Cc1onc(-c2ccccc2)c1C(=O)N/N=C/c1ccc([N+](=O)[O-])s1 ZINC000001001081 FG Annotated Reactive O=C1/C(=C/c2ccco2)N=C(N2CCOCC2)N1c1cccc(Cl)c1 ZINC000001016290 FG Annotated Anodyne CC1=N/C(=C/c2cc(Br)cc(Br)c2O)C(=O)O1 ZINC000001041604 FG Annotated Anodyne CC(=O)Oc1ccc2c(=O)c(Oc3ccccc3)coc2c1OC(C)=O ZINC000001165779 FG Annotated Anodyne Cc1cnn(-c2ccc3nnc(-c4ccc(Br)cc4)n3n2)c1 ZINC000001170347 FG Annotated Anodyne O=C1N=C(O)/C(=C\c2cnn(-c3ccccc3)c2)C(=O)N1Cc1ccccc1 ZINC000001183471 FG Annotated Clean O=C1CCCc2c1cc(C(=O)NCc1ccccc1)c(=O)n2-c1ccccc1 ZINC000001215013 FG Annotated Anodyne Cc1ccc(C(=O)N/N=C/c2c(C)nn(-c3ccccc3)c2Cl)cn1 ZINC000001254100 FG Annotated Reactive CC1CCN([C@@H](c2ccc(N(C)C)cc2)c2nnnn2C(C)(C)C)CC1 ZINC000001330529 FG Annotated Clean CC1CCN([C@H](c2ccc(N(C)C)cc2)c2nnnn2C(C)(C)C)CC1 ZINC000001330531 FG Annotated Clean Cc1ccc2[nH]c(=O)c(CN(CCO)C(=O)Nc3ccccc3F)cc2c1 ZINC000001353006 FG Annotated Anodyne in-vitro Cc1cc(C)c2nc(SCC(=O)NC[C@H]3CCCO3)c(C#N)cc2c1 ZINC000001354207 FG Annotated Mild Cc1cc(C)c2nc(SCC(=O)NC[C@@H]3CCCO3)c(C#N)cc2c1 ZINC000001354209 FG Annotated Mild Cc1noc(C)c1C(=O)O[C@H](C(=O)NC1CCCC1)c1ccc(F)cc1 ZINC000001361148 FG Annotated Anodyne Cc1noc(C)c1C(=O)O[C@@H](C(=O)NC1CCCC1)c1ccc(F)cc1 ZINC000001361152 FG Annotated Anodyne COc1ccc([C@H](OC(=O)c2c(C)noc2C)C(=O)NC2CCCC2)cc1 ZINC000001361154 FG Annotated Anodyne COc1ccc([C@@H](OC(=O)c2c(C)noc2C)C(=O)NC2CCCC2)cc1 ZINC000001361157 FG Annotated Anodyne Cc1cccc(N(CC(=O)NC2CCCC2)C(=O)c2c(C)noc2C)c1 ZINC000001368391 FG Annotated Anodyne C#CC(=O)N(Cc1ccco1)[C@H](C(=O)NC1CCCC1)c1ccccc1F ZINC000001376651 FG Annotated Mild C#CC(=O)N(Cc1ccco1)[C@@H](C(=O)NC1CCCC1)c1ccccc1F ZINC000001376652 FG Annotated Mild Cc1ccc2c(c1)cc(CN(Cc1ccccc1)C(=O)N(C)C)c1nnnn12 ZINC000001376912 FG Annotated Anodyne COc1ccc([C@H](OC(=O)c2ccco2)C(=O)NCc2ccco2)cc1 ZINC000001381067 FG Annotated Anodyne COc1ccc([C@@H](OC(=O)c2ccco2)C(=O)NCc2ccco2)cc1 ZINC000001381068 FG Annotated Anodyne O=C(Nc1nnc(SCC(=O)N2CCCCC2)s1)C1CCCCC1 ZINC000001381484 FG Annotated Anodyne O=C(O)CCNC(=O)c1cc2cc(CCC3CCNCC3)sc2s1 ZINC000001484517 FG Annotated Anodyne COc1cc(C[S@@](=O)c2nc3cscc3[nH]2)ncc1Br ZINC000001485842 FG Annotated Anodyne Cc1nsc(-c2ccc(N3CCN(c4cccc(Cl)c4)CC3)nn2)n1 ZINC000001486864 FG Annotated Anodyne CCc1c(C(=O)c2cc(C)cc(C)c2)n(CC2CCCC2)c(=O)[nH]c1=O ZINC000001487091 FG Annotated Anodyne C[C@H]1CCc2cc(F)cc3c(=O)c(C(=O)NCCc4ccncc4)cn1c23 ZINC000001487292 FG Annotated Anodyne C[C@H]1SC(=O)NN=C1c1ccc2c(c1)C1(SCCCS1)C(=O)N2 ZINC000001488559 FG Annotated Anodyne CCC(=O)c1ccc(F)c([C@H]2C[C@H]2NC(=O)Nc2ccc(C#N)cn2)c1O ZINC000001490703 FG Annotated Mild CS(=O)(=O)c1ccc(-n2nc(C(F)(F)F)nc2C2CCCCC2)nc1 ZINC000001491304 FG Annotated Anodyne O=c1cc(-c2ccc(Br)cc2)sc(N2CCOCC2)c1 ZINC000001492321 FG Annotated Anodyne O=c1cc(-c2cccc(Br)c2)sc(N2CCOCC2)c1 ZINC000001492322 FG Annotated Anodyne Cc1cnccc1NC(=O)c1c(O)c2cccnc2n(-c2ccccc2)c1=O ZINC000100013291 FG Annotated Anodyne COc1cccc2c1nc1n2CCC(O)=C1C(=O)Nc1ccccc1F ZINC000100018357 FG Annotated Anodyne COc1ccc2c(c1)nc1n2CCC(O)=C1C(=O)Nc1ccccc1F ZINC000100018475 FG Annotated Anodyne C[C@@H]1CC[C@H]2[C@@H](C)C(=O)N(Cc3ccccn3)[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000100036598 FG Annotated Reactive C[C@@H]1CC[C@@H]2[C@@H](C)C(=O)N(Cc3ccccn3)[C@H]3O[C@]4(C)CC[C@@H]1[C@]32O4 ZINC000100036604 FG Annotated Anodyne C[C@@H]1CC[C@@H]2[C@@H](C)C(=O)N(Cc3ccccn3)[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23O4 ZINC000100036612 FG Annotated Anodyne CCC1=C(C)N/C(=C2/C=CC=CC2=O)N(CCc2ccccc2F)C1=O ZINC000100057622 FG Annotated Mild in-vitro O=C(Nc1ccc2c(c1)OCO2)c1ccccc1Cn1ccc2ncnc-2c1 ZINC000100062288 FG Annotated Anodyne C/C=C1/C=[N+]2CCc3c([nH]c4ccccc34)[C@@H]2C[C@@H]1/C(=C/O)C(=O)OC ZINC000100066744 FG Annotated Clean in-vitro C=CCN1[C@H](c2ccccn2)C(C(=O)OC)=C(O)C[C@@H]1c1ccccn1 ZINC000100073469 FG Annotated Mild Cc1ccc(-n2c(SCC(N)=O)nc3c4ccccc4nc-3c2O)cc1 ZINC000100086870 FG Annotated Anodyne CC[C@H]1C/C=C\C[C@@H](c2ccc(OC)cc2OC)NC(=O)[C@@H](C)CC(=O)N1 ZINC000100087027 FG Annotated Anodyne CC[C@H]1C/C=C\C[C@@H](c2ccc(OC)cc2OC)NC(=O)[C@H](C)CC(=O)N1 ZINC000100087968 FG Annotated Anodyne O=C(Nc1ccccn1)N1[C@@H]2CC[C@@H]1CC(S(=O)(=O)c1ccccc1)C2 ZINC000100091479 FG Annotated Anodyne O=C(Nc1ccncc1)N1[C@@H]2CC[C@@H]1CC(S(=O)(=O)c1ccccc1)C2 ZINC000100091994 FG Annotated Anodyne C/C=C/c1ccc([C@H]2[C@H]3CNC[C@@H]2N3S(=O)(=O)c2ccccc2C)cc1 ZINC000100092580 FG Annotated Anodyne C/C=C/c1ccc([C@H]2[C@H]3CNC[C@@H]2N3S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000100093553 FG Annotated Anodyne CC(C)NC(=O)N1[C@@H]2CNC[C@H]1[C@@H]2c1ccc(-c2ccc(C#N)cc2)cc1 ZINC000100093809 FG Annotated Mild COc1ccc(-c2ccc([C@H]3[C@H]4CNC[C@@H]3N4Cc3cncnc3)cc2)cc1 ZINC000100094175 FG Annotated Anodyne CC(C)NC(=O)N1[C@@H]2CNC[C@H]1[C@@H]2c1ccc(-c2cccc(C#N)c2)cc1 ZINC000100094385 FG Annotated Mild N#Cc1ccc(-c2ccc([C@H]3[C@H]4CN(C(=O)C5CCC5)C[C@@H]3N4)cc2)cc1 ZINC000100100054 FG Annotated Mild C/C=C/c1ccc([C@@H]2[C@H]3CN(S(=O)(=O)c4ccccc4C)C[C@@H]2N3)cc1 ZINC000100101422 FG Annotated Anodyne C/C=C/c1ccc([C@H]2[C@H]3CN(S(=O)(=O)c4ccccc4C)C[C@@H]2N3)cc1 ZINC000100101424 FG Annotated Anodyne O=c1oc2ccccc2c(O)c1C1=NC(S)=N[C@H](c2cccnc2)C1 ZINC000100104059 FG Annotated Anodyne O=c1oc2ccccc2c(O)c1C1=NC(S)=N[C@@H](c2cccnc2)C1 ZINC000100104063 FG Annotated Anodyne N#Cc1ccc(-c2ccc([C@@H]3[C@H]4CN(C(=O)C5CCC5)C[C@@H]3N4)cc2)cc1 ZINC000100104866 FG Annotated Mild O=C(c1ccccn1)N1C[C@H]2N[C@@H](C1)[C@H]2c1ccc(-c2ccccc2F)cc1 ZINC000100105858 FG Annotated Anodyne O=C(c1ccccn1)N1C[C@H]2N[C@@H](C1)[C@@H]2c1ccc(-c2ccccc2F)cc1 ZINC000100105860 FG Annotated Anodyne O=C(Cc1ccncc1)N1C[C@H]2N[C@@H](C1)[C@@H]2c1ccc(-c2ccccc2)cc1 ZINC000100105908 FG Annotated Anodyne N#Cc1cccc(-c2ccc([C@H]3[C@H]4CN(Cc5cocn5)C[C@@H]3N4)cc2)c1 ZINC000100106197 FG Annotated Mild CC(C)NC(=O)N1[C@@H]2CNC[C@H]1[C@H]2c1ccc(-c2cccc(C#N)c2)cc1 ZINC000100106348 FG Annotated Mild COc1cccc(-c2ccc([C@H]3[C@H]4CNC[C@@H]3N4Cc3cncnc3)cc2)c1 ZINC000100106434 FG Annotated Anodyne CCCNC(=O)N1[C@@H]2CNC[C@H]1[C@@H]2c1ccc(-c2ccc(C#N)cc2)cc1 ZINC000100106451 FG Annotated Mild C/C=C/c1ccc([C@@H]2[C@H]3CN(C(=O)c4ccc5c(c4)OCO5)C[C@@H]2N3)cc1 ZINC000100106523 FG Annotated Anodyne C/C=C/c1ccc([C@H]2[C@H]3CN(C(=O)c4ccc5c(c4)OCO5)C[C@@H]2N3)cc1 ZINC000100106526 FG Annotated Anodyne C/C=C/c1ccc([C@@H]2[C@H]3CNC[C@@H]2N3S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000100106658 FG Annotated Anodyne Fc1cccc(CN2C[C@H]3N[C@@H](C2)[C@@H]3c2ccc(-c3cncnc3)cc2)c1 ZINC000100106696 FG Annotated Anodyne Fc1cccc(CN2C[C@H]3N[C@@H](C2)[C@H]3c2ccc(-c3cncnc3)cc2)c1 ZINC000100106754 FG Annotated Anodyne CCCNC(=O)N1C[C@H]2N[C@@H](C1)[C@@H]2c1ccc(-c2ccc(F)cc2)cc1 ZINC000100107175 FG Annotated Anodyne CCCNC(=O)N1C[C@H]2N[C@@H](C1)[C@H]2c1ccc(-c2ccc(F)cc2)cc1 ZINC000100107177 FG Annotated Anodyne Fc1cccc(-c2ccc([C@@H]3[C@H]4CN(Cc5cncnc5)C[C@@H]3N4)cc2)c1 ZINC000100107560 FG Annotated Anodyne Fc1cccc(-c2ccc([C@H]3[C@H]4CN(Cc5cncnc5)C[C@@H]3N4)cc2)c1 ZINC000100107563 FG Annotated Anodyne O=C(c1ccc(F)cc1)N1C[C@H]2N[C@@H](C1)[C@H]2c1ccc(-c2cccnc2)cc1 ZINC000100107867 FG Annotated Anodyne O=C(c1ccc(F)cc1)N1C[C@H]2N[C@@H](C1)[C@@H]2c1ccc(-c2cccnc2)cc1 ZINC000100107869 FG Annotated Anodyne Fc1cccc(-c2ccc([C@@H]3[C@H]4CNC[C@@H]3N4Cc3cncnc3)cc2)c1 ZINC000100107962 FG Annotated Anodyne N#Cc1ccc(-c2ccc([C@H]3[C@H]4CN(Cc5cocn5)C[C@@H]3N4)cc2)cc1 ZINC000100108004 FG Annotated Mild Cc1ccccc1-c1ccc([C@@H]2[C@H]3CN(Cc4cncnc4)C[C@@H]2N3)cc1 ZINC000100108112 FG Annotated Anodyne Cc1ccccc1-c1ccc([C@H]2[C@H]3CN(Cc4cncnc4)C[C@@H]2N3)cc1 ZINC000100108116 FG Annotated Anodyne C/C=C/c1ccc([C@@H]2[C@H]3CN(S(=O)(=O)c4ccc(C)cc4)C[C@@H]2N3)cc1 ZINC000100108542 FG Annotated Anodyne C/C=C/c1ccc([C@H]2[C@H]3CN(S(=O)(=O)c4ccc(C)cc4)C[C@@H]2N3)cc1 ZINC000100108546 FG Annotated Anodyne Cc1ccccc1-c1ccc([C@H]2[C@H]3CN(C(=O)c4cnccn4)C[C@@H]2N3)cc1 ZINC000100108682 FG Annotated Anodyne Cc1ccccc1-c1ccc([C@@H]2[C@H]3CN(C(=O)c4cnccn4)C[C@@H]2N3)cc1 ZINC000100108685 FG Annotated Anodyne CCCNC(=O)N1[C@@H]2CNC[C@H]1[C@H]2c1ccc(-c2ccccc2F)cc1 ZINC000100108697 FG Annotated Anodyne O=C(NC1CCCC1)N1[C@@H]2CNC[C@H]1[C@@H]2c1ccc(-c2cccnc2)cc1 ZINC000100109045 FG Annotated Anodyne O=C(NC1CCCC1)N1[C@@H]2CNC[C@H]1[C@H]2c1ccc(-c2cccnc2)cc1 ZINC000100109048 FG Annotated Anodyne CCCNC(=O)N1C[C@H]2N[C@@H](C1)[C@@H]2c1ccc(-c2cccc(F)c2)cc1 ZINC000100109325 FG Annotated Anodyne CCCNC(=O)N1C[C@H]2N[C@@H](C1)[C@H]2c1ccc(-c2cccc(F)c2)cc1 ZINC000100109331 FG Annotated Anodyne C/C=C/c1ccc([C@@H]2[C@H]3CNC[C@@H]2N3S(=O)(=O)c2ccccc2C)cc1 ZINC000100109431 FG Annotated Anodyne Fc1cccc(-c2ccc([C@H]3[C@H]4CNC[C@@H]3N4Cc3cncnc3)cc2)c1 ZINC000100114237 FG Annotated Anodyne Cc1ccccc1-c1ccc([C@H]2[C@H]3CNC[C@@H]2N3Cc2cncnc2)cc1 ZINC000100114489 FG Annotated Anodyne CCOC1=NN(c2ccccc2)C(=O)/C1=C/Nc1ccc(C(=O)OC)cc1 ZINC000100249942 FG Annotated Clean CCOC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C/NCc1cccnc1 ZINC000100249988 FG Annotated Clean COc1ccc([C@H]2C[C@H]3C(Br)=C[C@H]2C(=O)[C@]32CO2)cc1OC ZINC000100264420 FG Annotated Anodyne Cc1ccsc1[C@@H]1[C@H](C(=O)c2ccco2)C(=O)C(=O)N1Cc1ccco1 ZINC000100276004 FG Annotated Anodyne Cc1ccsc1[C@H]1[C@H](C(=O)c2ccco2)C(=O)C(=O)N1Cc1ccco1 ZINC000100276005 FG Annotated Anodyne Cc1ccsc1[C@@H]1[C@@H](C(=O)c2ccco2)C(=O)C(=O)N1Cc1ccco1 ZINC000100276009 FG Annotated Anodyne Cc1ccsc1[C@H]1[C@@H](C(=O)c2ccco2)C(=O)C(=O)N1Cc1ccco1 ZINC000100276012 FG Annotated Anodyne O=C1C(=O)N(Cc2ccco2)[C@H](c2ccccc2)[C@@H]1C(=O)c1cccs1 ZINC000100276049 FG Annotated Anodyne O=C1C(=O)N(Cc2ccco2)[C@@H](c2ccccc2)[C@@H]1C(=O)c1cccs1 ZINC000100276053 FG Annotated Anodyne O=C1C(=O)N(Cc2ccco2)[C@H](c2ccccc2)[C@H]1C(=O)c1cccs1 ZINC000100276055 FG Annotated Anodyne O=C1C(=O)N(Cc2ccco2)[C@@H](c2ccccc2)[C@H]1C(=O)c1cccs1 ZINC000100276058 FG Annotated Anodyne Cc1nnn(C23C[C@@H]4C[C@H](CC(C(=O)NC5CCCCCC5)(C4)C2)C3)n1 ZINC000100292663 FG Annotated Anodyne Cc1cccc(NC(=O)C23C[C@@H]4C[C@@H](C2)CC(n2nnc(C)n2)(C4)C3)c1 ZINC000100292678 FG Annotated Anodyne Cc1cccc(NC(=O)C23C[C@H]4C[C@H](C2)CC(n2nnc(C)n2)(C4)C3)c1 ZINC000100292685 FG Annotated Anodyne O=C1C(=O)N(c2ccccn2)[C@H](c2ccccc2)[C@@H]1C(=O)c1cccs1 ZINC000100293743 FG Annotated Anodyne O=C1C(=O)N(c2ccccn2)[C@@H](c2ccccc2)[C@@H]1C(=O)c1cccs1 ZINC000100293745 FG Annotated Anodyne O=C1C(=O)N(c2ccccn2)[C@H](c2ccccc2)[C@H]1C(=O)c1cccs1 ZINC000100293751 FG Annotated Anodyne O=C1C(=O)N(c2ccccn2)[C@@H](c2ccccc2)[C@H]1C(=O)c1cccs1 ZINC000100293757 FG Annotated Anodyne CCCC1=C/C(=C2\NNC=C2c2ccc3c(c2)OCCCO3)C(=O)C=C1O ZINC000100429688 FG Annotated Mild O=C1C([N+](=O)[O-])=Cc2oc3c(c2/C1=C/NCc1ccccc1)CCCC3 ZINC000100465264 FG Annotated Mild Cc1ccc(C2=NNC(c3ccncc3)=c3ccc4ccccc4c3=N2)cc1 ZINC000100466399 FG Annotated Anodyne C[C@@H]1CCCCN1C(=O)CSC1=NN/C(=C2/C=Nc3ccccc32)O1 ZINC000100468390 FG Annotated Anodyne C[C@H]1CCCCN1C(=O)CSC1=NN/C(=C2/C=Nc3ccccc32)O1 ZINC000100468394 FG Annotated Anodyne O=C1C=C/C(=C2/CSc3nnc(-c4ccccc4Cl)n3N2)C=C1O ZINC000100473877 FG Annotated Mild CSc1nsc2nc(=O)c(/C=C3\C(C)=Nc4ccccc43)c(N)n12 ZINC000100475282 FG Annotated Anodyne COC1=C/C(=C(\S)NCc2ccccc2)C=C(Br)C1=O ZINC000100477350 FG Annotated Mild CCCCNC(=O)C1=CC2=N[C@H](c3ccccc3)C[C@H](C(F)(F)F)N2N1 ZINC000100483755 FG Annotated Anodyne CCCCNC(=O)C1=CC2=N[C@@H](c3ccccc3)C[C@H](C(F)(F)F)N2N1 ZINC000100483757 FG Annotated Anodyne CCCCNC(=O)C1=CC2=N[C@H](c3ccccc3)C[C@@H](C(F)(F)F)N2N1 ZINC000100483760 FG Annotated Anodyne CCCCNC(=O)C1=CC2=N[C@@H](c3ccccc3)C[C@@H](C(F)(F)F)N2N1 ZINC000100483762 FG Annotated Anodyne C=C(C)COC1=CC(=O)/C(=C2/NC=NC=C2Oc2ccc(OC)cc2)C=C1 ZINC000100487836 FG Annotated Mild Cc1csc(NC(=O)c2c(O)n(CC(C)C)c3c(c2=O)CCCC3)n1 ZINC000100489538 FG Annotated Anodyne CCOc1ccc(/C=N\NC(=S)N[C@@H]2C[C@@H]3C[C@@H]2[C@H]2C=CC[C@H]32)cc1 ZINC000100492996 FG Annotated Mild CCOc1ccc(/C=N\NC(=S)N[C@H]2C[C@@H]3C[C@@H]2[C@H]2C=CC[C@H]32)cc1 ZINC000100493002 FG Annotated Mild C=C(C)COC1=CC(=O)/C(=C2\NC(N)=NC=C2c2ccc(Cl)cc2)C=C1 ZINC000100493410 FG Annotated Mild COCc1cc(=O)n2[nH]c(-c3ccsc3-n3c(C)ccc3C)cc2n1 ZINC000100505571 FG Annotated Anodyne COc1ccc(-n2c(SC)nc(=O)c(Cc3ccccc3)c2O)cc1 ZINC000100507149 FG Annotated Anodyne COc1cc(-c2c3c(C)[nH]n(-c4ccccc4)c-3nc(=O)c2C#N)ccc1O ZINC000100508989 FG Annotated Mild C/C(NNC(=O)CSCc1ccccc1Cl)=C1/C=C(O)C=CC1=O ZINC000100527609 FG Annotated Reactive Cc1[nH]n(-c2ccccc2)c(=O)c1[C@@H](c1ccccc1[N+](=O)[O-])C(C#N)C#N ZINC000100530019 FG Annotated Mild Cc1[nH]n(-c2ccccc2)c(=O)c1[C@H](c1ccccc1[N+](=O)[O-])C(C#N)C#N ZINC000100530024 FG Annotated Mild C=C(C)COC1=CC(=O)/C(=C2/NNC(C)=C2c2ccccc2OC)C=C1 ZINC000100536623 FG Annotated Mild C=C(C)COC1=CC(=O)/C(=C2/NNC(C)=C2Oc2ccccc2OC)C=C1 ZINC000100536630 FG Annotated Mild C=C(C)COC1=CC(=O)/C(=C2/NNC=C2Oc2ccccc2OCC)C=C1 ZINC000100536645 FG Annotated Mild CCOC(=O)c1c(N/C=C2\C=CC(C)=CC2=O)sc2c1CCN(C)C2 ZINC000100558194 FG Annotated Mild C[C@@]1(O)/C(=C2/C(=O)Nc3ccc(Br)cc32)Nc2ccccc21 ZINC000100574606 FG Annotated Anodyne C[C@]1(O)/C(=C2/C(=O)Nc3ccc(Br)cc32)Nc2ccccc21 ZINC000100574607 FG Annotated Anodyne COC(=O)c1ccc(CSC2=NN/C(=C3\C=Nc4ccccc43)N2C)o1 ZINC000100582655 FG Annotated Anodyne O=c1cc(-c2ccc([N+](=O)[O-])cc2)nc2cc(-c3ccc(F)cc3)[nH]n12 ZINC000100591487 FG Annotated Bother CCc1ccccc1N/C=c1/c(C)c(C#N)c2nc3ccccc3n2c1=O ZINC000100592669 FG Annotated Mild Cc1cc([N+](=O)[O-])ccc1OCc1cn([C@H]2C[C@@H]3CC[C@H](C2)[N+]3(C)C)nn1 ZINC000100597391 FG Annotated Bother CN1[C@H]2CC[C@@H]1C[C@@H](n1cc(COc3ccccc3-c3ccno3)nn1)C2 ZINC000100597501 FG Annotated Anodyne Cc1cc(C)nc(SCCCc2cn([C@H]3C[C@@H]4CC[C@H](C3)N4C)nn2)n1 ZINC000100597540 FG Annotated Anodyne CC(C)C[C@H]1NC(=O)C([S@@](=O)Cc2cccc(C(F)(F)F)c2)=C1O ZINC000100603566 FG Annotated Anodyne CC(C)C[C@@H]1NC(=O)C([S@@](=O)Cc2cccc(C(F)(F)F)c2)=C1O ZINC000100603573 FG Annotated Anodyne CC(C)C[C@H]1NC(=O)C([S@](=O)Cc2cccc(C(F)(F)F)c2)=C1O ZINC000100603576 FG Annotated Anodyne CC(C)C[C@@H]1NC(=O)C([S@](=O)Cc2cccc(C(F)(F)F)c2)=C1O ZINC000100603583 FG Annotated Anodyne c1ccc2nc(N3CC(Oc4nccnc4N4C[C@@H]5CC[C@@H]4C5)C3)ccc2c1 ZINC000100619886 FG Annotated Anodyne NC(=O)c1ccc2c(c1)CC[C@H]1[C@H]2CCCN1C(=O)c1ccc2c(c1)N=CC2 ZINC000100620846 FG Annotated Anodyne NC(=O)c1ccc2c(c1)CC[C@H]1[C@@H]2CCCN1C(=O)c1ccc2c(c1)N=CC2 ZINC000100620848 FG Annotated Anodyne NC(=O)c1cccc2c1[C@@H]1CCCN(C(=O)c3ccc4c(c3)N=CC4)[C@H]1CC2 ZINC000100620972 FG Annotated Anodyne NC(=O)c1cccc2c1[C@H]1CCCN(C(=O)c3ccc4c(c3)N=CC4)[C@H]1CC2 ZINC000100620978 FG Annotated Anodyne CNC(=O)c1ccc2c(c1)C[C@H]1[C@@H]2CCCN1C(=O)c1ccc2c(c1)N=CC2 ZINC000100621047 FG Annotated Anodyne CNC(=O)c1ccc2c(c1)C[C@H]1[C@H]2CCCN1C(=O)c1ccc2c(c1)N=CC2 ZINC000100621051 FG Annotated Anodyne Cc1noc(C)c1CSc1nc2nncc-2c(O)n1-c1ccccc1 ZINC000100630989 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc(F)cc4)ccc31)[C@@H]1CC[C@@H](C2)N1 ZINC000100632169 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc(F)cc4)ccc31)[C@H]1CC[C@H](C2)N1 ZINC000100632178 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc(O)cc4)ccc31)[C@@H]1CC[C@@H](C2)N1 ZINC000100632227 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc(O)cc4)ccc31)[C@H]1CC[C@H](C2)N1 ZINC000100632243 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4cccc(O)c4)ccc31)[C@@H]1CC[C@@H](C2)N1 ZINC000100632392 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4cccc(O)c4)ccc31)[C@H]1CC[C@H](C2)N1 ZINC000100632393 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccsc4)ccc31)[C@@H]1CC[C@@H](C2)N1 ZINC000100632475 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccsc4)ccc31)[C@H]1CC[C@H](C2)N1 ZINC000100632482 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4)cc(F)c31)[C@@H]1CC[C@@H](C2)N1 ZINC000100632741 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4)cc(F)c31)[C@H]1CC[C@H](C2)N1 ZINC000100632744 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4O)ccc31)[C@@H]1CC[C@@H](C2)N1 ZINC000100632866 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4O)ccc31)[C@H]1CC[C@H](C2)N1 ZINC000100632871 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4F)ccc31)[C@@H]1CC[C@@H](C2)N1 ZINC000100632929 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4F)ccc31)[C@H]1CC[C@H](C2)N1 ZINC000100632930 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4)cc(O)c31)[C@@H]1CC[C@@H](C2)N1 ZINC000100633089 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4)cc(O)c31)[C@H]1CC[C@H](C2)N1 ZINC000100633092 FG Annotated Anodyne N=C(Nc1ccccc1I)N[C@@H]1C[C@@H]2CC[C@@H]1C2 ZINC000100653372 FG Annotated Anodyne N=C(Nc1ccccc1I)N[C@H]1C[C@@H]2CC[C@@H]1C2 ZINC000100653374 FG Annotated Anodyne C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)/C(O)=C1/C(=O)[C@@H](CO)N(C)C1=O ZINC000100658890 FG Annotated Mild Cc1nc(N)c2ccc(-c3nn(C)/c(=N\C4CCCCC4)s3)cc2n1 ZINC000100658910 FG Annotated Anodyne CC(=O)SC[C@H](C)C(=O)N(CC(=O)O)C[C@@H]1C[C@@H]2C[C@@H]([C@@H]1C)C2(C)C ZINC000100682674 FG Annotated Anodyne CC(=O)SC[C@H](C)C(=O)N(CC(=O)O)C[C@@H]1C[C@@H]2C[C@@H]([C@H]1C)C2(C)C ZINC000100682678 FG Annotated Anodyne CC(=O)SC[C@H](C)C(=O)N(CC(=O)O)C[C@H]1C[C@@H]2C[C@@H]([C@@H]1C)C2(C)C ZINC000100682682 FG Annotated Anodyne CC(=O)SC[C@H](C)C(=O)N(CC(=O)O)C[C@H]1C[C@@H]2C[C@@H]([C@H]1C)C2(C)C ZINC000100682685 FG Annotated Anodyne C=CCO/C(O)=C1/C(C)=Nc2nc(O)nc(O)c2[C@@H]1c1ccc(F)cc1 ZINC000100703120 FG Annotated Mild C=CCO/C(O)=C1/C(C)=Nc2nc(O)nc(O)c2[C@H]1c1ccc(F)cc1 ZINC000100703122 FG Annotated Mild CCOC(=O)c1ccccc1N/C(O)=C/c1nc2ccccc2nc1O ZINC000100703687 FG Annotated Anodyne Cn1c(SCC(=O)N2CCCCCC2)nc2c3ccccc3nc-2c1O ZINC000100705122 FG Annotated Anodyne CC1CCN(C(=O)CSc2nc3c4ccccc4nc-3c(O)n2C)CC1 ZINC000100705165 FG Annotated Anodyne COC(=O)c1ccc(CSc2nc3c4ccccc4nc-3c(O)n2C)o1 ZINC000100705205 FG Annotated Anodyne C=CCO/C(O)=C1/C(C)=Nc2nc(O)nc(O)c2[C@H]1c1ccc(C)cc1 ZINC000100706489 FG Annotated Mild C=CCO/C(O)=C1/C(C)=Nc2nc(O)nc(O)c2[C@@H]1c1ccc(C)cc1 ZINC000100706491 FG Annotated Mild C[C@@H]1CC/C(=N\Nc2cccc3ccccc23)c2ncc(C(=O)O)c(=O)n21 ZINC000100761310 FG Annotated Mild C[C@H]1CC/C(=N/Nc2cccc3ccccc23)c2ncc(C(=O)O)c(=O)n21 ZINC000100761320 FG Annotated Mild Cc1cc(C)c(N/N=C2/CC[C@H](C)n3c2ncc(C(=O)O)c3=O)c(C)c1 ZINC000100761501 FG Annotated Mild Cc1cc(C)c(N/N=C2\CC[C@@H](C)n3c2ncc(C(=O)O)c3=O)c(C)c1 ZINC000100761508 FG Annotated Mild C[C@@H]1CC/C(=N\Nc2ccc3ccccc3c2)c2ncc(C(=O)O)c(=O)n21 ZINC000100761874 FG Annotated Mild C[C@H]1CC/C(=N/Nc2ccc3ccccc3c2)c2ncc(C(=O)O)c(=O)n21 ZINC000100761879 FG Annotated Mild Cc1ccc2c(c1)CC=C(c1ccccc1)C(N1CCN(CCO)CC1)=N2 ZINC000100765071 FG Annotated Anodyne C=C(C)[C@@H]1C[C@]2(C)C(=CC1=O)CC[C@@H](OC(=O)/C=C/[S@@](C)=O)[C@H]2C ZINC000100775841 FG Annotated Mild in-man endogenous C=C(C)[C@@H]1C[C@]2(C)C(=CC1=O)CC[C@@H](OC(=O)/C=C/[S@@](C)=O)[C@@H]2C ZINC000100775845 FG Annotated Mild in-man endogenous C=C(C)[C@@H]1C[C@]2(C)C(=CC1=O)CC[C@H](OC(=O)/C=C/[S@@](C)=O)[C@H]2C ZINC000100775849 FG Annotated Mild in-man endogenous C=C(C)[C@@H]1C[C@]2(C)C(=CC1=O)CC[C@H](OC(=O)/C=C/[S@@](C)=O)[C@@H]2C ZINC000100775851 FG Annotated Mild in-man endogenous C=C1[C@H](O)[C@]23CC[C@@H](C(C)(C)C(=O)O)[C@](C)(CC(=O)O)[C@H]2CC[C@@H]1C3 ZINC000100782608 FG Annotated Mild in-man endogenous C=C1[C@H](O)[C@]23CC[C@H](C(C)(C)C(=O)O)[C@](C)(CC(=O)O)[C@H]2CC[C@@H]1C3 ZINC000100782609 FG Annotated Mild in-man endogenous N[C@]12CC(C(F)(F)F)=C[C@@H](Cc3nc(O)ccc31)/C2=C\C(F)(F)F ZINC000100809900 FG Annotated Anodyne N[C@@]12CC(C(F)(F)F)=C[C@H](Cc3nc(O)ccc31)/C2=C\C(F)(F)F ZINC000100809904 FG Annotated Anodyne Clc1ccc(C#CCSc2nsnc2C23CN4C[C@H]2[C@@H]3C4)cc1 ZINC000100811045 FG Annotated Mild Clc1ccc(C#CCSc2nsnc2C23CN4C[C@@H]2[C@H]3C4)cc1 ZINC000100811047 FG Annotated Mild CSc1cccc2c1c(O)c(C(=O)N(C)c1ccccc1)c(=O)n2C ZINC000100814262 FG Annotated Anodyne COc1cccc2c1c(O)c(C(=O)N(C)c1cccc(Cl)c1)c(=O)n2C ZINC000100815928 FG Annotated Anodyne COc1ccc(N(C)C(=O)c2c(O)c3ccccc3n(C3CC3)c2=O)cc1 ZINC000100818861 FG Annotated Anodyne Clc1cccc(C#CCSc2nsnc2C23CN4C[C@H]2[C@@H]3C4)c1 ZINC000100829423 FG Annotated Mild Clc1cccc(C#CCSc2nsnc2C23CN4C[C@@H]2[C@H]3C4)c1 ZINC000100829427 FG Annotated Mild CC(C)N1C[C@@H]2CC(NC(=O)N3CC(C)(C)c4ccccc43)C[C@@H](C1)N2C ZINC000100831460 FG Annotated Anodyne CC(C)N1C[C@H]2CC(NC(=O)N3CC(C)(C)c4ccccc43)C[C@H](C1)N2C ZINC000100831463 FG Annotated Anodyne CCC(=O)N1[C@@H]2CC[C@@H]3[C@H]1CC[C@@H]2N3C/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000100854344 FG Annotated Bother CCC(=O)N1[C@H]2CC[C@@H]1[C@@H]1CC[C@@H]2N1C/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000100854374 FG Annotated Bother CCC(=O)N1[C@H]2CC[C@H]1[C@@H]1CC[C@@H]2N1C/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000100854378 FG Annotated Bother CCC(=O)N1[C@H]2CC[C@H]1[C@H]1CC[C@@H]2N1C/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000100854388 FG Annotated Bother CCOC(=O)Nc1cc2c(c(N)n1)N=C(COc1ccccc1)[C@@H](C)N2 ZINC000100871265 FG Annotated Anodyne OC1=C2C(=Nc3cc4c(cc3[C@H]2c2ccc3c(c2)OCO3)OCO4)CO1 ZINC000100871371 FG Annotated Anodyne OC1=C2C(=Nc3cc4c(cc3[C@@H]2c2ccc3c(c2)OCO3)OCO4)CO1 ZINC000100871374 FG Annotated Anodyne CNCc1ccc(NCCCN(C)C)c2c(=O)c3ccccc3sc12 ZINC000100892199 FG Annotated Bother Cc1c(N2CCC(C)CC2)c(N)cc2c(=O)c(C(=O)O)cn(C3CC3)c12 ZINC000100894870 FG Annotated Anodyne COc1ccc(NC(=O)[C@@H]2C(=O)N(C)[C@@]3(C)C[C@H]2c2ccccc2O3)cc1 ZINC000100906905 FG Annotated Anodyne COc1ccc(NC(=O)[C@@H]2C(=O)N(C)[C@]3(C)C[C@@H]2c2ccccc2O3)cc1 ZINC000100906908 FG Annotated Anodyne OC1=C2C(=Nc3nnnn3[C@@H]2c2ccc(F)c(Br)c2)CCC1 ZINC000100914061 FG Annotated Anodyne OC1=C2C(=Nc3nnnn3[C@H]2c2ccc(F)c(Br)c2)CCC1 ZINC000100914064 FG Annotated Anodyne Cc1c(N2CC3CCC2CC3)c(N)cc2c(=O)c(C(=O)O)cn(C3CC3)c12 ZINC000100916087 FG Annotated Anodyne Cc1c(N2CCC[C@H](C)C2)c(N)cc2c(=O)c(C(=O)O)cn(C3CC3)c12 ZINC000100918390 FG Annotated Anodyne Cc1c(N2CCC[C@@H](C)C2)c(N)cc2c(=O)c(C(=O)O)cn(C3CC3)c12 ZINC000100918392 FG Annotated Anodyne Cc1c(N2CCCCCC2)c(N)cc2c(=O)c(C(=O)O)cn(C3CC3)c12 ZINC000100918980 FG Annotated Anodyne CCOC(=O)[C@H](I)[C@]12CCC[C@@H](C1)C(C)(C)OO2 ZINC000100919666 FG Annotated Reactive CCOC(=O)[C@@H](I)[C@]12CCC[C@@H](C1)C(C)(C)OO2 ZINC000100919668 FG Annotated Reactive CC(=O)OC1=CC[C@@H]2C(=C1)[C@@H]1c3cc(OC(C)=O)ccc3C[C@@H]2N(C)[C@@H]1C ZINC000100931670 FG Annotated Anodyne COC1=C(OC)C[C@@H]2C(=C1)[C@@H]1c3cc(OC)c(OC)cc3C[C@@H]2N(C)[C@@H]1C ZINC000100931673 FG Annotated Anodyne COC1=C(OC)C[C@H]2C(=C1)[C@H]1c3cc(OC)c(OC)cc3C[C@H]2N(C)[C@H]1C ZINC000100931689 FG Annotated Anodyne Cc1c[nH]c2c1[C@]13C[C@@H]1CN(C(=O)c1cc4ccccc4n1C)C3=CC2=O ZINC000100956555 FG Annotated Mild Cc1c[nH]c2c1[C@@]13C[C@H]1CN(C(=O)c1cc4ccccc4n1C)C3=CC2=O ZINC000100956557 FG Annotated Mild Cc1c[nH]c2c1[C@]13C[C@@H]1CN(C(=O)c1ccc4ccccc4n1)C3=CC2=O ZINC000100956561 FG Annotated Mild Cc1c[nH]c2c1[C@@]13C[C@H]1CN(C(=O)c1ccc4ccccc4n1)C3=CC2=O ZINC000100956564 FG Annotated Mild CSc1ccc2c(c1)c(O)c(C(=O)N(C)c1ccc(F)cc1)c(=O)n2C ZINC000100988370 FG Annotated Anodyne CO[C@H]1O[C@@]2(C)OO[C@]13[C@H](CCO)CCC[C@@H]3C[C@H]2Cc1ccccc1 ZINC000100999552 FG Annotated Reactive CO[C@H]1O[C@@]2(C)OO[C@]13[C@H](CCO)CCC[C@@H]3C[C@@H]2Cc1ccccc1 ZINC000100999554 FG Annotated Reactive O=[N+]([O-])c1ccc(S(=O)(=O)NC2[C@H]3CC[C@H]2Cc2ccccc2C3)cc1 ZINC000101007646 FG Annotated Bother O=[N+]([O-])c1ccc(S(=O)(=O)NC2[C@@H]3CC[C@@H]2Cc2ccccc2C3)cc1 ZINC000101007648 FG Annotated Bother Cc1cc(-c2nnc3c4c(c(OCc5ccccn5)nn23)[C@@H]2CC[C@@H]4C2)no1 ZINC000101011559 FG Annotated Anodyne Cc1cc(-c2nnc3c4c(c(OCc5ccccn5)nn23)[C@H]2CC[C@H]4C2)no1 ZINC000101011565 FG Annotated Anodyne COC(=O)C1=C(c2ccc(I)cc2)C[C@@H]2CC[C@@H]1O2 ZINC000101019553 FG Annotated Anodyne COC(=O)C1=C(c2ccc(I)cc2)C[C@H]2CC[C@H]1O2 ZINC000101019558 FG Annotated Anodyne C[C@@H](COC(=O)c1ccccc1O)CC1=C(O)C(=O)c2ccccc2C1=O ZINC000101021244 FG Annotated Mild O=C1[C@H]2[C@@H]3C=C[C@H]([C@@H]4C[C@H]34)[C@H]2C(=O)N1c1ccc([N+](=O)[O-])c2ccccc12 ZINC000101027466 FG Annotated Bother O=C1[C@H]2[C@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C(=O)N1c1ccc([N+](=O)[O-])c2ccccc12 ZINC000101027467 FG Annotated Bother COc1c(C(=O)/C=C(\O)c2ccc(CO)c(CO)c2)ccc2occc12 ZINC000101079637 