccccc1)n2)cc3	ZINC000000185421	O=S(=O)(Nc2ccn(c1ccccc1)n2)c3ccccc3
CC(C)(C)[C@@]1(O)C=C(C(F)(F)F)NN1C(=O)c2cccc(Cl)c2	ZINC000000067586	O=C(N1CC=CN1)c2ccccc2
O=C(NC(=S)N(Cc1ccccc1)c2ccccc2)c3cccnc3	ZINC000000346490	O=C(NC(=S)N(Cc1ccccc1)c2ccccc2)c3cccnc3