FG Annotated Mild COC(=O)/C=C1/CN2[C@@H]3CC[C@@H]2[C@@H]1[C@H](c1ccc(Br)cc1)C3 ZINC000101090381 FG Annotated Anodyne O=C(N[C@@H]1CC[C@@H](c2ccc(O)cc2)CC1)[C@@H]1Cc2ccccc2CN1 ZINC000101096782 FG Annotated Anodyne O=C(N[C@@H]1CC[C@@H](c2ccc(O)cc2)CC1)[C@H]1Cc2ccccc2CN1 ZINC000101096784 FG Annotated Anodyne O=c1c(Nc2ccccc2)c(Nc2cc(Cl)c([N+](=O)[O-])cc2O)c1=O ZINC000101099369 FG Annotated Bother CN(C)CCO/N=C/[C@H]1CC[C@]2(O)C[C@H]([C@@H]3CC[C@H](O)CC3)CC[C@]12C ZINC000101122248 FG Annotated Mild CN(C)CCO/N=C/[C@H]1CC[C@]2(O)C[C@@H]([C@@H]3CC[C@H](O)CC3)CC[C@]12C ZINC000101122253 FG Annotated Mild CN(C)CCO/N=C/[C@H]1CC[C@]2(O)C[C@H]([C@@H]3CC[C@@H](O)CC3)CC[C@]12C ZINC000101140305 FG Annotated Mild CN(C)CCO/N=C/[C@H]1CC[C@]2(O)C[C@@H]([C@@H]3CC[C@@H](O)CC3)CC[C@]12C ZINC000101140307 FG Annotated Mild Cc1cccc(Cl)c1N/N=C1/CC[C@H](C)n2c1ncc(C(=O)O)c2=O ZINC000101167804 FG Annotated Mild Cc1cccc(Cl)c1N/N=C1/CC[C@@H](C)n2c1ncc(C(=O)O)c2=O ZINC000101167814 FG Annotated Mild C[C@@H]1CC[C@H]2[C@@H](C)[C@](O)(C(F)(F)F)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000101168290 FG Annotated Reactive O=C1CCC/C=C\C[C@H]2[C@@H](O)C[C@@H](O)[C@H]2/C=C\[C@@H](COc2ccccc2)O1 ZINC000101168520 FG Annotated Anodyne C[C@@H]1CCC(/C=N/c2ccc3ccccc3c2)=C2NC=C(C(=O)O)C(=O)N21 ZINC000101181359 FG Annotated Mild C[C@H]1CCC(/C=N/c2ccc3ccccc3c2)=C2NC=C(C(=O)O)C(=O)N21 ZINC000101181362 FG Annotated Mild Cc1c(Cl)cccc1NC(=O)CCN1C(=O)[C@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C1=O ZINC000101212751 FG Annotated Anodyne Cc1c(Cl)cccc1NC(=O)CCN1C(=O)[C@@H]2[C@@H](C1=O)[C@H]1C=C[C@H]2CC1 ZINC000101212757 FG Annotated Anodyne CCCCc1c(O)c2cccnc2n(-c2ccc(OC)c(OC)c2)c1=O ZINC000101238918 FG Annotated Anodyne CCN(CC)C(=O)OCC[C@@H]1CCC[C@@H]2CC[C@]3(C)OO[C@@]12[C@@H](OC)O3 ZINC000101256346 FG Annotated Reactive CC(=O)c1cccc(NC(=O)N2[C@@H]3CC[C@@H]2CC(O)(c2cccnc2)C3)c1 ZINC000101260768 FG Annotated Anodyne CC(=O)c1cccc(NC(=O)N2[C@H]3CC[C@H]2CC(O)(c2cccnc2)C3)c1 ZINC000101260775 FG Annotated Anodyne CCN(CC)C(=O)OCC[C@@H]1CCC[C@@H]2CC[C@@]3(C)OO[C@]12[C@H](OC)O3 ZINC000101267461 FG Annotated Reactive CCN(CC)C(=O)OCC[C@@H]1CCC[C@@H]2CC[C@]3(C)OO[C@@]12[C@H](OC)O3 ZINC000101267465 FG Annotated Reactive O=C(Nc1ccc(Br)cc1)C1=C(O)[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C1=O ZINC000101270728 FG Annotated Mild COc1cc2c(cc1OC)[C@@H](c1ccc3c(c1)OCO3)C1=C(O)OCC1=N2 ZINC000101271285 FG Annotated Anodyne COc1cc2c(cc1OC)[C@H](c1ccc3c(c1)OCO3)C1=C(O)OCC1=N2 ZINC000101271288 FG Annotated Anodyne CCCCS(=O)(=O)N1C[C@H]2CC[C@H]1[C@H](C(=O)Nc1ccc(C)cc1)C2 ZINC000101283321 FG Annotated Anodyne Cc1cncn1CCCN/C(=C\[N+](=O)[O-])Nc1ccc(C(F)(F)F)cc1 ZINC000101285208 FG Annotated Anodyne CCN(CC)CCO[C@@H]1CC[C@@H]([C@@H]2CC[C@@](O)(CC(=O)O)CC2)CC1 ZINC000101316635 FG Annotated Anodyne O=C(N[C@@H]1C[C@@H]2CC[C@@H]1C2)c1cccc(N2C(=O)c3ccccc3C2=O)c1 ZINC000101328755 FG Annotated Anodyne O=C(N[C@H]1C[C@@H]2CC[C@@H]1C2)c1cccc(N2C(=O)c3ccccc3C2=O)c1 ZINC000101328760 FG Annotated Anodyne CCCCCCCCCCCCCOC1=C(O)O[C@H]([C@H](O)CO)C1=O ZINC000101329321 FG Annotated Mild CCCCCCCCCCCCCOC1=C(O)O[C@@H]([C@H](O)CO)C1=O ZINC000101329325 FG Annotated Mild CCCCCCCCCCCCCOC1=C(O)O[C@H]([C@@H](O)CO)C1=O ZINC000101329327 FG Annotated Mild CCCCCCCCCCCCCOC1=C(O)O[C@@H]([C@@H](O)CO)C1=O ZINC000101329330 FG Annotated Mild O=P(O)(O)O[C@H]1C=C(c2ccccc2F)Nc2cc3c(cc21)OCO3 ZINC000101330029 FG Annotated Anodyne O=P(O)(O)O[C@@H]1C=C(c2ccccc2F)Nc2cc3c(cc21)OCO3 ZINC000101330032 FG Annotated Anodyne C[C@@H](CC1=N[C@@H]2[C@@H](C=NN2c2ccccc2Cl)C(=O)N1)C(F)(F)F ZINC000101330037 FG Annotated Anodyne C[C@@H](CC1=N[C@H]2[C@@H](C=NN2c2ccccc2Cl)C(=O)N1)C(F)(F)F ZINC000101330038 FG Annotated Anodyne C[C@@H](CC1=N[C@@H]2[C@H](C=NN2c2ccccc2Cl)C(=O)N1)C(F)(F)F ZINC000101330040 FG Annotated Anodyne C[C@@H](CC1=N[C@H]2[C@H](C=NN2c2ccccc2Cl)C(=O)N1)C(F)(F)F ZINC000101330044 FG Annotated Anodyne C[C@H](CC1=N[C@@H]2[C@@H](C=NN2c2ccccc2Cl)C(=O)N1)C(F)(F)F ZINC000101330045 FG Annotated Anodyne C[C@H](CC1=N[C@H]2[C@@H](C=NN2c2ccccc2Cl)C(=O)N1)C(F)(F)F ZINC000101330047 FG Annotated Anodyne C[C@H](CC1=N[C@@H]2[C@H](C=NN2c2ccccc2Cl)C(=O)N1)C(F)(F)F ZINC000101330049 FG Annotated Anodyne C[C@H](CC1=N[C@H]2[C@H](C=NN2c2ccccc2Cl)C(=O)N1)C(F)(F)F ZINC000101330051 FG Annotated Anodyne CC[C@H]1C[C@H]2C[C@@]3(C(=O)OC)c4[nH]c5ccccc5c4CCN([C@@H]2C#N)[C@@H]13 ZINC000101356618 FG Annotated Mild CC[C@H]1C[C@H]2C[C@@]3(C(=O)OC)c4[nH]c5ccccc5c4CCN([C@@H]13)[C@H]2C#N ZINC000101356624 FG Annotated Mild CSc1ccc2c(c1)c(O)c(C(=O)N(C)C1CCCCC1)c(=O)n2C ZINC000101359086 FG Annotated Anodyne O=C1[C@H]2CC=CC[C@H]2C(=O)N1CCOC(=S)Nc1ccc(Cl)cc1 ZINC000101380714 FG Annotated Anodyne O=C1[C@H]2CC=CC[C@@H]2C(=O)N1CCOC(=S)Nc1ccc(Cl)cc1 ZINC000101380717 FG Annotated Anodyne CCCN1Cc2cc(-c3nnn(-c4cccnc4[18F])c3C)ccc2C1=O ZINC000101385031 FG Annotated Anodyne CC(=O)O[C@H]1C[C@H]2/C=C/CCC[C@H](C)OC(=O)/C=C/[C@@H](OC(C)=O)[C@@H]2C1 ZINC000101392714 FG Annotated Anodyne CN(C(=O)c1ccno1)[C@@H]1CC[C@@H]([C@H](N)Cc2cc(F)ccc2F)CC1 ZINC000101403221 FG Annotated Anodyne Oc1nc2n(c3nc(Cc4ccccc4)nc1-3)C[C@@H](Cc1ccccc1)N2 ZINC000101404810 FG Annotated Anodyne COC(=O)CC[C@@]12C3=CCC[C@@H]3CC[C@@H]3CN4C[C@@H](C)[C@@H](CC[C@@]31CO)[C@@H]42 ZINC000101430249 FG Annotated Anodyne CNC1=Nc2cc(-c3cccc(CCC(=O)O)c3)sc2N2C(C)=CN[C@@H]12 ZINC000101442090 FG Annotated Anodyne CNC1=Nc2cc(-c3cccc(CCC(=O)O)c3)sc2N2C(C)=CN[C@H]12 ZINC000101442092 FG Annotated Anodyne C[C@]12CC[C@@](C)(O1)[C@@H]1C(=O)N(c3ccc(C#N)c(C(F)(F)F)c3)C(=O)[C@@H]12 ZINC000101445122 FG Annotated Mild C[C@@]12CC[C@](C)(O1)[C@@H]1C(=O)N(c3ccc(C#N)c(C(F)(F)F)c3)C(=O)[C@@H]12 ZINC000101445126 FG Annotated Mild O=C1[C@@H]2[C@@H]3CC[C@H](O3)[C@@H]2C(=O)N1c1ccc(Br)c2ccccc12 ZINC000101449055 FG Annotated Anodyne O=C1[C@@H]2[C@H]3CC[C@@H](O3)[C@@H]2C(=O)N1c1ccc(Br)c2ccccc12 ZINC000101449058 FG Annotated Anodyne Cc1cccc(NC(=O)CNC(=O)C23C[C@@H]4C[C@H](CC(Cl)(C4)C2)C3)n1 ZINC000101469208 FG Annotated Anodyne Cc1cccnc1NC(=O)CNC(=O)C12C[C@@H]3C[C@H](CC(Cl)(C3)C1)C2 ZINC000101470336 FG Annotated Anodyne CN(C)/C(Cc1ccccc1)=N/C(=N/c1ccccc1)N1CCOCC1 ZINC000101471049 FG Annotated Mild CCCCC(=O)NS(=O)(=O)c1ccc(/N=N\N2CCCCC2)cc1 ZINC000101476313 FG Annotated Clean O=C(O)c1c(=O)c2cc(F)c(N3CCCCC3)c3c2n2c(csc12)CO3 ZINC000101498998 FG Annotated Anodyne CCCNC(=O)c1c(NC(=O)[C@@H]2C[C@@H]3CC[C@@H]2C3)sc2c1CCOC2 ZINC000101500816 FG Annotated Anodyne CCCNC(=O)c1c(NC(=O)[C@H]2C[C@@H]3CC[C@@H]2C3)sc2c1CCOC2 ZINC000101500820 FG Annotated Anodyne CCNC(=O)c1c(NC(=O)C23C[C@H]4CC2C[C@@H](C4)C3)sc2c1CCOC2 ZINC000101500830 FG Annotated Anodyne CCNC(=O)c1c(NC(=O)C23C[C@@H]4CC2C[C@H](C4)C3)sc2c1CCOC2 ZINC000101500837 FG Annotated Anodyne CCOC(=O)C/N=c1\nc(-c2ccc(OC)cc2)n(-c2ccccc2)s1 ZINC000101506394 FG Annotated Anodyne CCOC(=O)C/N=c1\nc(-c2ccccc2)n(-c2ccc(OC)cc2)s1 ZINC000101506416 FG Annotated Anodyne Cc1cc(C)c(N/N=C2/CC[C@H](C)n3c2ncc(C(=O)O)c3=O)cc1C ZINC000101507493 FG Annotated Mild Cc1cc(C)c(N/N=C2\CC[C@@H](C)n3c2ncc(C(=O)O)c3=O)cc1C ZINC000101507497 FG Annotated Mild Cc1ccc(COC(=O)N2CC[C@@H](CNc3ncccn3)[C@H]([18F])C2)cc1 ZINC000101509593 FG Annotated Anodyne Cc1ccc(COC(=O)N2CC[C@H](CNc3ncccn3)[C@H]([18F])C2)cc1 ZINC000101509596 FG Annotated Anodyne O=C(CSc1n[nH]c2c3ccccc3nc-2n1)OCc1ccccc1 ZINC000101514042 FG Annotated Anodyne C=CCn1c(O)c(/N=N/C(=O)CNC(=O)c2ccco2)c2ccccc21 ZINC000101531095 FG Annotated Mild Cc1nccc2c1[nH]c1cc([C@@]34CC[C@](C(=O)O)(OC3=O)C4(C)C)ccc12 ZINC000101551156 FG Annotated Anodyne Cc1nccc2c1[nH]c1cc([C@]34CC[C@@](C(=O)O)(OC3=O)C4(C)C)ccc12 ZINC000101551161 FG Annotated Anodyne COc1ccc(NC(=S)c2c3n(c(=O)c4ccccc24)CCN3)cc1 ZINC000101556387 FG Annotated Anodyne CCCCC[C@H]1C(=O)C(I)=C[C@H]1CC(=O)OC ZINC000101562125 FG Annotated Mild CCCCC[C@@H]1C(=O)C(I)=C[C@@H]1CC(=O)OC ZINC000101562134 FG Annotated Mild C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)/C(O)=C1\C(=O)N[C@@H]([C@@H](C)O)C1=O ZINC000101563019 FG Annotated Mild C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)/C(O)=C1\C(=O)N[C@@H]([C@H](C)O)C1=O ZINC000101563021 FG Annotated Mild O=c1c2c[nH]c3ccc([N+](=O)[O-])cc3c-2nn1-c1nc2ccccc2s1 ZINC000101588281 FG Annotated Bother C[C@@H]1CC[C@@H]([C@](C)(NC(=O)c2ccsc2)c2cn(CC#N)nn2)CC1 ZINC000101594285 FG Annotated Mild O=c1[nH]c([C@@H]2CC[C@H](c3ccccc3)CC2)c(Cc2ccccn2)c(=O)[nH]1 ZINC000101598417 FG Annotated Anodyne O=C1[C@H]2C=C(I)[C@@H](C[C@H]2c2ccccc2)[C@]12CO2 ZINC000101609360 FG Annotated Anodyne O=C1[C@H]2C=C(I)[C@@H](C[C@@H]2c2ccccc2)[C@]12CO2 ZINC000101609364 FG Annotated Anodyne COC1=C(OC)c2ccccc2[C@H](C(=O)O)N/C1=C(/C)Nc1ccncc1 ZINC000101617660 FG Annotated Anodyne COC1=C(OC)c2ccccc2[C@@H](C(=O)O)N/C1=C(/C)Nc1ccncc1 ZINC000101617664 FG Annotated Anodyne C[C@@H](/C(O)=C(\C#N)c1nc2ccccc2n1C)N1C(=O)c2ccccc2C1=O ZINC000101618233 FG Annotated Reactive C[C@H](/C(O)=C(\C#N)c1nc2ccccc2n1C)N1C(=O)c2ccccc2C1=O ZINC000101618236 FG Annotated Reactive Cn1/c(=N/NC(=O)C2CCCC2)sc2cc(OC(F)(F)F)ccc21 ZINC000101635527 FG Annotated Reactive [18F]CCOCCOCCOc1ccc(C#Cc2ccc3c(c2)CCN3)cc1 ZINC000101644293 FG Annotated Mild CO/C(O)=C1\C(C)=Nc2nc(S)nc(O)c2[C@@H]1c1ccc(OC)cc1 ZINC000101653047 FG Annotated Anodyne CO/C(O)=C1\C(C)=Nc2nc(S)nc(O)c2[C@H]1c1ccc(OC)cc1 ZINC000101653052 FG Annotated Anodyne CCSc1nc(O)c2c(n1)N=C(C)/C(=C(/O)OC)[C@@H]2c1cccnc1 ZINC000101656883 FG Annotated Anodyne CC(C)Cn1c(O)cc(=O)nc1SCc1nnc(-c2cccs2)o1 ZINC000101661611 FG Annotated Anodyne CCOC(=O)c1s/c(=N/c2ccc3oc(=O)ccc3c2)n(CC)c1C ZINC000101671140 FG Annotated Anodyne Fc1ccccc1/C=C1\CNCC2=C1NC(=S)N[C@@H]2c1ccccc1F ZINC000101679958 FG Annotated Anodyne Fc1ccccc1/C=C1\CNCC2=C1NC(=S)N[C@H]2c1ccccc1F ZINC000101679960 FG Annotated Anodyne Cc1nnn(C23C[C@@H]4C[C@H](CC(CC(=O)Nc5cccc(F)c5)(C4)C2)C3)n1 ZINC000101686702 FG Annotated Anodyne Cc1nnn(C23C[C@H]4C[C@@H](CC(CC(=O)Nc5cccc(F)c5)(C4)C2)C3)n1 ZINC000101686709 FG Annotated Anodyne C[C@@H](C(=O)/N=N/c1c(O)[nH]c2ccccc12)n1cnc2ccccc2c1=O ZINC000101694791 FG Annotated Clean C[C@H](C(=O)/N=N/c1c(O)[nH]c2ccccc12)n1cnc2ccccc2c1=O ZINC000101694794 FG Annotated Clean O=[N+]([O-])c1ccc(OC2[C@@H](n3ccnc3)CCC[C@H]2n2ccnc2)cc1 ZINC000101696267 FG Annotated Bother CC1=C2C(=NC3=C(C(=O)CCC3)[C@H]2c2ccccn2)N(c2ccccn2)N1 ZINC000101706596 FG Annotated Mild CC1=C2C(=NC3=C(C(=O)CCC3)[C@@H]2c2ccccn2)N(c2ccccn2)N1 ZINC000101706600 FG Annotated Mild CCc1c(O)n(-c2ccccc2)c(SCC(=O)c2ccccc2)nc1=O ZINC000101713956 FG Annotated Anodyne CN1c2ccccc2C(O)=C(/C=N/c2ccc(F)cc2F)S1(=O)=O ZINC000101735579 FG Annotated Mild C=CCO/C(O)=C1\C(C)=Nc2nc(O)nc(O)c2[C@@H]1c1cccc(OC)c1 ZINC000101742651 FG Annotated Mild C=CCO/C(O)=C1\C(C)=Nc2nc(O)nc(O)c2[C@H]1c1cccc(OC)c1 ZINC000101742655 FG Annotated Mild O=C1[C@H]2[C@@H](c3ccccc3)C=C[C@@H](c3ccccc3)[C@@H]2C(=O)N1CCCO ZINC000101750006 FG Annotated Anodyne O=C1[C@H]2[C@H](c3ccccc3)C=C[C@H](c3ccccc3)[C@H]2C(=O)N1CCCO ZINC000101750011 FG Annotated Anodyne NC1=C(c2ccc(Br)cc2)C(=O)[C@@H]2CCc3ccccc3N12 ZINC000101752442 FG Annotated Mild CCn1c(O)c(/N=N/C(=O)CNC(=O)/C=C/c2ccco2)c2ccccc21 ZINC000101759114 FG Annotated Clean CC(=O)O[C@]1(C)CC[C@@H]2C[C@@H]1OO[C@]2(C)C[S@](=O)c1ccccc1 ZINC000101766649 FG Annotated Reactive CC(=O)O[C@@]1(C)CC[C@@H]2C[C@@H]1OO[C@]2(C)C[S@](=O)c1ccccc1 ZINC000101766652 FG Annotated Reactive CC(=O)O[C@]1(C)CC[C@H]2C[C@@H]1OO[C@]2(C)C[S@](=O)c1ccccc1 ZINC000101766656 FG Annotated Reactive CC(=O)O[C@@]1(C)CC[C@H]2C[C@@H]1OO[C@]2(C)C[S@](=O)c1ccccc1 ZINC000101766660 FG Annotated Reactive COc1ccccc1Nc1c([N+](=O)[O-])ccc2c1=NC1(CCCCC1)N=2 ZINC000101766940 FG Annotated Bother O=C(CSc1n[nH]c2c3ccccc3nc-2n1)NCc1ccccc1F ZINC000101772485 FG Annotated Anodyne CCn1c(O)c(/N=N/C(=O)CNC(=O)Cc2ccccc2)c2ccccc21 ZINC000101779763 FG Annotated Clean Cc1ccc(CNC(=O)CSc2n[nH]c3c4ccccc4nc-3n2)cc1 ZINC000101780522 FG Annotated Anodyne CCCn1c(O)c(/N=N/C(=O)CNC(=O)c2cccnc2)c2ccccc21 ZINC000101788800 FG Annotated Clean Cn1c(O)c(/N=N/C(=O)CNC(=O)/C=C/c2ccccc2)c2ccccc21 ZINC000101789059 FG Annotated Clean Cc1cccc(CCNC(=O)Cn2ncc3c4cc(C)ccc4nc-3c2O)c1 ZINC000101800325 FG Annotated Anodyne CC(C)n1c(O)c(/N=N/C(=O)CNC(=O)c2cccnc2)c2ccccc21 ZINC000101800916 FG Annotated Clean CCN(CC)CCS/C(=N/O)C(=O)c1ccc(Br)cc1 ZINC000101801917 FG Annotated Mild Cn1c(O)c(/N=N/C(=O)Cn2ccc(C(F)(F)F)n2)c2ccccc21 ZINC000101812535 FG Annotated Clean COc1c2c(c(C(C)(C)[C@@H]3CO3)c3oc(=O)ccc13)OC(C)(C)[C@@H]1O[C@@H]21 ZINC000101815025 FG Annotated Anodyne COc1c2c(c(C(C)(C)[C@@H]3CO3)c3oc(=O)ccc13)OC(C)(C)[C@H]1O[C@H]21 ZINC000101815029 FG Annotated Anodyne N#C/C(=C(/O)COC(=O)c1cccnc1Cl)c1nc2ccccc2[nH]1 ZINC000101818009 FG Annotated Reactive Nc1c2ccccc2nc2c(=O)c3ccccc3c(=O)c=2n1-c1ccccc1 ZINC000101832842 FG Annotated Bother C[C@@H]1CN2[C@H]3[C@@H]4CC[C@@]35CCC[C@H]5[C@@]3(CCC(=O)O)[C@H]2[C@]1(O)CC[C@@]43C ZINC000101850422 FG Annotated Anodyne C[C@@H]1CN2[C@@H]3[C@]1(O)CC[C@@]1(C)[C@H]4CC[C@@]5(CCC[C@H]5[C@@]31CCC(=O)O)[C@@H]42 ZINC000101850427 FG Annotated Anodyne COc1ccc(N2CCN(c3[nH]cnc4c5ccccc5nc3-4)CC2)cc1 ZINC000101867357 FG Annotated Clean O=C(CCCn1c(=S)[nH]c2ccsc2c1=O)NC1CCCCC1 ZINC000101878899 FG Annotated Anodyne C=CCn1c(SCC(=O)N2CCCC2)nc2c3ccccc3nc-2c1O ZINC000101881313 FG Annotated Mild COc1ccc(NC2=CC(=O)c3c(c(C)nc4c3C(=O)CCC4)C2=O)cc1 ZINC000101899938 FG Annotated Mild COc1ccccc1NC1=CC(=O)c2c(c(C)nc3c2C(=O)CCC3)C1=O ZINC000101899947 FG Annotated Mild Cc1nc2c(c3c1C(=O)C(Nc1ccc(F)cc1)=CC3=O)C(=O)CCC2 ZINC000101909279 FG Annotated Mild CCCn1c(O)c(/N=N/C(=O)CNC(=O)c2ccncc2)c2ccccc21 ZINC000101911822 FG Annotated Clean CCN1C(=O)/C(=C2/Sc3ccccc3N2CC)S/C1=N\c1nc[nH]n1 ZINC000101919669 FG Annotated Mild COc1ccc(OCC/N=c2\c([N+](=O)[O-])c(O)oc3ccccc23)cc1 ZINC000101924565 FG Annotated Bother COc1ccc(OC)c([C@H]2C3=C(O)OCC3=Nc3cc4c(cc32)OCO4)c1 ZINC000101930484 FG Annotated Anodyne COc1ccc(OC)c([C@@H]2C3=C(O)OCC3=Nc3cc4c(cc32)OCO4)c1 ZINC000101930488 FG Annotated Anodyne CCO/C(O)=C1\C(C)=Nc2nc(C)nn2[C@H]1c1cc(OC)ccc1OC ZINC000101934617 FG Annotated Anodyne CCO/C(O)=C1\C(C)=Nc2nc(C)nn2[C@@H]1c1cc(OC)ccc1OC ZINC000101934622 FG Annotated Anodyne O=C1CCCC2=C1[C@@H](c1ccc(F)cc1Cl)N=C(c1cnccn1)N2 ZINC000101939342 FG Annotated Mild Oc1[nH]c2ccc(Br)cc2c1/N=N/C(=S)N1CCOCC1 ZINC000101957184 FG Annotated Clean C/C=C1/C[N+]2([O-])[C@H]3C[C@H]1[C@@H]1[C@@H]2C[C@@]2(C3=Nc3ccccc32)[C@@H]1OC(C)=O ZINC000101973926 FG Annotated Bother CC(=O)OC1=CC[C@H]2C(=C1)[C@@H]1c3cc(OC(C)=O)ccc3C[C@@H]2N(C)[C@@H]1C ZINC000101974675 FG Annotated Anodyne CC1(C)C[C@H](O[P@@](=O)(O)Oc2ccc([N+](=O)[O-])cc2)C(C)(C)N1[O] ZINC000101982302 FG Annotated Bother CC1(C)C[C@@H](O[P@@](=O)(O)Oc2ccc([N+](=O)[O-])cc2)C(C)(C)N1[O] ZINC000101982305 FG Annotated Bother CC1(C)CC(O[P@@](=O)(O)Oc2ccc([N+](=O)[O-])cc2)CC(C)(C)N1[O] ZINC000101982309 FG Annotated Bother Cc1n[nH]c2c1[C@@H]1CCC[C@@H](C2)N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000102021492 FG Annotated Anodyne Cc1n[nH]c2c1[C@H]1CCC[C@H](C2)N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000102021500 FG Annotated Anodyne COC1=C(OC)C[C@H]2C(=C1)[C@@H]1c3cc(OC)c(OC)cc3C[C@@H]2N(C)[C@@H]1C ZINC000102037925 FG Annotated Anodyne Nc1nc2c(s1)[C@H]1CCC[C@H](C2)N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000102044458 FG Annotated Anodyne COc1cc2c(c(OC)c1)C(=O)/C(=C/c1ccc(N3CCOCC3)cc1)N2 ZINC000102132423 FG Annotated Mild COc1cc(OC)c(/C=C2\Nc3cc(OC)cc(OC)c3C2=O)c(OC)c1 ZINC000102133636 FG Annotated Mild CC(C)c1ccc(S(=O)(=O)Nc2ccc([C@@]34CNC[C@H]3C4)cc2)cc1 ZINC000102170456 FG Annotated Anodyne CC(=O)O[C@]1(C)CC[C@@H]2C[C@@H]1OO[C@@]2(C)C[S@](=O)c1ccccc1 ZINC000102193993 FG Annotated Reactive CC(=O)O[C@@]1(C)CC[C@@H]2C[C@@H]1OO[C@@]2(C)C[S@](=O)c1ccccc1 ZINC000102193997 FG Annotated Reactive CC(=O)O[C@]1(C)CC[C@H]2C[C@@H]1OO[C@@]2(C)C[S@](=O)c1ccccc1 ZINC000102194004 FG Annotated Reactive CC(=O)O[C@@]1(C)CC[C@H]2C[C@@H]1OO[C@@]2(C)C[S@](=O)c1ccccc1 ZINC000102194010 FG Annotated Reactive Cc1nnn(C23C[C@H]4C[C@@H](CC(C(=O)N[C@@H](C)c5ccccc5)(C4)C2)C3)n1 ZINC000102204016 FG Annotated Anodyne CC(C)(C)CCN[C@H]1C(=O)C(=O)/C1=C\c1ccc(Br)cc1 ZINC000102224203 FG Annotated Mild CCOC(=O)c1c(O)c2cc(Cc3ccc(F)cc3)ccc2n(C)c1=O ZINC000102230087 FG Annotated Anodyne N#Cc1c(F)c(F)c2c(C(=O)c3ccccc3)c3n(c(=N)c2c1F)CCO3 ZINC000102238080 FG Annotated Mild CC(=O)c1s/c(=N\c2ccc(OC(F)(F)F)cc2)n(CCO)c1C ZINC000102259825 FG Annotated Anodyne Cc1ccc2nc(NCc3ccco3)c(/C=N\Cc3ccco3)c(=O)n2c1 ZINC000102277990 FG Annotated Mild O=[N+]([O-])C/C(=N\N=C/c1oc(O)c2ccccc12)Nc1ccc(F)cc1 ZINC000102280389 FG Annotated Mild CC(C)n1c(O)c(/N=N\C(=O)CNC(=O)c2cccnc2)c2ccccc21 ZINC000102325687 FG Annotated Clean Cc1ccc2nc3c(O)n(CC(=O)N4C[C@@H](C)C[C@@H](C)C4)ncc-3c2c1 ZINC000102342832 FG Annotated Anodyne Cc1ccc2nc3c(O)n(CC(=O)N4C[C@@H](C)C[C@H](C)C4)ncc-3c2c1 ZINC000102342833 FG Annotated Anodyne Cc1ccc2nc3c(O)n(CC(=O)N4C[C@H](C)C[C@@H](C)C4)ncc-3c2c1 ZINC000102342838 FG Annotated Anodyne CCOC(=O)C(/C=N/c1ccc(Oc2cccnc2)nc1)=C(\O)OCC ZINC000102383013 FG Annotated Mild CC1(C)O[C@H]2C3=C([C@H]2O1)[C@@H](c1ccccc1)[C@H](C(C)(C)O)C=CC=C3CO ZINC000102394349 FG Annotated Anodyne Cc1cc(CO[P@](N)(=O)N(CCCl)CCCl)ccc1[N+](=O)[O-] ZINC000102402644 FG Annotated Reactive O=C(COC(=O)C12C[C@@H]3C[C@H](CC(Cl)(C3)C1)C2)NCc1ccco1 ZINC000102413016 FG Annotated Anodyne CC(=O)Nc1ccccc1NC(=O)C/C(C)=N/NC(=O)C1CCCCC1 ZINC000102420806 FG Annotated Reactive COC(=O)c1nc2n(n1)[C@H](c1cccc(Cl)c1)C1=C(O)CCCC1=N2 ZINC000102476879 FG Annotated Anodyne aggregator COC(=O)c1nc2n(n1)[C@@H](c1cccc(Cl)c1)C1=C(O)CCCC1=N2 ZINC000102476881 FG Annotated Anodyne aggregator C=CCn1c(O)c(/N=N\C(=O)CNC(=O)c2ccco2)c2ccccc21 ZINC000102496649 FG Annotated Mild CCSc1nc(O)c2c(n1)N=C(C)/C(=C(\O)OC)[C@H]2c1cccnc1 ZINC000102567589 FG Annotated Anodyne CCn1c(O)c(/N=N\C(=O)CNC(=O)/C=C/c2ccco2)c2ccccc21 ZINC000102595954 FG Annotated Clean CCCn1c(O)c(/N=N\C(=O)CNC(=O)c2ccncc2)c2ccccc21 ZINC000102601311 FG Annotated Clean O=c1cc(C2CCOCC2)nc(-c2ccc(CN3C[C@H]4CC[C@H]3C4)cc2)[nH]1 ZINC000102605062 FG Annotated Anodyne C=CCOC(=O)N[C@@H](c1ccc(Br)cc1)C(C(C)=O)C(C)=O ZINC000102631427 FG Annotated Mild CC1(C)Cc2ccccc2C(/C(=N\Nc2cccc(Cl)c2)C(N)=O)=N1 ZINC000102653185 FG Annotated Mild Cn1c(O)c(/N=N\C(=O)CNC(=O)/C=C/c2ccccc2)c2ccccc21 ZINC000102657410 FG Annotated Clean CCCn1c(O)c(/N=N\C(=O)CNC(=O)c2cccnc2)c2ccccc21 ZINC000102677035 FG Annotated Clean CCn1c(O)c(/N=N\C(=O)CNC(=O)Cc2ccccc2)c2ccccc21 ZINC000102682356 FG Annotated Clean NC(=S)/N=N\c1c(O)n(CC(=O)Nc2ccccc2)c2ccccc12 ZINC000102711773 FG Annotated Clean Cc1ccc(CN(C)C(=O)COC(=O)C2C[C@@H]3CCC[C@@H](C2)C3=O)c(C)c1 ZINC000102726043 FG Annotated Anodyne Cc1ccc(CN(C)C(=O)COC(=O)C2C[C@H]3CCC[C@H](C2)C3=O)c(C)c1 ZINC000102726046 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1cccc(/N=N\c2sc(N)nc2C)c1 ZINC000102730071 FG Annotated Clean CCO/C(O)=C1\C(C)=Nc2nc(C)nn2[C@H]1c1ccc(OC)c(OC)c1 ZINC000102740473 FG Annotated Anodyne CCO/C(O)=C1\C(C)=Nc2nc(C)nn2[C@@H]1c1ccc(OC)c(OC)c1 ZINC000102740483 FG Annotated Anodyne NC(=S)/N=N\c1c(O)n([C@H]2OC(=O)c3ccccc32)c2ccccc12 ZINC000102754960 FG Annotated Clean NC(=S)/N=N\c1c(O)n([C@@H]2OC(=O)c3ccccc32)c2ccccc12 ZINC000102754963 FG Annotated Clean Cc1nnc(SCc2cc(=O)n(-c3nc4ccccc4s3)[nH]2)s1 ZINC000102806951 FG Annotated Anodyne CN1O[C@@H]2C(=O)NC(=O)[C@@H]2[C@@H]1c1ccc2ccc3cccc4ccc1c2c34 ZINC000102812947 FG Annotated Bother CC1=C(O)c2c(oc(-c3ccc4c(c3)OCCO4)cc2=O)C(C)(C)C1=O ZINC000102814805 FG Annotated Mild Cc1ccc(C(=O)COC(=O)C2C[C@@H]3CCC[C@@H](C2)C3=O)cc1[N+](=O)[O-] ZINC000102832779 FG Annotated Bother Cc1ccc(C(=O)COC(=O)C2C[C@H]3CCC[C@H](C2)C3=O)cc1[N+](=O)[O-] ZINC000102832780 FG Annotated Bother N#Cc1c(F)c(F)c2c(C(=O)c3ccccc3)c3n(c(=N)c2c1F)CCN3 ZINC000102843877 FG Annotated Mild C[C@H](NC(=O)c1cnn2c1NC(=C1CC1)C=C2C(F)F)c1ccncc1 ZINC000102855063 FG Annotated Anodyne C[C@@H](NC(=O)c1cnn2c1NC(=C1CC1)C=C2C(F)F)c1ccncc1 ZINC000102855065 FG Annotated Anodyne C[C@@H]1CCCCN1C(=O)CSc1n[nH]c2c3cc(F)ccc3nc-2n1 ZINC000102869028 FG Annotated Anodyne C[C@H]1CCCCN1C(=O)CSc1n[nH]c2c3cc(F)ccc3nc-2n1 ZINC000102869032 FG Annotated Anodyne C[C@@H]1/C=C/CC(=O)NCc2cccc(c2)CNC(=O)N[C@@H]1c1ccccc1 ZINC000102874970 FG Annotated Anodyne C[C@H]1/C=C/CC(=O)NCc2cccc(c2)CNC(=O)N[C@@H]1c1ccccc1 ZINC000102874975 FG Annotated Anodyne Cc1[nH]c2ccccc2c1-c1c(C#N)c(=O)[nH]c2nn(-c3ccccc3)nc12 ZINC000102889407 FG Annotated Mild Cc1c(C(=O)/C=C(\O)c2ccc(O)cc2)nnn1Cc1cccc(F)c1 ZINC000102899444 FG Annotated Mild CCC(=O)N1[C@H]2CC[C@@H]3[C@H]1CC[C@H]2N3C/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000102905531 FG Annotated Bother CCC(=O)N1[C@H]2CC[C@@H]3[C@H]1CC[C@@H]2N3C/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000102905532 FG Annotated Bother O=C1C(=O)N(Cc2cccnc2)[C@@H](c2ccccn2)/C1=C(/O)c1ccccc1 ZINC000102912076 FG Annotated Mild O=C1C(=O)N(Cc2cccnc2)[C@H](c2ccccn2)/C1=C(/O)c1ccccc1 ZINC000102912077 FG Annotated Mild CCO/C(O)=C1\C(C)=Nc2nc(C)nn2[C@@H]1c1ccc(OCC)c(OC)c1 ZINC000102912946 FG Annotated Anodyne CCO/C(O)=C1\C(C)=Nc2nc(C)nn2[C@H]1c1ccc(OCC)c(OC)c1 ZINC000102912950 FG Annotated Anodyne Cc1c(C(=O)/C=C(\O)c2ccc(O)cc2)nnn1Cc1ccc(F)cc1 ZINC000102928429 FG Annotated Mild COC(=O)[C@H]1C(=O)/C(=C/Nc2ccc3ccccc3c2)C(=O)CC1(C)C ZINC000102932698 FG Annotated Mild COC(=O)[C@@H]1C(=O)/C(=C/Nc2ccc3ccccc3c2)C(=O)CC1(C)C ZINC000102932704 FG Annotated Mild COc1cc(N/C=C2/C(=O)Oc3ccccc3C2=O)c(OC)cc1Cl ZINC000102938636 FG Annotated Mild CC(C)N(C(=O)C12[C@H]3C4C5[C@H]3C1(C(=O)N(C(C)C)C(C)C)[C@H]5[C@H]42)C(C)C ZINC000102940191 FG Annotated Anodyne CC(C)N(C(=O)C12[C@H]3C4C5[C@@H]3C1(C(=O)N(C(C)C)C(C)C)[C@H]5[C@H]42)C(C)C ZINC000102940195 FG Annotated Anodyne Cc1ccc(S(=O)(=O)NC(=O)NC23C[C@@H]4C[C@H](CC(F)(C4)C2)C3)cc1 ZINC000102952228 FG Annotated Anodyne Cc1ccc(S(=O)(=O)NC(=O)NC23C[C@H]4C[C@@H](CC(F)(C4)C2)C3)cc1 ZINC000102952231 FG Annotated Anodyne C=C1C(=O)O[C@@]23CC[C@@H]4[C@](C)(C(=O)OC)CCC[C@@]4(C)[C@@H]2CC[C@@]1(O)C3 ZINC000102955246 FG Annotated Mild CCCCCCN1C[C@H]2[C@@H](C1)[C@]2(C)c1cccc(NS(C)(=O)=O)c1 ZINC000102955370 FG Annotated Anodyne COC(=O)c1cc(N/N=C2\C(C)=Nc3ccccc32)cc(C(=O)OC)c1 ZINC000102956168 FG Annotated Mild CCC(=O)C1=C(OC(C)=O)[C@H]2Cc3c(n(C)c4ccccc34)[C@H](C1)N2C ZINC000102962476 FG Annotated Mild Cc1[nH]c2ncn(/N=C/c3ccccc3O)c(=N)c2c1Cc1ccccc1 ZINC000102967931 FG Annotated Mild O=C(Nc1ccc(Cl)cc1Cl)C1C(=O)OC2(CCCCC2)OC1=O ZINC000102971387 FG Annotated Anodyne CN(C)/C=N/c1nsc2ccc(NS(=O)(=O)c3ccccc3)cc12 ZINC000102974758 FG Annotated Mild O=C1N[C@@H]2CCCC[C@@H]2NC1=C(C(=O)c1ccccc1)C(=O)c1ccccc1 ZINC000102978067 FG Annotated Mild O=C1N[C@H]2CCCC[C@@H]2NC1=C(C(=O)c1ccccc1)C(=O)c1ccccc1 ZINC000102978070 FG Annotated Mild O=C1N[C@@H]2CCCC[C@H]2NC1=C(C(=O)c1ccccc1)C(=O)c1ccccc1 ZINC000102978072 FG Annotated Mild O=C1N[C@H]2CCCC[C@H]2NC1=C(C(=O)c1ccccc1)C(=O)c1ccccc1 ZINC000102978075 FG Annotated Mild C[C@@]1(C(=O)Nc2ccc3ccccc3c2)C[C@]2(C)C[C@@](C)(C1)[C@@H](O)NC2=O ZINC000102985648 FG Annotated Anodyne C[C@]1(C(=O)Nc2ccc3ccccc3c2)C[C@@]2(C)C[C@](C)(C1)C(=O)N[C@@H]2O ZINC000102985649 FG Annotated Anodyne O=C(c1cccs1)[C@@H]1CC[C@@H]2[C@H]3CCCN4CCC[C@@H](CN2C1=O)[C@@H]34 ZINC000102987672 FG Annotated Anodyne O=C(c1cccs1)[C@H]1CC[C@@H]2[C@H]3CCCN4CCC[C@@H](CN2C1=O)[C@@H]34 ZINC000102987676 FG Annotated Anodyne CNc1ccc(-c2nc3cc(OCCOCCOCC[18F])ccc3o2)cn1 ZINC000103070154 FG Annotated Anodyne O=C1N=C(C2C(=O)c3ccccc3C2=O)C[C@@H](c2c[nH]c3ccccc23)N1 ZINC000103072576 FG Annotated Clean O=C1N=C(C2C(=O)c3ccccc3C2=O)C[C@H](c2c[nH]c3ccccc23)N1 ZINC000103072578 FG Annotated Clean CN(C)c1ccc([C@@H]2CC(C3C(=O)c4ccccc4C3=O)=NC(=O)N2)cc1 ZINC000103074515 FG Annotated Clean CN(C)c1ccc([C@H]2CC(C3C(=O)c4ccccc4C3=O)=NC(=O)N2)cc1 ZINC000103074520 FG Annotated Clean O=C(Nc1ccccn1)N1[C@H]2CC[C@@H]1C[C@H](S(=O)(=O)c1ccccc1)C2 ZINC000103097116 FG Annotated Anodyne O=C(Nc1ccncc1)N1[C@H]2CC[C@@H]1C[C@H](S(=O)(=O)c1ccccc1)C2 ZINC000103097134 FG Annotated Anodyne COc1ccc2c(c1)Oc1ncn(N)c(=N)c1[C@@H]2c1ccc(Cl)cc1 ZINC000103099270 FG Annotated Anodyne COc1ccc2c(c1)Oc1ncn(N)c(=N)c1[C@H]2c1ccc(Cl)cc1 ZINC000103099272 FG Annotated Anodyne COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CC[C@]13C[C@H](CO)[C@@H](C[C@@H](O)[C@H]12)C3 ZINC000103110027 FG Annotated Anodyne COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CC[C@]13C[C@H](CO)[C@@H](C[C@H](O)[C@H]12)C3 ZINC000103110031 FG Annotated Anodyne C=C1C=C(C(F)(F)F)n2ncc(C(=O)NCc3ccc(F)cc3)c2N1 ZINC000103116589 FG Annotated Anodyne COC(=O)c1c(C)nc(C)c2c1C(=O)C=C(Nc1ccc(C)cc1)C2=O ZINC000103123275 FG Annotated Mild CC(C)(C)OC(=O)N1[C@H]2CCC[C@]23O[C@@H]1c1cc2c(cc1C3=O)OCO2 ZINC000103132135 FG Annotated Anodyne CC(C)(C)OC(=O)N1[C@@H]2O[C@]3(CCC[C@@H]13)C(=O)c1cc3c(cc12)OCO3 ZINC000103132139 FG Annotated Anodyne COC(=O)c1ccc2nc3n(C)c4ccccc4c(NCCCN)c-3c2c1 ZINC000103142082 FG Annotated Bother COC(=O)c1ccc2nc3n(C)c4ccccc4c(NCCCO)c-3c2c1 ZINC000103142093 FG Annotated Bother N=c1c2c([nH]c(=O)n1-c1ccccc1)N(c1ccccc1)C(=O)N1CCC[C@H]21 ZINC000103152735 FG Annotated Anodyne N=c1c2c([nH]c(=O)n1-c1ccccc1)N(c1ccccc1)C(=O)N1CCC[C@@H]21 ZINC000103152737 FG Annotated Anodyne COc1ccc([C@H]2C3=C(CCCC3)Nc3nc(C)[nH]c(=O)c32)cc1OC ZINC000103157933 FG Annotated Anodyne COc1ccc([C@@H]2C3=C(CCCC3)Nc3nc(C)[nH]c(=O)c32)cc1OC ZINC000103157936 FG Annotated Anodyne O=C1CS/C(=N\N=C/c2cn(-c3ccccc3)nc2-c2cccs2)N1 ZINC000103171275 FG Annotated Mild CCCCn1c(=O)c2ccccc2n2c(-c3ccc(O)c(OC)c3)nnc12 ZINC000103171450 FG Annotated Anodyne O=c1c2ccccc2nc(-c2ccccc2)n1NCCNc1nccs1 ZINC000103171695 FG Annotated Anodyne CCc1nn(C)c(C(=O)N[C@@H](CO)c2ccc(C(C)(C)C)cc2)c1Cl ZINC000103173728 FG Annotated Anodyne CCc1nn(C)c(C(=O)N[C@H](CO)c2ccc(C(C)(C)C)cc2)c1Cl ZINC000103173730 FG Annotated Anodyne O=C1NC(c2ccccc2)(c2ccccc2)C(=O)N1CNc1nccs1 ZINC000103173800 FG Annotated Anodyne CCO[C@@H]1Sc2nnc(CC)n2N=C1c1ccc(Br)cc1 ZINC000103174215 FG Annotated Anodyne CCO[C@H]1Sc2nnc(CC)n2N=C1c1ccc(Br)cc1 ZINC000103174217 FG Annotated Anodyne CC(C)Cc1nn(C)c(C(=O)Nc2nnc(C(F)(F)F)s2)c1Cl ZINC000103174637 FG Annotated Anodyne O=c1c2ccccc2nc(-c2ccccc2)n1NCCNCc1ccccc1 ZINC000103175113 FG Annotated Anodyne COc1cc(/C=C2\CN(CC(=O)O)c3c(C)cccc3C2=O)cc(OC)c1 ZINC000103175506 FG Annotated Mild O=C(N/N=C\c1ccc([N+](=O)[O-])cc1)c1cc2c(cn1)[nH]c1ccccc12 ZINC000103175705 FG Annotated Reactive COc1cccc(/C=C2\CN(CC(=O)O)c3c(C)cccc3C2=O)c1OC ZINC000103175994 FG Annotated Mild COc1ccc2c(c1)OC[C@]21C(=O)N(C[C@@H]2CCCCO2)c2ccccc21 ZINC000103177630 FG Annotated Anodyne COc1ccc2c(c1)OC[C@@]21C(=O)N(C[C@@H]2CCCCO2)c2ccccc21 ZINC000103177632 FG Annotated Anodyne COc1ccc2c(c1)OC[C@]21C(=O)N(C[C@H]2CCCCO2)c2ccccc21 ZINC000103177636 FG Annotated Anodyne COc1ccc2c(c1)OC[C@@]21C(=O)N(C[C@H]2CCCCO2)c2ccccc21 ZINC000103177638 FG Annotated Anodyne Cn1c(-c2cccs2)nc2ccc(I)cc2c1=O ZINC000103178260 FG Annotated Anodyne CCCCCC/C(=N/S(=O)(=O)c1ccc(C)cc1)N1CCOCC1 ZINC000103178437 FG Annotated Mild C[C@@H]1C/C(=N\NC(=O)Nc2ccccc2)Nc2cc([N+](=O)[O-])ccc2N1 ZINC000103179013 FG Annotated Reactive C[C@H]1C/C(=N\NC(=O)Nc2ccccc2)Nc2cc([N+](=O)[O-])ccc2N1 ZINC000103179014 FG Annotated Reactive Cc1n[nH]c(Cl)c1/C=N\NC(=O)c1cc2c(cn1)[nH]c1ccccc12 ZINC000103179237 FG Annotated Reactive COc1ccc(C(=O)[C@H](NNc2ccc(F)cc2)C(=O)C(F)(F)F)cc1 ZINC000103180440 FG Annotated Anodyne COc1ccc(C(=O)[C@@H](NNc2ccc(F)cc2)C(=O)C(F)(F)F)cc1 ZINC000103180442 FG Annotated Anodyne O=C(CSc1nc2ccccc2s1)Nc1cc(C(=O)O)ccc1O ZINC000103181464 FG Annotated Anodyne Cc1ccc(C)c(NC(=O)c2nc(C)c(C)nc2C(=O)NCC(C)C)c1 ZINC000103182948 FG Annotated Anodyne CCCCNC(=O)c1nc(C)c(C)nc1C(=O)Nc1cc(C)ccc1C ZINC000103182950 FG Annotated Anodyne COC(=O)c1ccccc1/C(=C/S(=O)(=O)c1ccc(C)cc1)N(C)C ZINC000103183588 FG Annotated Anodyne C[C@@H]1CC[C@H]2C(CO)=C(C(F)(F)F)O[C@@H]3O[C@]4(C)CC[C@H]1[C@@]23OO4 ZINC000103183668 FG Annotated Reactive C[C@@H]1CC[C@H]2C(CO)=C(C(F)(F)F)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000103183669 FG Annotated Reactive CCOCCOC(=O)/C(C#N)=C(/NCc1ccc(Cl)cc1)SC ZINC000103183753 FG Annotated Reactive CCOCCOC(=O)/C(C#N)=C(/NCc1ccc(Cl)cc1)C(C)C ZINC000103183757 FG Annotated Reactive Cn1nc(C(C)(C)C)c(Cl)c1C(=O)Nc1nnc(C(F)(F)F)s1 ZINC000103185188 FG Annotated Anodyne CCCc1nn(C)c(C(=O)Nc2nnc(C(F)(F)F)s2)c1Cl ZINC000103185253 FG Annotated Anodyne CC(C)c1nn(C)c(C(=O)Nc2nnc(C(F)(F)F)s2)c1Cl ZINC000103185255 FG Annotated Anodyne Cn1nc(C2CC2)c(Cl)c1C(=O)Nc1nnc(C(F)(F)F)s1 ZINC000103185257 FG Annotated Anodyne CCN(CC)C(=O)c1nc(C)c(C)nc1C(=O)Nc1cc(C)ccc1C ZINC000103185362 FG Annotated Anodyne CC[C@@H](C)[C@H](NC(=O)c1cnc2cc(C(F)(F)F)ccc2c1O)C(=O)O ZINC000103185637 FG Annotated Anodyne CC(C)C[C@H](NC(=O)c1cnc2cc(C(F)(F)F)ccc2c1O)C(=O)O ZINC000103185639 FG Annotated Anodyne CCCCOc1ccc(CNC(=O)c2c(Cl)c(CC)nn2C)cn1 ZINC000103187170 FG Annotated Anodyne CNCC1=C(C(F)(F)F)O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@]42OO3 ZINC000103187411 FG Annotated Reactive COP(=O)(OC)[C@H](OC(=O)COc1ccc(C#N)cc1)c1ccco1 ZINC000103190697 FG Annotated Mild COP(=O)(OC)[C@@H](OC(=O)COc1ccc(C#N)cc1)c1ccco1 ZINC000103190700 FG Annotated Mild CCOC(=O)/C=C\[C@@]1(C)O[C@@H]2O[C@]3(C)CC[C@@H]4[C@H](C)CC[C@@H]1[C@@]24OO3 ZINC000103190915 FG Annotated Reactive CCOC(=O)/C=C\[C@@]1(C)O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@]42OO3 ZINC000103190917 FG Annotated Reactive Nc1nc(Nc2ccc(C(=O)O)cc2)nc(OCC2CCCCC2)c1C=O ZINC000103191898 FG Annotated Anodyne CCCCCCCCCNC(=O)C1(C#N)SCC(N(C)C)CS1 ZINC000103192047 FG Annotated Mild C/C(CC(=O)Nc1nnc(-c2ccc(O)cc2)s1)=N\c1ccccn1 ZINC000103192466 FG Annotated Mild CNC(=O)[C@@H](OC)c1ccccc1CO/N=C(/C)c1ccc(OC)cc1 ZINC000103192862 FG Annotated Mild CNC(=O)[C@H](OC)c1ccccc1CO/N=C(/C)c1ccc(OC)cc1 ZINC000103192865 FG Annotated Mild C/C(CC(=O)Nc1nnc(-c2ccc(N)cc2)s1)=N\c1ccccn1 ZINC000103193926 FG Annotated Mild C[C@@H]1CC[C@H]2[C@@](C)(C(=O)OCCCCl)O[C@@H]3O[C@]4(C)CC[C@H]1[C@@]23OO4 ZINC000103194240 FG Annotated Reactive C[C@@H]1CC[C@H]2[C@@](C)(C(=O)OCCCCl)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000103194244 FG Annotated Reactive O=C(c1ccc(F)cc1)[C@H](NNc1ccc(F)cc1)C(=O)C(F)(F)F ZINC000103194288 FG Annotated Anodyne O=C(c1ccc(F)cc1)[C@@H](NNc1ccc(F)cc1)C(=O)C(F)(F)F ZINC000103194291 FG Annotated Anodyne O=C1/C(=C/N=C2C=CC=C2)SC(=S)N1Cc1nc2ccccc2[nH]1 ZINC000103194665 FG Annotated Mild CNC(=O)/C(=N/OC)c1ccccc1Oc1ccc(Br)cc1 ZINC000103196032 FG Annotated Mild CCc1nn(C)c(C(=O)NCc2ccc(Br)cc2)c1Cl ZINC000103196456 FG Annotated Anodyne CCOC(=O)Cn1c(C(F)(F)C(F)(F)F)nc2ccc([N+](=O)[O-])cc21 ZINC000103197631 FG Annotated Bother Cc1c(C(F)(F)F)noc1OCC(=O)N(C)c1c(F)cccc1F ZINC000103198534 FG Annotated Anodyne CCOc1ccc(/C(C)=N/OCc2ccccc2[C@H](OC)C(=O)NC)cc1 ZINC000103199204 FG Annotated Mild CCOc1ccc(/C(C)=N/OCc2ccccc2[C@@H](OC)C(=O)NC)cc1 ZINC000103199205 FG Annotated Mild CNC(=O)[C@@H](OC)c1ccccc1CO/N=C(\C)c1ccc(OC)cc1 ZINC000103199212 FG Annotated Mild CNC(=O)[C@H](OC)c1ccccc1CO/N=C(\C)c1ccc(OC)cc1 ZINC000103199213 FG Annotated Mild CCOC(=O)c1s/c(=N\Cc2ccccc2)n(-c2ccccc2)c1N ZINC000103199697 FG Annotated Anodyne c1ccc(-c2nnc(CN3CCC(n4nc5ccccc5n4)CC3)o2)cc1 ZINC000103199993 FG Annotated Anodyne COc1ccc2c(c1)OC[C@]21C(=O)N(Cc2ccccn2)c2ccccc21 ZINC000103200095 FG Annotated Anodyne COc1ccc2c(c1)OC[C@@]21C(=O)N(Cc2ccccn2)c2ccccc21 ZINC000103200096 FG Annotated Anodyne C[C@H](C(=O)N/N=C1\SCC(=O)N1C)c1ccc(-c2ccccc2)c(F)c1 ZINC000103200104 FG Annotated Reactive C[C@@H](C(=O)N/N=C1\SCC(=O)N1C)c1ccc(-c2ccccc2)c(F)c1 ZINC000103200107 FG Annotated Reactive CCOCCOC(=O)/C(C#N)=C(\NCc1ccc2ccccc2n1)SC ZINC000103200617 FG Annotated Reactive CCOCCOC(=O)/C(C#N)=C(/CC)NCc1ccc2ccccc2n1 ZINC000103200623 FG Annotated Reactive O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(C2=NO[C@H]3C[C@H]23)cc1 ZINC000103201066 FG Annotated Anodyne O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(C2=NO[C@@H]3C[C@H]23)cc1 ZINC000103201069 FG Annotated Anodyne O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(C2=NO[C@H]3C[C@@H]23)cc1 ZINC000103201071 FG Annotated Anodyne O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(C2=NO[C@@H]3C[C@@H]23)cc1 ZINC000103201074 FG Annotated Anodyne COc1ccc2c(c1)cc(-c1nc3cc(Cl)ccc3[nH]1)c1nnnn12 ZINC000103201604 FG Annotated Anodyne CCOCCOC(=O)/C(C#N)=C(\NCc1ccc2ccccc2n1)C(C)C ZINC000103201796 FG Annotated Reactive CCOCCOC(=O)/C(C#N)=C(\NCc1ccc2ncccc2c1)SC ZINC000103201798 FG Annotated Reactive CCOCCOC(=O)/C(C#N)=C(\NCc1ccc2ncccc2c1)C(C)C ZINC000103201800 FG Annotated Reactive CCOCCOC(=O)/C(C#N)=C(\NCc1cnc2ccccc2c1)C(C)C ZINC000103201802 FG Annotated Reactive CCOCCOC(=O)/C(C#N)=C(\NCc1cnc2ccccc2c1)SC ZINC000103201804 FG Annotated Reactive CCn1c(-c2ccc(OC)c(OC)c2)cc(-c2cccn2C)c(C#N)c1=O ZINC000103201978 FG Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@@H](C[C@H]12)[C@H]3CC[C@H](C)OC(=O)c1cnc(C)cn1 ZINC000103202578 FG Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@@H](C[C@H]12)[C@H]3CC[C@@H](C)OC(=O)c1cnc(C)cn1 ZINC000103202580 FG Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@H](C)OC(=O)c4cnc(C)cn4)[C@@H]3C[C@H]12 ZINC000103202582 FG Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@@H](C)OC(=O)c4cnc(C)cn4)[C@@H]3C[C@H]12 ZINC000103202583 FG Annotated Mild O=C(Nn1c(S)nnc1-c1cccc2ccccc12)c1ccc(O)cc1 ZINC000103203532 FG Annotated Anodyne CCCO[C@@H]1C[C@H](C)C([N+](=O)[O-])=C(N(C)Cc2ccc(Cl)nc2)N1C ZINC000103204818 FG Annotated Anodyne CCCO[C@H]1C[C@H](C)C([N+](=O)[O-])=C(N(C)Cc2ccc(Cl)nc2)N1C ZINC000103204821 FG Annotated Anodyne CCCO[C@@H]1C[C@@H](C)C([N+](=O)[O-])=C(N(C)Cc2ccc(Cl)nc2)N1C ZINC000103204824 FG Annotated Anodyne CCCO[C@H]1C[C@@H](C)C([N+](=O)[O-])=C(N(C)Cc2ccc(Cl)nc2)N1C ZINC000103204826 FG Annotated Anodyne CC(C)O[C@H]1C[C@@H](C)C([N+](=O)[O-])=C(N(C)Cc2ccc(Cl)nc2)N1C ZINC000103204829 FG Annotated Anodyne CC(C)O[C@H]1C[C@H](C)C([N+](=O)[O-])=C(N(C)Cc2ccc(Cl)nc2)N1C ZINC000103204832 FG Annotated Anodyne CC(C)O[C@@H]1C[C@@H](C)C([N+](=O)[O-])=C(N(C)Cc2ccc(Cl)nc2)N1C ZINC000103204834 FG Annotated Anodyne CC(C)O[C@@H]1C[C@H](C)C([N+](=O)[O-])=C(N(C)Cc2ccc(Cl)nc2)N1C ZINC000103204838 FG Annotated Anodyne O=S(=O)(Nc1ccc(Cl)cc1C(F)(F)F)[C@@H]1CCCC[C@@H]1O ZINC000103205794 FG Annotated Anodyne O=S(=O)(Nc1ccc(Cl)cc1C(F)(F)F)[C@H]1CCCC[C@@H]1O ZINC000103205797 FG Annotated Anodyne O=S(=O)(Nc1ccc(Cl)cc1C(F)(F)F)[C@@H]1CCCC[C@H]1O ZINC000103205799 FG Annotated Anodyne O=S(=O)(Nc1ccc(Cl)cc1C(F)(F)F)[C@H]1CCCC[C@H]1O ZINC000103205801 FG Annotated Anodyne CN(Cc1ccc(F)nc1)c1ccc2ncc(-c3ccc(C#N)cc3)n2n1 ZINC000103205936 FG Annotated Mild CN(Cc1ccc(F)nc1)c1ccc2ncc(-c3ccc(CO)cc3)n2n1 ZINC000103207222 FG Annotated Anodyne COc1cc(/C=C2\CN(CC(=O)O)c3ccc(C)cc3C2=O)cc(OC)c1 ZINC000103208801 FG Annotated Mild CCOC(=O)OC1=C(c2cc(C)ccc2C)C(=O)NC12CCC(=O)CC2 ZINC000103210512 FG Annotated Anodyne CCCC(=O)OC1=C(c2cc(C)ccc2C)C(=O)NC12CCC(=O)CC2 ZINC000103210515 FG Annotated Anodyne C/C=C/C(=O)OC1=C(c2cc(C)ccc2C)C(=O)NC12CCC(=O)CC2 ZINC000103210519 FG Annotated Anodyne CCn1cc(C(=O)N/N=C/c2ccccc2Cl)c(=O)c2ccc(C)nc21 ZINC000103210610 FG Annotated Reactive CC(C)NC(=O)c1onc(CSc2ccccc2)c1C(=O)NC(C)C ZINC000103211233 FG Annotated Anodyne CCOC(=O)c1cn[nH]c1NC(=S)Nc1ccc(Br)cc1 ZINC000103211472 FG Annotated Anodyne COc1ccc2c(c1)OC(C)(C)[C@@]1(I)CC(=O)O[C@@H]21 ZINC000103212210 FG Annotated Anodyne Cc1ccc(N/N=C2/SC3=NCN(c4ccccc4)CN3C2=O)cc1 ZINC000103214266 FG Annotated Mild COc1ccccc1NC1=CC(=O)C(Nc2ccccc2OC)=CC1=O ZINC000103214705 FG Annotated Mild CCOC(=O)C(=O)n1cc(-c2ocnc2Br)c2ccccc21 ZINC000103214942 FG Annotated Anodyne CCCO[C@@H]1C[C@H](CC)C([N+](=O)[O-])=C(NCc2ccc(Cl)nc2)N1C ZINC000103215055 FG Annotated Anodyne CCCO[C@H]1C[C@H](CC)C([N+](=O)[O-])=C(NCc2ccc(Cl)nc2)N1C ZINC000103215058 FG Annotated Anodyne CCCO[C@@H]1C[C@@H](CC)C([N+](=O)[O-])=C(NCc2ccc(Cl)nc2)N1C ZINC000103215060 FG Annotated Anodyne CCCO[C@H]1C[C@@H](CC)C([N+](=O)[O-])=C(NCc2ccc(Cl)nc2)N1C ZINC000103215062 FG Annotated Anodyne CC[C@@H]1C[C@H](OC(C)C)N(C)C(NCc2ccc(Cl)nc2)=C1[N+](=O)[O-] ZINC000103215064 FG Annotated Anodyne CC[C@H]1C[C@H](OC(C)C)N(C)C(NCc2ccc(Cl)nc2)=C1[N+](=O)[O-] ZINC000103215067 FG Annotated Anodyne CC[C@@H]1C[C@@H](OC(C)C)N(C)C(NCc2ccc(Cl)nc2)=C1[N+](=O)[O-] ZINC000103215069 FG Annotated Anodyne CC[C@H]1C[C@@H](OC(C)C)N(C)C(NCc2ccc(Cl)nc2)=C1[N+](=O)[O-] ZINC000103215070 FG Annotated Anodyne O=C(Nn1c(S)nnc1-c1cccc2ccccc12)c1ccccc1O ZINC000103215151 FG Annotated Anodyne CC(C)(C)n1ncc(OCc2nnc(-c3cccs3)o2)c(Cl)c1=O ZINC000103215966 FG Annotated Anodyne CCOC(=O)C(=O)OC1=C(c2c(C)cc(C)cc2C)C(=O)OC12CCCC2 ZINC000103216318 FG Annotated Anodyne O=C(O)[C@@H]1[C@@H](C(=O)Nc2cccc(Br)c2)[C@H]2C=C[C@H]1C21CC1 ZINC000103216346 FG Annotated Anodyne O=C(O)[C@@H]1[C@H](C(=O)Nc2cccc(Br)c2)[C@H]2C=C[C@H]1C21CC1 ZINC000103216349 FG Annotated Anodyne O=C(Nc1cccc(Br)c1)[C@@H]1[C@H](C(=O)O)[C@H]2C=C[C@H]1C21CC1 ZINC000103216352 FG Annotated Anodyne O=C(O)[C@H]1[C@H](C(=O)Nc2cccc(Br)c2)[C@H]2C=C[C@H]1C21CC1 ZINC000103216354 FG Annotated Anodyne CCCO[C@@H]1C[C@H](C)C([N+](=O)[O-])=C(NCc2ccc(Cl)nc2)N1CC ZINC000103216379 FG Annotated Anodyne CCCO[C@H]1C[C@H](C)C([N+](=O)[O-])=C(NCc2ccc(Cl)nc2)N1CC ZINC000103216382 FG Annotated Anodyne CCCO[C@@H]1C[C@@H](C)C([N+](=O)[O-])=C(NCc2ccc(Cl)nc2)N1CC ZINC000103216384 FG Annotated Anodyne CCCO[C@H]1C[C@@H](C)C([N+](=O)[O-])=C(NCc2ccc(Cl)nc2)N1CC ZINC000103216386 FG Annotated Anodyne CCN1C(NCc2ccc(Cl)nc2)=C([N+](=O)[O-])[C@@H](C)C[C@H]1OC(C)C ZINC000103216388 FG Annotated Anodyne CCN1C(NCc2ccc(Cl)nc2)=C([N+](=O)[O-])[C@@H](C)C[C@@H]1OC(C)C ZINC000103216391 FG Annotated Anodyne CCO[C@H]1C[C@@H](CC)C([N+](=O)[O-])=C(NCc2ccc(Cl)nc2)N1CC ZINC000103216402 FG Annotated Anodyne CCO[C@H]1C[C@H](CC)C([N+](=O)[O-])=C(NCc2ccc(Cl)nc2)N1CC ZINC000103216404 FG Annotated Anodyne CCO[C@@H]1C[C@@H](CC)C([N+](=O)[O-])=C(NCc2ccc(Cl)nc2)N1CC ZINC000103216407 FG Annotated Anodyne CCO[C@@H]1C[C@H](CC)C([N+](=O)[O-])=C(NCc2ccc(Cl)nc2)N1CC ZINC000103216409 FG Annotated Anodyne CCO[C@H]1C[C@@H](C)C([N+](=O)[O-])=C(N(CC)Cc2ccc(Cl)nc2)N1C ZINC000103216528 FG Annotated Anodyne CCO[C@H]1C[C@H](C)C([N+](=O)[O-])=C(N(CC)Cc2ccc(Cl)nc2)N1C ZINC000103216530 FG Annotated Anodyne Cc1nnsc1C1=NN[C@H]2SC(c3c(Cl)cccc3Cl)=NN12 ZINC000103216884 FG Annotated Anodyne Cc1nnsc1C1=NN[C@@H]2SC(c3c(Cl)cccc3Cl)=NN12 ZINC000103216886 FG Annotated Anodyne Brc1ccccc1COc1ccc2c(c1)CCc1nnnn1-2 ZINC000103217805 FG Annotated Anodyne CCO[C@H]1CCC([N+](=O)[O-])=C(N(CC)Cc2ccc(Cl)nc2)N1C ZINC000103217814 FG Annotated Anodyne CCO[C@@H]1CCC([N+](=O)[O-])=C(N(CC)Cc2ccc(Cl)nc2)N1C ZINC000103217816 FG Annotated Anodyne CCCO[C@@H]1CCC([N+](=O)[O-])=C(N(CC)Cc2ccc(Cl)nc2)N1C ZINC000103217827 FG Annotated Anodyne CCCO[C@H]1CCC([N+](=O)[O-])=C(N(CC)Cc2ccc(Cl)nc2)N1C ZINC000103217830 FG Annotated Anodyne CCN(Cc1ccc(Cl)nc1)C1=C([N+](=O)[O-])CC[C@H](OC(C)C)N1C ZINC000103217834 FG Annotated Anodyne CCN(Cc1ccc(Cl)nc1)C1=C([N+](=O)[O-])CC[C@@H](OC(C)C)N1C ZINC000103217837 FG Annotated Anodyne COP(=O)(OC)[C@@H](C)OC(=O)COc1ccc(Br)cc1 ZINC000103218292 FG Annotated Anodyne COP(=O)(OC)[C@H](C)OC(=O)COc1ccc(Br)cc1 ZINC000103218295 FG Annotated Anodyne COP(=O)(OC)[C@@H](C)OC(=O)COc1ccc(Cl)cc1[N+](=O)[O-] ZINC000103218304 FG Annotated Bother COP(=O)(OC)[C@H](C)OC(=O)COc1ccc(Cl)cc1[N+](=O)[O-] ZINC000103218308 FG Annotated Bother C=CCn1c(-c2ccccc2)c(C=C2C(=O)NC(=O)NC2=O)c2ccccc21 ZINC000103218898 FG Annotated Mild CC(C)Nc1nc(Cl)nc(NCc2cnc(Br)s2)n1 ZINC000103218931 FG Annotated Anodyne CC(=O)N1N=C(c2ccc(F)cc2)O[C@H]1/C=C/c1ccc(N(C)C)cc1 ZINC000103219328 FG Annotated Clean CC(=O)N1N=C(c2ccc(F)cc2)O[C@@H]1/C=C/c1ccc(N(C)C)cc1 ZINC000103219330 FG Annotated Clean O=C1Nc2ccc(Cl)cc2/C1=N/N1C(=O)CS[C@@H]1c1ccccc1 ZINC000103219549 FG Annotated Mild O=C1Nc2ccc(Cl)cc2/C1=N/N1C(=O)CS[C@H]1c1ccccc1 ZINC000103219552 FG Annotated Mild O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(/C=N/OCCF)cc1 ZINC000103219781 FG Annotated Mild C=CCO/N=C/c1ccc(NC(=O)NC(=O)c2c(F)cccc2F)cc1 ZINC000103219784 FG Annotated Mild O=c1c2cnn(-c3ccccc3)c2nc2sc(CNc3ccccc3)nn12 ZINC000103219958 FG Annotated Anodyne Cc1cccc2c1N(CC(=O)O)C/C(=C\c1ccc(N(C)C)cc1)C2=O ZINC000103220808 FG Annotated Mild COc1ccc(OC)c(/C=C2\CN(CC(=O)O)c3c(C)cccc3C2=O)c1 ZINC000103220816 FG Annotated Mild COc1ccc(/C=C2\CN(CC(=O)O)c3c(C)cccc3C2=O)c(OC)c1 ZINC000103220826 FG Annotated Mild CC1=NN(CC(=O)N/N=C(\C)c2ccc(-c3ccccc3)cc2)C(=O)CC1 ZINC000103221526 FG Annotated Reactive CCn1cc(C(=O)N/N=C/c2cccc(Cl)c2)c(=O)c2ccc(C)nc21 ZINC000103222702 FG Annotated Reactive CCn1cc(C(=O)N/N=C/c2ccc(Cl)cc2)c(=O)c2ccc(C)nc21 ZINC000103222707 FG Annotated Reactive CCOCCOC(=O)/C(C#N)=C(\NCc1ccc(Cl)cc1)C(C)C ZINC000103222751 FG Annotated Reactive CCOCCOC(=O)/C(C#N)=C(\NCc1ccc(Cl)cc1)SC ZINC000103222754 FG Annotated Reactive COc1ccc(OC[C@@H](N)CC(C)C)c2cc(-c3nc(C)no3)n(C)c12 ZINC000103224952 FG Annotated Anodyne Sc1nnc(-c2cnccn2)n1/N=C/c1ccc(Cl)cc1Cl ZINC000103226611 FG Annotated Mild COc1ccc([C@H]2CCN(c3nncc(-c4ccc(C)o4)n3)C2)cc1O ZINC000103227048 FG Annotated Anodyne COc1ccc([C@@H]2CCN(c3nncc(-c4ccc(C)o4)n3)C2)cc1O ZINC000103227052 FG Annotated Anodyne Nc1ccccc1C(=O)N/N=C1/c2ccccc2-c2nc3ccccc3nc21 ZINC000103227527 FG Annotated Reactive O=C(N/N=C1/c2ccccc2-c2nc3ccccc3nc21)c1ccc(O)cc1 ZINC000103227544 FG Annotated Reactive COc1ccc2c(=O)c3cc(C(=O)N[C@@H](CO)CC(C)C)ccc3oc2c1 ZINC000103228853 FG Annotated Bother N#CC(=C\c1ccc(Cl)cc1)/C=C1\SC(=S)N(CC(=O)O)C1=O ZINC000103229568 FG Annotated Reactive N#CC(=C\c1ccc(Br)cc1)/C=C1\SC(=S)NC1=O ZINC000103229604 FG Annotated Reactive COc1cc(-c2c(C#N)nnn2-c2cccc(Cl)c2)cc(OC)c1OC ZINC000103230353 FG Annotated Mild Cc1ccc(/C=C2\CNC[C@@H]3[C@@H]2NC(=S)N[C@@H]3c2ccc(C)cc2)cc1 ZINC000103231017 FG Annotated Anodyne Cc1ccc(/C=C2\CNC[C@H]3[C@@H](c4ccc(C)cc4)NC(=S)N[C@@H]23)cc1 ZINC000103231021 FG Annotated Anodyne Cc1ccc(/C=C2\CNC[C@@H]3[C@@H](c4ccc(C)cc4)NC(=S)N[C@@H]23)cc1 ZINC000103231023 FG Annotated Anodyne Fc1ccc(/C=C2\CNC[C@@H]3[C@@H]2NC(=S)N[C@@H]3c2ccc(F)cc2)cc1 ZINC000103231034 FG Annotated Anodyne Fc1ccc(/C=C2\CNC[C@H]3[C@@H](c4ccc(F)cc4)NC(=S)N[C@@H]23)cc1 ZINC000103231038 FG Annotated Anodyne Fc1ccc(/C=C2\CNC[C@@H]3[C@@H](c4ccc(F)cc4)NC(=S)N[C@@H]23)cc1 ZINC000103231040 FG Annotated Anodyne COc1ccc(CCC(=O)c2ccc3c(c2O)C[C@@H](O)C(C)(C)O3)cc1 ZINC000103233418 FG Annotated Anodyne COc1ccc(CCC(=O)c2ccc3c(c2O)C[C@H](O)C(C)(C)O3)cc1 ZINC000103233421 FG Annotated Anodyne O=C1C=C(NCCc2cc(Cl)c(O)c(Cl)c2)C(=O)c2ncccc21 ZINC000103234353 FG Annotated Mild COc1ccc(-c2coc(COc3ccc(F)c(C(N)=O)c3F)n2)cc1 ZINC000103234515 FG Annotated Anodyne O=C(OCc1cc(O)c2c(c1)C(=O)c1cccc(O)c1C2=O)c1ccccc1 ZINC000103235118 FG Annotated Clean O=C(NCc1ccccc1)c1c(NO)cc(-c2ccc(F)cc2)oc1=O ZINC000103238518 FG Annotated Anodyne Cc1ccc(-c2cc(NO)c(C(=O)NCc3ccccc3)c(=O)o2)cc1 ZINC000103238522 FG Annotated Anodyne O=S1(=O)C=Cc2cc(-n3cc(-c4cccc(Cl)c4)nn3)ccc2O1 ZINC000103241883 FG Annotated Anodyne Nc1c(C(=O)N2CCOCC2)sc2nc(C3CC3)cc(C(F)(F)F)c12 ZINC000103241935 FG Annotated Anodyne NCCCCN(C[C@@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21 ZINC000103242141 FG Annotated Anodyne NCCCCN(C[C@H]1Cc2ccccc2CN1)[C@H]1CCCc2cccnc21 ZINC000103242168 FG Annotated Anodyne O=S1(=O)N=C(OCc2cccc(Br)c2)c2ccccc21 ZINC000103243898 FG Annotated Anodyne C[C@H]1NC(c2ccc(Br)cc2)=Nc2nc3ccccn3c2C1=O ZINC000103245036 FG Annotated Anodyne C[C@@H]1NC(c2ccc(Br)cc2)=Nc2nc3ccccn3c2C1=O ZINC000103245063 FG Annotated Anodyne CN(CCN)CCC[C@@]1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 ZINC000103245782 FG Annotated Mild CN(CCN)CCC[C@]1(c2ccc(F)cc2)OCc2cc(C#N)ccc21 ZINC000103245785 FG Annotated Mild CCOc1nc(C2CC2)c(C(=O)NC2[C@H]3CC4C[C@H]2CC(O)(C4)C3)s1 ZINC000103246858 FG Annotated Anodyne CCOc1nc(C2CC2)c(C(=O)NC2[C@@H]3CC4C[C@@H]2CC(O)(C4)C3)s1 ZINC000103246867 FG Annotated Anodyne Cc1nc(OC2CCC2)c(C(=O)NC2[C@@H]3CC4C[C@@H]2CC(O)(C4)C3)s1 ZINC000103247204 FG Annotated Anodyne Cc1nc(OC2CCC2)c(C(=O)NC2[C@H]3CC4C[C@@H]2CC(O)(C4)C3)s1 ZINC000103247206 FG Annotated Anodyne Cc1nc(OC2CCC2)c(C(=O)NC2[C@H]3CC4C[C@H]2CC(O)(C4)C3)s1 ZINC000103247208 FG Annotated Anodyne COc1ccc2c(c1O)C[C@@H]1C=C[C@@]2(c2cc(OC)c(OC)c(OC)c2)O1 ZINC000103247657 FG Annotated Anodyne CC(C)n1ccnc1/C=C1\CN(C)C/C(=C\c2nccn2C(C)C)C1=O ZINC000103248387 FG Annotated Mild CCOC(=O)C1CCC2(CC1)OOC1(OO2)C2CC3CC(C2)CC1C3 ZINC000103250430 FG Annotated Reactive CN(C)CCCO[P@](=O)(O)Oc1ccc(NC(=O)OC(C)(C)C)cc1 ZINC000103250459 FG Annotated Anodyne CNc1cc(N2CCC(CN)(c3ccc(Cl)c(Cl)c3)CC2)ncn1 ZINC000103251764 FG Annotated Anodyne O=S1(=O)C=Cc2cc(-n3nncc3-c3cccc(Cl)c3)ccc2O1 ZINC000103251766 FG Annotated Anodyne CCOC(=O)C1=C(N)Oc2cc(O)ccc2[C@@H]1c1ccnc2ccccc12 ZINC000103252981 FG Annotated Anodyne CCOC(=O)C1=C(N)Oc2cc(O)ccc2[C@H]1c1ccnc2ccccc12 ZINC000103252982 FG Annotated Anodyne CCOC(=O)C1=C(N)Oc2cc(O)ccc2[C@@H]1c1cnc2ccccc2c1 ZINC000103253061 FG Annotated Anodyne CCOC(=O)C1=C(N)Oc2cc(O)ccc2[C@H]1c1cnc2ccccc2c1 ZINC000103253064 FG Annotated Anodyne CCC(CC)C(=O)Nc1cc(NC(=O)c2ccco2)ccc1OCC(=O)O ZINC000103253700 FG Annotated Anodyne O=C(O)Cc1cnc(C(=O)c2ccc(NC(=O)C3CC3)cc2)c2ccccc12 ZINC000103256295 FG Annotated Anodyne Cc1nc(N)cc2c1cc(-c1cnc3[nH]cnc3c1)c(=O)n2C1CCCC1 ZINC000103260633 FG Annotated Anodyne C=C[C@H]1CN(C(=O)c2cc(-c3ccc(F)cc3)on2)[C@@H](CC(C)C)C(=O)N1 ZINC000103261204 FG Annotated Mild Cc1c(Cl)cncc1-c1nn(C)c2nc(OCc3ccccn3)cnc12 ZINC000103261406 FG Annotated Anodyne O=CN1CCN(Cc2c(O)ccc3oc(Cc4ccccc4)cc23)CC1 ZINC000103262340 FG Annotated Clean NC(=O)C1CCN(Cc2c(O)ccc3oc(Cc4ccccc4)cc23)CC1 ZINC000103262348 FG Annotated Clean COc1ccc([C@@H]2NC(=N)NC(c3ccc(C)cc3)=C2CC(=O)O)cc1 ZINC000103262474 FG Annotated Anodyne COc1ccc([C@H]2NC(=N)NC(c3ccc(C)cc3)=C2CC(=O)O)cc1 ZINC000103262476 FG Annotated Anodyne O=C1CN(CCCCCN2CCCCCC2)c2ccc([N+](=O)[O-])cc2N1 ZINC000103262734 FG Annotated Bother CN1C(=O)CN(CCCCCN2CCCCCC2)c2ccc([N+](=O)[O-])cc21 ZINC000103262748 FG Annotated Bother CNc1nc(NCCCN(C)C)c2sc(-c3ccc(OC)nc3)cc2n1 ZINC000103263078 FG Annotated Anodyne CNc1nc(NCCCN(C)C)c2sc(-c3ccc(N)cc3)cc2n1 ZINC000103263083 FG Annotated Anodyne COc1ccc(CCc2noc(-c3cc(OC)c4c(c3)OCCO4)n2)cc1 ZINC000103263302 FG Annotated Anodyne CN(C)CCCSc1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000103264523 FG Annotated Clean CCNC(=O)Nc1nc2cc(-c3cccnc3)c(=O)n(C(C)C)c2s1 ZINC000103264860 FG Annotated Anodyne CCNC(=O)Nc1nc2cc(-c3cccnc3)c(=O)n(CC3CC3)c2s1 ZINC000103264861 FG Annotated Anodyne CCNC(=O)Nc1nc2cc(-c3cccnc3)c(=O)n(CC(C)C)c2s1 ZINC000103264866 FG Annotated Anodyne CC[C@H]1CN(C(=O)c2cc(-c3ccc(F)cc3)on2)[C@@H](CC(C)C)C(=O)N1 ZINC000103265364 FG Annotated Anodyne COc1ccc(-c2c(N)noc2-c2cc(OC)c3c(c2)OCCO3)cc1 ZINC000103265706 FG Annotated Anodyne COc1ccc(/C=C/C(=O)N2C[C@H](CC(C)C)NC(=O)[C@@H]2CC(C)C)cc1 ZINC000103267077 FG Annotated Anodyne CC(C)(C)OC(=O)n1cc(-c2ccc(NC(=O)c3ccc[nH]3)cc2)nc1N ZINC000103267309 FG Annotated Anodyne CC(C)(C)OC(=O)n1cc(-c2cccc(NC(=O)c3ccc[nH]3)c2)nc1N ZINC000103267347 FG Annotated Anodyne N#Cc1c(-c2ccc(Cl)cc2)cc(-c2ccccn2)n(CCCO)c1=O ZINC000103267964 FG Annotated Mild CCn1c(C(=O)NCc2cncnc2)nc2c(-c3ccccc3)cccc21 ZINC000103268362 FG Annotated Anodyne Nc1ccccc1CNc1ccc(S(=O)(=O)Nc2nccs2)cc1 ZINC000103268883 FG Annotated Anodyne O=S(=O)(Nc1nccs1)c1ccc(NCc2cccc(O)c2)cc1 ZINC000103268885 FG Annotated Anodyne C#CCCNCCc1cc(OC)c(Br)cc1Br ZINC000103269931 FG Annotated Mild COc1ccc2oc(=O)cc(-n3cc(COc4ccc(F)cc4)nn3)c2c1 ZINC000103271644 FG Annotated Anodyne CCOC(=O)C(=O)CC(=O)/C=C/c1cccn1Cc1ccccc1OCC ZINC000103273791 FG Annotated Mild O=C1C(Nc2ccc(C(F)(F)F)cc2)=C(Cl)C(=O)c2ncncc21 ZINC000103274471 FG Annotated Mild Cc1cc(C)c(-c2c(OC(=O)C(C)(C)C)n3n(c2=O)CCOCC3)c(C)c1 ZINC000103274815 FG Annotated Anodyne O=C1[C@@H]([C@H](O)c2ccc3c(c2)OCCO3)CCN1C/C=C/c1ccccc1 ZINC000103275035 FG Annotated Anodyne O=C1[C@H]([C@H](O)c2ccc3c(c2)OCCO3)CCN1C/C=C/c1ccccc1 ZINC000103275038 FG Annotated Anodyne O=C1[C@@H]([C@@H](O)c2ccc3c(c2)OCCO3)CCN1C/C=C/c1ccccc1 ZINC000103275039 FG Annotated Anodyne O=C1[C@H]([C@@H](O)c2ccc3c(c2)OCCO3)CCN1C/C=C/c1ccccc1 ZINC000103275042 FG Annotated Anodyne Cc1cc(C)c2c(=O)c3ccccc3n(CCCN3CCN(C)CC3)c2c1 ZINC000103275049 FG Annotated Bother O=C1C(Nc2ccc(OC(F)(F)F)cc2)=C(Cl)C(=O)c2ncncc21 ZINC000103275863 FG Annotated Mild Clc1ccc2c(-c3ccccc3)cc(CCN3CCNCC3)nc2n1 ZINC000103278470 FG Annotated Anodyne O=C(Nc1nnc(C(F)(F)F)s1)[C@@H](Br)C1CCCC1 ZINC000103278940 FG Annotated Reactive O=C(Nc1nnc(C(F)(F)F)s1)[C@H](Br)C1CCCC1 ZINC000103278942 FG Annotated Reactive N#Cc1c(N2CCCC2=O)c(C(=O)Nc2ccc(Cl)cc2)n2c1CCC2 ZINC000103280011 FG Annotated Mild Cc1ccc(NC(=O)c2c(NC(=O)CCl)c(C#N)c3n2CCC3)cc1 ZINC000103280020 FG Annotated Reactive COc1ccc([C@@H]2C=C(c3cc(OC)ccc3OC)NC(=S)N2)cc1 ZINC000103280780 FG Annotated Anodyne COc1ccc([C@H]2C=C(c3cc(OC)ccc3OC)NC(=S)N2)cc1 ZINC000103280782 FG Annotated Anodyne O=C1[C@@H]([C@H](O)c2ccc3c(c2)OCCO3)CCCN1/C=C/c1ccccc1 ZINC000103280847 FG Annotated Anodyne O=C1[C@H]([C@H](O)c2ccc3c(c2)OCCO3)CCCN1/C=C/c1ccccc1 ZINC000103280849 FG Annotated Anodyne O=C1[C@@H]([C@@H](O)c2ccc3c(c2)OCCO3)CCCN1/C=C/c1ccccc1 ZINC000103280850 FG Annotated Anodyne O=C1[C@H]([C@@H](O)c2ccc3c(c2)OCCO3)CCCN1/C=C/c1ccccc1 ZINC000103280853 FG Annotated Anodyne Cc1ccc(-[n+]2noc(O)c2/C=N/c2nnc(-c3ccccc3)s2)cc1 ZINC000103280876 FG Annotated Mild Cc1noc(C)c1S(=O)(=O)NCc1ccc(-c2cccc(C#N)c2)cc1 ZINC000103281431 FG Annotated Mild O=C1C(=O)c2c(nc3ccccn23)C(Br)=C1CC(F)(F)F ZINC000103281871 FG Annotated Mild O=C1C(=O)c2c(nc3ccccn23)C(Br)=C1c1ccccc1 ZINC000103281876 FG Annotated Mild CCC1(CC)C[C@H](CNC(=O)c2ccc(Br)cc2)OC1=O ZINC000103282624 FG Annotated Anodyne CCC1(CC)C[C@@H](CNC(=O)c2ccc(Br)cc2)OC1=O ZINC000103282625 FG Annotated Anodyne COc1cc(Br)cc(-c2noc([C@H]3CCCN3C)n2)c1OC ZINC000103285086 FG Annotated Anodyne COc1cc(Br)cc(-c2noc([C@@H]3CCCN3C)n2)c1OC ZINC000103285089 FG Annotated Anodyne Cc1ccc(C2=NN(c3nc(C)cc(C)n3)[C@](O)(C(F)(F)F)C2)cc1 ZINC000103285627 FG Annotated Anodyne Cc1cc(C)nc(N2N=C(c3ccc(F)cc3)C[C@@]2(O)C(F)(F)F)n1 ZINC000103285632 FG Annotated Anodyne CCOC(=O)c1cc(O)c(OCc2cc(=O)oc3ccc(C)cc23)c(O)c1 ZINC000103285965 FG Annotated Anodyne CCOC(=O)c1cc(O)c(OCc2cc(=O)oc3cc(C)ccc23)c(O)c1 ZINC000103285969 FG Annotated Anodyne CN1CCN(c2ncnc3sc(Nc4ccc(Cl)cc4)nc23)CC1 ZINC000103287360 FG Annotated Anodyne CNc1cc2c(cc1[N+](=O)[O-])C(=O)C[C@@H]1[C@]2(C)CCC[C@@]1(C)C(=O)OC ZINC000103287599 FG Annotated Bother O=C1c2ccc([N+](=O)[O-])cc2C(=O)[C@@H]1[C@H](C[N+](=O)[O-])c1cccc(Cl)c1 ZINC000103287751 FG Annotated Clean O=C1c2ccc([N+](=O)[O-])cc2C(=O)[C@@H]1[C@@H](C[N+](=O)[O-])c1cccc(Cl)c1 ZINC000103287754 FG Annotated Clean O=C1c2ccc([N+](=O)[O-])cc2C(=O)[C@H]1[C@H](C[N+](=O)[O-])c1cccc(Cl)c1 ZINC000103287757 FG Annotated Clean O=C1c2ccc([N+](=O)[O-])cc2C(=O)[C@H]1[C@@H](C[N+](=O)[O-])c1cccc(Cl)c1 ZINC000103287761 FG Annotated Clean O=C1c2ccc([N+](=O)[O-])cc2C(=O)[C@@H]1[C@H](C[N+](=O)[O-])c1ccccc1Cl ZINC000103287764 FG Annotated Clean O=C1c2ccc([N+](=O)[O-])cc2C(=O)[C@@H]1[C@@H](C[N+](=O)[O-])c1ccccc1Cl ZINC000103287766 FG Annotated Clean O=C1c2ccc([N+](=O)[O-])cc2C(=O)[C@H]1[C@H](C[N+](=O)[O-])c1ccccc1Cl ZINC000103287769 FG Annotated Clean O=C1c2ccc([N+](=O)[O-])cc2C(=O)[C@H]1[C@@H](C[N+](=O)[O-])c1ccccc1Cl ZINC000103287772 FG Annotated Clean O=C1c2ccc([N+](=O)[O-])cc2C(=O)[C@@H]1[C@H](C[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000103287905 FG Annotated Clean O=C1c2ccc([N+](=O)[O-])cc2C(=O)[C@@H]1[C@@H](C[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000103287908 FG Annotated Clean O=C1c2ccc([N+](=O)[O-])cc2C(=O)[C@H]1[C@H](C[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000103287910 FG Annotated Clean O=C1c2ccc([N+](=O)[O-])cc2C(=O)[C@H]1[C@@H](C[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000103287913 FG Annotated Clean C[C@@]12CCCC(/C=N/NC(=O)c3ccncc3)=C1C(=O)O[C@H]2c1ccoc1 ZINC000103288534 FG Annotated Reactive O=Cc1ccc(/C=N/c2c(O)cc(S(=O)(=O)O)c3ccccc23)cc1 ZINC000103288952 FG Annotated Mild CC1=C2C(=O)O[C@@H](c3ccoc3)[C@]2(C)CC/C1=N\NC(=O)c1ccncc1 ZINC000103289653 FG Annotated Reactive CCS(=O)(=O)n1cc(-c2ocnc2Br)c2ccccc21 ZINC000103290813 FG Annotated Anodyne CCCc1cc(C(=O)NCCOc2ccc(CCOCC)cc2C)n(C)n1 ZINC000103292558 FG Annotated Anodyne CC(C)NC(=S)SCC(CSC(=S)NC(C)C)CN(C)C ZINC000103292639 FG Annotated Anodyne CCN(CC)C(=S)SCC(=O)CSC(=S)N(CC)CC ZINC000103293891 FG Annotated Anodyne CCOC(=O)[C@@H]1CC(c2ccc(OCCc3ccc(CC)cn3)cc2)=NO1 ZINC000103296681 FG Annotated Anodyne CCOC(=O)[C@H]1CC(c2ccc(OCCc3ccc(CC)cn3)cc2)=NO1 ZINC000103296683 FG Annotated Anodyne CCCCC(=O)NC[C@@H]1C[C@@H]2c3cccc4c3c(cn4C)C[C@H]2N(C)C1 ZINC000103297447 FG Annotated Clean CN1C[C@H](CNC(=O)C2CCCC2)C[C@@H]2c3cccc4c3c(cn4C)C[C@H]21 ZINC000103297465 FG Annotated Clean O=C(N1CCCCC1)n1ncc(C(O)(c2ccccc2)c2ccccc2)n1 ZINC000103298497 FG Annotated Anodyne O=C(c1nc(-c2ccc(C(F)(F)F)cc2)n2ccccc12)N1CCNCC1 ZINC000103298997 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1cc2c(c([N+](=O)[O-])c1)Nc1ccccc1O2 ZINC000103299692 FG Annotated Bother FC(F)Oc1ccc(-c2nnc3cncc(OCC(F)(F)F)n23)cc1 ZINC000103303148 FG Annotated Anodyne C=Cc1cc([C@H]2C3=C(CCCC3=O)NC3=C2S(=O)(=O)CC3)ccc1F ZINC000103303150 FG Annotated Mild CS(=O)(=O)N1CCC(N(c2ccc(Cl)cc2)c2cccnc2)CC1 ZINC000103303256 FG Annotated Anodyne O=C1CCCC2=C1[C@H](c1ccc(F)c(Cl)c1)C1=C(CCS1(=O)=O)N2 ZINC000103303452 FG Annotated Mild O=C1CCCC2=C1[C@H](c1ccc(Cl)c(F)c1)C1=C(CCS1(=O)=O)N2 ZINC000103303536 FG Annotated Mild CO/C(O)=C1/C(C)=NC(=S)N[C@@H]1c1ccc(OC(=O)c2ccco2)cc1 ZINC000103347573 FG Annotated Anodyne CO/C(O)=C1/C(C)=NC(=S)N[C@H]1c1ccc(OC(=O)c2ccco2)cc1 ZINC000103347576 FG Annotated Anodyne Cc1cccc(N/C=C2\N=C(c3ccccc3Br)OC2=O)n1 ZINC000103352303 FG Annotated Anodyne CN(C)c1ccc([C@H]2[C@@H]3C=C[C@H](C3)[C@@]2(C#N)C(=O)O)c(Br)c1 ZINC000103471878 FG Annotated Mild CC1(C)Cc2c(cnn2-c2ccccc2)C(=O)/C1=N\NC(=O)c1ccccc1 ZINC000103483974 FG Annotated Reactive Cc1ccnc(SCc2cc(O)c3c(O)n(-c4ccccc4)nc3n2)n1 ZINC000103524126 FG Annotated Anodyne CNC(=N)N1C=CC[C@@]2(C1)[C@@H]1CC[C@H]3CC=C[C@H]4CC(C(=O)O)=C(C1)[C@@]342 ZINC000103525006 FG Annotated Anodyne in-vitro biogenic CNC(=N)N1C=CC[C@@]2(C1)[C@@H]1CC[C@H]3CCC[C@H]4CC(C(=O)O)=C(C1)[C@]432 ZINC000103525014 FG Annotated Anodyne in-vitro biogenic CNC(=N)N1C=CC[C@]23[C@@H]4CC[C@@](C)(CC[C@@H]12)[C@]31CCC(C(=O)O)=C1C4 ZINC000103525019 FG Annotated Anodyne in-vitro biogenic Cc1cnccc1N1CCCN(C(=O)c2ccc([C@@H]3CCCN3)s2)CC1 ZINC000103525759 FG Annotated Anodyne Cc1cnccc1N1CCCN(C(=O)c2ccc([C@H]3CCCN3)s2)CC1 ZINC000103525767 FG Annotated Anodyne COc1ccccc1-c1c(C)nn2c(O)cc(CCCc3cn[nH]c3)nc12 ZINC000103525971 FG Annotated Anodyne CC(C)(C)c1cc2nc(CCn3c(O)nc4ccccc43)cc(O)n2n1 ZINC000103526025 FG Annotated Anodyne CCCc1nn(-c2ccc(F)cc2)c(O)c1/C=N/CCCn1ccnc1 ZINC000103530424 FG Annotated Mild CC/N=c1\c(NS(=O)(=O)c2ccc(C)cc2C)c(O)oc2ccccc12 ZINC000103532176 FG Annotated Anodyne COC(=O)c1nc2n(n1)[C@@H](c1ccccc1)C1=C(O)CC(C)(C)CC1=N2 ZINC000103532527 FG Annotated Anodyne COC(=O)c1nc2n(n1)[C@H](c1ccccc1)C1=C(O)CC(C)(C)CC1=N2 ZINC000103532529 FG Annotated Anodyne CCOc1ccc(CC/N=c2/c(-c3ccccc3)c(O)c2=O)cc1OCC ZINC000103535519 FG Annotated Anodyne O=C(Cn1ncc2c3ccccc3nc-2c1O)NCCC1=CCCCC1 ZINC000103536054 FG Annotated Anodyne O=C(Cn1ncc2c3ccccc3nc-2c1O)N[C@H]1CCCc2ccccc21 ZINC000103536361 FG Annotated Anodyne O=C(Cn1ncc2c3ccccc3nc-2c1O)N[C@@H]1CCCc2ccccc21 ZINC000103536367 FG Annotated Anodyne O=C(Cn1ncc2c3ccccc3nc-2c1O)N1CC[C@@H](c2ccccc2)C1 ZINC000103536390 FG Annotated Anodyne O=C(Cn1ncc2c3ccccc3nc-2c1O)N1CC[C@H](c2ccccc2)C1 ZINC000103536398 FG Annotated Anodyne Cc1ccc2nc3c(O)n(CC(=O)Nc4cccnc4Cl)ncc-3c2c1 ZINC000103536657 FG Annotated Anodyne Cc1ccc2nc3c(O)n(CC(=O)N[C@@H]4CCC[C@H](C)[C@@H]4C)ncc-3c2c1 ZINC000103536705 FG Annotated Anodyne Cc1ccc2nc3c(O)n(CC(=O)N[C@@H]4CCC[C@@H](C)[C@@H]4C)ncc-3c2c1 ZINC000103536715 FG Annotated Anodyne CCc1ccc(CNC(=O)Cn2ncc3c4cc(C)ccc4nc-3c2O)cc1 ZINC000103536778 FG Annotated Anodyne CC1(C)CC2=Nc3nc(O)nc(O)c3[C@@H](c3ccc(O)cc3)C2=C(O)C1 ZINC000103537742 FG Annotated Anodyne CC1(C)CC2=Nc3nc(O)nc(O)c3[C@H](c3ccc(O)cc3)C2=C(O)C1 ZINC000103537748 FG Annotated Anodyne COC(=O)c1nc2n(n1)[C@H](c1ccccc1Cl)C1=C(O)CCCC1=N2 ZINC000103538842 FG Annotated Anodyne COC(=O)c1nc2n(n1)[C@@H](c1ccccc1Cl)C1=C(O)CCCC1=N2 ZINC000103538847 FG Annotated Anodyne CCO/C(O)=C1/C(C)=Nc2ncnn2[C@H]1c1ccccc1OC(F)F ZINC000103539087 FG Annotated Anodyne CCO/C(O)=C1/C(C)=Nc2ncnn2[C@@H]1c1ccccc1OC(F)F ZINC000103539093 FG Annotated Anodyne CCO/C(O)=C1/C(C)=Nc2ncnn2[C@H]1c1ccc(OC(F)F)cc1 ZINC000103539254 FG Annotated Anodyne CCO/C(O)=C1/C(C)=Nc2ncnn2[C@@H]1c1ccc(OC(F)F)cc1 ZINC000103539259 FG Annotated Anodyne COCC1=Nc2ncnn2[C@H](c2ccc(Cl)cc2Cl)/C1=C(/O)OC ZINC000103539571 FG Annotated Anodyne COCC1=Nc2ncnn2[C@@H](c2ccc(Cl)cc2Cl)/C1=C(/O)OC ZINC000103539575 FG Annotated Anodyne COc1ccc([C@@H]2/C(=C(\O)OC(C)C)C(C)=Nc3ncnn32)c(OC)c1 ZINC000103542748 FG Annotated Anodyne COc1ccc([C@H]2/C(=C(\O)OC(C)C)C(C)=Nc3ncnn32)c(OC)c1 ZINC000103542754 FG Annotated Anodyne C=CC[C@]12C(=O)C=C(OC)[C@]3(OC)[C@@H]1[C@@]3(C)[C@@H]2c1ccc(OC)c(OC)c1 ZINC000103547129 FG Annotated Mild in-vitro biogenic C=CC[C@]12C(=O)C=C(OC)[C@]3(OC)[C@@H]1[C@]3(C)[C@@H]2c1ccc(OC)c(OC)c1 ZINC000103547134 FG Annotated Mild in-vitro biogenic O=[N+]([O-])c1cccc(/N=C2/N=CCC(c3cccc(Cn4cncn4)c3)=N2)c1 ZINC000103550302 FG Annotated Mild CC(C)=CC[C@]12C[C@H](C(C)(C)O)[C@](C)(C1=O)C(O)=C(C(=O)C(C)C)C2=O ZINC000103553308 FG Annotated Mild in-vitro biogenic CC(C)=CC[C@]12C[C@@H](C(C)(C)O)[C@](C)(C1=O)C(O)=C(C(=O)C(C)C)C2=O ZINC000103553315 FG Annotated Mild in-vitro biogenic CC(C)C(=O)C1=C(O)[C@]2(C)C[C@H]3C(C)(C)[C@H](C(C)(C)O)C[C@]3(C1=O)C2=O ZINC000103557535 FG Annotated Mild in-vitro biogenic CC(C)C(=O)C1=C(O)[C@]2(C)C[C@H]3C(C)(C)[C@@H](C(C)(C)O)C[C@]3(C1=O)C2=O ZINC000103557544 FG Annotated Mild in-vitro biogenic C[C@H]1[C@H](O)CC[C@H]2C[C@H](CCCCCCC[C@@H](O)CC(=O)O)C=CN21 ZINC000103573544 FG Annotated Anodyne in-vitro biogenic CN1[C@H]2O[C@@H]3Cc4cc5c(cc4[C@H]1[C@]3(C)c1ccc3c(c12)OCO3)OCO5 ZINC000103579057 FG Annotated Anodyne in-vitro biogenic COc1ccc(C2=C(O)[C@H](O)c3cc(OC)c(OC)cc3O2)cc1OC ZINC000103579968 FG Annotated Anodyne in-vitro biogenic CN1CCC(n2[nH]cc3nc(-c4ccc(-c5csnn5)cc4)nc2-3)CC1 ZINC000103595619 FG Annotated Anodyne O=S(=O)(Cl)c1cc(Br)cc(OCc2ccccc2)n1 ZINC000103605315 FG Annotated Unstable O=S(=O)(Cl)c1cc(Br)nc(OCc2ccccc2)c1 ZINC000103605601 FG Annotated Unstable C/C(=C\c1nsc(Nc2ccc(Cl)cc2)n1)NCCO[N+](=O)[O-] ZINC000103624514 FG Annotated Anodyne c1ccc2c(c1)OC[C@@H](CSc1n[nH]c3c4ccccc4nc-3n1)O2 ZINC000103637711 FG Annotated Anodyne c1ccc2c(c1)OC[C@H](CSc1n[nH]c3c4ccccc4nc-3n1)O2 ZINC000103637713 FG Annotated Anodyne CC1=C(C(=O)N2CCOCC2)[C@H](c2ccc(F)cc2)C2=C(O)CCCC2=N1 ZINC000103638051 FG Annotated Anodyne CC1=C(C(=O)N2CCOCC2)[C@@H](c2ccc(F)cc2)C2=C(O)CCCC2=N1 ZINC000103638058 FG Annotated Anodyne COc1ccc([C@H]2/C(=C(/O)c3ccc(C)cc3)C(=O)C(=O)N2C)c(OC)c1 ZINC000103650133 FG Annotated Mild COc1ccc([C@@H]2/C(=C(/O)c3ccc(C)cc3)C(=O)C(=O)N2C)c(OC)c1 ZINC000103650136 FG Annotated Mild C[C@H]1[C@H](C)CCC[C@H]1NC(=O)CCCN1C(=O)CSc2ncccc21 ZINC000103670767 FG Annotated Anodyne C[C@@H]1[C@@H](NC(=O)CCCN2C(=O)CSc3ncccc32)CCC[C@H]1C ZINC000103670773 FG Annotated Anodyne C/N=c1\c(NS(=O)(=O)c2cc(C)cc(C)c2)c(O)oc2ccccc12 ZINC000103673376 FG Annotated Anodyne CC/N=c1\c(NS(=O)(=O)c2cc(C)cc(C)c2)c(O)oc2ccccc12 ZINC000103673440 FG Annotated Anodyne Cc1cc2nc3n(c2cc1C)C[C@@H]1C[C@@H](C(=O)NCc2ccccc2)N(C)[C@H]31 ZINC000103675275 FG Annotated Anodyne Cc1cc2nc3n(c2cc1C)C[C@@H]1C[C@@H](C(=O)NCCC(C)C)N(C)[C@H]31 ZINC000103675352 FG Annotated Anodyne CCOC(=O)Cc1cc(=O)n2[nH]c(-c3ccccc3)c(-c3ccccc3)c2n1 ZINC000103679382 FG Annotated Anodyne Cc1cc2nc(SC/C(O)=N/c3ccc4c(c3)OCO4)n(C)c(O)c-2n1 ZINC000103688420 FG Annotated Mild COc1cc([C@@H]2C3=C(O)CCCC3=Nc3c(C#N)cnn32)cc(OC)c1O ZINC000103693177 FG Annotated Anodyne COc1cc([C@H]2C3=C(O)CCCC3=Nc3c(C#N)cnn32)cc(OC)c1O ZINC000103693183 FG Annotated Anodyne COc1cccc([C@@H]2C3=C(O)CCCC3=Nc3c(C#N)cnn32)c1OC ZINC000103693202 FG Annotated Anodyne COc1cccc([C@H]2C3=C(O)CCCC3=Nc3c(C#N)cnn32)c1OC ZINC000103693208 FG Annotated Anodyne COc1ccc([C@@H]2C3=C(O)CCCC3=Nc3c(C#N)cnn32)cc1OC ZINC000103693288 FG Annotated Anodyne COc1ccc([C@H]2C3=C(O)CCCC3=Nc3c(C#N)cnn32)cc1OC ZINC000103693293 FG Annotated Anodyne COc1ccc([C@@H]2C3=C(O)CCCC3=Nc3c(C#N)cnn32)c(OC)c1 ZINC000103693368 FG Annotated Anodyne COc1ccc([C@H]2C3=C(O)CCCC3=Nc3c(C#N)cnn32)c(OC)c1 ZINC000103693373 FG Annotated Anodyne C/N=c1\c(NC(=O)c2ccc(Br)o2)c(O)oc2ccccc12 ZINC000103705966 FG Annotated Anodyne CCOC(=O)Cc1c(C)nc2cc(-c3ccc(C(C)(C)C)cc3)[nH]n2c1=O ZINC000103739918 FG Annotated Anodyne CC(C)(C)C(=O)/C=c1/nc(O)/c(=C/c2cccc(C(F)(F)F)c2)s1 ZINC000103754853 FG Annotated Anodyne CC(C)(C)C(=O)/C=c1/nc(O)/c(=C/c2ccc(C(F)(F)F)cc2)s1 ZINC000103754913 FG Annotated Anodyne CC(C)(C)C(=O)/C=c1/nc(O)/c(=C/c2ccccc2C(F)(F)F)s1 ZINC000103754961 FG Annotated Anodyne NC1=NC=C(c2ccccc2)/C(=C2/C=CC(OCc3ccccc3)=CC2=O)N1 ZINC000103756020 FG Annotated Mild COc1ccc(/C=N/N/C=C2\C=NC(=O)C(C#N)=C2Nc2ccccc2)cc1 ZINC000103764786 FG Annotated Reactive O=C1C(=O)N(C[C@H]2CCCO2)[C@H](c2ccco2)/C1=C(/O)c1ccc(F)cc1 ZINC000103805732 FG Annotated Mild O=C1C(=O)N(C[C@@H]2CCCO2)[C@H](c2ccco2)/C1=C(/O)c1ccc(F)cc1 ZINC000103805736 FG Annotated Mild O=C1C(=O)N(C[C@H]2CCCO2)[C@@H](c2ccco2)/C1=C(/O)c1ccc(F)cc1 ZINC000103805742 FG Annotated Mild O=C1C(=O)N(C[C@@H]2CCCO2)[C@@H](c2ccco2)/C1=C(/O)c1ccc(F)cc1 ZINC000103805750 FG Annotated Mild C/C(N[C@@H]1CCCC[C@H]1N/C(C)=C1\C=CC=CC1=O)=C1/C=CC=CC1=O ZINC000103821275 FG Annotated Mild CCOC(=O)Cc1c(C)nc2c(-c3ccc(Cl)cc3)c(C)[nH]n2c1=O ZINC000103836081 FG Annotated Anodyne C=C(C)COC1=CC(=O)/C(=C2/NNC(C)=C2c2ccc(OC)cc2)C=C1 ZINC000103864658 FG Annotated Mild CCOc1cccc2c1O[C@@]1(C)C[C@H]2[C@@H](C(=O)c2ccccc2)C(=O)N1 ZINC000103871206 FG Annotated Anodyne COc1ccc([C@H]2C3=C(O)CCCC3=Nc3nc(O)nc(O)c32)cc1OC ZINC000103878172 FG Annotated Anodyne COc1ccc([C@@H]2C3=C(O)CCCC3=Nc3nc(O)nc(O)c32)cc1OC ZINC000103878177 FG Annotated Anodyne C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@@]1(C)/C(O)=C1\C(=O)[C@H](CO)N(C)C1=O ZINC000103884759 FG Annotated Anodyne CCO/C(O)=C1\C(C)=NC(S)=N[C@H]1c1cc(OC)c(OC)c(OC)c1 ZINC000103889700 FG Annotated Anodyne CCO/C(O)=C1\C(C)=NC(S)=N[C@@H]1c1cc(OC)c(OC)c(OC)c1 ZINC000103889706 FG Annotated Anodyne N#CCSc1nc2nncc-2c(O)n1-c1cccc(C(F)(F)F)c1 ZINC000103903651 FG Annotated Mild CCN1C(SCC(=O)NC2CCCC2)=NN/C1=C1\C=Nc2ccccc21 ZINC000103917314 FG Annotated Anodyne O=[N+]([O-])c1ccccc1/N=N/c1c(O)[nH]c2ccc(S(=O)(=O)O)cc12 ZINC000103939530 FG Annotated Clean C=CCn1c(O)cc(=O)nc1SCc1c(F)c(F)c(F)c(F)c1F ZINC000103941972 FG Annotated Mild CCOC(=O)CCc1c(C)nc2cc(-c3ccc(Cl)cc3)[nH]n2c1=O ZINC000103951549 FG Annotated Anodyne CC(C)CCNS(=O)(=O)c1ccc2[nH]c(O)c(/N=N/C(=N)S)c2c1 ZINC000103967054 FG Annotated Clean O=C1C=CC(=C2NNC(c3ccccc3)=C2c2nc3ccccc3[nH]2)C=C1 ZINC000104000274 FG Annotated Mild C[C@@H]1CCCCN1C(=O)CSC1=NN/C(=C2\C=Nc3ccccc32)O1 ZINC000104004577 FG Annotated Anodyne C[C@H]1CCCCN1C(=O)CSC1=NN/C(=C2\C=Nc3ccccc32)O1 ZINC000104004580 FG Annotated Anodyne CC[C@H](C)NC(=O)C1=CNN2C1=N[C@H](c1cccs1)C[C@@H]2C(F)(F)F ZINC000104010682 FG Annotated Anodyne CC[C@H](C)NC(=O)C1=CNN2C1=N[C@@H](c1cccs1)C[C@@H]2C(F)(F)F ZINC000104010692 FG Annotated Anodyne C=CCO/C(O)=C1/C(C)=Nc2nc(O)nc(O)c2[C@@H]1c1ccc(OC)cc1 ZINC000104015844 FG Annotated Mild C=CCO/C(O)=C1/C(C)=Nc2nc(O)nc(O)c2[C@H]1c1ccc(OC)cc1 ZINC000104015851 FG Annotated Mild COc1ccc([C@H]2NC(=O)C(=O)/C2=C(\O)c2ccc(Cl)cc2)cc1OC ZINC000104016397 FG Annotated Mild COc1ccc([C@@H]2NC(=O)C(=O)/C2=C(\O)c2ccc(Cl)cc2)cc1OC ZINC000104016403 FG Annotated Mild COc1ccc(-c2csc(-n3[nH]c(C)c(/C(O)=C/C(C)=O)c3=O)n2)cc1 ZINC000104018384 FG Annotated Mild CC(=O)/C=C(\O)c1c(C)[nH]n(-c2nc(-c3ccc(C)cc3)cs2)c1=O ZINC000104018397 FG Annotated Mild CCOC1=CC(=O)/C(=C2\ONC(C(F)(F)F)=C2c2cscn2)C=C1 ZINC000104018920 FG Annotated Mild CCCOC(=O)c1ccc(C2=C(C)NO/C2=C2/C=CC(OC)=CC2=O)o1 ZINC000104019327 FG Annotated Mild COC1=C(C)C(=O)/C(=C2\ONC(C)=C2c2cnn(-c3ccccc3)c2)C=C1 ZINC000104019634 FG Annotated Mild CCOC1=CC(=O)/C(=C2\N=C(N)NC(C)=C2c2ccc(Cl)cc2)C=C1 ZINC000104019716 FG Annotated Mild CCOC(=O)c1c(N/C=C2\C=C(C)C=CC2=O)sc2c1CCN(C)C2 ZINC000104020258 FG Annotated Mild Cc1ccc(N/C(S)=C2\C(=O)c3ccccc3N(C)S2(=O)=O)cc1 ZINC000104021028 FG Annotated Mild COC1=CC(=O)/C(=C2\N=CNC(C(F)(F)F)=C2c2csc(C)n2)C=C1 ZINC000104021590 FG Annotated Mild COC1=C/C(=C2\Nc3ccccc3N\C2=C2/C=CC(=O)C(OC)=C2)C=CC1=O ZINC000104023148 FG Annotated Mild COC1=C(C)C(=O)/C(=C2\NNC(C)=C2c2cnn(-c3ccccc3)c2)C=C1 ZINC000104023214 FG Annotated Mild Cc1cc(C)c2c(c1)N/C(=C1/C=CC(NC(=O)c3ccncc3)=CC1=O)O2 ZINC000104024989 FG Annotated Mild COC1=CC(=O)/C(=C2\ONC(C)=C2c2ccc(C(=O)OC(C)C)o2)C=C1 ZINC000104025391 FG Annotated Mild C=C(C)COC1=CC(=O)/C(=C2/NNC=C2c2ccc(OC)c(OC)c2)C=C1 ZINC000104028318 FG Annotated Mild O=C1C=CC([N+](=O)[O-])=C/C1=C1\NC(c2ccccc2)=C(c2cccs2)N1 ZINC000104032411 FG Annotated Mild O=C1C=CC([N+](=O)[O-])=C/C1=C1\C=C(C(F)(F)F)NC(c2ccccc2)=N1 ZINC000104033154 FG Annotated Mild CCCC1=C/C(=C2/NNC(C)=C2c2ccc(C(=O)OCC)o2)C(=O)C=C1O ZINC000104035372 FG Annotated Mild COCCN1C(SCc2cccnc2)=NN/C1=C1\C=Nc2ccccc21 ZINC000104036892 FG Annotated Anodyne CCCCO/C(O)=C1/C(C)=Nc2ncnn2[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000104059864 FG Annotated Bother CCCCO/C(O)=C1/C(C)=Nc2ncnn2[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000104059867 FG Annotated Bother CCCCCO/C(O)=C1\C(C)=Nc2nnnn2[C@H]1c1ccc(OC)cc1 ZINC000104061044 FG Annotated Anodyne CCCCCO/C(O)=C1\C(C)=Nc2nnnn2[C@@H]1c1ccc(OC)cc1 ZINC000104061048 FG Annotated Anodyne C/C(=N/Cc1cccnc1)c1c(C)nn(-c2ccc([N+](=O)[O-])cc2)c1O ZINC000104102141 FG Annotated Mild Brc1ccc([C@H]2C=C(c3cccnc3)Nc3ncnn32)cc1 ZINC000104118978 FG Annotated Anodyne Brc1ccc([C@@H]2C=C(c3cccnc3)Nc3ncnn32)cc1 ZINC000104118983 FG Annotated Anodyne Brc1cccc([C@@H]2C=C(c3cccnc3)Nc3ncnn32)c1 ZINC000104119227 FG Annotated Anodyne Brc1cccc([C@H]2C=C(c3cccnc3)Nc3ncnn32)c1 ZINC000104119233 FG Annotated Anodyne Cc1c(Cl)cccc1NC(=O)CCN1C(=O)[C@@H]2[C@H]3C=C[C@@H](CC3)[C@H]2C1=O ZINC000104135471 FG Annotated Anodyne C=CCn1c(O)cc(=O)nc1SCC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000104147294 FG Annotated Mild CCC/N=c1\c(NC(=O)c2ccc3c(c2)OCO3)c(O)oc2ccccc12 ZINC000104199093 FG Annotated Anodyne Cc1nc2sc([C@H](c3ccccc3)N3C[C@H](C)O[C@@H](C)C3)c(O)n2n1 ZINC000104199533 FG Annotated Anodyne CN1C(=O)[C@H](C(=O)NC(C)(C)C)[C@@H]2c3ccccc3O[C@@]13CCCC[C@@H]23 ZINC000104203838 FG Annotated Anodyne CN1C(=O)[C@@H](C(=O)NC(C)(C)C)[C@@H]2c3ccccc3O[C@@]13CCCC[C@@H]23 ZINC000104203841 FG Annotated Anodyne Cc1ccc2c(c1)=C(c1ccncc1)NN=C(c1ccc(C(C)C)cc1)N=2 ZINC000104227133 FG Annotated Anodyne CC(C)(C)CN1CCN(Cc2ccc3cccc(F)c3n2)C[C@H]1CCO ZINC000104303954 FG Annotated Anodyne COC(=O)c1cc(=O)n(-c2c(Cl)cc(C(F)(F)F)cc2Cl)[nH]1 ZINC000104336578 FG Annotated Anodyne CCCCCOC(=O)[C@@H]1[C@@H]2C=C[C@]3(CN(c4ccccc4C)C(=O)[C@@H]13)O2 ZINC000104430462 FG Annotated Anodyne CC(C)CCN1CCN(C2CCN(c3ccccc3)CC2)C[C@H]1CCO ZINC000104443462 FG Annotated Anodyne C/C=C(\C=O)[C@@H]1C[C@@H]2c3[nH]c4ccccc4c3CCN2C=C1C(=O)OC ZINC000104545572 FG Annotated Reactive O=C(Cc1nccc2c1[nH]c1ccccc12)O[C@@H]1C#CCSCC#C/C=C/1 ZINC000104566320 FG Annotated Mild C[C@H]1/C=C/CC(=O)NCc2cccc(c2)CNC(=O)N[C@H]1c1ccccc1 ZINC000104691576 FG Annotated Anodyne CCCn1c2nc(C34C[C@H]5CC3C[C@@H](C5)C4)nc-2c2n(c1=O)C[C@H](CC)N2 ZINC000104935204 FG Annotated Anodyne CCCn1c2nc(C34C[C@H]5CC3C[C@@H](C5)C4)nc-2c2n(c1=O)C[C@@H](CC)N2 ZINC000104935208 FG Annotated Anodyne CCCn1c2nc(C34C[C@@H]5CC3C[C@@H](C5)C4)nc-2c2n(c1=O)C[C@H](CC)N2 ZINC000104935212 FG Annotated Anodyne CCCn1c2nc(C34C[C@@H]5CC3C[C@@H](C5)C4)nc-2c2n(c1=O)C[C@@H](CC)N2 ZINC000104935216 FG Annotated Anodyne O=C(CSc1n[nH]c2c3ccccc3nc-2n1)Nc1ccccc1F ZINC000104996360 FG Annotated Anodyne C[C@@]1(C(=O)Nc2ccc3ccccc3c2)C[C@@]2(C)C[C@@](C)(C1)[C@H](O)NC2=O ZINC000105479801 FG Annotated Anodyne C[C@]1(C(=O)Nc2ccc3ccccc3c2)C[C@@]2(C)C[C@@](C)(C1)[C@H](O)NC2=O ZINC000105479805 FG Annotated Anodyne CC(C)N(C(=O)C12[C@H]3C4C5[C@H]3C1(C(=O)N(C(C)C)C(C)C)[C@H]5[C@@H]42)C(C)C ZINC000105495799 FG Annotated Anodyne Cc1cc([C@]23O[C@@H]4COC(C)(C)O[C@H]4[C@@H]2OC(C)(C)O3)nc2ccccc12 ZINC000105524567 FG Annotated Anodyne [N-]=[N+]=NC[C@@H]1OC[C@H](O)[C@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 ZINC000105527477 FG Annotated Clean [N-]=[N+]=NC[C@@H]1OC[C@H](O)[C@H](OCc2ccccc2)[C@H]1OCc1ccccc1 ZINC000105527481 FG Annotated Clean [N-]=[N+]=NC[C@@H]1OC[C@H](O)[C@@H](OCc2ccccc2)[C@H]1OCc1ccccc1 ZINC000105527486 FG Annotated Clean C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)/C(O)=C1\C(=O)[C@H](CO)N(C)C1=O ZINC000105558591 FG Annotated Mild CC[C@@H](C)[C@H]1[C@](C)(O)C(=O)[C@H]2C[C@](C)(O)C[C@@H](C)[C@@H]2[C@@]1(C)C(=O)/C=C\O ZINC000105563086 FG Annotated Mild COc1ccc(C2=CC(=O)/C(=C(\O)c3ccc(OC)cc3)C(=O)O2)cc1 ZINC000105954931 FG Annotated Mild CCCCS(=O)(=O)/C=C\[C@@H]1[C@@H]2C=C[C@H](C2)[C@@H]1S(=O)(=O)CCCC ZINC000108544612 FG Annotated Anodyne CCCCS(=O)(=O)/C=C\[C@H]1[C@@H]2C=C[C@H](C2)[C@@H]1S(=O)(=O)CCCC ZINC000108544616 FG Annotated Anodyne O=C1C(=O)N(c2nccs2)[C@H](c2cccs2)[C@@H]1C(=O)c1cccs1 ZINC000109430934 FG Annotated Anodyne O=C1C(=O)N(c2nccs2)[C@@H](c2cccs2)[C@@H]1C(=O)c1cccs1 ZINC000109430937 FG Annotated Anodyne O=C1C(=O)N(c2nccs2)[C@H](c2cccs2)[C@H]1C(=O)c1cccs1 ZINC000109430941 FG Annotated Anodyne O=C1C(=O)N(c2nccs2)[C@@H](c2cccs2)[C@H]1C(=O)c1cccs1 ZINC000109430945 FG Annotated Anodyne C/C=C(\C)C(=O)O[C@H]1Cc2c(cc3oc(C)cc(=O)c3c2O)OC1(C)C ZINC000111956576 FG Annotated Anodyne O=c1nc(-c2ccc(Cl)cc2)c2c(=O)nc(-c3ccc(Cl)cc3)c1=2 ZINC000113153647 FG Annotated Anodyne CC[C@@H](C)Nc1ncc(C#Cc2ccc(C[C@@H](C)NC(C)=O)cc2)cn1 ZINC000113255493 FG Annotated Mild CC[C@H](C)Nc1ncc(C#Cc2ccc(C[C@@H](C)NC(C)=O)cc2)cn1 ZINC000113255495 FG Annotated Mild CC[C@@H](C)Nc1ncc(C#Cc2ccc(C[C@H](C)NC(C)=O)cc2)cn1 ZINC000113255498 FG Annotated Mild CC[C@H](C)Nc1ncc(C#Cc2ccc(C[C@H](C)NC(C)=O)cc2)cn1 ZINC000113255499 FG Annotated Mild Cc1cc(NC(=O)C2CCOCC2)ccc1N1CC[C@@H](N2CCC[C@H]2C)C1 ZINC000113335006 FG Annotated Anodyne Cc1cc(N2CC[C@@H](N3CCC[C@H]3C)C2)ccc1NC(=O)C1CCOCC1 ZINC000113336536 FG Annotated Anodyne CC(C)Nc1ncc(C#Cc2ccc(C[C@@H](C)NC(=O)C3CC3)cc2)cn1 ZINC000113409077 FG Annotated Mild CC(C)Nc1ncc(C#Cc2ccc(C[C@H](C)NC(=O)C3CC3)cc2)cn1 ZINC000113409080 FG Annotated Mild CC[C@@H](C)N(C)c1ncc(C#Cc2ccc(C[C@@H](C)NC(C)=O)cc2)cn1 ZINC000113409404 FG Annotated Mild CC[C@H](C)N(C)c1ncc(C#Cc2ccc(C[C@@H](C)NC(C)=O)cc2)cn1 ZINC000113409405 FG Annotated Mild CC(=O)N[C@H](C)Cc1ccc(C#Cc2cnc(NCC(C)C)nc2)cc1 ZINC000113409456 FG Annotated Mild CC(=O)N[C@@H](C)Cc1ccc(C#Cc2cnc(NCC(C)C)nc2)cc1 ZINC000113409459 FG Annotated Mild CC(=O)NCC(C)(C)c1ccc(C#Cc2cnc(NC3CCC3)nc2)cc1 ZINC000113412142 FG Annotated Mild CC(=O)NCC(C)(C)c1ccc(C#Cc2cnc(OC3CCC3)nc2)cc1 ZINC000113412173 FG Annotated Mild CC(=O)N[C@@H](C)Cc1ccc(C#Cc2cnc(N[C@@H](C)C(C)C)nc2)cc1 ZINC000113412488 FG Annotated Mild CC(=O)N[C@H](C)Cc1ccc(C#Cc2cnc(N[C@@H](C)C(C)C)nc2)cc1 ZINC000113412491 FG Annotated Mild CC(=O)N[C@@H](C)Cc1ccc(C#Cc2cnc(N[C@H](C)C(C)C)nc2)cc1 ZINC000113412495 FG Annotated Mild CC(=O)N[C@H](C)Cc1ccc(C#Cc2cnc(N[C@H](C)C(C)C)nc2)cc1 ZINC000113412497 FG Annotated Mild CCC(=O)NC[C@@H](C)c1ccc(C#Cc2cnc(OC3CCC3)nc2)cc1 ZINC000113413819 FG Annotated Mild CCC(=O)NC[C@H](C)c1ccc(C#Cc2cnc(OC3CCC3)nc2)cc1 ZINC000113413820 FG Annotated Mild CC(=O)N[C@H](C)Cc1ccc(C#Cc2ccnc(NCC(C)C)n2)cc1 ZINC000113413937 FG Annotated Mild CC(=O)N[C@@H](C)Cc1ccc(C#Cc2ccnc(NCC(C)C)n2)cc1 ZINC000113413939 FG Annotated Mild CC[C@@H](C)Nc1ncc(C#Cc2ccc(C[C@@H](C)NC(=O)OC)cc2)cn1 ZINC000113413953 FG Annotated Mild CC[C@H](C)Nc1ncc(C#Cc2ccc(C[C@@H](C)NC(=O)OC)cc2)cn1 ZINC000113413956 FG Annotated Mild CC[C@@H](C)Nc1ncc(C#Cc2ccc(C[C@H](C)NC(=O)OC)cc2)cn1 ZINC000113413958 FG Annotated Mild CC[C@H](C)Nc1ncc(C#Cc2ccc(C[C@H](C)NC(=O)OC)cc2)cn1 ZINC000113413961 FG Annotated Mild C[C@@H](Cc1ccc(C#Cc2cnc(NC3CCC3)nc2)cc1)NC(=O)C1CC1 ZINC000113414086 FG Annotated Mild C[C@H](Cc1ccc(C#Cc2cnc(NC3CCC3)nc2)cc1)NC(=O)C1CC1 ZINC000113414089 FG Annotated Mild CC(=O)N[C@H](C)Cc1ccc(C#Cc2ccnc(N(C)CC(C)C)n2)cc1 ZINC000113414190 FG Annotated Mild CC(=O)N[C@@H](C)Cc1ccc(C#Cc2ccnc(N(C)CC(C)C)n2)cc1 ZINC000113414193 FG Annotated Mild CC(=O)N[C@@H](C)Cc1ccc(C#Cc2ccnc(N[C@@H](C)C3CC3)n2)cc1 ZINC000113414195 FG Annotated Mild CC(=O)N[C@H](C)Cc1ccc(C#Cc2ccnc(N[C@@H](C)C3CC3)n2)cc1 ZINC000113414198 FG Annotated Mild CC(=O)N[C@@H](C)Cc1ccc(C#Cc2ccnc(N[C@H](C)C3CC3)n2)cc1 ZINC000113414201 FG Annotated Mild CC(=O)N[C@H](C)Cc1ccc(C#Cc2ccnc(N[C@H](C)C3CC3)n2)cc1 ZINC000113414203 FG Annotated Mild CC[C@@H](C)CNc1ncc(C#Cc2ccc(C[C@@H](C)NC(C)=O)cc2)cn1 ZINC000113414236 FG Annotated Mild CC[C@H](C)CNc1ncc(C#Cc2ccc(C[C@@H](C)NC(C)=O)cc2)cn1 ZINC000113414238 FG Annotated Mild CC[C@@H](C)CNc1ncc(C#Cc2ccc(C[C@H](C)NC(C)=O)cc2)cn1 ZINC000113414240 FG Annotated Mild CC[C@H](C)CNc1ncc(C#Cc2ccc(C[C@H](C)NC(C)=O)cc2)cn1 ZINC000113414243 FG Annotated Mild C=C1CCN(c2ncc(C#Cc3ccc(C[C@H](C)NC(C)=O)cc3)cn2)CC1 ZINC000113414246 FG Annotated Mild C=C1CCN(c2ncc(C#Cc3ccc(C[C@@H](C)NC(C)=O)cc3)cn2)CC1 ZINC000113414249 FG Annotated Mild Cc1cc(C)n2nc(CCc3nc(-c4ccc(F)cc4F)cn3C)nc2n1 ZINC000113419792 FG Annotated Anodyne N#CC1(NC(=O)C2(NC(=O)N3CCC4(CCCC4)CC3)CCCCC2)CC1 ZINC000113632247 FG Annotated Mild N[C@@]1(c2ccc(-c3nc4nc(O)ccn4c3-c3ccccc3)cc2)C[C@H](O)C1 ZINC000113660112 FG Annotated Anodyne COc1cc(NS(=O)(=O)c2ccccc2)ccc1-c1cncnc1C ZINC000114033472 FG Annotated Anodyne CS(=O)(=O)Nc1ccc(-c2cncc3ncccc23)c(OCCF)c1 ZINC000114034540 FG Annotated Anodyne CC(C)CN(Cc1cc(Cl)c2c(c1)OCCCO2)C(=O)[C@@H](C)CN ZINC000114099596 FG Annotated Anodyne CC(C)CN(Cc1cc(Cl)c2c(c1)OCCCO2)C(=O)[C@H](C)CN ZINC000114099597 FG Annotated Anodyne NC(=O)c1cccc2c(NCc3ccccc3Br)ncnc12 ZINC000114345470 FG Annotated Anodyne CN(C)C[C@@H](Nc1ncnc2c(C(N)=O)cccc12)c1cccc(Cl)c1 ZINC000114346454 FG Annotated Anodyne CN(C)C[C@H](Nc1ncnc2c(C(N)=O)cccc12)c1cccc(Cl)c1 ZINC000114346456 FG Annotated Anodyne CCCN(C)C[C@@H](Nc1ncnc2c(C(N)=O)cccc12)c1ccccc1 ZINC000114347056 FG Annotated Anodyne CCCN(C)C[C@H](Nc1ncnc2c(C(N)=O)cccc12)c1ccccc1 ZINC000114347058 FG Annotated Anodyne CC(C)N(C)C[C@@H](Nc1ncnc2c(C(N)=O)cccc12)c1ccccc1 ZINC000114347935 FG Annotated Anodyne c1cc2[nH]nc(-c3cnn(C4CCCC4)c3)c2c(OC2CCOCC2)n1 ZINC000114759405 FG Annotated Anodyne CN1CCc2c(-c3n[nH]c4ccnc(OC5CCOCC5)c34)cccc21 ZINC000114772099 FG Annotated Anodyne c1ncc(-c2cc(-c3n[nH]c4ccnc(OC5CCOCC5)c34)ccn2)cn1 ZINC000114773202 FG Annotated Anodyne CC(C)Oc1nccc2[nH]nc(-c3cc(C(=O)N(C)C)n(C(C)C)c3)c12 ZINC000114773244 FG Annotated Anodyne Nc1nc2c(s1)[C@@H]1CCC[C@@H](C2)N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000114841241 FG Annotated Anodyne Cc1ccc(N2CCc3ncnc(N[C@H](C)c4cnc(C)nc4)c3C2)nc1 ZINC000114996104 FG Annotated Anodyne O=c1ccc(S(=O)(=O)c2oc3ccccc3c2-c2ccc(F)cc2)n[nH]1 ZINC000011536188 FG Annotated Anodyne O=c1ccc(S(=O)(=O)c2oc3ccccc3c2-c2ccccc2)n[nH]1 ZINC000011536189 FG Annotated Anodyne CC(C)c1c(S(=O)(=O)c2ccc(=O)[nH]n2)oc2ccc(Cl)cc12 ZINC000011536190 FG Annotated Anodyne COCCCC1CCN(c2nncc(-c3ccc(OC)cc3OC)n2)CC1 ZINC000011661869 FG Annotated Anodyne CCn1ccnc1CN(C)C(=O)CCc1nnc(CCC2CCCCC2)o1 ZINC000011663514 FG Annotated Anodyne CSc1ncc(CNCc2cccnc2Oc2ccc(C)nc2)cn1 ZINC000011665188 FG Annotated Anodyne COc1ccc(CN2C[C@@H]3C[C@@H](c4cccnc4)N4CCC[C@@]34C2=O)cc1 ZINC000011665328 FG Annotated Anodyne Cc1cc(-c2nnc3c4c(c(OCc5ccccn5)nn23)[C@@H]2CC[C@H]4C2)no1 ZINC000011689016 FG Annotated Anodyne CC(C)c1ccc(CN2CCC[C@]3(CCN(C(=O)C(C)(C)O)C3)C2)cc1 ZINC000011703907 FG Annotated Anodyne CC(C)c1ccc(CN2CCC[C@@]3(CCN(C(=O)C(C)(C)O)C3)C2)cc1 ZINC000011703915 FG Annotated Anodyne O=C(N[C@@H]1CCCc2c1cnn2-c1cc(F)cc(F)c1)c1ccncc1 ZINC000011719587 FG Annotated Anodyne O=C(N[C@H]1CCCc2c1cnn2-c1cc(F)cc(F)c1)c1ccncc1 ZINC000011719590 FG Annotated Anodyne CCCN(CC1CC1)C(=O)CCc1nnc([C@@H](OC)c2ccccc2)o1 ZINC000011753414 FG Annotated Anodyne CCCN(CC1CC1)C(=O)CCc1nnc([C@H](OC)c2ccccc2)o1 ZINC000011753415 FG Annotated Anodyne CCN(CCn1cccn1)Cc1nc(-c2cc(OC)ccc2OC)oc1C ZINC000011753761 FG Annotated Anodyne Cc1c(CN2CC[C@]3(CCCN(Cc4cccc(F)c4F)C3)C2)cnn1C ZINC000011762202 FG Annotated Anodyne Cc1c(CN2CC[C@@]3(CCCN(Cc4cccc(F)c4F)C3)C2)cnn1C ZINC000011762211 FG Annotated Anodyne O=C(/C=C/c1cccs1)NC[C@@H]1Cc2cccc(-c3ncccn3)c2O1 ZINC000011789051 FG Annotated Anodyne O=C(/C=C/c1cccs1)NC[C@H]1Cc2cccc(-c3ncccn3)c2O1 ZINC000011789052 FG Annotated Anodyne CCN(CC)c1ccc(CN2CCC3(CC[C@@H](CNC(C)=O)O3)CC2)cc1 ZINC000011790352 FG Annotated Clean CCN(CC)c1ccc(CN2CCC3(CC[C@H](CNC(C)=O)O3)CC2)cc1 ZINC000011790353 FG Annotated Clean CN1CCC(N(C)C(=O)CC[C@@H]2CCCN(Cc3cccs3)C2)CC1 ZINC000011812814 FG Annotated Anodyne CN1CCC(N(C)C(=O)CC[C@H]2CCCN(Cc3cccs3)C2)CC1 ZINC000011812815 FG Annotated Anodyne COc1cccc(OCc2cc(C(=O)N(C)CCC3CCOCC3)no2)c1 ZINC000011813554 FG Annotated Anodyne Cc1cc(C)cc(-n2ncc3c2CCC[C@H]3NC(=O)c2cc(C)n(C)n2)c1 ZINC000011814631 FG Annotated Anodyne Cc1cc(C)cc(-n2ncc3c2CCC[C@@H]3NC(=O)c2cc(C)n(C)n2)c1 ZINC000011814633 FG Annotated Anodyne COc1ccc(CN2C[C@@H]3C[C@H]2C(=O)N3c2ccccc2Cl)c(O)c1 ZINC000011815170 FG Annotated Clean CC(C)N(Cc1cn(C)nc1-c1cccc(Cl)c1)C[C@@H]1CCC(=O)N1 ZINC000011818168 FG Annotated Anodyne CC(C)N(Cc1cn(C)nc1-c1cccc(Cl)c1)C[C@H]1CCC(=O)N1 ZINC000011818169 FG Annotated Anodyne O=C(c1ccccc1OC1CCN(C[C@@H]2CCOC2)CC1)N1CCCCC1 ZINC000011818426 FG Annotated Anodyne O=C(c1ccccc1OC1CCN(C[C@H]2CCOC2)CC1)N1CCCCC1 ZINC000011818427 FG Annotated Anodyne O=C(c1cc(COc2ccc(F)cc2Cl)on1)N1CCSCC1 ZINC000011818706 FG Annotated Anodyne COc1ccc(-c2n[nH]cc2CN(CCO)Cc2cccs2)c(F)c1 ZINC000011819598 FG Annotated Anodyne c1ccc(-n2ncc3c2CCC[C@H]3NCc2cccn2-c2ncccn2)nc1 ZINC000011821626 FG Annotated Anodyne c1ccc(-n2ncc3c2CCC[C@@H]3NCc2cccn2-c2ncccn2)nc1 ZINC000011821627 FG Annotated Anodyne Cc1cc(C(=O)N[C@@H]2CCCc3c2cnn3-c2cccc(C)c2C)n(C)n1 ZINC000011840336 FG Annotated Anodyne Cc1cc(C(=O)N[C@H]2CCCc3c2cnn3-c2cccc(C)c2C)n(C)n1 ZINC000011840337 FG Annotated Anodyne CCn1nc(C)cc1C(=O)NC[C@@H]1Cc2cccc(-c3cccnc3)c2O1 ZINC000011840505 FG Annotated Anodyne CCn1nc(C)cc1C(=O)NC[C@H]1Cc2cccc(-c3cccnc3)c2O1 ZINC000011840507 FG Annotated Anodyne CC(C)Oc1cccc(C(=O)[C@@H]2CCCN(C(=O)c3csnn3)C2)c1 ZINC000011841677 FG Annotated Anodyne CC(C)Oc1cccc(C(=O)[C@H]2CCCN(C(=O)c3csnn3)C2)c1 ZINC000011841679 FG Annotated Anodyne O=C(NCCc1cccs1)[C@@H]1CCC(=O)N(CCc2cccc(F)c2)C1 ZINC000011842396 FG Annotated Anodyne O=C(NCCc1cccs1)[C@H]1CCC(=O)N(CCc2cccc(F)c2)C1 ZINC000011842397 FG Annotated Anodyne CO[C@H](c1ccccc1)c1nnc(CCC(=O)N(C)C(C2CC2)C2CC2)o1 ZINC000011843055 FG Annotated Anodyne CO[C@@H](c1ccccc1)c1nnc(CCC(=O)N(C)C(C2CC2)C2CC2)o1 ZINC000011843056 FG Annotated Anodyne O=C(N[C@H]1CCCc2nc(-c3cccnc3)ncc21)c1ncoc1C1CC1 ZINC000011873077 FG Annotated Anodyne O=C(N[C@@H]1CCCc2nc(-c3cccnc3)ncc21)c1ncoc1C1CC1 ZINC000011873078 FG Annotated Anodyne COCc1ccc(CN2CCC[C@](CO)(Cc3cccc(OC)c3)C2)o1 ZINC000011873241 FG Annotated Anodyne COCc1ccc(CN2CCC[C@@](CO)(Cc3cccc(OC)c3)C2)o1 ZINC000011873242 FG Annotated Anodyne CC(C)Cc1cc(C(=O)N2CCC[C@](CO)(Cc3ccc(F)cc3)C2)no1 ZINC000011874333 FG Annotated Anodyne CC(C)Cc1cc(C(=O)N2CCC[C@@](CO)(Cc3ccc(F)cc3)C2)no1 ZINC000011874334 FG Annotated Anodyne Cc1cnc(C(=O)N2CCC[C@@H](C(=O)c3cccc(OC(C)C)c3)C2)cn1 ZINC000011878899 FG Annotated Anodyne Cc1cnc(C(=O)N2CCC[C@H](C(=O)c3cccc(OC(C)C)c3)C2)cn1 ZINC000011878900 FG Annotated Anodyne CC(C)c1ccc(N[C@@H]2CCCN(C(=O)CSc3nncn3C)C2)cc1 ZINC000011932921 FG Annotated Anodyne CC(C)c1ccc(N[C@H]2CCCN(C(=O)CSc3nncn3C)C2)cc1 ZINC000011932922 FG Annotated Anodyne Cc1nc2sccn2c1CN1CCC(CO)(C[C@@H]2CCCCO2)CC1 ZINC000011935970 FG Annotated Anodyne Cc1nc2sccn2c1CN1CCC(CO)(C[C@H]2CCCCO2)CC1 ZINC000011935971 FG Annotated Anodyne COc1ccc(-c2[nH]ncc2CN(C)Cc2c(C)n[nH]c2C)c(OC)c1 ZINC000011936617 FG Annotated Anodyne Cc1ccc(OCc2cc(C(=O)N[C@@H](C)Cc3cccc(C)n3)no2)cn1 ZINC000011937552 FG Annotated Anodyne Cc1ccc(OCc2cc(C(=O)N[C@H](C)Cc3cccc(C)n3)no2)cn1 ZINC000011937553 FG Annotated Anodyne Cc1ccc(OCc2cc(C(=O)NCc3cc(F)ccc3C)no2)cn1 ZINC000011937768 FG Annotated Anodyne CCOC(=O)C1(CCOC)CCN(C/C=C/c2ccccc2OC)CC1 ZINC000011956561 FG Annotated Anodyne CC(=O)c1ccc(C(=O)NC[C@@H]2Cc3cccc(-c4ncccn4)c3O2)cc1 ZINC000011974751 FG Annotated Anodyne CC(=O)c1ccc(C(=O)NC[C@H]2Cc3cccc(-c4ncccn4)c3O2)cc1 ZINC000011974757 FG Annotated Anodyne C[C@H]1CN(Cc2ccc3c(c2)CN(Cc2nccs2)CCO3)C[C@@H](C)O1 ZINC000011975410 FG Annotated Anodyne COc1c(C)cc(C(=O)[C@@H]2CCCN(C(=O)c3cc(C)n(C)n3)C2)cc1C ZINC000011998398 FG Annotated Anodyne COc1c(C)cc(C(=O)[C@H]2CCCN(C(=O)c3cc(C)n(C)n3)C2)cc1C ZINC000011998401 FG Annotated Anodyne CC1(C)CC[C@H](c2cc(F)ccc2F)N1c1ccn2ncc(C(N)=O)c2n1 ZINC000115078223 FG Annotated Anodyne CC(C)Nc1nc(-c2ccc(C(C)(C)N)cc2)cc2ncn(C)c(=O)c12 ZINC000115624122 FG Annotated Anodyne CC(C)Nc1nc(-c2ccc(C3(O)CCC3)cc2)cc2ncn(C)c(=O)c12 ZINC000115624162 FG Annotated Anodyne CC(C)CCn1cc(-c2cc3ncn(C)c(=O)c3c(NC(C)C)n2)cn1 ZINC000115624299 FG Annotated Anodyne CCNc1nc(-c2ccc(C(C)(C)OC)cc2)cc2ncn(C)c(=O)c12 ZINC000115624378 FG Annotated Anodyne Cn1cnc2cc(-c3ccc(C(C)(C)C#N)cc3)nc(NC3CC3)c2c1=O ZINC000115625084 FG Annotated Mild CCNc1nc(-c2ccc(C3(O)CCCC3)cc2)cc2ncn(C)c(=O)c12 ZINC000115625433 FG Annotated Anodyne COC(C)(C)c1ccc(-c2cc3ncn(C)c(=O)c3c(NC3CC3)n2)cc1 ZINC000115626101 FG Annotated Anodyne CCc1nc(-c2nnc(S)n2-c2ccc3c(ccn3C)c2)c(O)cc1O ZINC000115810761 FG Annotated Anodyne Cc1noc(-c2cc3cc(-c4nc(C(=O)NC5CC5)[nH]c4C)ccc3[nH]2)n1 ZINC000115839398 FG Annotated Anodyne C[C@@H]1CN(c2ccn3ncc(-c4ccc(-c5ncc[nH]5)cc4)c3n2)C(=O)O1 ZINC000116184737 FG Annotated Anodyne C[C@H]1CN(c2ccn3ncc(-c4ccc(-c5ncc[nH]5)cc4)c3n2)C(=O)O1 ZINC000116184739 FG Annotated Anodyne C[C@H]1COC(=O)N1c1ccn2ncc(-c3ccc(-c4ncc[nH]4)cc3)c2n1 ZINC000116185175 FG Annotated Anodyne CCOC(=O)[C@@H]1CS[C@H](c2cc(-c3cccs3)cc(OC)c2O)N1 ZINC000116439242 FG Annotated Clean CCOC(=O)[C@H]1CS[C@H](c2cc(-c3cccs3)cc(OC)c2O)N1 ZINC000116439245 FG Annotated Clean CCOC(=O)[C@@H]1CS[C@@H](c2cc(-c3cccs3)cc(OC)c2O)N1 ZINC000116439247 FG Annotated Clean CCOC(=O)[C@H]1CS[C@@H](c2cc(-c3cccs3)cc(OC)c2O)N1 ZINC000116439250 FG Annotated Clean O=C(/C=C/c1cc(O)ccc1[N+](=O)[O-])CC(=O)CCc1ccc(O)cc1 ZINC000116760451 FG Annotated Mild Cc1ccnc(N2C[C@@H]3CN(C(=O)c4c(C)ccc5ccccc45)C[C@H]3C2)n1 ZINC000116821570 FG Annotated Anodyne Cc1cc(C)nc(N2C[C@H]3CN(C(=O)c4c(C)cccc4Cl)C[C@H]3C2)n1 ZINC000116821881 FG Annotated Anodyne Cc1cc(C)nc(N2C[C@H]3CN(C(=O)c4c(C)cccc4Cl)C[C@@H]3C2)n1 ZINC000116821883 FG Annotated Anodyne Cc1cc(C)nc(N2C[C@@H]3CN(C(=O)c4c(C)cccc4Cl)C[C@H]3C2)n1 ZINC000116821886 FG Annotated Anodyne Cc1ccoc1C(=O)N1C[C@@H]2CN(c3ccc(C(F)(F)F)cn3)C[C@@H]2C1 ZINC000116822037 FG Annotated Anodyne Cc1ccoc1C(=O)N1C[C@H]2CN(c3ccc(C(F)(F)F)cn3)C[C@@H]2C1 ZINC000116822039 FG Annotated Anodyne Cc1ccoc1C(=O)N1C[C@@H]2CN(c3ccc(C(F)(F)F)cn3)C[C@H]2C1 ZINC000116822040 FG Annotated Anodyne Cc1cc(C)nc(N2C[C@H]3CN(C(=O)c4ccccc4C(C)C)C[C@H]3C2)n1 ZINC000116823976 FG Annotated Anodyne Cc1cc(C)nc(N2C[C@@H]3CN(C(=O)c4ccccc4C(C)C)C[C@H]3C2)n1 ZINC000116823978 FG Annotated Anodyne Cc1cc(C)nc(N2C[C@H]3CN(C(=O)c4ccccc4C(C)C)C[C@@H]3C2)n1 ZINC000116823980 FG Annotated Anodyne Cc1cc(C)nc(N2C[C@H]3CN(C(=O)c4cc(Cl)ccc4C)C[C@H]3C2)n1 ZINC000116824014 FG Annotated Anodyne Cc1cc(C)nc(N2C[C@H]3CN(C(=O)c4cc(Cl)ccc4C)C[C@@H]3C2)n1 ZINC000116824017 FG Annotated Anodyne Cc1cc(C)nc(N2C[C@@H]3CN(C(=O)c4cc(Cl)ccc4C)C[C@H]3C2)n1 ZINC000116824020 FG Annotated Anodyne NS(=O)(=O)c1ccccc1-c1ccc2[nH]c(C#Cc3ccccc3)nc2c1 ZINC000117144830 FG Annotated Anodyne COc1cccn2nc(CSc3nc(-c4ccccc4)cn3C)nc12 ZINC000117237388 FG Annotated Anodyne C[C@@H]1c2cc(F)cc(C(N)=O)c2C(=O)N1C1CCN(C2CCCCC2)CC1 ZINC000117365000 FG Annotated Anodyne C[C@H]1c2cc(F)cc(C(N)=O)c2C(=O)N1C1CCN(C2CCCCC2)CC1 ZINC000117371852 FG Annotated Anodyne C[C@H]1c2cccc(C(N)=O)c2C(=O)N1C1CCN(C[C@H]2CC=CCC2)CC1 ZINC000117377006 FG Annotated Anodyne C[C@@H]1c2cccc(C(N)=O)c2C(=O)N1C1CCN(C[C@H]2CC=CCC2)CC1 ZINC000117377011 FG Annotated Anodyne C[C@H]1c2cccc(C(N)=O)c2C(=O)N1C1CCN(C[C@@H]2CC=CCC2)CC1 ZINC000117377014 FG Annotated Anodyne C[C@@H]1c2cccc(C(N)=O)c2C(=O)N1C1CCN(C[C@@H]2CC=CCC2)CC1 ZINC000117377016 FG Annotated Anodyne C[C@H]1c2cccc(C(N)=O)c2C(=O)N1C1CCN(Cc2cccs2)CC1 ZINC000117392229 FG Annotated Anodyne C[C@@H]1c2cccc(C(N)=O)c2C(=O)N1C1CCN(Cc2cccs2)CC1 ZINC000117392232 FG Annotated Anodyne O=C(c1ccc2[nH]c(=O)cnc2c1)N1CCC[C@H]2c3ccccc3CC[C@@H]21 ZINC000117621157 FG Annotated Anodyne O=C(c1ccc2[nH]c(=O)cnc2c1)N1CCC[C@@H]2c3ccccc3CC[C@@H]21 ZINC000117621158 FG Annotated Anodyne O=C(O)c1ccc2c(c1)[C@H]1CCCN(C(=O)c3ccc4[nH]cnc4c3)[C@H]1C2 ZINC000117621973 FG Annotated Anodyne O=C(O)c1ccc2c(c1)[C@@H]1CCCN(C(=O)c3ccc4[nH]cnc4c3)[C@H]1C2 ZINC000117621982 FG Annotated Anodyne CC(=O)Nc1ccc2c(c1)C[C@H]1[C@@H]2CCCN1C(=O)c1ccc2[nH]cnc2c1 ZINC000117622303 FG Annotated Anodyne O=C(O)c1ccc2c(c1)C[C@H]1[C@@H]2CCCN1C(=O)c1ccc2[nH]cnc2c1 ZINC000117623179 FG Annotated Anodyne O=C(c1ccc2[nH]cnc2c1)N1CCC[C@H]2c3ccc(CO)cc3CC[C@@H]21 ZINC000117625233 FG Annotated Anodyne O=C(c1ccc2[nH]cnc2c1)N1CCC[C@@H]2c3ccc(CO)cc3CC[C@@H]21 ZINC000117625235 FG Annotated Anodyne O=C(O)c1ccc2c(c1)C[C@H]1[C@H]2CCCN1C(=O)c1ccc2[nH]cnc2c1 ZINC000117629131 FG Annotated Anodyne O=C(c1ccc2[nH]cnc2c1)N1CCC[C@H]2c3c(CO)cccc3CC[C@@H]21 ZINC000117630631 FG Annotated Anodyne O=C(c1ccc2[nH]cnc2c1)N1CCC[C@@H]2c3c(CO)cccc3CC[C@@H]21 ZINC000117630634 FG Annotated Anodyne c1cc(OCC2CCNCC2)c2nc(-c3nnc4ccccn34)ccc2c1 ZINC000117655472 FG Annotated Anodyne CC(C)c1ccc(NC(=O)C[C@H]2C(=O)OC(C)(C)CN2CCF)cc1 ZINC000117788301 FG Annotated Anodyne CC(C)c1ccc(NC(=O)C[C@@H]2C(=O)OC(C)(C)CN2CCF)cc1 ZINC000117788304 FG Annotated Anodyne CCN1CC(C)(C)OC(=O)[C@@H]1CC(=O)NCc1ccc(Cl)c(Cl)c1 ZINC000117794304 FG Annotated Anodyne CCN1CC(C)(C)OC(=O)[C@H]1CC(=O)NCc1ccc(Cl)c(Cl)c1 ZINC000117794308 FG Annotated Anodyne COc1ccc(C)n2nc(CCc3cn(C)c(-c4cccs4)n3)nc12 ZINC000117874801 FG Annotated Anodyne O=C1CNCC2=C1[C@H](c1cccc(Oc3ccccc3)c1)c1c[nH]nc1N2 ZINC000118046161 FG Annotated Mild O=C1CNCC2=C1[C@@H](c1cccc(Oc3ccccc3)c1)c1c[nH]nc1N2 ZINC000118046163 FG Annotated Mild COCCN1CC(C)(C)S/C1=N\C(=O)c1cc(Cl)ccc1OC ZINC000118061288 FG Annotated Mild CC[C@@H](C)C(=O)Nc1cc(N)c2c3c(cc(C(=O)/C=C/OC)nc13)C=N2 ZINC000118187345 FG Annotated Mild N#Cc1cccc(-c2nc(N)c3cc(CN4CCSCC4)sc3n2)c1 ZINC000118596109 FG Annotated Mild Nc1nc(-c2ccc(Cl)o2)nc2sc(CN3CCOCC3)cc12 ZINC000118599644 FG Annotated Anodyne Cc1cc(C(F)(F)F)cc(C)c1C(=O)N[C@H]1COCC[C@@H]1N1CCCC1 ZINC000118614275 FG Annotated Anodyne Cc1cc(C(F)(F)F)cc(C)c1C(=O)N[C@@H]1COCC[C@H]1N1CCCC1 ZINC000118614277 FG Annotated Anodyne CN1C[C@H]2CCN(c3ccc(-c4ccc(-n5ncccc5=O)cc4)cc3)[C@H]2C1 ZINC000118827084 FG Annotated Anodyne in-man CN1C[C@@H]2CCN(c3ccc(-c4ccc(-n5ncccc5=O)cc4)cc3)[C@@H]2C1 ZINC000118832488 FG Annotated Anodyne in-man CN1C[C@@H]2[C@H](CCN2c2ccc(-c3ccc(-n4ncccc4=O)cc3)cc2)C1 ZINC000118832490 FG Annotated Anodyne in-man Cc1n[nH]c(C)c1[C@@H](C)N(C)C(=O)c1coc(COc2ccccc2)n1 ZINC000012029786 FG Annotated Anodyne Cc1n[nH]c(C)c1[C@H](C)N(C)C(=O)c1coc(COc2ccccc2)n1 ZINC000012029790 FG Annotated Anodyne Cc1ccc(CNc2nc(CN3CCCC[C@@H]3CO)nc3ccccc23)o1 ZINC000012050986 FG Annotated Anodyne Cc1ccc(CNc2nc(CN3CCCC[C@H]3CO)nc3ccccc23)o1 ZINC000012050990 FG Annotated Anodyne COCc1ccc(C(=O)NC[C@@H]2CC(Cc3ccc(OC)cc3)=NO2)s1 ZINC000012052575 FG Annotated Anodyne COCc1ccc(C(=O)NC[C@H]2CC(Cc3ccc(OC)cc3)=NO2)s1 ZINC000012052578 FG Annotated Anodyne O=C(c1cscn1)N1CCC[C@@](CO)(Cc2cccc(Cl)c2)C1 ZINC000012057217 FG Annotated Anodyne O=C(c1cscn1)N1CCC[C@](CO)(Cc2cccc(Cl)c2)C1 ZINC000012057219 FG Annotated Anodyne Cc1ccc(C)c(OCc2cc(C(=O)N[C@H](C)c3cnn(C)c3)no2)c1 ZINC000012058064 FG Annotated Anodyne Cc1ccc(C)c(OCc2cc(C(=O)N[C@@H](C)c3cnn(C)c3)no2)c1 ZINC000012058067 FG Annotated Anodyne CCn1cc(CN2CC[C@@]3(CCCN(Cc4ccc(F)cc4)C3=O)C2)cn1 ZINC000012072330 FG Annotated Anodyne CCn1cc(CN2CC[C@]3(CCCN(Cc4ccc(F)cc4)C3=O)C2)cn1 ZINC000012072331 FG Annotated Anodyne O=C(NCCc1cn[nH]c1)c1ccc2oc(CCc3ccccc3)nc2c1 ZINC000012072414 FG Annotated Anodyne Cc1ccc(-n2ncc3c2CCC[C@@H]3NC(=O)c2csnn2)cc1C ZINC000012073485 FG Annotated Anodyne Cc1ccc(-n2ncc3c2CCC[C@H]3NC(=O)c2csnn2)cc1C ZINC000012073487 FG Annotated Anodyne CC(C)(C)C(=O)Nc1ccnn1C1CCN(Cc2ccccc2O)CC1 ZINC000012074446 FG Annotated Clean CCc1ccc(CN2CC[C@@]3(CCCN(Cc4cccnc4)C3=O)C2)o1 ZINC000012074795 FG Annotated Anodyne CCc1ccc(CN2CC[C@]3(CCCN(Cc4cccnc4)C3=O)C2)o1 ZINC000012074797 FG Annotated Anodyne CCCO[C@@H]1CCCN(C(=O)CCc2nnc(Cc3cccc(C)c3)o2)C1 ZINC000012075875 FG Annotated Anodyne CCCO[C@H]1CCCN(C(=O)CCc2nnc(Cc3cccc(C)c3)o2)C1 ZINC000012075879 FG Annotated Anodyne O=C(NC[C@@H]1Cc2cc(F)cc(-c3cnccn3)c2O1)c1ccsc1 ZINC000012078866 FG Annotated Anodyne O=C(NC[C@H]1Cc2cc(F)cc(-c3cnccn3)c2O1)c1ccsc1 ZINC000012078868 FG Annotated Anodyne Cc1cccnc1-c1cccc2c1O[C@H](CNC(=O)C(=O)c1ccccc1)C2 ZINC000012123847 FG Annotated Anodyne Cc1cccnc1-c1cccc2c1O[C@@H](CNC(=O)C(=O)c1ccccc1)C2 ZINC000012123854 FG Annotated Anodyne CCc1ccc(CN2CCC3(CC2)C[C@@H]3C(=O)N2CCCN(C)CC2)cc1 ZINC000012149287 FG Annotated Anodyne CCc1ccc(CN2CCC3(CC2)C[C@H]3C(=O)N2CCCN(C)CC2)cc1 ZINC000012149288 FG Annotated Anodyne Cc1cccc(SC2CCN(C(=O)[C@@H]3CCC(=O)N(C4CC4)C3)CC2)c1 ZINC000012192153 FG Annotated Anodyne Cc1cccc(SC2CCN(C(=O)[C@H]3CCC(=O)N(C4CC4)C3)CC2)c1 ZINC000012192156 FG Annotated Anodyne CCOC(=O)C1(C[C@@H]2CCCCO2)CCN(C2CCSCC2)CC1 ZINC000012196907 FG Annotated Anodyne CCOC(=O)C1(C[C@H]2CCCCO2)CCN(C2CCSCC2)CC1 ZINC000012196912 FG Annotated Anodyne CC(C)(C)C(=O)Nc1ccnn1C1CCN(C(=O)[C@@H]2CC23CCC3)CC1 ZINC000012201052 FG Annotated Anodyne CC(C)(C)C(=O)Nc1ccnn1C1CCN(C(=O)[C@H]2CC23CCC3)CC1 ZINC000012201057 FG Annotated Anodyne Cc1cc(C(=O)N[C@@H]2CCCc3c2cnn3-c2ccccc2F)nc(C)n1 ZINC000012203583 FG Annotated Anodyne Cc1cc(C(=O)N[C@H]2CCCc3c2cnn3-c2ccccc2F)nc(C)n1 ZINC000012203589 FG Annotated Anodyne Cc1nn(C)cc1CN(C)C(=O)CCc1nnc(CCC2CCCCC2)o1 ZINC000012208723 FG Annotated Anodyne Cc1nccn1-c1ccc(NC(=O)[C@@H]2CCCN(Cc3ccon3)C2)cc1 ZINC000012299881 FG Annotated Anodyne Cc1nccn1-c1ccc(NC(=O)[C@H]2CCCN(Cc3ccon3)C2)cc1 ZINC000012299882 FG Annotated Anodyne CC(=O)Nc1ccnn1C1CCN(Cc2ccccc2OC(F)F)CC1 ZINC000012301774 FG Annotated Anodyne Cc1ccc(OCc2cc(C(=O)N(C)CC3CCOCC3)no2)cc1C ZINC000012302310 FG Annotated Anodyne CSc1ccccc1OCc1cc(C(=O)N(C)Cc2ccncn2)no1 ZINC000012303209 FG Annotated Anodyne CC1=C(C(=O)N[C@@H]2CCCc3c2cnn3-c2cccc(C)c2C)OCCO1 ZINC000012303461 FG Annotated Anodyne CC1=C(C(=O)N[C@H]2CCCc3c2cnn3-c2cccc(C)c2C)OCCO1 ZINC000012303462 FG Annotated Anodyne CC(=O)Nc1ccnn1C1CCN(Cc2c(F)cccc2Cl)CC1 ZINC000012303920 FG Annotated Anodyne c1ccc([C@H]2CCCN2c2nc3nonc3nc2NC2CCCC2)nc1 ZINC000012304628 FG Annotated Anodyne c1ccc([C@@H]2CCCN2c2nc3nonc3nc2NC2CCCC2)nc1 ZINC000012304629 FG Annotated Anodyne CSc1ccccc1OCc1cc(C(=O)N(C)Cc2cc(C)[nH]n2)no1 ZINC000012305114 FG Annotated Anodyne O=C(c1cc(COc2ccc3c(c2)OCO3)[nH]n1)N1CCCCCCC1 ZINC000012305121 FG Annotated Anodyne CCc1ccc(CN(C)C(=O)[C@@H]2CCC(=O)N(CC3CCCCC3)C2)nc1 ZINC000012306476 FG Annotated Anodyne CCc1ccc(CN(C)C(=O)[C@H]2CCC(=O)N(CC3CCCCC3)C2)nc1 ZINC000012306479 FG Annotated Anodyne COc1ccc(-c2[nH]ncc2CN(Cc2nccn2C)C(C)C)c(F)c1 ZINC000012306764 FG Annotated Anodyne CC(C)c1ccc(N[C@@H]2CCCN(C(=O)CCN3CCCC3=O)C2)cc1 ZINC000012308090 FG Annotated Anodyne CC(C)c1ccc(N[C@H]2CCCN(C(=O)CCN3CCCC3=O)C2)cc1 ZINC000012308091 FG Annotated Anodyne CCOC(=O)C1(CCOc2ccccc2)CCN(Cc2c[nH]c(C)n2)CC1 ZINC000012313957 FG Annotated Anodyne COc1ccc(CCN(Cc2nc(C)c[nH]2)CC2CCN(C)CC2)cc1 ZINC000012316476 FG Annotated Anodyne CC(=O)c1cc(CC(=O)N[C@H](C)c2cnn(-c3ccccn3)c2C)cs1 ZINC000012317947 FG Annotated Anodyne CC(=O)c1cc(CC(=O)N[C@@H](C)c2cnn(-c3ccccn3)c2C)cs1 ZINC000012317948 FG Annotated Anodyne C[C@H]1CN(C(=O)c2cc(COc3ccc4ncccc4c3)on2)C[C@@H](C)O1 ZINC000012318921 FG Annotated Anodyne O=C([C@@H]1CCCO1)N(Cc1cccnc1)CC1CCN(C2CCCC2)CC1 ZINC000012320354 FG Annotated Anodyne O=C([C@H]1CCCO1)N(Cc1cccnc1)CC1CCN(C2CCCC2)CC1 ZINC000012320355 FG Annotated Anodyne CCN(CC)c1nc(N)c2c(N)nc3c(c2c1C#N)C[C@H](c1ccccc1)O3 ZINC000012338850 FG Annotated Mild aggregator CCN(CC)c1nc(N)c2c(N)nc3c(c2c1C#N)C[C@@H](c1ccccc1)O3 ZINC000012338851 FG Annotated Mild aggregator O=C1NC(=O)c2cc(Nc3ccc(O)cc3)c(Nc3ccc(O)cc3)cc21 ZINC000012352703 FG Annotated Anodyne COc1ccc(CCNCCOc2cc(F)cc3c2OCCC3=O)cc1 ZINC000012356182 FG Annotated Anodyne Fc1ccc(-c2ncn(CCCN3CCOCC3)c2-c2cccnc2)cc1 ZINC000012365480 FG Annotated Anodyne Cc1cc(C(=O)NC[C@@H]2CCCN(Cc3nc4ccccc4s3)C2)no1 ZINC000012372756 FG Annotated Anodyne Cc1cc(C(=O)NC[C@H]2CCCN(Cc3nc4ccccc4s3)C2)no1 ZINC000012372757 FG Annotated Anodyne CC1(C)Cc2c(cnn2-c2cccc(F)c2)[C@H](NC(=O)c2csnn2)C1 ZINC000012386313 FG Annotated Anodyne CC1(C)Cc2c(cnn2-c2cccc(F)c2)[C@@H](NC(=O)c2csnn2)C1 ZINC000012386314 FG Annotated Anodyne C=C(C)CNC(=O)CCc1nnc(Cc2cccc(C(F)(F)F)c2)o1 ZINC000012429795 FG Annotated Mild CC(=O)c1cc(CN2CCC(CO)(C[C@@H]3CCCCO3)CC2)cs1 ZINC000012430699 FG Annotated Anodyne CC(=O)c1cc(CN2CCC(CO)(C[C@H]3CCCCO3)CC2)cs1 ZINC000012430700 FG Annotated Anodyne CC(C)N(Cc1cnn(C)c1)Cc1nc(Cc2ccccc2Cl)no1 ZINC000012430713 FG Annotated Anodyne O=C(NC[C@@H]1CCCN(C2CSCCSC2)C1)c1cccs1 ZINC000012431754 FG Annotated Anodyne O=C(NC[C@H]1CCCN(C2CSCCSC2)C1)c1cccs1 ZINC000012431755 FG Annotated Anodyne CN(Cc1cccnc1)C(=O)c1cc(COc2ccc3ncccc3c2)on1 ZINC000012434911 FG Annotated Anodyne Cc1nc(CNC(=O)c2cc(COc3c(F)cccc3F)on2)cs1 ZINC000012438894 FG Annotated Anodyne Cc1cc(C)n(CC(=O)N[C@@H]2CCCc3c2cnn3-c2ccccc2F)n1 ZINC000012439598 FG Annotated Anodyne Cc1cc(C)n(CC(=O)N[C@H]2CCCc3c2cnn3-c2ccccc2F)n1 ZINC000012439599 FG Annotated Anodyne O=C(CCc1nnc(C2CCCCC2)o1)NCCCOc1cccnc1 ZINC000012443855 FG Annotated Anodyne Cc1c[nH]c(CN(C)Cc2nc(Cc3cccc(C(F)(F)F)c3)no2)n1 ZINC000012445494 FG Annotated Anodyne CN(CCc1ccccn1)C(=O)CC[C@@H]1CCCN(C(=O)C2=CCCC2)C1 ZINC000012448325 FG Annotated Anodyne CN(CCc1ccccn1)C(=O)CC[C@H]1CCCN(C(=O)C2=CCCC2)C1 ZINC000012448326 FG Annotated Anodyne CSc1ccc(C(=O)[C@@H]2CCCN(C(=O)CCc3cnn(C)c3)C2)cc1 ZINC000012459647 FG Annotated Anodyne CSc1ccc(C(=O)[C@H]2CCCN(C(=O)CCc3cnn(C)c3)C2)cc1 ZINC000012459648 FG Annotated Anodyne COC1=C/C(=C/C=C2/NC(=O)c3ccccc3N2)C=C(Br)C1=O ZINC000012470890 FG Annotated Mild CCOC(=O)/C(=N/Nc1ncnc2ccccc12)c1ccc(OC)cc1 ZINC000012472282 FG Annotated Mild C[C@H](NS(=O)(=O)OCC(Cl)(Cl)Cl)[C@@H]1C[C@@H]1c1ccccc1 ZINC000012472304 FG Annotated Anodyne C[C@H](NS(=O)(=O)OCC(Cl)(Cl)Cl)[C@H]1C[C@@H]1c1ccccc1 ZINC000012472310 FG Annotated Anodyne C[C@H](NS(=O)(=O)OCC(Cl)(Cl)Cl)[C@@H]1C[C@H]1c1ccccc1 ZINC000012472315 FG Annotated Anodyne C[C@H](NS(=O)(=O)OCC(Cl)(Cl)Cl)[C@H]1C[C@H]1c1ccccc1 ZINC000012472319 FG Annotated Anodyne C[C@@H]1C[C@@H](NS(=O)(=O)OCC(Cl)(Cl)Cl)c2ccccc2O1 ZINC000012472359 FG Annotated Anodyne C[C@H]1C[C@@H](NS(=O)(=O)OCC(Cl)(Cl)Cl)c2ccccc2O1 ZINC000012472364 FG Annotated Anodyne C[C@@H]1C[C@H](NS(=O)(=O)OCC(Cl)(Cl)Cl)c2ccccc2O1 ZINC000012472368 FG Annotated Anodyne C[C@H]1C[C@H](NS(=O)(=O)OCC(Cl)(Cl)Cl)c2ccccc2O1 ZINC000012472373 FG Annotated Anodyne CC(=O)N(C1=C(Cl)C(=O)c2ccccc2C1=O)c1ccc(C(=O)O)cc1 ZINC000012474196 FG Annotated Mild COc1cc(-c2noc(C)c2C#Cc2ccccn2)cc(OC)c1OC ZINC000012474216 FG Annotated Mild CCCCN1CC[C@H]2C=CC[C@@H](C(=O)NCCc3ccccc3)[C@H]2C1=O ZINC000012478309 FG Annotated Anodyne O=C(O)C[C@H]1c2cc(C(F)(F)F)ccc2S(=O)(=O)N1C1CCCC1 ZINC000012478467 FG Annotated Anodyne CC(C)(C)N1[C@@H](CC(=O)O)c2cc(C(F)(F)F)ccc2S1(=O)=O ZINC000012478473 FG Annotated Anodyne CCOC(=O)C[C@H]1c2cc(C(F)(F)F)ccc2S(=O)(=O)N1C(C)C ZINC000012478495 FG Annotated Anodyne CC(=O)C[C@H]1c2cc(F)ccc2S(=O)(=O)N1c1ccc(N(C)C)cc1 ZINC000012478583 FG Annotated Anodyne CCOC(=O)C[C@H]1c2cc(F)ccc2S(=O)(=O)N1C1CCCCC1 ZINC000012478597 FG Annotated Anodyne CCCCN1CC[C@H]2C=CC[C@@H](C(=O)Nc3ccc(OC)cc3)[C@H]2C1=O ZINC000012478675 FG Annotated Anodyne CCCCN1CC[C@H]2C=CC[C@@H](C(=O)NCc3ccc(OC)cc3)[C@H]2C1=O ZINC000012478715 FG Annotated Anodyne CCOC(=O)C[C@H]1c2ccc(C(F)(F)F)cc2S(=O)(=O)N1C(C)C ZINC000012478717 FG Annotated Anodyne COC(=O)C[C@H]1c2cc(C(F)(F)F)ccc2S(=O)(=O)N1C(C)(C)C ZINC000012478825 FG Annotated Anodyne O=S1(=O)CCOC[C@H](Cc2ccccc2)N1Cc1cccc(Cl)c1 ZINC000012479100 FG Annotated Anodyne O=S1(=O)CCOC[C@H](Cc2ccccc2)N1Cc1ccc(Cl)cc1 ZINC000012479138 FG Annotated Anodyne CC(C)C[C@H]1COCCS(=O)(=O)N1Cc1cccc(C(F)(F)F)c1 ZINC000012479145 FG Annotated Anodyne COC(=O)C1=C(c2ccccc2)C[C@@H]2CC[C@H]1N2C(=O)N1CCCCC1 ZINC000012479542 FG Annotated Anodyne COC(=O)C1=C(c2ccccc2)C[C@@H]2CC[C@H]1N2C(=O)NCc1ccco1 ZINC000012479668 FG Annotated Anodyne COc1ccc(C2(c3cccc(O)c3OC)CCN(C(C)=O)CC2)cc1O ZINC000012480127 FG Annotated Anodyne CN[C@@H](C)C#Cc1ccc2sc3cc(OC)c(OC)cc3c(=O)c2c1 ZINC000012481985 FG Annotated Mild CN[C@H](C)C#Cc1ccc2sc3cc(OC)c(OC)cc3c(=O)c2c1 ZINC000012481993 FG Annotated Mild CC(C)(C)[C@H]1C=C(C(=O)NCc2ccccc2)O[C@@H](OCCCCO)C1 ZINC000012482188 FG Annotated Anodyne CCO[C@@H]1OC(C(=O)NC2CC2)=C[C@H](C2CCCCC2)[C@H]1CCCO ZINC000012482521 FG Annotated Anodyne O=C(O)C1=C[C@@H](c2ccc(Br)cc2)C[C@@H](OCCCCO)O1 ZINC000012482589 FG Annotated Anodyne O=C(O)C1=C[C@H](c2ccc(C(F)(F)F)cc2)C[C@H](OCCCCO)O1 ZINC000012482761 FG Annotated Anodyne O=C(O)C1=C[C@@H](c2ccc(C(F)(F)F)cc2)C[C@@H](OCCCCO)O1 ZINC000012487773 FG Annotated Anodyne Cc1ccc(NC(=S)NNc2ccc(C(=O)O)cc2[N+](=O)[O-])cc1C ZINC000012508844 FG Annotated Clean C=CCNC(=O)[C@H]1C[C@@H]2Cn3c(nc4cc(Cl)c(Cl)cc43)[C@@H]2N1C ZINC000012509790 FG Annotated Mild C=CCNC(=O)[C@@H]1C[C@@H]2Cn3c(nc4cc(Cl)c(Cl)cc43)[C@@H]2N1C ZINC000012509805 FG Annotated Mild Cc1cc2nc3n(c2cc1C)C[C@H]1C[C@H](C(=O)NCc2ccccc2)N(C)[C@@H]31 ZINC000012509886 FG Annotated Anodyne Cc1cc2nc3n(c2cc1C)C[C@H]1C[C@@H](C(=O)NCc2ccccc2)N(C)[C@@H]31 ZINC000012509896 FG Annotated Anodyne Cc1cc2nc3n(c2cc1C)C[C@H]1C[C@@H](C(=O)NCCC(C)C)N(C)[C@@H]31 ZINC000012509944 FG Annotated Anodyne Cc1cc2nc3n(c2cc1C)C[C@H]1C[C@H](C(=O)NCCC(C)C)N(C)[C@@H]31 ZINC000012509951 FG Annotated Anodyne Cc1cc2nc3n(c2cc1C)C[C@@H]1C[C@@H](C(=O)NCCC(C)C)N(C)[C@@H]31 ZINC000012509957 FG Annotated Anodyne Cc1cc2nc3n(c2cc1C)C[C@@H]1C[C@H](C(=O)NCCC(C)C)N(C)[C@@H]31 ZINC000012509962 FG Annotated Anodyne COc1ccc(C)cc1Nc1n[n+](C)c(-c2ccc(C(=O)O)cc2)s1 ZINC000012510188 FG Annotated Anodyne Cn1/c(=N/N=C/c2ccc(N3CCOCC3)cc2)sc2ccccc21 ZINC000012510974 FG Annotated Mild Cc1cccnc1NC(=O)CNC(=O)C12C[C@@H]3C[C@@H](CC(Cl)(C3)C1)C2 ZINC000012523618 FG Annotated Anodyne CCCn1ccnc1SCc1nc(N)nc(Nc2ccc(F)cc2)n1 ZINC000012551420 FG Annotated Anodyne CN(C)c1ccc([C@@H]2[C@H]3C=C[C@H](C3)[C@@]2(C#N)C(=O)O)c(Br)c1 ZINC000012561348 FG Annotated Mild CN(C)c1ccc([C@H]2[C@H]3C=C[C@H](C3)[C@@]2(C#N)C(=O)O)c(Br)c1 ZINC000012561350 FG Annotated Mild COc1ccc(C(=O)N[C@@H]2CCCc3c2cnn3-c2ccccc2F)o1 ZINC000012577947 FG Annotated Anodyne COc1ccc(C(=O)N[C@H]2CCCc3c2cnn3-c2ccccc2F)o1 ZINC000012577954 FG Annotated Anodyne Cc1ccc(CNC(=O)[C@@H]2CCC(=O)N(CCc3cccc(F)c3)C2)s1 ZINC000012590998 FG Annotated Anodyne Cc1ccc(CNC(=O)[C@H]2CCC(=O)N(CCc3cccc(F)c3)C2)s1 ZINC000012591003 FG Annotated Anodyne Cc1ccccc1C[C@@]1(CO)CCCN(C(=O)c2ccc3c(c2)OCO3)C1 ZINC000012594223 FG Annotated Anodyne Cc1ccccc1C[C@]1(CO)CCCN(C(=O)c2ccc3c(c2)OCO3)C1 ZINC000012594229 FG Annotated Anodyne CCCc1ccc2oc(C(=O)N3CCN(c4cnccn4)CC3)c(C)c2c1 ZINC000012595885 FG Annotated Anodyne CC/N=c1\scc(C)n1/N=C/c1cc(Br)c(O)c(OC)c1 ZINC000012623041 FG Annotated Mild CCOC(=O)C1(C[C@@H]2CCCCO2)CCN(C(=O)/C=C/C(C)C)CC1 ZINC000012702365 FG Annotated Anodyne CCOC(=O)C1(C[C@H]2CCCCO2)CCN(C(=O)/C=C/C(C)C)CC1 ZINC000012702371 FG Annotated Anodyne Cc1ncoc1C(=O)N1CCC[C@@H](CCC(=O)NCc2ccccc2F)C1 ZINC000012703941 FG Annotated Anodyne Cc1ncoc1C(=O)N1CCC[C@H](CCC(=O)NCc2ccccc2F)C1 ZINC000012703947 FG Annotated Anodyne O=C(CCc1nnc(COc2ccccc2)o1)NC1(c2ccccc2)CC1 ZINC000012707017 FG Annotated Anodyne Cc1oc(-c2cccs2)nc1CN[C@@H]1CCCN(c2ncccn2)C1 ZINC000012710673 FG Annotated Anodyne Cc1oc(-c2cccs2)nc1CN[C@H]1CCCN(c2ncccn2)C1 ZINC000012710679 FG Annotated Anodyne CSc1ccccc1OCc1cc(C(=O)NCc2cnc(C)cn2)no1 ZINC000012710732 FG Annotated Anodyne c1ccc(Cn2cc(CN3CCCO3)c(-c3ccc4c(c3)OCO4)n2)cc1 ZINC000012712042 FG Annotated Anodyne O=C(N[C@H]1CCCc2c1cnn2-c1cc(F)cc(F)c1)c1ccccn1 ZINC000012714141 FG Annotated Anodyne O=C(N[C@@H]1CCCc2c1cnn2-c1cc(F)cc(F)c1)c1ccccn1 ZINC000012714144 FG Annotated Anodyne Cc1cc(OCc2cc(C(=O)NCC3(C)COC3)no2)cc(C)c1Cl ZINC000012714235 FG Annotated Anodyne Cc1ccc(CN(C)C(=O)[C@@H]2CCC(=O)N(CCc3ccccc3)C2)o1 ZINC000012714398 FG Annotated Anodyne Cc1ccc(CN(C)C(=O)[C@H]2CCC(=O)N(CCc3ccccc3)C2)o1 ZINC000012714402 FG Annotated Anodyne O=C1NC[C@H](c2ccccc2)N(CCC23CC4CC(CC(C4)C2)C3)C1=O ZINC000012726272 FG Annotated Anodyne CCCNC(=O)c1onc(CSc2ccccc2)c1C(=O)NCCC ZINC000012726706 FG Annotated Anodyne Cc1ccc(CNC(=O)[C@@H]2CC(c3ccccc3C(F)(F)F)=NO2)o1 ZINC000012727078 FG Annotated Anodyne Cc1ccc(CNC(=O)[C@H]2CC(c3ccccc3C(F)(F)F)=NO2)o1 ZINC000012727080 FG Annotated Anodyne COC1=C/C(=C/c2c(-c3ccccc3)[nH]oc2=O)C=C(Br)C1=O ZINC000012733532 FG Annotated Mild Cc1cc(CN(C)C(=O)c2cc(COc3ccc(C)c(C)c3)on2)on1 ZINC000012744040 FG Annotated Anodyne Cc1ccc(OCc2cc(C(=O)N[C@@H](C)Cc3cnccn3)no2)cc1C ZINC000012754515 FG Annotated Anodyne Cc1ccc(OCc2cc(C(=O)N[C@H](C)Cc3cnccn3)no2)cc1C ZINC000012754520 FG Annotated Anodyne Cc1ccc2c(C)c(C(=O)N3CCN(c4ncccn4)CC3)oc2c1C ZINC000012755768 FG Annotated Anodyne COc1cccc(OCc2cc(C(=O)N(C)Cc3nc(C)cs3)no2)c1 ZINC000012757996 FG Annotated Anodyne CN(CC[C@@H]1CCCCO1)Cc1cn(C)nc1-c1ccc2c(c1)OCCO2 ZINC000012761766 FG Annotated Anodyne CN(CC[C@H]1CCCCO1)Cc1cn(C)nc1-c1ccc2c(c1)OCCO2 ZINC000012761771 FG Annotated Anodyne O=C(COC(=O)C12C[C@@H]3C[C@@H](CC(Cl)(C3)C1)C2)NCc1ccco1 ZINC000012995481 FG Annotated Anodyne O=C(N/N=C\C(Br)=C\c1ccccc1)c1n[nH]c2c1CCC2 ZINC000013108174 FG Annotated Reactive C/C(=N/NS(=O)(=O)c1ccc(Br)cc1)c1ccc(C)o1 ZINC000013108460 FG Annotated Mild Cc1ccc(C(=O)N/N=C\c2cc3c(cc2Br)OCO3)s1 ZINC000013108705 FG Annotated Reactive Cc1nc2c(C(=O)NCCC(C)C)cnn2c(O)c1Cc1ccccc1F ZINC000013110845 FG Annotated Clean CC(=O)c1cccc(NC(=O)N2[C@H]3CC[C@@H]2CC(O)(c2cccnc2)C3)c1 ZINC000013116621 FG Annotated Anodyne C[C@@H](c1ccccc1F)n1cc(C(=O)Nc2ccc3nc[nH]c3c2)nn1 ZINC000013116826 FG Annotated Anodyne C[C@H](c1ccccc1F)n1cc(C(=O)Nc2ccc3nc[nH]c3c2)nn1 ZINC000013116827 FG Annotated Anodyne CCN(CC)c1ccc(/C=c2/sc3nc4ccccc4n3c2=O)c(O)c1 ZINC000013118318 FG Annotated Clean O=C1C=C/C(=C\Nn2cnn(Cc3ccccc3Cl)c2=S)C(O)=C1 ZINC000013119281 FG Annotated Mild O=C(CCC(=O)Nc1ccccc1Cl)NN/C=C1\C=Nc2ccccc21 ZINC000013119315 FG Annotated Reactive COC1=CC(=CNn2cc(-c3ccccc3)[nH]c2=S)C=C(OC)C1=O ZINC000013120213 FG Annotated Mild COC1=CC(=C/C=C2/C=C(C(=O)O)c3ccccc3N2)C=C(OC)C1=O ZINC000013120402 FG Annotated Mild CC/N=c1\scc(-c2cccs2)n1N/C=C1\C=C(OC)C=CC1=O ZINC000013121644 FG Annotated Mild COc1cc([C@@H]2CC(c3cccs3)=Nc3ncnn32)cc(OC)c1OC ZINC000013121780 FG Annotated Anodyne COc1cc([C@H]2CC(c3cccs3)=Nc3ncnn32)cc(OC)c1OC ZINC000013121781 FG Annotated Anodyne CC(C)(C)C1=C2C(=NC(N)=C(C#N)[C@H]2c2ccc(Br)cc2)ON1 ZINC000013122082 FG Annotated Reactive CC(C)(C)C1=C2C(=NC(N)=C(C#N)[C@@H]2c2ccc(Br)cc2)ON1 ZINC000013122083 FG Annotated Reactive Cc1sc(NN/C=C2\C=C([N+](=O)[O-])C=CC2=O)nc1-c1ccccc1 ZINC000013122255 FG Annotated Mild C=CCC1=CC=C/C(=C\NNC(=O)CCCNc2ccc(C)cc2)C1=O ZINC000013122494 FG Annotated Reactive CC(=O)Nc1sc(NNC=C2C=CC(=O)C=C2)nc1-c1cccs1 ZINC000013122586 FG Annotated Mild CCCCc1nn2c(N)c(/C=C3\C=Nc4ccccc43)c(=O)nc2s1 ZINC000013122692 FG Annotated Anodyne O=C(CCCOc1ccc(Cl)cc1Cl)NN/C=C1\C=CC=CC1=O ZINC000013122825 FG Annotated Reactive COC1=CC(=CNn2c(C3CCCCC3)n[nH]c2=S)C=C(OC)C1=O ZINC000013122887 FG Annotated Mild CCOc1ccccc1[C@@H]1C(C#N)=C(N)N=C2ONC(c3ccccc3)=C21 ZINC000013123505 FG Annotated Reactive CCOc1ccccc1[C@H]1C(C#N)=C(N)N=C2ONC(c3ccccc3)=C21 ZINC000013123506 FG Annotated Reactive CC1=C(C(=O)Nc2ccc(Cl)cc2)[C@@H](c2cccs2)n2nnnc2N1 ZINC000013123524 FG Annotated Anodyne CC1=C(C(=O)Nc2ccc(Cl)cc2)[C@H](c2cccs2)n2nnnc2N1 ZINC000013123525 FG Annotated Anodyne Cc1ccc(O)c(/N=N\c2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 ZINC000013123972 FG Annotated Clean Cc1cc(-c2ccccc2)n(-c2cc(NN/C=C3\C=CC=CC3=O)ncn2)n1 ZINC000013124164 FG Annotated Mild O=C1C=CC(Br)=C/C1=C\NNc1ncc(-c2ccccc2)cn1 ZINC000013124296 FG Annotated Mild CCOC1=C/C(=C/Nn2c(COc3ccccc3)n[nH]c2=S)C=CC1=O ZINC000013124853 FG Annotated Mild O=C1C=CC(=CNN2C(=O)c3ccccc3N[C@H]2c2ccc(O)cc2)C=C1 ZINC000013124988 FG Annotated Mild O=C1C=CC(=CNN2C(=O)c3ccccc3N[C@@H]2c2ccc(O)cc2)C=C1 ZINC000013124989 FG Annotated Mild C[C@@H](C(=O)/N=N\c1c(O)[nH]c2ccccc12)n1cnc2ccccc2c1=O ZINC000013125309 FG Annotated Clean C[C@H](C(=O)/N=N\c1c(O)[nH]c2ccccc12)n1cnc2ccccc2c1=O ZINC000013125310 FG Annotated Clean COC(=O)CSC1=C(C#N)C(=C2C=CC(=O)C=C2)C2=C(CCCC2)N1 ZINC000013125594 FG Annotated Reactive CC1=C(O)/C(=C/NNc2nc(-c3cccnc3)nc3ccccc23)C=CC1=O ZINC000013125688 FG Annotated Mild C=CCC1=CC=C/C(=C\NNC(=O)c2ccccc2Br)C1=O ZINC000013125707 FG Annotated Reactive C=CCC1=CC=C/C(=C\NNC(=O)CNc2cccc3ccccc23)C1=O ZINC000013125937 FG Annotated Reactive Cc1nc2ccccc2c(=O)n1N/C=C1\C(=O)C=Cc2oc3c(c21)CCCC3 ZINC000013127830 FG Annotated Mild CCCCS(=O)(=O)/C=C\[C@H]1[C@@H](S(=O)(=O)CCCC)[C@@H]2C=C[C@H]1C2 ZINC000013132517 FG Annotated Anodyne CCOC(=O)/C(=N/Nc1cc(Cl)ccc1Cl)N1C[C@H](C)O[C@H](C)C1 ZINC000013133158 FG Annotated Mild CCOC(=O)/C(=N/Nc1cc(Cl)ccc1Cl)N1C[C@H](C)O[C@@H](C)C1 ZINC000013133159 FG Annotated Mild CC(=O)[C@H]1[C@@H](c2ccc(Br)cc2)[C@@H]2C(C)=NN=C2C[C@@]1(C)O ZINC000013136362 FG Annotated Anodyne CC(=O)[C@H]1[C@H](c2ccc(Br)cc2)[C@@H]2C(C)=NN=C2C[C@@]1(C)O ZINC000013136364 FG Annotated Anodyne COc1ccc2c(Cl)c(C(=O)NNC3=CC(=O)CCC3)sc2c1 ZINC000013138366 FG Annotated Reactive C/C(=N\OCC(=O)Nc1cc(C)cc(C)c1)c1ccc2c(c1)OCCO2 ZINC000013139986 FG Annotated Mild COc1cccc([C@@H]2N[C@@H](c3cccc(OC)c3O)[C@@H](C)C(=O)[C@@H]2C)c1O ZINC000013142242 FG Annotated Clean COc1cccc([C@H]2N[C@H](c3cccc(OC)c3O)[C@@H](C)C(=O)[C@@H]2C)c1O ZINC000013142245 FG Annotated Clean CN(C)c1cc(N/N=C\c2ccccc2C(F)(F)F)nc(N(C)C)n1 ZINC000013142546 FG Annotated Mild Cc1cc(-c2n[nH]c(=S)n2/N=C\c2cc([N+](=O)[O-])ccc2Cl)n[nH]1 ZINC000013142812 FG Annotated Mild COC(=O)c1c(NC(=O)[C@H]2[C@@H](C(=O)O)[C@@H]3C=C[C@H]2CC3)sc(C)c1C ZINC000013144063 FG Annotated Anodyne COC(=O)c1c(NC(=O)[C@@H]2[C@@H](C(=O)O)[C@@H]3C=C[C@H]2CC3)sc(C)c1C ZINC000013144064 FG Annotated Anodyne CCOC(=O)c1s/c(=N/C(=O)c2ccc(OC(C)C)cc2)n(C)c1C ZINC000013146816 FG Annotated Anodyne C/C(=N/NS(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1)c1cc2ccccc2o1 ZINC000013147006 FG Annotated Mild Cc1nc2sc([C@H](c3ccccc3)N3C[C@H](C)O[C@H](C)C3)c(O)n2n1 ZINC000013147436 FG Annotated Anodyne Cc1nc2sc([C@@H](c3ccccc3)N3C[C@H](C)O[C@H](C)C3)c(O)n2n1 ZINC000013147437 FG Annotated Anodyne CN1C(=O)[C@@H](C(=O)NC(C)(C)C)[C@H]2c3ccccc3O[C@@]13CCCC[C@@H]23 ZINC000013147525 FG Annotated Anodyne CN1C(=O)[C@H](C(=O)NC(C)(C)C)[C@H]2c3ccccc3O[C@@]13CCCC[C@@H]23 ZINC000013147526 FG Annotated Anodyne CCCCCOc1ccc(Br)cc1/C(C)=N\NC1=NCCN1 ZINC000013152341 FG Annotated Mild CC1(C)Cc2c(sc3nc(NN=Cc4ccccc4)[nH]c(=O)c23)CO1 ZINC000013152418 FG Annotated Anodyne aggregator CC/N=C1/Cn2c(nc3scc(-c4ccccc4)c3c2=O)CN1CC ZINC000013152657 FG Annotated Mild COc1ccc(CCN2C(=O)[C@H]3[C@@H]4CC[C@@H](C4=C(C)C)[C@H]3C2=O)cc1OC ZINC000013153618 FG Annotated Anodyne S=C(NCc1ccccc1)c1nc[nH]c1C(=S)NCc1ccccc1 ZINC000013219498 FG Annotated Anodyne CC(=N)[C@H](C#N)C(=O)CSc1nnc(COc2ccccc2Cl)o1 ZINC000013285583 FG Annotated Mild CC(=O)C[C@@]12c3[nH]c4ccccc4c3CCN1C(=O)c1ccccc1N2C ZINC000013304766 FG Annotated Clean CCCCO[C@H]1c2c(cc(OC)c(C(C)=O)c2OC)OC(C)(C)[C@H]1O ZINC000013305697 FG Annotated Anodyne C/C(C=O)=C\CC[C@H](C)C1=CC[C@@](C)(O)[C@@H]1CC1=C(O)CC[C@H](O)C1=O ZINC000013307824 FG Annotated Reactive Nc1nc2c(-c3cc(Br)c(Br)[nH]3)nccc2[nH]1 ZINC000013309005 FG Annotated Anodyne in-vivo COC(=O)C1=CO[C@@H](C)[C@@H]2C[N+]3([O-])CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 ZINC000013309405 FG Annotated Bother COC(=O)c1cncc(CC[C@H](C)c2cncc(C(=O)OC)c2C)c1C ZINC000013310789 FG Annotated Anodyne C=CC[C@@]1(OC)C=C([C@H](C)[C@H](O)c2ccc3c(c2)OCO3)C(OC)=CC1=O ZINC000013311460 FG Annotated Mild CN(C)[C@@H](Cc1ccccc1)c1ncc(C(=O)c2ccccc2NC=O)o1 ZINC000013311507 FG Annotated Anodyne CCC(=O)O[C@H]1C/C=C(\C)CCC2=C(COC(C)=O)C(=O)O[C@@H]2/C=C/1C ZINC000013324154 FG Annotated Anodyne CCCC(=O)O[C@@H](CC=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000013328093 FG Annotated Mild CCCC(=O)O[C@H](CC=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000013328095 FG Annotated Mild COc1ccc(OC)c2c1C(=O)C=C([C@@H](CC=C(C)C)OC(C)=O)C2=O ZINC000013328125 FG Annotated Mild COc1c(O)c2c(c3c1CCOC3=O)CC[C@H]1C(C)(C)C(=O)CC[C@]21C ZINC000013337284 FG Annotated Anodyne COc1c(C)ccc2cc3c(c(O)c12)C(=O)C1=C(C[C@@](C)(O)CC1)C3=O ZINC000013368548 FG Annotated Mild O=c1[nH]c(=O)c2c3c([nH]c4cc(O)ccc43)oc3cccc4[nH]cc(c1=2)c43 ZINC000013372417 FG Annotated Bother COc1c(O)ccc(-c2ccc3cc4c(cc3c2N(C)C=O)OCO4)c1O ZINC000013372802 FG Annotated Anodyne CC(C)=CCc1ccc(O)c(C(=O)c2c(O)cc(C)c(O)c2C=O)c1O ZINC000013373313 FG Annotated Anodyne COc1ccc2c(c1OC)N(C=O)C13CCC4(CCCN5CC[C@@]21[C@H]54)CC3 ZINC000013373748 FG Annotated Anodyne CCCC/C=C/c1c(O)cc2c(c1O)C(=O)c1c(O)cc(O)cc1C2=O ZINC000013374856 FG Annotated Clean CO[C@H]1c2cc(O)ccc2OC[C@H]1[C@@H]1COc2ccc(O)cc2[C@@H]1OC ZINC000013376915 FG Annotated Anodyne COc1cc2c(cc1O)[C@@H](CO)[C@@H](c1ccc(OC)c(OC)c1)OCCC2 ZINC000013377015 FG Annotated Anodyne in-vitro COc1cc2c(cc1O)[C@@H](CO)[C@H](c1ccc(OC)c(OC)c1)OCCC2 ZINC000013377016 FG Annotated Anodyne in-vitro biogenic COc1cc2c(cc1O)[C@H](CO)[C@@H](c1ccc(OC)c(OC)c1)OCCC2 ZINC000013377017 FG Annotated Anodyne in-vitro COc1cc2c(cc1O)[C@H](CO)[C@H](c1ccc(OC)c(OC)c1)OCCC2 ZINC000013377018 FG Annotated Anodyne in-vitro COc1cc2oc3c(c(=O)c2c(O)c1C)-c1cccc(O)c1O[C@H]3OC ZINC000013378584 FG Annotated Anodyne COc1cc2oc3c(c(=O)c2c(O)c1C)-c1cccc(O)c1O[C@@H]3OC ZINC000013378585 FG Annotated Anodyne COC(=O)[C@@H]1O[C@H](OC)c2c1c(C)c1oc3c(C)cccc3c(=O)c1c2O ZINC000013378678 FG Annotated Bother CC[C@@H]1CC(=O)c2c(cc(O)c3c2C(=O)c2cccc(OC)c2C3=O)C1 ZINC000013379077 FG Annotated Clean in-vitro C[C@@H](CO)CCc1cc2c(cc1O)OC[C@H]1c3cc4c(cc3O[C@H]21)OCO4 ZINC000013380861 FG Annotated Anodyne CC1=C(c2c(O)c3c(C)cccc3oc2=O)C(=O)c2c(O)cccc2C1=O ZINC000013382872 FG Annotated Mild C=CCc1cc(OC)c(O)c([C@@H](CO)C(=O)c2ccc(OC)c(OC)c2)c1 ZINC000013383573 FG Annotated Mild COc1cc2c(cc1OC)C[N+]1([O-])CCc3ccc(OC)c(O)c3[C@@H]1C2 ZINC000013383908 FG Annotated Clean Oc1cc(O)c2c(c1)[C@@H]1Cc3c(O)cc(O)cc3[C@H]2c2cc(O)c(O)cc21 ZINC000013384043 FG Annotated Clean Oc1cc(O)c2c(c1)[C@H]1Cc3c(O)cc(O)cc3[C@@H]2c2cc(O)c(O)cc21 ZINC000013384044 FG Annotated Clean in-vitro biogenic C=C(C)[C@H]([C@@H]1C=C(CCC(C=O)=C(C)C)C(=O)O1)[C@@]1(OC)C=C(C)C(=O)O1 ZINC000013384185 FG Annotated Reactive CO[C@]1(/C=C(\C)C[C@@H]2C=C(CCC(C=O)=C(C)C)C(=O)O2)C=C(C)C(=O)O1 ZINC000013384197 FG Annotated Reactive CO[C@@]1(/C=C(\C)C[C@H]2C=C(CCC(C=O)=C(C)C)C(=O)O2)C=C(C)C(=O)O1 ZINC000013384200 FG Annotated Reactive CO[C@@](C)(/C=C1/C=C(C)C(=O)O1)C[C@@H]1C=C(CCC(C=O)=C(C)C)C(=O)O1 ZINC000013384201 FG Annotated Reactive CO[C@](C)(/C=C1/C=C(C)C(=O)O1)C[C@@H]1C=C(CCC(C=O)=C(C)C)C(=O)O1 ZINC000013384202 FG Annotated Reactive CO[C@](C)(/C=C1/C=C(C)C(=O)O1)C[C@H]1C=C(CCC(C=O)=C(C)C)C(=O)O1 ZINC000013384204 FG Annotated Reactive COc1cc2oc(C)cc(=O)c2c(O)c1C[C@@H](C)C1=CC(=O)C[C@H](C)O1 ZINC000013385313 FG Annotated Mild in-vitro biogenic COc1cc2oc(C)cc(=O)c2c(O)c1C[C@H](C)C1=CC(=O)C[C@H](C)O1 ZINC000013385314 FG Annotated Mild in-vitro biogenic CC(=O)[C@@H](C)[C@@H]1c2cc3c(cc2C(=O)c2ccc4c(c21)OCO4)OCO3 ZINC000013385381 FG Annotated Anodyne CC(=O)[C@@H](C)[C@@H]1c2ccc3c(c2C(=O)c2ccc4c(c21)OCO4)OCO3 ZINC000013385385 FG Annotated Anodyne COc1cc(O)c2c(c[n+](C)c3c4cc5c(cc4ccc23)OCO5)c1OC ZINC000013385537 FG Annotated Bother CN1CC[C@@]2([C@@]34CCN(C)[C@@H]3N(C)c3ccccc34)c3ccccc3N[C@H]12 ZINC000013385666 FG Annotated Anodyne in-man endogenous COc1cc2c3c(c1O)-c1c(ccc(OC)c1OC)C[C@@H]3[N+](C)([O-])CC2 ZINC000013408659 FG Annotated Bother COc1cc2c3c(c1O)-c1c(ccc(OC)c1OC)C[C@@H]3[N+](C)(C)CC2 ZINC000013408666 FG Annotated Bother in-vitro biogenic COc1cc2c3c(c1O)-c1c(ccc(OC)c1OC)C[C@H]3[N+](C)(C)CC2 ZINC000013408670 FG Annotated Bother CC(=O)O[C@H](/C=C/c1ccccc1)C[C@H](O)C/C=C/[C@@H]1CC=CC(=O)O1 ZINC000013411251 FG Annotated Anodyne CO[C@H]1OC[C@@H](Cc2ccc3c(c2)OCO3)[C@@H]1Cc1ccc2c(c1)OCO2 ZINC000013411688 FG Annotated Anodyne CO[C@@H]1OC[C@@H](Cc2ccc3c(c2)OCO3)[C@@H]1Cc1ccc2c(c1)OCO2 ZINC000013411691 FG Annotated Anodyne Cc1cccc2oc(=O)c3c(c12)OCC1=C3C(=O)c2c(O)cccc2C1=O ZINC000013414820 FG Annotated Mild COc1cccc2c1cc([N+](=O)[O-])c1c(CC(=O)O)cc3c(c12)OCO3 ZINC000013433310 FG Annotated Bother in-vitro biogenic COC(OC)c1c[n+]([C@@H](Cc2ccccc2)C(=O)O)cc2c1CC[C@@H]2C ZINC000013434507 FG Annotated Mild COc1ccc2c(c1)CN(C=O)N=C2Cc1c(Cl)cncc1Cl ZINC000013435998 FG Annotated Anodyne COc1ccc2c(c1)CN(C(N)=O)N=C2Cc1c(Cl)cncc1Cl ZINC000013436021 FG Annotated Anodyne CCN(CC)Cc1cc(/C=C/S(N)(=O)=O)cc(C(=O)c2ccccc2)c1 ZINC000013438169 FG Annotated Anodyne COc1ccc([C@@H](F)Cn2cc[nH]c2=O)cc1OC1Cc2ccccc2C1 ZINC000013438917 FG Annotated Anodyne COc1ccc([C@H](F)Cn2cc[nH]c2=O)cc1OC1Cc2ccccc2C1 ZINC000013438920 FG Annotated Anodyne CCCc1c(C)c(=O)[nH]c2c(O)c3[nH]c(=O)c(C)c(CCC)c3c(O)c12 ZINC000013439538 FG Annotated Bother O=P(O)(O)Cc1cc(-c2ccc(Cl)cc2)cc2nc(O)c(O)nc12 ZINC000013440448 FG Annotated Anodyne O=C(O)CCCCCCC(=O)N1CCC2(CCN(c3ccncc3)CC2)C1 ZINC000013440550 FG Annotated Anodyne CC(=O)Oc1cc(Br)cc(Br)c1OC(C)=O ZINC000013449735 FG Annotated Anodyne CC(=O)OCc1cc(Br)c(OC(C)=O)c(Br)c1 ZINC000013450320 FG Annotated Anodyne COc1c(Br)cc(CC[N+](C)(C)C)cc1Br ZINC000013450426 FG Annotated Bother C=CCc1cc2c(cc1O[C@@]13C[C@H](CC=C)C(=O)C=C1OCO3)OCO2 ZINC000013453960 FG Annotated Mild CC1=CCc2c(cc(O)c(C(=O)CCc3ccc(O)c(O)c3)c2O)OC1 ZINC000013459842 FG Annotated Clean CS(=O)(=O)c1ccc(N/C=C2\C(=O)Nc3ccc4ncsc4c32)cc1 ZINC000013470495 FG Annotated Anodyne CCCN(CCc1csc(N)n1)C1Cc2cc(OC)c(OC)cc2C1 ZINC000013471439 FG Annotated Anodyne NC(=S)/N=N/c1c(O)n([C@@H]2OC(=O)c3ccccc32)c2ccccc12 ZINC000013471553 FG Annotated Clean NC(=S)/N=N/c1c(O)n([C@H]2OC(=O)c3ccccc32)c2ccccc12 ZINC000013471556 FG Annotated Clean O[C@@H]1c2cc(F)ccc2C[C@H]1N1CCC(c2cccc3c2OCCO3)CC1 ZINC000013471796 FG Annotated Anodyne O[C@@H]1c2ccc(F)cc2C[C@H]1N1CC=C(c2cccc3c2OCCO3)CC1 ZINC000013471798 FG Annotated Anodyne CN(C)CCO/N=C/[C@H]1CC[C@]2(O)C[C@@H](c3cccc(CO)c3)CC[C@]12C ZINC000013471881 FG Annotated Mild COc1cc(-c2oc(C)nc2C2CCCCC2)ccc1S(N)(=O)=O ZINC000013473012 FG Annotated Anodyne Cc1nc(-c2ccc(C)s2)c(-c2ccc(S(N)(=O)=O)c(F)c2)o1 ZINC000013473015 FG Annotated Anodyne COc1ccc(C2=NNC(=O)[C@@H]3CC=CC[C@H]23)c2c1OC1(CCCC1)C2 ZINC000013474146 FG Annotated Anodyne COc1ccc(C2=NNC(=O)[C@H]3CC=CC[C@H]23)c2c1OC1(CCCC1)C2 ZINC000013474147 FG Annotated Anodyne COc1ccc(C2=NNC(=O)[C@@H]3CC=CC[C@@H]23)c2c1OC1(CCCC1)C2 ZINC000013474148 FG Annotated Anodyne COc1ccc(C2=NNC(=O)[C@H]3CC=CC[C@@H]23)c2c1OC1(CCCC1)C2 ZINC000013474149 FG Annotated Anodyne CC(C)C(=O)Nc1nc(O)c2nc(-c3ccc(N=[N+]=[N-])cc3)cnc2n1 ZINC000013474424 FG Annotated Mild CCCN(CCC)c1nc(N)nc2c1N[C@H](c1ccc(OC)cc1)CN2 ZINC000013474491 FG Annotated Anodyne CCCN(CCC)c1nc(N)nc2c1N[C@@H](c1ccc(OC)cc1)CN2 ZINC000013474492 FG Annotated Anodyne Cc1ccnc2c1/C(=N/N=C(N)N)C[C@H](c1sc(Cl)cc1Cl)C2 ZINC000013474720 FG Annotated Mild Cc1ccnc2c1/C(=N/N=C(N)N)C[C@@H](c1sc(Cl)cc1Cl)C2 ZINC000013474721 FG Annotated Mild Cc1ccnc2c1/C(=N/N=C(N)N)C[C@H](c1cc(Cl)sc1Cl)C2 ZINC000013474726 FG Annotated Mild Cc1ccnc2c1/C(=N/N=C(N)N)C[C@@H](c1cc(Cl)sc1Cl)C2 ZINC000013474727 FG Annotated Mild O=c1[nH]c(=O)n(Cc2ccccc2)c2nc3cc(-c4ccccc4)ccn3c12 ZINC000013475097 FG Annotated Anodyne CC1(C)C(=O)NC(=O)c2c1ccc1[nH]c(Nc3c(F)cccc3F)nc21 ZINC000013475185 FG Annotated Anodyne Cc1ccc(CNC(=O)[C@@H]2CC(c3ccc(C(F)(F)F)cc3)=NO2)o1 ZINC000013478294 FG Annotated Anodyne Cc1ccc(CNC(=O)[C@H]2CC(c3ccc(C(F)(F)F)cc3)=NO2)o1 ZINC000013478296 FG Annotated Anodyne C=CCC1=C[C@@](OC)([C@H](C)[C@@H](O)c2ccc3c(c2)OCO3)C(OC)=CC1=O ZINC000013480164 FG Annotated Mild C[C@@H]1[C@H](O)C[C@@]23COC(=O)C2=CCC[C@@H]3[C@@]1(C)CC[C@@H](C)CC(=O)O ZINC000013484342 FG Annotated Anodyne COC[C@H](C)Nc1cc(-c2c(-c3ccccc3)nc3nc(N)ccn23)ccn1 ZINC000013487228 FG Annotated Anodyne CCN1C(=O)c2cc3c(OC)cc(OCc4ccccn4)cc3n2C1=S ZINC000013487562 FG Annotated Anodyne Cc1ccc2c(c1)C1=C(c3ccc(S(C)(=O)=O)cc3)C(=O)O[C@H]1CC2 ZINC000013489706 FG Annotated Anodyne Cc1ccc2c(c1)C1=C(c3ccc(S(C)(=O)=O)cc3)C(=O)O[C@@H]1CC2 ZINC000013489707 FG Annotated Anodyne Cc1cc(C)cc(Nc2nccc(-n3ccnc3-c3ccc[n+]([O-])c3)n2)c1 ZINC000013489754 FG Annotated Anodyne Cc1cc(C)c([C@@H](O)c2nc(C(=O)O)cc3cc(O)c(O)cc23)c(C)c1 ZINC000013490156 FG Annotated Clean Cc1cc(C)c([C@H](O)c2nc(C(=O)O)cc3cc(O)c(O)cc23)c(C)c1 ZINC000013490157 FG Annotated Clean C[C@@H](OC(=O)c1cnn2c1n[n+]([O-])c1ccc(Cl)cc12)c1ccccc1 ZINC000013492633 FG Annotated Anodyne C[C@H](OC(=O)c1cnn2c1n[n+]([O-])c1ccc(Cl)cc12)c1ccccc1 ZINC000013492634 FG Annotated Anodyne COc1ccccc1COC(=O)c1cnn2c1nnc1ccc(Cl)cc12 ZINC000013492636 FG Annotated Anodyne C/C=C1/CN2[C@H]3C[C@@H]1[C@H]1[C@@H]2C[C@@]2(C3=Nc3cc(OC)ccc32)[C@@H]1OC(C)=O ZINC000013514335 FG Annotated Anodyne in-vitro CCCNC1=C(N(C(C)=O)c2cccc(F)c2)C(=O)c2ccccc2C1=O ZINC000013519042 FG Annotated Mild C[C@H]1c2ccc3c4ccccc4n(C)c3c2CCN1Cc1cnc(N)nc1N ZINC000013520560 FG Annotated Anodyne C[C@@H]1c2ccc3c4ccccc4n(C)c3c2CCN1Cc1cnc(N)nc1N ZINC000013520564 FG Annotated Anodyne COc1ccccc1C(=O)Oc1cccnc1C(=O)Nc1nccs1 ZINC000013521954 FG Annotated Anodyne COC(=O)C1=C(C)N(C)C(=S)N[C@@H]1c1c(OC)ccc2ccccc12 ZINC000013522802 FG Annotated Anodyne COC(=O)C1=C(C)N(C)C(=S)N[C@H]1c1c(OC)ccc2ccccc12 ZINC000013522806 FG Annotated Anodyne C[n+]1cccc(C(=O)OCCCCn2ccc3cc([N+](=O)[O-])ccc32)c1 ZINC000013524839 FG Annotated Bother C[n+]1cccc(C(=O)OCCCCCn2ccc3cc([N+](=O)[O-])ccc32)c1 ZINC000013524842 FG Annotated Bother COc1ccccc1-c1oc2c(CC(=O)O)cccc2c(=O)c1[N+](=O)[O-] ZINC000013526442 FG Annotated Bother N=C(N)c1ccc(/C=C2\CCC/C(=C\c3ccc(C(=N)N)cc3)C2=O)cc1 ZINC000013527449 FG Annotated Mild Cn1ccc2ccc3c4[nH]c5cccc(CO)c5c4c4c(c3c21)C(=O)NC4=O ZINC000013534917 FG Annotated Bother CCCN(CCC)c1c(C)nc(-c2c(OC)cccc2OC)n(C)c1=O ZINC000013536175 FG Annotated Anodyne CCOc1ccc2[nH]cc(S(=O)(=O)c3ccc(Cl)cc3)c(=O)c2c1 ZINC000013544235 FG Annotated Anodyne COc1ccc2c(c1)O[C@H](c1cc(OC)c(OC)c(OC)c1)C(CO)=C2 ZINC000013553832 FG Annotated Anodyne COc1ccc2c(c1)O[C@@H](c1cc(OC)c(OC)c(OC)c1)C(CO)=C2 ZINC000013553833 FG Annotated Anodyne COc1ccc2c(c1)O[C@H](c1cc(OC)c(OC)c(OC)c1)C(C(=O)O)=C2 ZINC000013553862 FG Annotated Anodyne COc1ccc2c(c1)O[C@@H](c1cc(OC)c(OC)c(OC)c1)C(C(=O)O)=C2 ZINC000013553863 FG Annotated Anodyne COc1cc2c(cc1OC)C(c1ccc([N+](=O)[O-])cc1)=NN(C)C(=S)C2 ZINC000013555787 FG Annotated Bother COCCCNC(=S)N1CCC[C@@H](c2nc3cc(C)c(C)cc3[nH]2)C1 ZINC000013556116 FG Annotated Anodyne COCCCNC(=S)N1CCC[C@H](c2nc3cc(C)c(C)cc3[nH]2)C1 ZINC000013556120 FG Annotated Anodyne COc1cc2c(c(OC)c1OC)c1c3c(cc4c1n2C(=O)CC4)CNCC3 ZINC000013558723 FG Annotated Anodyne CCCC1(CCC)C(=O)OC[C@H]1NS(=O)(=O)c1ccc(Cl)cc1 ZINC000013558768 FG Annotated Anodyne CCCCO[C@H]1c2c(ncn2Cc2ccc(OC)cc2)N=CN(C)N1C ZINC000013559509 FG Annotated Anodyne CCCCO[C@@H]1c2c(ncn2Cc2ccc(OC)cc2)N=CN(C)N1C ZINC000013559510 FG Annotated Anodyne CS(=O)(=O)c1ccc(-c2cc(CCCO)nn2C2CCCCC2)cc1 ZINC000013560525 FG Annotated Anodyne C=C(Cl)CN1CCN(C(=O)CCC(=O)c2ccc(Cl)cc2)CC1 ZINC000013561110 FG Annotated Mild CCC(CC)N1CCN(C(=O)CCC(=O)c2ccc(OC)c(F)c2)CC1 ZINC000013561114 FG Annotated Anodyne C[C@H]1S[C@H](c2ccccc2)N(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1=O ZINC000013571517 FG Annotated Bother Cc1nnn(C23C[C@H]4C[C@H](CC(CC(=O)Nc5cccc(F)c5)(C4)C2)C3)n1 ZINC000013574174 FG Annotated Anodyne COc1cccc(-c2c(C#N)c(N)nc(SCc3ncc[nH]3)c2C#N)c1 ZINC000013580868 FG Annotated Mild COc1ccc(-c2c(C#N)c(N)nc(SCc3ncc[nH]3)c2C#N)cc1 ZINC000013580870 FG Annotated Mild Cc1nc2c(c(C#N)nn2-c2c(Cl)cc(Cl)cc2Cl)c(=O)[nH]1 ZINC000013585090 FG Annotated Mild CN(C)c1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cncc(Br)c1 ZINC000013586205 FG Annotated Reactive CN(C)c1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cncc(Br)c1 ZINC000013586206 FG Annotated Reactive NS(=O)(=O)Oc1ccc2nc(C=C3C4CC5CC(C4)CC3C5)oc2c1 ZINC000013587733 FG Annotated Anodyne CN1C(=O)[C@@H](NC(=O)c2cc3cccc(Cl)c3[nH]2)Cc2ccccc21 ZINC000013587915 FG Annotated Anodyne CN1C(=O)[C@H](NC(=O)c2cc3cccc(Cl)c3[nH]2)Cc2ccccc21 ZINC000013587916 FG Annotated Anodyne Cc1ccc(-c2n[nH]c3c2C(=O)c2c(NC(=O)NN(C)C)cccc2-3)s1 ZINC000013588747 FG Annotated Reactive NCCCC(=O)Nc1ccccc1S[C@@H](CC(=O)O)c1cccnc1 ZINC000013589274 FG Annotated Anodyne NCCCC(=O)Nc1ccccc1S[C@H](CC(=O)O)c1cccnc1 ZINC000013589275 FG Annotated Anodyne Cc1cnc(C(=O)N2CCC[C@@H](C(=O)c3ccc(Cl)cc3C)C2)cn1 ZINC000013593434 FG Annotated Anodyne Cc1cnc(C(=O)N2CCC[C@H](C(=O)c3ccc(Cl)cc3C)C2)cn1 ZINC000013593436 FG Annotated Anodyne CCCn1ncc(CN2CCC(CO)(Cc3ccc(OC)cc3)CC2)c1C ZINC000013593526 FG Annotated Anodyne COc1ccc(F)cc1C(=O)[C@@H]1CCCN(C(=O)Cc2c(C)noc2C)C1 ZINC000013593616 FG Annotated Anodyne COc1ccc(F)cc1C(=O)[C@H]1CCCN(C(=O)Cc2c(C)noc2C)C1 ZINC000013593618 FG Annotated Anodyne CC(C)C[C@@H](O)C1CCN(C(=O)CCc2nnc(-c3ccccc3)o2)CC1 ZINC000013595297 FG Annotated Anodyne CC(C)C[C@H](O)C1CCN(C(=O)CCc2nnc(-c3ccccc3)o2)CC1 ZINC000013595300 FG Annotated Anodyne CCn1cc(CNC(=O)CCc2nnc(CCC3CCCCC3)o2)cn1 ZINC000013595470 FG Annotated Anodyne Cc1ccc(-c2nnc(CCC(=O)NC[C@H](C)Oc3cccnc3)o2)s1 ZINC000013597008 FG Annotated Anodyne Cc1ccc(-c2nnc(CCC(=O)NC[C@@H](C)Oc3cccnc3)o2)s1 ZINC000013597010 FG Annotated Anodyne COc1ccc(-c2nn(CCn3ccnc3)c(=O)c3ccccc23)s1 ZINC000013600524 FG Annotated Anodyne Oc1cc2c(cc1O)CN(C(=S)NCCc1ccc(Cl)cc1)CC2 ZINC000013601131 FG Annotated Clean Oc1ccc2c(c1O)CCN(C(=S)NCCc1ccc(Cl)cc1)C2 ZINC000013601139 FG Annotated Clean COc1ccc2[nH]c([S@](=O)Cc3nccc(OC(C)C)c3C)nc2c1 ZINC000013603902 FG Annotated Anodyne CC(C)NC(=O)N1N=C(c2ccc(N)cc2)c2cc3c(cc2[C@@H]1C)OCO3 ZINC000013604060 FG Annotated Anodyne CC(C)NC(=O)N1N=C(c2ccc(N)cc2)c2cc3c(cc2[C@H]1C)OCO3 ZINC000013604062 FG Annotated Anodyne CN(O)C(=O)CCCCCc1ccc2c(c1O)C(=O)c1c(O)cccc1C2 ZINC000013606215 FG Annotated Anodyne Oc1ccc(-n2nc3ccc(O)cc3c2I)cc1 ZINC000013609484 FG Annotated Anodyne OCCCOc1nn2c(-c3ccccc3)nnc2c2c1C1CCC2CC1 ZINC000013610389 FG Annotated Anodyne c1ccc(-c2nnc3c4c(c(OCc5nc[nH]n5)nn23)C2CCC4CC2)cc1 ZINC000013610459 FG Annotated Anodyne N#Cc1c(N)nc(SCCO)c(C#N)c1-c1cccc(C(F)(F)F)c1 ZINC000013612579 FG Annotated Mild N#Cc1c(N)nc(SCCO)c(C#N)c1-c1ccc(C(F)(F)F)cc1 ZINC000013612582 FG Annotated Mild C#Cc1ccc([C@@H]2C=C(C(=O)OCC=C)O[C@H](OCC)[C@H]2CCCO)cc1 ZINC000013634566 FG Annotated Mild C#Cc1ccc([C@H]2C=C(C(=O)OCC=C)O[C@@H](OCC)[C@@H]2CCCO)cc1 ZINC000013634572 FG Annotated Mild C#Cc1ccc([C@H]2C=C(C(=O)O)O[C@@H](OCc3ccc(CO)cc3)C2)cc1 ZINC000013634603 FG Annotated Mild C#Cc1ccc([C@@H]2C=C(C(=O)O)O[C@H](OCc3ccc(CO)cc3)C2)cc1 ZINC000013634625 FG Annotated Mild O=C(O)C1=C[C@H](c2ccc(Br)cc2)C[C@H](OCCCCO)O1 ZINC000013634778 FG Annotated Anodyne C[C@@H]1C=C(C(=O)NCc2ccccc2)O[C@H](OCc2ccc(CO)cc2)C1 ZINC000013634947 FG Annotated Anodyne C[C@H]1C=C(C(=O)NCc2ccccc2)O[C@@H](OCc2ccc(CO)cc2)C1 ZINC000013635016 FG Annotated Anodyne Oc1c2nc3ccc(Br)cc3c-2ncn1Cc1ccncc1 ZINC000013635060 FG Annotated Anodyne COc1ccc(-c2n[nH]cc2CN(Cc2nccn2C)C(C)C)cc1F ZINC000013636673 FG Annotated Anodyne Cc1nc2ccccc2nc1CN1CCC(CO)(C[C@@H]2CCCCO2)CC1 ZINC000013636852 FG Annotated Anodyne Cc1nc2ccccc2nc1CN1CCC(CO)(C[C@H]2CCCCO2)CC1 ZINC000013636855 FG Annotated Anodyne C[C@@H](Cc1ccsc1)NC(=O)CCc1nnc(COc2ccccc2)o1 ZINC000013636876 FG Annotated Anodyne C[C@H](Cc1ccsc1)NC(=O)CCc1nnc(COc2ccccc2)o1 ZINC000013636879 FG Annotated Anodyne C[C@H]1CCC[C@@H](NC(=S)Nc2cccc(S(=O)(=O)N(C)C)c2)[C@@H]1C ZINC000013637333 FG Annotated Anodyne CO[C@@]1(c2ccc(Br)cc2)SC=C(C)n2c1noc2=O ZINC000013641911 FG Annotated Anodyne CO[C@]1(c2ccc(Br)cc2)SC=C(C)n2c1noc2=O ZINC000013641914 FG Annotated Anodyne CCO[C@@]1(c2ccc(Br)cc2)SC=C(C)n2c1noc2=O ZINC000013641929 FG Annotated Anodyne CCO[C@]1(c2ccc(Br)cc2)SC=C(C)n2c1noc2=O ZINC000013641932 FG Annotated Anodyne C[C@@H](C(=O)NS(C)(=O)=O)c1ccc2c(c1)[nH]c1ccc(Cl)cc12 ZINC000013646065 FG Annotated Anodyne C[C@H](C(=O)NS(C)(=O)=O)c1ccc2c(c1)[nH]c1ccc(Cl)cc12 ZINC000013646068 FG Annotated Anodyne CCN(CC)C1=NS(=O)(=O)C(c2ccccn2)=C1c1ccc(OC)cc1 ZINC000013648821 FG Annotated Anodyne CN(O)C(=O)NCCSc1nc2cc(C(F)(F)F)ccc2s1 ZINC000013650919 FG Annotated Anodyne C[C@@H](O)c1nccn1C[C@@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651112 FG Annotated Anodyne C[C@H](O)c1nccn1C[C@@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651113 FG Annotated Anodyne C[C@@H](O)c1nccn1C[C@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651114 FG Annotated Anodyne C[C@H](O)c1nccn1C[C@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651115 FG Annotated Anodyne COCc1nccn1C[C@@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651120 FG Annotated Anodyne COCc1nccn1C[C@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651121 FG Annotated Anodyne CC(=O)c1nccn1C[C@@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651126 FG Annotated Anodyne CC(=O)c1nccn1C[C@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651127 FG Annotated Anodyne CCc1n(C[C@@H]2CC(c3ccccc3)(c3ccccc3)C(=O)O2)cc[n+]1C ZINC000013651150 FG Annotated Anodyne CCc1n(C[C@H]2CC(c3ccccc3)(c3ccccc3)C(=O)O2)cc[n+]1C ZINC000013651151 FG Annotated Anodyne CC[n+]1c(C)ccn1C[C@@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651182 FG Annotated Anodyne CC[n+]1c(C)ccn1C[C@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651183 FG Annotated Anodyne CC[n+]1cc(C)cn1C[C@@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651184 FG Annotated Anodyne CC[n+]1cc(C)cn1C[C@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651185 FG Annotated Anodyne O=C1O[C@@H](Cn2cc[n+]3c2CCC3)CC1(c1ccccc1)c1ccccc1 ZINC000013651198 FG Annotated Anodyne O=C1O[C@H](Cn2cc[n+]3c2CCC3)CC1(c1ccccc1)c1ccccc1 ZINC000013651199 FG Annotated Anodyne O=C1O[C@@H](Cn2cc[n+]3c2CCCC3)CC1(c1ccccc1)c1ccccc1 ZINC000013651200 FG Annotated Anodyne O=C1O[C@H](Cn2cc[n+]3c2CCCC3)CC1(c1ccccc1)c1ccccc1 ZINC000013651201 FG Annotated Anodyne COc1cc([S@@](C)=O)ccc1-c1nc2cc(-n3ccnc3)ccc2[nH]1 ZINC000013651249 FG Annotated Anodyne COc1cc([S@](C)=O)ccc1-c1nc2cc(-n3ccnc3)ccc2[nH]1 ZINC000013651250 FG Annotated Anodyne Cc1c(C)c2c(c(C)c1O)CC[C@](C)(C(=O)NCCc1ccccn1)O2 ZINC000013651298 FG Annotated Anodyne Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(C(=O)NCCc1ccccn1)O2 ZINC000013651299 FG Annotated Anodyne Cc1c(C)c2c(c(C)c1O)CC[C@](C)(C(=O)N(C)CCc1ccccn1)O2 ZINC000013651300 FG Annotated Anodyne Cc1c(C)c2c(c(C)c1O)CC[C@@](C)(C(=O)N(C)CCc1ccccn1)O2 ZINC000013651301 FG Annotated Anodyne COc1ccc(OC)c2c1C(=O)C(Cl)=C(Oc1cccc(O)c1)C2=O ZINC000013652347 FG Annotated Mild CCN1Cc2cc(OC)c(OC)cc2[C@@H]2[C@H]1c1cc3c(cc1[C@@H]2O)OCO3 ZINC000013652372 FG Annotated Anodyne CCO[C@H]1OC(C(N)=O)=C[C@@H](c2csc3ccccc23)[C@@H]1CCCO ZINC000013656540 FG Annotated Anodyne COc1ccc([C@H]2C=C(C(=O)O)O[C@@H](OCc3ccc(CO)cc3)C2)cc1 ZINC000013657261 FG Annotated Anodyne CCO[C@H]1OC(C(=O)NC2CC2)=C[C@@H](C2CCCCC2)[C@@H]1CCCO ZINC000013657281 FG Annotated Anodyne CC(C)(C)[C@@H]1C=C(C(=O)NC2CC2)O[C@H](OCc2ccc(CO)cc2)C1 ZINC000013657315 FG Annotated Anodyne O=C(O)C1=C[C@H](c2ccc(F)cc2)C[C@H](OCc2ccc(CO)cc2)O1 ZINC000013657341 FG Annotated Anodyne CC(C)(C)[C@H]1C=C(C(=O)NC2CC2)O[C@@H](OCc2ccc(CO)cc2)C1 ZINC000013657375 FG Annotated Anodyne C[C@@]1(c2nnc(-c3ccncc3)o2)CC(c2ccc([N+](=O)[O-])cc2)=NO1 ZINC000013657582 FG Annotated Bother C[C@]1(c2nnc(-c3ccncc3)o2)CC(c2ccc([N+](=O)[O-])cc2)=NO1 ZINC000013657584 FG Annotated Bother Cc1cc(-c2cc(C(=O)NC3CCCC3)on2)nc(NC2CCCC2)n1 ZINC000013657598 FG Annotated Anodyne CO/C(O)=C1\CSC\C1=N/c1ccccc1NC(=O)CCCC(=O)O ZINC000013657762 FG Annotated Mild CCCNc1nc(C)cc(-c2cc(C(=O)NCc3ccccc3)on2)n1 ZINC000013660308 FG Annotated Anodyne O=C1c2cc(F)ccc2OC2(CCNCC2)[C@@]12CC(c1ccccc1)=NO2 ZINC000013660429 FG Annotated Anodyne O=C1c2cc(F)ccc2OC2(CCNCC2)[C@]12CC(c1ccccc1)=NO2 ZINC000013660432 FG Annotated Anodyne CN1[C@@H](C(=O)NCC2CC2)C[C@@H]2Cn3c(nc4cc5ccccc5cc43)[C@@H]21 ZINC000013660777 FG Annotated Anodyne CN1[C@H](C(=O)NCC2CC2)C[C@@H]2Cn3c(nc4cc5ccccc5cc43)[C@@H]21 ZINC000013660780 FG Annotated Anodyne COc1ccc(SC[C@H](CC(C)C)N2CCN(C)CCC2=O)cc1 ZINC000013661822 FG Annotated Anodyne O=C1NC[C@@H](Cc2cccc3ccccc23)N(CC2CCCCC2)C1=O ZINC000013662246 FG Annotated Anodyne CC(C)(C)c1ccc(CNC(=S)NCc2ccc3[nH]nnc3c2)cc1 ZINC000013672890 FG Annotated Anodyne CCc1c2s[nH]c(=O)c2c(=O)n2ccc(-c3cc(C)nc(C)c3)cc12 ZINC000013678287 FG Annotated Anodyne COc1ccc(C[C@H]2c3cc(OC)c(OC)c(OC)c3CCN2C)cc1 ZINC000013724730 FG Annotated Anodyne COc1ccc(C[C@@H]2c3cc(OC)c(OC)c(OC)c3CCN2C)cc1 ZINC000013724732 FG Annotated Anodyne O=C(CCCCc1ccc2nc3[nH]c(=O)[nH]c3cc2c1)N1CCCCC1 ZINC000013725792 FG Annotated Anodyne CN1C(NC#N)=NC(=O)/C1=C/c1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1 ZINC000013734196 FG Annotated Anodyne COc1cc(CCNCc2ccc(N)cc2)c(OC)cc1Br ZINC000013737385 FG Annotated Clean CCN(CC)CCOCCOC(=O)C1(c2ccc(OC)cc2)CCCC1 ZINC000013737818 FG Annotated Anodyne O=C1CCCc2sc(CC(=O)N3CCCC[C@H]3CN3CCCC3)cc21 ZINC000013738794 FG Annotated Anodyne CC(C)N(C)C[C@@H]1CCCCN1C(=O)Cc1ccc2c(c1)CCCC2=O ZINC000013738798 FG Annotated Anodyne N=C(N)c1ccc(-c2ccc(C3=CC[C@@](O)(CC(=O)O)CC3)cc2)cc1 ZINC000013739725 FG Annotated Anodyne N=C(N)c1ccc(-c2ccc(C3=CC[C@](O)(CC(=O)O)CC3)cc2)cc1 ZINC000013739726 FG Annotated Anodyne N/C(=N\O)c1ccc(-c2ccc(C3=CC[C@@](O)(CC(=O)O)CC3)cc2)cc1 ZINC000013739731 FG Annotated Mild N/C(=N\O)c1ccc(-c2ccc(C3=CC[C@](O)(CC(=O)O)CC3)cc2)cc1 ZINC000013739732 FG Annotated Mild N/C(=N/N=C/c1c[nH]c2ccc(O)cc12)NCCc1ccccc1Cl ZINC000013741835 FG Annotated Mild N/C(=N/N=C/c1c[nH]c2ccc(O)cc12)NCCc1ccc(Cl)cc1 ZINC000013741836 FG Annotated Mild Fc1cccc2c1C[C@@H]2CN1CCN(c2cccc3c2OCCO3)CC1 ZINC000013743685 FG Annotated Anodyne Fc1cccc2c1C[C@H]2CN1CCN(c2cccc3c2OCCO3)CC1 ZINC000013743686 FG Annotated Anodyne CS(=O)(=O)Nc1cc2c(cc1Sc1ccccc1F)C(=O)CC2 ZINC000013744773 FG Annotated Anodyne COc1ccc(Sc2cc3c(cc2NS(C)(=O)=O)CCC3=O)cc1 ZINC000013744808 FG Annotated Anodyne CCc1nc(-c2ncn3c2CN(C(=O)N2CCCC2)c2ccccc2-3)no1 ZINC000013745333 FG Annotated Anodyne CN(C)c1ccccc1C[S@@](=O)c1nc2c(n1-c1ccccn1)CCC2 ZINC000013746057 FG Annotated Anodyne CN(C)c1ccccc1C[S@](=O)c1nc2c(n1-c1ccccn1)CCC2 ZINC000013746059 FG Annotated Anodyne CN(C)c1ccccc1C[S@@](=O)c1nccn1-c1ccc(Cl)cn1 ZINC000013746129 FG Annotated Anodyne CN(C)c1ccccc1C[S@](=O)c1nccn1-c1ccc(Cl)cn1 ZINC000013746131 FG Annotated Anodyne Cc1cc(C)nc(-n2ccnc2[S@](=O)Cc2ccccc2N(C)C)c1 ZINC000013746153 FG Annotated Anodyne Cc1cc(C)nc(-n2ccnc2[S@@](=O)Cc2ccccc2N(C)C)c1 ZINC000013746155 FG Annotated Anodyne CCN(CC)c1ccccc1C[S@@](=O)c1nccn1-c1ccccn1 ZINC000013746173 FG Annotated Anodyne CCN(CC)c1ccccc1C[S@](=O)c1nccn1-c1ccccn1 ZINC000013746175 FG Annotated Anodyne CCNc1ccccc1C[S@@](=O)c1nccn1-c1ncccc1OC ZINC000013746200 FG Annotated Anodyne CCNc1ccccc1C[S@](=O)c1nccn1-c1ncccc1OC ZINC000013746202 FG Annotated Anodyne CNc1ccccc1C[S@@](=O)c1nc2c(n1-c1ncccc1C)CCC2 ZINC000013746208 FG Annotated Anodyne CNc1ccccc1C[S@](=O)c1nc2c(n1-c1ncccc1C)CCC2 ZINC000013746210 FG Annotated Anodyne CCCOc1ccccc1-c1nc2c(c(C)nn2CC(F)(F)F)c(=O)[nH]1 ZINC000013755570 FG Annotated Anodyne CCCC[C@@H](Sc1nc(S)c2cnn(-c3ccccc3)c2n1)C(N)=O ZINC000013759698 FG Annotated Anodyne CCCC[C@H](Sc1nc(S)c2cnn(-c3ccccc3)c2n1)C(N)=O ZINC000013759699 FG Annotated Anodyne CSc1nc(S[C@H](C(N)=O)C(C)C)nc2c1cnn2-c1ccccc1 ZINC000013759702 FG Annotated Anodyne CSc1nc(S[C@@H](C(N)=O)C(C)C)nc2c1cnn2-c1ccccc1 ZINC000013759703 FG Annotated Anodyne CCC[C@@H](Sc1nc(SC)c2cnn(-c3ccccc3)c2n1)C(N)=O ZINC000013759704 FG Annotated Anodyne CCC[C@H](Sc1nc(SC)c2cnn(-c3ccccc3)c2n1)C(N)=O ZINC000013759705 FG Annotated Anodyne N#Cc1ccc(F)c(CCNC(=S)Nc2ccc(Cl)cn2)c1F ZINC000013759854 FG Annotated Mild in-vivo CO/N=C(/c1ccccc1)c1ccc(NC(=O)[C@@](C)(O)C(F)(F)F)cc1 ZINC000013760199 FG Annotated Mild CO/N=C(/c1ccccc1)c1ccc(NC(=O)[C@](C)(O)C(F)(F)F)cc1 ZINC000013760200 FG Annotated Mild C[C@@](O)(C(=O)Nc1ccc(C(=O)c2ccccc2F)cc1)C(F)(F)F ZINC000013760204 FG Annotated Anodyne C[C@](O)(C(=O)Nc1ccc(C(=O)c2ccccc2F)cc1)C(F)(F)F ZINC000013760205 FG Annotated Anodyne C[C@@](O)(C(=O)Nc1ccc(C(=O)c2ccc(F)cc2)cc1)C(F)(F)F ZINC000013760208 FG Annotated Anodyne C[C@](O)(C(=O)Nc1ccc(C(=O)c2ccc(F)cc2)cc1)C(F)(F)F ZINC000013760209 FG Annotated Anodyne C[C@](O)(C(=O)Nc1ccc(C(=O)c2ccccc2)cc1C#N)C(F)(F)F ZINC000013760210 FG Annotated Mild CC1(C)CC(=O)N2Cc3c(-c4noc(C5CC5)n4)ncn3-c3cccc1c32 ZINC000013760368 FG Annotated Anodyne CNC(=O)Oc1ccc2c(c1)[C@]1(C)CCN(C)[C@@H]1N2Cc1ccccc1 ZINC000013765002 FG Annotated Anodyne CNC(=O)Oc1ccc2c(c1)[C@@]1(C)CCN(C)[C@H]1N2Cc1ccccc1 ZINC000013765005 FG Annotated Anodyne N#Cc1cccc(-c2cc(-c3cccc(C#N)c3)c(O)c(=O)c(O)c2O)c1 ZINC000013775901 FG Annotated Mild CCc1c(Sc2cc(C)cc(C)c2)n(COCCO)c(=S)[nH]c1=O ZINC000013775991 FG Annotated Anodyne Cc1ccc(S(=O)(=O)/N=c2/[nH]c(-c3ccc(O)c(C)c3)cs2)cc1 ZINC000013776367 FG Annotated Anodyne CCC(C)(C)/N=C(\NC#N)Nc1ccc(I)cc1 ZINC000013777072 FG Annotated Mild O=S1(=O)c2ccccc2Oc2cccc(I)c21 ZINC000013779766 FG Annotated Anodyne CNC(=O)Oc1ccc2c(c1)[C@]1(C)CCN(C)[C@H]1N2Cc1ccccc1 ZINC000013779947 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3=CCOC3=O)[C@@H](CO)CC[C@@H]12 ZINC000013780190 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@@]2(C)[C@H]1CC[C@]1(CO1)[C@@H]2CCC1=CCOC1=O ZINC000013780191 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3=CCOC3=O)[C@@H](O)CC[C@@H]12 ZINC000013780193 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@]2(C)C(CCC3=CCOC3=O)=C(CO)CC[C@@H]12 ZINC000013780196 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CC[C@@H]3CCOC3=O)C(=O)CC[C@@H]12 ZINC000013780204 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CC[C@H]3CCOC3=O)C(=O)CC[C@@H]12 ZINC000013780205 FG Annotated Anodyne O=C1CCOc2c(OCCNCCCCc3ccc(O)cc3)cc(F)cc21 ZINC000013780393 FG Annotated Anodyne COc1ccc(CCNCCC[C@@H]2CNc3ccccc3O2)cc1OC ZINC000013780754 FG Annotated Anodyne COc1ccc(CCNCCC[C@H]2CNc3ccccc3O2)cc1OC ZINC000013780755 FG Annotated Anodyne CCOC(=O)OC[C@@H]1O[C@H](C#CC(C)(C)C)C=C[C@@H]1OC(=O)OCC ZINC000013783029 FG Annotated Mild CCOC(=O)OC[C@H]1O[C@H](C#CC(C)(C)C)C=C[C@@H]1OC(=O)OCC ZINC000013783030 FG Annotated Mild CCOC(=O)OC[C@@H]1O[C@H](C#Cc2ccccc2)C=C[C@@H]1OC(=O)OCC ZINC000013783110 FG Annotated Mild CCOC(=O)OC[C@H]1O[C@H](C#Cc2ccccc2)C=C[C@@H]1OC(=O)OCC ZINC000013783111 FG Annotated Mild CCOC(=O)OC[C@@H]1O[C@H](c2ccccc2)C=C[C@@H]1OC(=O)OCC ZINC000013783112 FG Annotated Anodyne CCOC(=O)OC[C@H]1O[C@H](c2ccccc2)C=C[C@@H]1OC(=O)OCC ZINC000013783113 FG Annotated Anodyne CC(=O)OC[C@@H]1O[C@H](C#Cc2ccc(C(C)(C)C)cc2)C=C[C@@H]1OC(C)=O ZINC000013783118 FG Annotated Mild CC(=O)OC[C@H]1O[C@H](C#Cc2ccc(C(C)(C)C)cc2)C=C[C@@H]1OC(C)=O ZINC000013783119 FG Annotated Mild COc1ccc(C#C[C@H]2C=C[C@H](Oc3cc(C)cc(C)c3)[C@H](CO)O2)cc1 ZINC000013783150 FG Annotated Mild COc1ccc(C#C[C@@H]2C=C[C@H](Oc3cc(C)cc(C)c3)[C@H](CO)O2)cc1 ZINC000013783151 FG Annotated Mild OC[C@H]1O[C@@H](/C=C\c2ccccc2)C=C[C@@H]1Oc1ccc2c(c1)OCO2 ZINC000013783160 FG Annotated Anodyne OC[C@H]1O[C@H](/C=C\c2ccccc2)C=C[C@@H]1Oc1ccc2c(c1)OCO2 ZINC000013783161 FG Annotated Anodyne Clc1cccc(C#CCSc2nsnc2C23CN4C[C@H]2[C@H]3C4)c1 ZINC000013798034 FG Annotated Mild Clc1ccc(C#CCSc2nsnc2C23CN4C[C@H]2[C@H]3C4)cc1 ZINC000013798040 FG Annotated Mild O=C(O)CCNC(=O)c1cc2sc(CCC3CCNCC3)cc2s1 ZINC000013798407 FG Annotated Anodyne Nc1ccc(C#CCCN2CCC(O)(Cc3ccc(F)cc3)CC2)cc1 ZINC000013798589 FG Annotated Mild N=C(N)c1ccc(/C=C2/CCC/C(=C\c3ccc(C(=N)N)cc3)C2=O)cc1 ZINC000013803380 FG Annotated Mild N=C(N)c1ccc(/C=C2/CCC/C(=C/c3ccc(C(=N)N)cc3)C2=O)cc1 ZINC000013803385 FG Annotated Mild O=C1CN=C(c2ccccc2[N+](=O)[O-])c2cc(Br)ccc2N1 ZINC000013803743 FG Annotated Bother COc1cc(/N=c2\c(O)c(O)\c2=N/[C@@H](C)C(C)(C)C)c2ncccc2c1 ZINC000013806349 FG Annotated Anodyne COc1cc(/N=c2\c(O)c(O)\c2=N/[C@H](C)C(C)(C)C)c2ncccc2c1 ZINC000013806351 FG Annotated Anodyne C[C@@H](/N=c1\c(O)c(O)\c1=N/c1ccc(Br)cc1)C(C)(C)C ZINC000013806363 FG Annotated Anodyne C[C@H](/N=c1\c(O)c(O)\c1=N/c1ccc(Br)cc1)C(C)(C)C ZINC000013806366 FG Annotated Anodyne C[C@@H](/N=c1\c(O)c(O)\c1=N/c1ccc(OC(F)(F)F)cc1)C(C)(C)C ZINC000013806380 FG Annotated Anodyne C[C@H](/N=c1\c(O)c(O)\c1=N/c1ccc(OC(F)(F)F)cc1)C(C)(C)C ZINC000013806382 FG Annotated Anodyne C[C@@H](/N=c1\c(O)c(O)\c1=N/c1ccc(C#N)c2c1CCCC2)C(C)(C)C ZINC000013806496 FG Annotated Mild C[C@]12CC[C@@](C)(O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1CCCN2C(=O)CO ZINC000013812910 FG Annotated Anodyne CC[C@@]12CCCN3CC[C@]4(c5ccc(OC)c(O)c5N(C(C)=O)[C@@H]4CC1)[C@@H]32 ZINC000013813057 FG Annotated Anodyne CC(=O)N1Cc2ccccc2N(Cc2c[nH]cn2)C[C@@H]1Cc1ccccc1 ZINC000013813357 FG Annotated Anodyne CC(=O)N1Cc2ccccc2N(Cc2c[nH]cn2)C[C@H]1Cc1ccccc1 ZINC000013813361 FG Annotated Anodyne COc1cc(OC)c2c(c1)OC(=O)C[C@@H]2c1cc(OC)c(OC)c(OC)c1 ZINC000013813551 FG Annotated Anodyne COc1cc(OC)c2c(c1)OC(=O)C[C@H]2c1cc(OC)c(OC)c(OC)c1 ZINC000013813553 FG Annotated Anodyne CC[C@@H]1C(c2ccccc2)=NN(c2ccccc2)[C@H]1C(=O)N1CCOC1=O ZINC000013813589 FG Annotated Anodyne C[C@@H]1C(c2ccc(F)cc2)=NN(c2ccccc2)[C@H]1C(=O)N1CCOC1=O ZINC000013814153 FG Annotated Anodyne CCOC(=O)[C@@H]1Oc2ccccc2C(c2ccc(C)cc2)=C1C(=O)OC ZINC000013814265 FG Annotated Anodyne CCOC(=O)[C@H]1Oc2ccccc2C(c2ccc(C)cc2)=C1C(=O)OC ZINC000013814269 FG Annotated Anodyne Cc1cccc(C2=NN(c3ccccc3)[C@@H](C(=O)N3CCOC3=O)[C@@H]2C)c1 ZINC000013814300 FG Annotated Anodyne CCOC(=O)[C@@H]1Oc2ccccc2C(c2ccc(F)cc2)=C1C(=O)OC ZINC000013814317 FG Annotated Anodyne CCOC(=O)[C@H]1Oc2ccccc2C(c2ccc(F)cc2)=C1C(=O)OC ZINC000013814320 FG Annotated Anodyne C[C@@]1(OC(=O)c2ccco2)C(=O)C=C2C=C(c3ccsc3)OC=C2C1=O ZINC000013815652 FG Annotated Mild C[C@]1(OC(=O)c2ccco2)C(=O)C=C2C=C(c3ccsc3)OC=C2C1=O ZINC000013815655 FG Annotated Mild Nc1cc(C(F)(F)F)ccc1S(=O)(=O)Nc1cccc2c1NCCC2 ZINC000013815908 FG Annotated Anodyne COCCN1C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)[C@H](C(C)=O)[C@H]1C ZINC000013816474 FG Annotated Anodyne CCCCc1nc2c(c3c1C[C@H](C)OC3)CN(C(=O)c1cccnc1)CC2 ZINC000013817529 FG Annotated Anodyne CC(C)Oc1ccc(-c2cc(NC[C@@H](O)CO)c3ccccc3n2)cc1 ZINC000013818391 FG Annotated Anodyne CC(C)Oc1ccc(-c2cc(NC[C@H](O)CO)c3ccccc3n2)cc1 ZINC000013818394 FG Annotated Anodyne CCCCS(=O)(=O)N1CCC[C@@H]2CN3CCc4ccccc4[C@@H]3C[C@@H]21 ZINC000013820209 FG Annotated Anodyne CCCCS(=O)(=O)N1CCC[C@H]2CN3CCc4ccccc4[C@@H]3C[C@H]21 ZINC000013820211 FG Annotated Anodyne CCCCS(=O)(=O)N1CCC[C@H]2CN3CCc4ccccc4[C@@H]3C[C@@H]21 ZINC000013820213 FG Annotated Anodyne CCOC(=O)Cc1c(C(=O)OCCCN(C)C)[nH]c2cc(Cl)ccc12 ZINC000013821258 FG Annotated Anodyne CCn1c(/C=C/C=C2\SCCN2C)[n+](CC)c2nc3ccccc3nc21 ZINC000013822045 FG Annotated Clean COc1ccc2c(C(=O)N(C)CC(=O)O)cc(C)cc2c1Br ZINC000013823588 FG Annotated Anodyne COc1c(C)cc2c(C(=O)N(C)CC(=O)O)cccc2c1Br ZINC000013823601 FG Annotated Anodyne CN(C)C(=O)Cn1c(-c2ccc(Br)s2)nc2cccnc21 ZINC000013824801 FG Annotated Anodyne COc1ccc(COc2ccc(-c3nn(CCC#N)c(=O)o3)cc2)cc1 ZINC000013826695 FG Annotated Mild N#CCCN1N=C(c2ccc(OCc3ccc(Cl)cc3)cc2)OCC1=O ZINC000013826747 FG Annotated Mild Cc1noc(-c2ncn3c2CN(Cc2ccccc2)C(=O)c2ccccc2-3)n1 ZINC000013828210 FG Annotated Anodyne Cc1nnc(-c2ncn3c2CN(Cc2ccccc2)C(=O)c2ccccc2-3)o1 ZINC000013828213 FG Annotated Anodyne CN1C(=O)C[C@@]2(C=CC(=O)C=C2OC(=O)c2ccccc2)c2ccccc21 ZINC000013828762 FG Annotated Mild CN1C(=O)C[C@]2(C=CC(=O)C=C2OC(=O)c2ccccc2)c2ccccc21 ZINC000013828764 FG Annotated Mild COCCNC(=O)[C@@]1(C(F)(F)F)C/C(=C\Cc2ccccc2)CCCO1 ZINC000013829100 FG Annotated Anodyne COCCNC(=O)[C@]1(C(F)(F)F)C/C(=C\Cc2ccccc2)CCCO1 ZINC000013829103 FG Annotated Anodyne O=C(NCc1ccccc1)[C@]1(C(F)(F)F)C[C@H](CCCO)CCCO1 ZINC000013829112 FG Annotated Anodyne O=C(NCc1ccccc1)[C@]1(C(F)(F)F)C[C@@H](CCCO)CCCO1 ZINC000013829114 FG Annotated Anodyne O=C(NCc1ccccc1)[C@@]1(C(F)(F)F)C[C@H](CCCO)CCCO1 ZINC000013829116 FG Annotated Anodyne O=C(NCc1ccccc1)[C@@]1(C(F)(F)F)C[C@@H](CCCO)CCCO1 ZINC000013829118 FG Annotated Anodyne CCC[C@@H]1CCCO[C@@](C(=O)NCc2cc(C)n(C)n2)(C(F)(F)F)C1 ZINC000013829130 FG Annotated Anodyne Cc1ccc(CNC(=O)[C@@]2(C(F)(F)F)C/C(=C\CCO)CCCO2)o1 ZINC000013829187 FG Annotated Anodyne Cc1ccc(CNC(=O)[C@]2(C(F)(F)F)C/C(=C\CCO)CCCO2)o1 ZINC000013829189 FG Annotated Anodyne O=C(NCc1ccccc1)[C@]1(C(F)(F)F)C/C(=C\CCO)CCCO1 ZINC000013829230 FG Annotated Anodyne O=C(NCc1ccccc1)[C@@]1(C(F)(F)F)C/C(=C\CCO)CCCO1 ZINC000013829232 FG Annotated Anodyne O=C(NCc1ccccc1)[C@]1(C(F)(F)F)C/C(=C/CCO)CCCO1 ZINC000013829234 FG Annotated Anodyne O=C(NCc1ccccc1)[C@@]1(C(F)(F)F)C/C(=C/CCO)CCCO1 ZINC000013829236 FG Annotated Anodyne CCCN1CCC(=O)N(CCSc2ccc(Br)cc2)CC1 ZINC000013829929 FG Annotated Anodyne COc1ccc(SC[C@@H](CC(C)C)N2CCN(C)CCC2=O)cc1 ZINC000013830512 FG Annotated Anodyne CC(C)COC(=O)N1[C@@H](COCc2ccccc2)CCC=CS1(=O)=O ZINC000013830844 FG Annotated Anodyne CC(C)COC(=O)N1[C@H](COCc2ccccc2)CCC=CS1(=O)=O ZINC000013830845 FG Annotated Anodyne C=C(C)[C@@H]1c2cc(C(=O)OC)c(o2)C[C@@H](C(=C)C)[C@H]2O[C@H]2C2=C[C@H]1OC2=O ZINC000013831509 FG Annotated Mild CC1(C)C(=O)c2cc(Cl)c(Cl)cc2[C@@H](n2ccccc2=O)[C@@H]1O ZINC000013832149 FG Annotated Anodyne COc1cc(/C=C(\C#N)C(N)=O)cc(CSc2ccc(C)cc2)c1O ZINC000013833845 FG Annotated Reactive COc1cc(C=C(C#N)C#N)cc(CS(=O)(=O)c2ccc(C)cc2)c1O ZINC000013833858 FG Annotated Reactive O=C(Cc1ccc(Br)cc1)N1CCCC[C@H]1CN1CCCC1 ZINC000013861044 FG Annotated Anodyne Cc1nc2cccc(Cl)c2c(N)c1CN[C@@]1(C(F)(F)F)CCC(=O)O1 ZINC000013864115 FG Annotated Anodyne Cc1nc2cccc(Cl)c2c(N)c1CN[C@]1(C(F)(F)F)CCC(=O)O1 ZINC000013864116 FG Annotated Anodyne CCCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(N)cc1 ZINC000013864520 FG Annotated Anodyne CC(C)N(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(N)cc1 ZINC000013864521 FG Annotated Anodyne CCCCN(c1ccnn1-c1ccccc1)S(=O)(=O)c1ccc(N)cc1 ZINC000013864522 FG Annotated Anodyne C=CCc1ccc(S(=O)(=O)N(C)c2ccnn2-c2ccccc2)cc1 ZINC000013864533 FG Annotated Mild Cc1ncc(CO)c(/C=N/NC(=S)Nc2ccc(C(C)C)cc2)c1O ZINC000013878641 FG Annotated Mild O=C(CNC(=S)N(Cc1ccccc1F)C1CCCCC1)NC1CC1 ZINC000013879175 FG Annotated Anodyne O=C(O)Cc1ccc2c(c1)[C@H]1C[C@@H](O)[C@H](/C=C\[C@@H](O)C3CCCCC3)[C@H]1C2 ZINC000013899153 FG Annotated Anodyne CC[C@H](C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)[C@@](C)(O)[C@@H](O)[C@@H]2CO1 ZINC000013905025 FG Annotated Mild C[C@](O)(C(=O)Nc1cccc2c1C(=O)c1sccc1CO2)C(F)(F)F ZINC000013910821 FG Annotated Anodyne CCCN1C(=O)N2CCN=C2c2[nH]c(-c3ccc(Br)cc3)nc21 ZINC000013912143 FG Annotated Anodyne CN1CCO[C@](OCCCO[N+](=O)[O-])(c2ccc(-c3ccccc3)cc2)C1 ZINC000013973732 FG Annotated Anodyne CC[C@@H](c1ccc(F)c(F)c1)n1c(C(=O)OC)c(C(=O)OC)[nH]c1=S ZINC000013977431 FG Annotated Anodyne Nc1ccc(C(=O)NCc2ccc(Oc3ccc(F)cc3)s2)c(N)n1 ZINC000013981409 FG Annotated Anodyne C[C@H]1O[C@@H](n2c(Cl)c(C=O)c3cc(Cl)c(Cl)cc32)[C@H](O)[C@@H]1O ZINC000013981787 FG Annotated Anodyne N[C@H](C(=O)N1CC(c2cc(F)ccc2F)=C[C@H]1c1cccc(O)c1)C1CC1 ZINC000013982379 FG Annotated Anodyne Cn1c(=O)c(Nc2ccc(C(=O)NCc3ccco3)cc2)nc2ccccc21 ZINC000013982629 FG Annotated Anodyne CCCN1Cc2cc(-c3nnn(-c4cccnc4F)c3C)ccc2C1=O ZINC000013983190 FG Annotated Anodyne CCS(=O)(=O)C[C@](C)(O)c1[nH]c2cc(C(F)(F)F)c(C#N)cc2c1C ZINC000013986390 FG Annotated Mild CC[C@H](C)NC(=O)C1=CNN2C1=N[C@H](c1cccs1)C[C@H]2C(F)(F)F ZINC000135673438 FG Annotated Anodyne C=CCOC(=O)C1=C(C)N=C(C)[C@@H](C(=O)OCC=C)[C@@H]1c1ccc(O)cc1 ZINC000135720877 FG Annotated Mild C=CCOC(=O)C1=C(C)N=C(C)[C@H](C(=O)OCC=C)[C@@H]1c1ccc(O)cc1 ZINC000135720904 FG Annotated Mild COc1cc(-c2oc3c(OC)cc(CCCO)cc3c2CO)ccc1O ZINC000135913889 FG Annotated Anodyne CC(/C=C/C=O)=C1\C(=O)C[C@@H]2[C@]1(C)CC[C@H]1[C@@](C)(CO)[C@H](O)CC[C@]21C ZINC000135921692 FG Annotated Reactive OCCSc1nc2c(Br)cc(Br)cc2[nH]1 ZINC000136006876 FG Annotated Anodyne Cc1ccc(OCC(=O)NC2=C/C(=C3/Nc4ccccc4O3)C(=O)C=C2)cc1 ZINC000136132393 FG Annotated Mild CCC[C@H]1[C@@H]2C(=O)N(c3ccccc3OC)C(=O)[C@@H]2ON1c1ccccc1 ZINC000136262990 FG Annotated Anodyne COC(=O)[C@@]1(C)CC(=O)C=C2[C@@](C)(CC(=O)c3ccoc3)[C@H](C)CC[C@]21O ZINC000136366165 FG Annotated Mild C[C@@H]1CCC[C@@H](C)N1C(=O)CSC1=NN/C(=C2\C=Nc3ccccc32)O1 ZINC000136406351 FG Annotated Anodyne COC/C=C(C)/C=C/[C@H]1[C@](C)(O)[C@@H](O)[C@H](O)[C@H]2C(C)(C)CCC[C@@]21C ZINC000136435940 FG Annotated Anodyne CC(/C=C/C=O)=C1\C(=O)C[C@@H]2[C@]1(C)CC[C@@H]1[C@]2(C)CC[C@@H](O)[C@]1(C)C(=O)O ZINC000136492050 FG Annotated Reactive COc1ccc(C2=C(O)[C@@H](O)c3cc(OC)c(OC)cc3O2)cc1OC ZINC000136687336 FG Annotated Anodyne CC1=CC(NC(=O)c2cccs2)=C/C(=C2/Nc3ncccc3O2)C1=O ZINC000136729506 FG Annotated Mild C[C@H]1CCC[C@H](C)N1C(=O)CSC1=NN/C(=C2\C=Nc3ccccc32)O1 ZINC000136751107 FG Annotated Anodyne C[C@H]1CCC[C@@H](C)N1C(=O)CSC1=NN/C(=C2\C=Nc3ccccc32)O1 ZINC000136872002 FG Annotated Anodyne COC/C=C(C)\C=C\[C@H]1[C@](C)(O)[C@@H](O)[C@H](O)[C@H]2C(C)(C)CCC[C@@]21C ZINC000136931072 FG Annotated Anodyne COc1c(O)c2c(c(O)c1C(C)C)C(=O)C[C@H]1[C@]3(C)CCC[C@]21COC3=O ZINC000137057153 FG Annotated Anodyne C[C@@H]1[C@@H](C)C(=O)c2ccc3c(c2[C@H]1c1cc2c(cc1O)OCO2)OCO3 ZINC000137470937 FG Annotated Anodyne C=C1C(=O)O[C@H]2C(=O)[C@H](C)CCC[C@](C)(OO)/C=C\C[C@@]3(C)O[C@@H]3C[C@@H]12 ZINC000137478575 FG Annotated Reactive CCC[C@H]1[C@@H]2C(=O)N(c3cccc(C)c3)C(=O)[C@@H]2ON1c1ccccc1 ZINC000137586429 FG Annotated Anodyne COC(=O)c1c[nH]n2c(NC3CCCC3)c(-c3cccc(OC)c3)nc12 ZINC000137671063 FG Annotated Anodyne O=C1[C@@H]2[C@@H](C(=O)N1CCCO)[C@H](c1ccccc1)C=C[C@H]2c1ccccc1 ZINC000137711222 FG Annotated Anodyne COC(=O)[C@H](C)CCC[C@@](C)(O)CCC1=C(C)C(=O)C(C)=C(C)C1=O ZINC000137724333 FG Annotated Mild NC(=O)c1ccc[n+](CCCCCCCCN2C=CC(=CN=O)C=C2)c1 ZINC000137754809 FG Annotated Anodyne NC(=O)c1cc[n+](CCCCCCCCN2C=CC(=CN=O)C=C2)cc1 ZINC000137759206 FG Annotated Anodyne CCOC(=O)c1cc(C)sc1-n1[nH]c2c(cnc3ccccc32)c1=O ZINC000137878140 FG Annotated Anodyne Cc1ccc(C(=O)C[C@@H](C(=O)c2ccc(C)cc2)[C@@H]2C(=N)ON=C2N)cc1 ZINC000137934924 FG Annotated Anodyne Cc1ccc(C(=O)C[C@H](C(=O)c2ccc(C)cc2)[C@@H]2C(=N)ON=C2N)cc1 ZINC000137935045 FG Annotated Anodyne CC/C(C)=C/C(=O)O[C@H]1[C@@H](O)C[C@@H]2C[C@@H]3OC(=O)C(C)=C3C[C@]2(C)[C@H]1C ZINC000137957038 FG Annotated Anodyne C/C=C(/C)C(=O)O[C@H]1CCC2=C[C@@H]3OC(=O)C(C)=C3[C@@H](OC)[C@]2(C)[C@H]1C ZINC000138018012 FG Annotated Anodyne COC(=O)/C(=C/c1ccc(OC)c(OC)c1)c1ccc(OC)c(OC)c1 ZINC000138025767 FG Annotated Anodyne C=C1C(=O)O[C@]2(C)CC[C@@H]1C[C@@H]1O[C@@]1(C)C/C=C/[C@@](C)(OO)CCC2=O ZINC000138030291 FG Annotated Reactive C/C=C1/CN2[C@H]3C[C@@H]1[C@]1(C(=O)OC)CO[C@H](c4c3n(C)c3ccccc43)[C@H]21 ZINC000138032619 FG Annotated Anodyne Cc1[nH]n(-c2ccccn2)c(=O)c1C(=O)Nc1ccccc1C(F)(F)F ZINC000138107731 FG Annotated Anodyne CO[C@H]1C[C@@]2(CC[C@@]3(O2)[C@H](C)C[C@H]2OC(=O)[C@@]4(C)CCC[C@@]3(C)[C@@H]24)CO1 ZINC000138116105 FG Annotated Anodyne C=C1C[C@]23C[C@H]1CC[C@H]2[C@]1(C=O)CCC[C@@](C)(C(=O)OC)[C@H]1[C@@H]3C(=O)OC ZINC000138200977 FG Annotated Mild O=NC=C1C=CN(COC/C=C\COCN2C=CC(=CN=O)C=C2)C=C1 ZINC000138401381 FG Annotated Anodyne CC[C@@H](C)C(=O)O[C@H]1C/C=C(\C)[C@@H](O)C[C@@H]2[C@@H](/C=C/1C)OC(=O)[C@@H]2C ZINC000138410738 FG Annotated Anodyne COc1ccc2[nH]cc([C@@]3(O)C(=O)Nc4ccc(Br)cc43)c2c1 ZINC000138436094 FG Annotated Anodyne CCC[C@@H]1C(C)=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)C(=O)C1=C(O)NC(=O)C1=O ZINC000138579372 FG Annotated Mild C=C1CC[C@H]2C(C)(C)C(=O)CC[C@]2(C)[C@H]1CC1=C(O)C(=O)C(CO)=CC1=O ZINC000138614874 FG Annotated Mild C=C1CC[C@H]2C(C)(C)[C@H](O)CC[C@]2(C)[C@H]1CC1=C(O)C(=O)C(CO)=CC1=O ZINC000138632774 FG Annotated Mild C=C1CC[C@H]2[C@@](C)(CO)CCC[C@]2(C)[C@H]1CC1=C(O)C(=O)C(CO)=CC1=O ZINC000138632917 FG Annotated Mild C/C=C/C1=CC2=C(CO1)C(=O)[C@]1(C)OC(=O)[C@H]([C@@H](O)CCCCC)[C@H]1C2 ZINC000138700349 FG Annotated Mild CCCOc1cc([S@](C)=O)cc2c(=O)c3cc(C(=O)O)ccc3oc12 ZINC000139015792 FG Annotated Bother CCCOc1cc([S@@](C)=O)cc2c(=O)c3cc(C(=O)O)ccc3oc12 ZINC000139015913 FG Annotated Bother CC(C)Oc1cc([S@](C)=O)cc2c(=O)c3cc(C(=O)O)ccc3oc12 ZINC000139016045 FG Annotated Bother CC(C)Oc1cc([S@@](C)=O)cc2c(=O)c3cc(C(=O)O)ccc3oc12 ZINC000139016171 FG Annotated Bother C=CCN1CC[C@H]2c3cccc(OS(=O)(=O)C(F)(F)F)c3CC[C@H]21 ZINC000139038250 FG Annotated Unstable CC(C)(C)NC(=O)[C@@H](c1ccsc1)N(C(=O)Cc1cccnc1)C1CC1 ZINC000139053295 FG Annotated Anodyne CC(C)(C)NC(=O)[C@H](c1ccsc1)N(C(=O)Cc1cccnc1)C1CC1 ZINC000139053391 FG Annotated Anodyne COc1c(C)c(O)c(C)c2c1C(=O)[C@H](Cc1ccc3c(c1)OCO3)CO2 ZINC000139118773 FG Annotated Anodyne Nc1ncc(-c2nccnc2Oc2ccc(Nc3ccccn3)cc2)cn1 ZINC000139313352 FG Annotated Anodyne COCCNC(=O)c1cccnc1Oc1ccc(Nc2ccccn2)cc1 ZINC000139347712 FG Annotated Anodyne N#Cc1c(-c2ccc(OC(F)(F)F)cc2)[n+](=O)c2ccc(F)cc2n1O ZINC000139362669 FG Annotated Mild N#Cc1c(-c2ccc(F)cc2)[n+](=O)c2ccc(C(F)(F)F)cc2n1O ZINC000139362777 FG Annotated Mild C=C(C)[C@H]1Cc2oc(cc2C(=O)OC)[C@H](C(=C)C)[C@H]2C=C(C(=O)O2)[C@H](O)C1 ZINC000139367851 FG Annotated Mild C=C1CC[C@@H]2C(=C)C(=O)O[C@H]2/C=C(/C)C[C@@H]2C=C(CC[C@H]1OO)C(=O)O2 ZINC000139407707 FG Annotated Reactive N#Cc1cc2c(cn1)[nH]c1ncc(-c3ccc(N4CCOCC4)cc3)cc12 ZINC000139424641 FG Annotated Anodyne CO[C@@]1(C)CC[C@@]23O[C@@H]1C[C@@]2(C)CC[C@@H]3[C@H](C)CO[C@@H]1CCC(=O)O1 ZINC000139480761 FG Annotated Anodyne NC1=N[C@@H](CCc2ccc(Nc3ccc(C(F)(F)F)cn3)cc2)CO1 ZINC000139695316 FG Annotated Anodyne Cc1ccc(-c2cnc3c(N4CCOC[C@@H]4C)nc(Cl)nc3n2)cc1 ZINC000139699527 FG Annotated Anodyne C[C@H](c1ccc2ncccc2c1)c1nnc2ccc(-c3cnn(C)c3)nn12 ZINC000139767477 FG Annotated Anodyne in-vivo C[C@@H]1CCCC[C@@H]1NC(=O)CCc1nc2sc3c(c2c(=O)[nH]1)CCCC3 ZINC000014084963 FG Annotated Anodyne C[C@H]1CCCC[C@@H]1NC(=O)CCc1nc2sc3c(c2c(=O)[nH]1)CCCC3 ZINC000014084965 FG Annotated Anodyne C[C@@H]1CCCC[C@H]1NC(=O)CCc1nc2sc3c(c2c(=O)[nH]1)CCCC3 ZINC000014084967 FG Annotated Anodyne C[C@H]1CCCC[C@H]1NC(=O)CCc1nc2sc3c(c2c(=O)[nH]1)CCCC3 ZINC000014084969 FG Annotated Anodyne Cc1c(-c2ccc3c(c2)CN(C(C)C)C3=O)nnn1-c1cccnc1F ZINC000014210660 FG Annotated Anodyne C=C(CO)[C@H]1C=C2C=C[C@@H]3C(C)(C)[C@@H](OC(C)=O)CC[C@@]3(C)[C@@H]2[C@@H](O)C1 ZINC000014410804 FG Annotated Mild in-vitro biogenic C=C[C@@](C)(CC/C=C(\C)CCC=C(C)C)S(=O)(=O)CCNC(=N)N ZINC000014415342 FG Annotated Mild COc1ccc2c3c(n(C)c2c1)[C@H]1C[C@H]2C(C(C)=O)=COC[C@@H]2[C@@H](C3)N1C ZINC000014417368 FG Annotated Mild COc1ccc2c(c1O)O[C@H](c1cc(OC)c(OC)c(OC)c1O)CC2 ZINC000014436000 FG Annotated Anodyne in-man COc1ccc2c(c1O)O[C@@H](c1cc(OC)c(OC)c(OC)c1O)CC2 ZINC000014436002 FG Annotated Anodyne in-man O=C1C=C[C@H](OC(=O)/C=C/c2ccccc2)[C@H]([C@@H]2O[C@@H]2c2ccccc2)O1 ZINC000014441547 FG Annotated Anodyne in-vitro biogenic O=C1C=C[C@H](OC(=O)/C=C/c2ccccc2)[C@H]([C@H]2O[C@@H]2c2ccccc2)O1 ZINC000014441551 FG Annotated Anodyne in-vitro biogenic COc1cc2c(c3c1OCO3)[C@](O)(c1ccc3c(c1)OCO3)[C@@H](C)[C@H](C)C2 ZINC000014488377 FG Annotated Anodyne COc1cc(-c2oc3c(OC)cc(CCCO)cc3c2C=O)cc(O)c1O ZINC000014488501 FG Annotated Clean CN1c2c(ccc3cc4c(cc23)OCO4)-c2ccc3c(c2[C@@H]1CO)OCO3 ZINC000014489740 FG Annotated Anodyne COC(=O)c1cc2c(c3c1c([N+](=O)[O-])cc1ccc(OC)cc13)OCO2 ZINC000014489982 FG Annotated Bother CC(=O)OC/C=C(\C)C[C@H]1C=C(CC/C=C(\C)COC(C)=O)C(=O)O1 ZINC000014498366 FG Annotated Anodyne C=C(C)[C@H]1Cc2oc(cc2C(=O)OC)[C@H](C(=C)C)[C@H]2C=C(C(=O)O2)[C@@H](O)C1 ZINC000140022907 FG Annotated Mild COC(=O)/C(=C\c1c(-c2ccccc2)[nH]c2ccccc12)S(C)(=O)=O ZINC000140044062 FG Annotated Anodyne C[C@]1(COc2cc(OC[C@]3(C)CO3)c3c(=O)c4ccccc4oc3c2)CO1 ZINC000140069085 FG Annotated Anodyne C[C@@]1(COc2cc(OC[C@]3(C)CO3)c3c(=O)c4ccccc4oc3c2)CO1 ZINC000140069219 FG Annotated Anodyne C[C@]1(COc2cc(OC[C@@]3(C)CO3)c3c(=O)c4ccccc4oc3c2)CO1 ZINC000140069383 FG Annotated Anodyne C[C@]1(COc2cc(OC[C@]3(C)CO3)cc3oc4ccccc4c(=O)c23)CO1 ZINC000140069524 FG Annotated Anodyne CS(=O)(=O)c1ccc2nccc(Nc3n[nH]c4ccc(F)cc34)c2c1 ZINC000140098690 FG Annotated Anodyne CN(C)c1ccc(-c2cncc(Cl)c2N2CCC(C(N)=O)CC2)cc1 ZINC000140116508 FG Annotated Anodyne O=C(CCCCCC(=O)N/N=C/c1ccc(-c2ccccc2)cc1)NO ZINC000140122970 FG Annotated Reactive O=C(c1nc2cccc(F)c2[nH]1)N1CC(c2nccnc2-c2ccccc2)C1 ZINC000140130369 FG Annotated Anodyne Cn1cc(-c2cc(F)c3nnc(Cc4ccc5ncc(O)cc5c4)n3c2)cn1 ZINC000140160648 FG Annotated Anodyne Nc1ccc(-c2nccnc2C2CN(c3ccc4ccccc4n3)C2)cn1 ZINC000140179832 FG Annotated Anodyne Nc1ccc(-c2nccnc2C2CN(c3ncc4ccccc4n3)C2)cc1F ZINC000140189977 FG Annotated Anodyne Nc1cncc(-c2nccnc2C2CN(c3ccc4ccccc4n3)C2)c1 ZINC000140191555 FG Annotated Anodyne C=C1CC[C@@H]2[C@](C)(COC(C)=O)[C@H](O)CC[C@@]2(C)[C@@H]1/C=C/C1=CCOC1=O ZINC000140354529 FG Annotated Mild COc1ccc2c(c1)CCN(C(=O)CNCC1(O)CCCCC1)[C@@H]2C(C)C ZINC000140370130 FG Annotated Anodyne C=C([C@@H]1C[C@@H](O)[C@]2(C)[C@H]3CC[C@@H](C)[C@H]3[C@H]12)[C@H]1O[C@@H]1/C=C(\C)COC(C)=O ZINC000140412089 FG Annotated Mild CCc1ccc2c(c1)[C@H](C1CCCCC1)N(C(=O)CNC[C@@H](C)O)CC2 ZINC000140423528 FG Annotated Anodyne CCc1ccc2c(c1)[C@@H](C1CCCCC1)N(C(=O)CNC[C@@H](C)O)CC2 ZINC000140423690 FG Annotated Anodyne CC(C)[C@@H]1c2ccc(F)cc2CCN1C(=O)CNCC1(O)CCCCC1 ZINC000140423866 FG Annotated Anodyne Cc1ccc2c(c1)CCN(C(=O)CNCC1(O)CCCCC1)[C@@H]2C(C)C ZINC000140424884 FG Annotated Anodyne Cc1ccc2c(c1)CCN(C(=O)CNCC1(O)CCCCC1)[C@H]2C(C)C ZINC000140425064 FG Annotated Anodyne CC1(C)[C@@H](Br)[C@@H](O)C[C@]2(O)C[C@]3(C)CC[C@]12C[C@@H]3Cl ZINC000140462107 FG Annotated Reactive Oc1cc(O)cc(Oc2c(O)cc(O)cc2Oc2cc(O)c(O)c(O)c2)c1 ZINC000140490736 FG Annotated Clean C=C(C)[C@H]1Cc2oc(cc2C(=O)OC)[C@H](C(=C)C)[C@H]2C=C(CC1=O)C(=O)O2 ZINC000140519964 FG Annotated Mild COC(=O)/C1=C\CCC2=C[C@@H](C/C(C)=C/C=C(/C(C)C)C[C@@H]1O)OC2=O ZINC000140577975 FG Annotated Anodyne CC(C)=CC(=O)C/C(C)=C/CC/C(C)=C/CC[C@@H]1C(=O)O[C@H](O)[C@H]1O ZINC000140598947 FG Annotated Mild COC1CCC2(CC1)Cc1ccc(CC(C)C)cc1[C@]21N=C(N)N(C)O1 ZINC000141079828 FG Annotated Anodyne COC1CCC2(CC1)Cc1ccc(CC(C)C)cc1[C@@]21N=C(N)N(C)O1 ZINC000141080015 FG Annotated Anodyne C/C1=C\CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)[C@@H](CNCc3ccc(N)cc3)[C@@H]2CC1 ZINC000141168219 FG Annotated Clean C/C1=C\CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)[C@@H](CNCc3cccnc3)[C@@H]2CC1 ZINC000141168635 FG Annotated Anodyne C/C1=C\CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)[C@@H](CNCCc3ccccn3)[C@@H]2CC1 ZINC000141171354 FG Annotated Anodyne CCc1ccc2c(c1)[C@]1(N=C(N)N(C(C)C)C1=O)C1(CCC(OC)CC1)C2 ZINC000141219352 FG Annotated Anodyne CCc1ccc2c(c1)[C@@]1(N=C(N)N(C(C)C)C1=O)C1(CCC(OC)CC1)C2 ZINC000141219510 FG Annotated Anodyne Cc1onc(-c2ccncc2)c1COc1ccc(C(=O)NCC2CC2)cn1 ZINC000141292922 FG Annotated Anodyne Cc1onc(-c2ccccn2)c1COc1ccc(C(=O)NC(C)C)cn1 ZINC000141364296 FG Annotated Anodyne Cc1nc(-c2cc(-c3ccon3)n(Cc3ccccc3F)n2)nc(O)c1F ZINC000141556721 FG Annotated Anodyne Cc1ccc(-c2ccc(=O)n(CC(=O)N(C)[C@@H](C)c3ccccc3)n2)cc1 ZINC000141585729 FG Annotated Anodyne CC[C@@]12C[C@@](C)(O)[C@](O)(c3cccnc3)C[C@H]1CCc1cc(O)ccc12 ZINC000141813359 FG Annotated Anodyne C[C@]12CC[C@H]3[C@@H](CC[C@H]4C[C@]5(CC[C@@]43C)CNCC(=O)O5)[C@@H]1CCC2=O ZINC000141827680 FG Annotated Anodyne CC[C@@]12C[C@@](C)(O)[C@](O)(c3ccncc3)C[C@H]1CCc1cc(O)ccc12 ZINC000141829633 FG Annotated Anodyne CCO[C@H]1C[C@]2(CC)CCCN3CCC(=O)c4ccccc4N1C(=O)[C@@H]32 ZINC000141891883 FG Annotated Anodyne CC(=O)OC1=C(C)C(=O)[C@]23[C@H](C=C(C)C)C[C@H](C)[C@H]2CC[C@H](C)[C@@]3(O)C1=O ZINC000141928107 FG Annotated Mild C[C@@H](Oc1nc(-c2ccc(C#N)cc2)cc2ncccc12)[C@H]1CNC(=O)C1 ZINC000141965784 FG Annotated Anodyne COc1cc([C@@H]2Oc3c(OC)cc([C@@H](O)[C@@H](C)O)cc3[C@H]2C)ccc1O ZINC000142006897 FG Annotated Anodyne CS(=O)(=O)CC1CCN(c2ccc(Cl)c(-c3ccccn3)n2)CC1 ZINC000142053351 FG Annotated Anodyne CC(C)c1noc([C@H](C)Nc2nccc(N3C(=O)OC[C@@H]3C(C)C)n2)n1 ZINC000142074584 FG Annotated Anodyne CC(C)c1noc([C@@H](C)Nc2nccc(N3C(=O)OC[C@@H]3C(C)C)n2)n1 ZINC000142074798 FG Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](C)c2cn3ccsc3n2)n1 ZINC000142080643 FG Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@H](C)c2cn3ccsc3n2)n1 ZINC000142080850 FG Annotated Anodyne CC(C)Cc1noc([C@@H](C)Nc2nccc(N3C(=O)OC[C@@H]3C(C)C)n2)n1 ZINC000142111965 FG Annotated Anodyne CC(C)Cc1noc([C@H](C)Nc2nccc(N3C(=O)OC[C@@H]3C(C)C)n2)n1 ZINC000142112168 FG Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](C)COc2ccccc2)n1 ZINC000142146038 FG Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@H](C)COc2ccccc2)n1 ZINC000142146251 FG Annotated Anodyne CCOC(=O)Cc1cc(OC)cc(O)c1C(=O)CCCCC[C@H](C)O ZINC000142220681 FG Annotated Anodyne CCCCn1ncc2c(-c3ccc(C)cn3)cc(C(=O)N[C@@H](C)CO)cc21 ZINC000142229449 FG Annotated Anodyne Cc1ccc(-c2cc(C(=O)N[C@@H](C)CO)cc3c2cnn3C(C)C)nc1 ZINC000142229673 FG Annotated Anodyne Cc1ccc(-c2cc(C(=O)N[C@@H](C)CO)cc3c2cnn3CC(C)C)nc1 ZINC000142240389 FG Annotated Anodyne Cc1ccc(-c2cc(C(=O)N[C@@H](C)CO)cc3c2ncn3CC(C)C)nc1 ZINC000142249564 FG Annotated Anodyne O=C(CNc1ccc2[nH]ncc2c1)Nc1nc2ccc3[nH]ncc3c2s1 ZINC000142272134 FG Annotated Anodyne O=C(CNc1ccc2cn[nH]c2c1)Nc1nc2ccc3[nH]ncc3c2s1 ZINC000142272573 FG Annotated Anodyne C[C@H](Nc1cccc(O)c1)C(=O)Nc1nc2ccc3[nH]ncc3c2s1 ZINC000142281360 FG Annotated Anodyne C[C@@H](Nc1cccc(O)c1)C(=O)Nc1nc2ccc3[nH]ncc3c2s1 ZINC000142281567 FG Annotated Anodyne Cc1cccnc1-c1cc(N2CCC3(CC2)CNC(=O)O3)ncc1Cl ZINC000142282044 FG Annotated Anodyne CC(=O)N[C@@H](C)Cc1ccc(C#Cc2ccc3c(ccn3CCO)c2)cc1 ZINC000142339907 FG Annotated Mild CC(=O)N[C@H](C)Cc1ccc(C#Cc2ccc3c(ccn3CCO)c2)cc1 ZINC000142340128 FG Annotated Mild CC(=O)N[C@@H](C)Cc1ccc(C#Cc2cnn(Cc3ccccc3)c2)cc1 ZINC000142342045 FG Annotated Mild CC(=O)N[C@H](C)Cc1ccc(C#Cc2cnn(Cc3ccccc3)c2)cc1 ZINC000142342261 FG Annotated Mild COc1[nH]c(O)c(C(=O)[C@@H](C)C[C@@H](C)C(C)(Cl)Cl)c(=O)c1OC ZINC000142344149 FG Annotated Anodyne in-vivo COc1[nH]c(O)c(C(=O)[C@H](C)C[C@@H](C)C(C)(Cl)Cl)c(=O)c1OC ZINC000142344358 FG Annotated Anodyne in-vivo COc1[nH]c(O)c(C(=O)[C@@H](C)C[C@H](C)C(C)(Cl)Cl)c(=O)c1OC ZINC000142344546 FG Annotated Anodyne in-vivo COc1[nH]c(O)c(C(=O)[C@H](C)C[C@H](C)C(C)(Cl)Cl)c(=O)c1OC ZINC000142344753 FG Annotated Anodyne in-vivo O=C(/C=C/c1ccc(O)c(O)c1)c1cc(O)c(O)cc1Br ZINC000142484225 FG Annotated Anodyne Cc1onc(-c2ccccn2)c1COc1ccc(C(=O)NCC2CC2)cn1 ZINC000142561326 FG Annotated Anodyne Cc1nc2c(N3CCOCC3)nccn2c1-c1ccc(CC(C)C)nc1 ZINC000142633968 FG Annotated Anodyne Cc1ccc(-c2cc(C(=O)N[C@@H](C)CO)cc(N(C)C(=O)C(C)C)c2)cc1 ZINC000142646149 FG Annotated Anodyne CCn1ncc2cc(-c3cc(=O)n4nc(C)c(-c5ncco5)c4[nH]3)ccc21 ZINC000142649885 FG Annotated Anodyne Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccncc2F)s1 ZINC000142676458 FG Annotated Anodyne COc1cc(-c2cc(=O)n3ncc(-c4cc(C)no4)c3[nH]2)ccc1Cl ZINC000142681374 FG Annotated Anodyne CCn1ncc2cc(-c3cc(=O)n4ncc(-c5nc(C)co5)c4[nH]3)ccc21 ZINC000142723827 FG Annotated Anodyne CCOc1cc(-c2cc(=O)n3ncc(-c4ncco4)c3[nH]2)ccc1Cl ZINC000142739998 FG Annotated Anodyne CCn1nc(C)c2cc(-c3cc(=O)n4ncc(-c5ncc(C)o5)c4[nH]3)ccc21 ZINC000142747075 FG Annotated Anodyne COc1cc(-c2cc(=O)n3ncc(-c4nc(C)co4)c3[nH]2)ccc1Cl ZINC000142750412 FG Annotated Anodyne CCn1ncc2cc(-c3cc(=O)n4ncc(-c5ncc(C)o5)c4[nH]3)ccc21 ZINC000142751014 FG Annotated Anodyne CC(C)n1ncc2cc(-c3cc(=O)n4ncc(-c5ccnn5C)c4[nH]3)ccc21 ZINC000142788264 FG Annotated Anodyne Cc1onc(-c2ccncc2)c1COc1ccc(C(=O)NC(C)C)cn1 ZINC000142847428 FG Annotated Anodyne COC(=O)[C@H](C)CC(=O)Oc1cn(Cc2ccccc2)c2occ(O)c12 ZINC000142865983 FG Annotated Anodyne COC(=O)c1ccc(OCc2c(-c3ccc(Cl)cn3)noc2C)nc1 ZINC000142898691 FG Annotated Anodyne N#Cc1cc(NC(=O)c2ccc(-c3noc(C(F)(F)F)n3)cc2)ccn1 ZINC000142914675 FG Annotated Anodyne Cc1ncc(OC[C@@]2(c3ccccc3)C[C@H]2C(=O)Nc2cccnc2)c(C)n1 ZINC000142921068 FG Annotated Anodyne Cc1ncc(OC[C@@]2(c3ccccc3)C[C@H]2C(=O)Nc2ccncc2)c(C)n1 ZINC000142921286 FG Annotated Anodyne COC(C#Cc1ccc(-c2ccc(C#CC(OC)OC)s2)s1)OC ZINC000142921822 FG Annotated Mild CCCN(C)C[C@@H](C)NC(=O)c1ccc(-c2noc(C(F)(F)F)n2)cc1 ZINC000142943924 FG Annotated Anodyne CCn1ncc2ccc(-c3cc(=O)n4ncc(-c5ncc(C)o5)c4[nH]3)cc21 ZINC000142961752 FG Annotated Anodyne C#CCn1c(Br)nc2c(N)nc(C#CCCCCCC)nc21 ZINC000142974228 FG Annotated Mild CCn1ncc2cc(-c3cc(=O)n4ncc(-c5oncc5C)c4[nH]3)ccc21 ZINC000142975998 FG Annotated Anodyne Cc1noc(-c2cnn3c(=O)cc(-c4ccc(Cl)c(Cl)c4)[nH]c23)n1 ZINC000143001908 FG Annotated Anodyne COC(=O)/C(=C\c1ccc(OC)c(OC)c1)c1ccc(OC)c(OC)c1 ZINC000143045078 FG Annotated Anodyne CCc1ccc(Cl)cc1-n1cc(-c2cc(NC)ncn2)cc1C(N)=O ZINC000143052180 FG Annotated Anodyne Cc1onc(-c2cccnc2)c1COc1ccc(C(=O)NC(C)C)cn1 ZINC000143055190 FG Annotated Anodyne CCn1nccc1-c1cnn2c(=O)cc(-c3ccc(Cl)c(OC)c3)[nH]c12 ZINC000143061825 FG Annotated Anodyne CCn1ncc2cc(-c3cc(=O)n4nc(C)c(-c5nc(C)co5)c4[nH]3)ccc21 ZINC000143102936 FG Annotated Anodyne CCc1cnc(-c2cnn3c(=O)cc(-c4ccc5c(cnn5CC)c4)[nH]c23)o1 ZINC000143104053 FG Annotated Anodyne COc1cc(-c2cc(=O)n3ncc(-c4ncc(C)o4)c3[nH]2)ccc1Cl ZINC000143118271 FG Annotated Anodyne COC(=O)[C@@]12CCC[C@]3(COC1=O)[C@H]1Cc4occc4[C@H](C)[C@@H]1CC[C@@H]23 ZINC000143179209 FG Annotated Anodyne COC(=O)[C@@]12CCC[C@]3(CO[C@@H]1O)[C@H]1Cc4occc4[C@H](C)[C@@H]1CC[C@H]32 ZINC000143188541 FG Annotated Anodyne CCn1ncc2c(-c3cc(=O)n4nc(C)c(-c5ncc(C)o5)c4[nH]3)cccc21 ZINC000143216587 FG Annotated Anodyne Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)NC2(C#N)CC2)cn1 ZINC000143223870 FG Annotated Mild OCCn1cc(-c2cccc3c2-c2ccccc2[C@@]3(O)C(F)(F)F)cn1 ZINC000143272898 FG Annotated Anodyne OCCn1cc(-c2cccc3c2-c2ccccc2[C@]3(O)C(F)(F)F)cn1 ZINC000143273130 FG Annotated Anodyne O=C1CC[C@@H](COc2ccc3c(c2)[C@@](O)(C(F)(F)F)c2ccccc2-3)N1 ZINC000143335295 FG Annotated Anodyne O=C1CC[C@@H](COc2ccc3c(c2)[C@](O)(C(F)(F)F)c2ccccc2-3)N1 ZINC000143335477 FG Annotated Anodyne Cn1nccc1-c1cnn2c(=O)cc(-c3ccc(Cl)c(Cl)c3)[nH]c12 ZINC000143346386 FG Annotated Anodyne CC[C@H](C)C(=O)NCc1ccc(C(F)F)c(C(=O)Nc2ncc[nH]2)c1 ZINC000143355671 FG Annotated Anodyne CCCc1c(C)cccc1C(=O)N[C@]1(C(=O)O)Cc2ccc(F)cc2C1 ZINC000143356226 FG Annotated Anodyne CCCc1c(C)cccc1C(=O)N[C@@]1(C(=O)O)Cc2ccc(F)cc2C1 ZINC000143356438 FG Annotated Anodyne CCn1ncc2cc(-c3cc(=O)n4ncc(-c5cc(C)no5)c4[nH]3)ccc21 ZINC000143358406 FG Annotated Anodyne Cc1csc(-c2cnn3c(=O)cc(-c4ccc5c(cnn5C)c4)[nH]c23)n1 ZINC000143361452 FG Annotated Anodyne CCn1ncc2cc(-c3cc(=O)n4ncc(-c5nccs5)c4[nH]3)ccc21 ZINC000143380908 FG Annotated Anodyne COc1cc(Br)ccc1Oc1nn(-c2ccccc2)c(=O)o1 ZINC000143394119 FG Annotated Anodyne COc1cc(-c2cc(=O)n3ncc(-c4cc(C)n[nH]4)c3[nH]2)ccc1Cl ZINC000143400104 FG Annotated Anodyne CC(C)N(C)c1nc2cc(C(=O)O)ccc2nc1-c1ccc2nccn2c1 ZINC000143430727 FG Annotated Anodyne O=C(O)Cn1cc(-c2cccc3c2-c2ccccc2[C@@]3(O)C(F)(F)F)cn1 ZINC000143446671 FG Annotated Anodyne O=C(O)Cn1cc(-c2cccc3c2-c2ccccc2[C@]3(O)C(F)(F)F)cn1 ZINC000143446868 FG Annotated Anodyne COC(=O)c1cc(C(=O)OC)c2c(c1)[C@@](O)(C(F)(F)F)c1ccccc1-2 ZINC000143478250 FG Annotated Anodyne COC(=O)c1cc(C(=O)OC)c2c(c1)[C@](O)(C(F)(F)F)c1ccccc1-2 ZINC000143478456 FG Annotated Anodyne COc1cc(-c2cc(=O)n3ncc(-c4nccs4)c3[nH]2)ccc1Cl ZINC000143504068 FG Annotated Anodyne OCCCCOc1cc(CO)c2c(c1)[C@@](O)(C(F)(F)F)c1ccccc1-2 ZINC000143509014 FG Annotated Anodyne OCCCCOc1cc(CO)c2c(c1)[C@](O)(C(F)(F)F)c1ccccc1-2 ZINC000143509186 FG Annotated Anodyne CCCn1ncc2cc(-c3cc(=O)n4ncc(-c5ncc(C)o5)c4[nH]3)ccc21 ZINC000143515940 FG Annotated Anodyne O=S(=O)(c1ccc2oc3c(c2c1)CNCC3)n1ccc2ccc(F)cc21 ZINC000143547931 FG Annotated Anodyne O=S(=O)(c1ccc2oc3c(c2c1)CNCC3)n1ccc2ccccc21 ZINC000143564534 FG Annotated Anodyne CCOc1cc(-c2cc(=O)n3ncc(-c4ncc(C)o4)c3[nH]2)ccc1F ZINC000143641004 FG Annotated Anodyne N#Cc1ccc(N[C@@H]2C[C@H](Oc3ncccc3C3CCOCC3)C2)nc1 ZINC000143813941 FG Annotated Anodyne COc1cccc2c1N(C(C)=O)C13CCC4(CCCN5CC[C@@]21[C@H]54)CC3 ZINC000143871185 FG Annotated Anodyne CCn1c([C@@H](C)NS(=O)(=O)c2ccc(Cl)cc2)nc2cccnc21 ZINC000143908325 FG Annotated Anodyne CCn1c([C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)nc2cccnc21 ZINC000143908495 FG Annotated Anodyne O=C1N(c2ccnc(Cl)c2)CCN1c1cnccc1C1(O)CCCC1 ZINC000143931060 FG Annotated Anodyne CCn1c([C@H](C)NS(=O)(=O)c2ccc(Cl)cc2)nc2ncccc21 ZINC000144199507 FG Annotated Anodyne Cc1ccnc(CO)c1-c1ccc2cc(NC(=O)[C@@H]3C[C@@H]3F)ncc2c1 ZINC000144287026 FG Annotated Anodyne COc1cc(CN2CC(C(=O)O)C2)ccc1OCc1ccccc1Cl ZINC000144303065 FG Annotated Anodyne C[C@@]12CC[C@H]3[C@]4(C)CCC[C@@](C)(C(=O)O)[C@H]4C[C@H](O)[C@]3(CC(=O)O1)C2 ZINC000144313621 FG Annotated Anodyne Cc1ccc(C(=O)NC2(C)COC2)c(F)c1-c1ccc2cc(N)ncc2c1 ZINC000144335359 FG Annotated Anodyne O=c1oc2ccc(Cl)cc2c(=O)n1-c1ccc([N+](=O)[O-])cc1Cl ZINC000144423304 FG Annotated Anodyne CCn1c([C@@H](C)NS(=O)(=O)c2ccc(Cl)cc2)nc2ccncc21 ZINC000144473533 FG Annotated Anodyne CC1=CC(=O)c2c(O)cc(-c3cc(O)c4c(c3)C(=O)C(C)=CC4=O)cc2C1=O ZINC000144528733 FG Annotated Mild Cc1cccc(CN2CCN(c3nc4ncccc4nc3NC3CC3)CC2)c1 ZINC000144574005 FG Annotated Anodyne N#Cc1ccc(N[C@@H]2C[C@@H](Oc3ncccc3C3CCOCC3)C2)nc1 ZINC000144585283 FG Annotated Anodyne CCn1c([C@@H](C)NS(=O)(=O)C2CC2)nc2ccc(C(F)(F)F)cc21 ZINC000144609611 FG Annotated Anodyne N#Cc1cc(C(=O)N2CCC2)cc2c1-c1ccccc1[C@]2(O)C(F)(F)F ZINC000144722260 FG Annotated Mild N#Cc1cc(C(=O)N2CCC2)cc2c1-c1ccccc1[C@@]2(O)C(F)(F)F ZINC000144722465 FG Annotated Mild NC(=O)CCCOc1ccc2c(c1)[C@](O)(C(F)(F)F)c1ccccc1-2 ZINC000144783725 FG Annotated Anodyne NC(=O)CCCOc1ccc2c(c1)[C@@](O)(C(F)(F)F)c1ccccc1-2 ZINC000144783912 FG Annotated Anodyne CNC(=O)CCCOc1ccc2c(c1)[C@](O)(C(F)(F)F)c1ccccc1-2 ZINC000144784133 FG Annotated Anodyne CNC(=O)CCCOc1ccc2c(c1)[C@@](O)(C(F)(F)F)c1ccccc1-2 ZINC000144784316 FG Annotated Anodyne CN(C)C(=O)CCOc1ccc2c(c1)[C@](O)(C(F)(F)F)c1ccccc1-2 ZINC000144793276 FG Annotated Anodyne CN(C)C(=O)CCOc1ccc2c(c1)[C@@](O)(C(F)(F)F)c1ccccc1-2 ZINC000144793508 FG Annotated Anodyne NC(=O)CCCCOc1ccc2c(c1)[C@](O)(C(F)(F)F)c1ccccc1-2 ZINC000144794572 FG Annotated Anodyne NC(=O)CCCCOc1ccc2c(c1)[C@@](O)(C(F)(F)F)c1ccccc1-2 ZINC000144794791 FG Annotated Anodyne CC(=O)N(C)CCOc1ccc2c(c1)[C@](O)(C(F)(F)F)c1ccccc1-2 ZINC000144803160 FG Annotated Anodyne CC(=O)N(C)CCOc1ccc2c(c1)[C@@](O)(C(F)(F)F)c1ccccc1-2 ZINC000144803361 FG Annotated Anodyne O=C(COc1ccc2c(c1)[C@@](O)(C(F)(F)F)c1ccccc1-2)N1CCC1 ZINC000144831504 FG Annotated Anodyne O=C(COc1ccc2c(c1)[C@](O)(C(F)(F)F)c1ccccc1-2)N1CCC1 ZINC000144831701 FG Annotated Anodyne O=C1CC[C@H](COc2ccc3c(c2)[C@@](O)(C(F)(F)F)c2ccccc2-3)N1 ZINC000144843062 FG Annotated Anodyne O=C1CC[C@H](COc2ccc3c(c2)[C@](O)(C(F)(F)F)c2ccccc2-3)N1 ZINC000144843278 FG Annotated Anodyne Cn1cc(-c2cc(CO)cc3c2-c2ccccc2[C@@]3(O)C(F)(F)F)cn1 ZINC000144889118 FG Annotated Anodyne Cn1cc(-c2cc(CO)cc3c2-c2ccccc2[C@]3(O)C(F)(F)F)cn1 ZINC000144889334 FG Annotated Anodyne Cn1cc(-c2cc(CO)c3c(c2)[C@@](O)(C(F)(F)F)c2ccccc2-3)cn1 ZINC000144893048 FG Annotated Anodyne Cn1cc(-c2cc(CO)c3c(c2)[C@](O)(C(F)(F)F)c2ccccc2-3)cn1 ZINC000144893255 FG Annotated Anodyne Cn1cc(-c2cc(CCO)c3c(c2)[C@@](O)(C(F)(F)F)c2ccccc2-3)cn1 ZINC000144918052 FG Annotated Anodyne Cn1cc(-c2cc(CCO)c3c(c2)[C@](O)(C(F)(F)F)c2ccccc2-3)cn1 ZINC000144918251 FG Annotated Anodyne NC(=O)c1cc(-c2cncnc2)cc2c1-c1ccccc1[C@]2(O)C(F)(F)F ZINC000144923859 FG Annotated Anodyne NC(=O)c1cc(-c2cncnc2)cc2c1-c1ccccc1[C@@]2(O)C(F)(F)F ZINC000144924050 FG Annotated Anodyne C=C1[C@H](O)[C@@]23CC[C@@H](C(C)(C)C(=O)O)[C@](C)(CC(=O)O)[C@H]2CC[C@@H]1C3 ZINC000014508978 FG Annotated Mild in-man endogenous C=C1[C@H](O)[C@@]23CC[C@H](C(C)(C)C(=O)O)[C@](C)(CC(=O)O)[C@H]2CC[C@@H]1C3 ZINC000014508980 FG Annotated Mild in-man endogenous COc1cc2c(cc1OC)-c1c(O)c(OC)cc3c1[C@H](C2)[N+](C)([O-])CC3 ZINC000014511226 FG Annotated Bother COc1cc2c(cc1OC)-c1c(O)c(OC)cc3c1[C@@H](C2)[N+](C)(C)CC3 ZINC000014511229 FG Annotated Bother CC(C)C(=O)C1=C(O)[C@]2(C)C[C@H]3C(C)(C)[C@H](C(C)(C)O)C[C@@]3(C1=O)C2=O ZINC000014514790 FG Annotated Mild CC(C)C(=O)C1=C(O)[C@]2(C)C[C@H]3C(C)(C)[C@@H](C(C)(C)O)C[C@@]3(C1=O)C2=O ZINC000014514793 FG Annotated Mild COc1ccc2c(c1O)-c1c(OC)c(OC)cc3c1[C@H](C2)[N+](C)([O-])CC3 ZINC000014559004 FG Annotated Bother C/C=C1\C(=O)NC=C(C(=O)OC)[C@H]1Cc1nccc2c1[nH]c1ccccc12 ZINC000014583377 FG Annotated Anodyne C/C=C1\C(=O)NC=C(C(=O)OC)[C@@H]1Cc1nccc2c1[nH]c1ccccc12 ZINC000014583378 FG Annotated Anodyne COC(OC)[C@@H]1O[C@@H](c2ccccc2)O[C@@H]2CO[C@@H](c3ccccc3)O[C@@H]21 ZINC000014584215 FG Annotated Anodyne COC(OC)[C@@H]1O[C@H](c2ccccc2)O[C@@H]2CO[C@@H](c3ccccc3)O[C@@H]21 ZINC000014584219 FG Annotated Anodyne C=C1CC[C@H]2C(C)(C)CCC[C@@]2(C)[C@H]1C[C@@]12O[C@@H]1[C@@H](O)C(CO)=CC2=O ZINC000014584767 FG Annotated Mild in-man endogenous C=C1CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1C[C@@]12O[C@@H]1[C@@H](O)C(CO)=CC2=O ZINC000014584769 FG Annotated Mild in-man endogenous C=C1CC[C@H]2C(C)(C)CCC[C@@]2(C)[C@@H]1C[C@@]12O[C@@H]1[C@@H](O)C(CO)=CC2=O ZINC000014584771 FG Annotated Mild in-man endogenous C=C1CC[C@H]2C(C)(C)CCC[C@]2(C)[C@@H]1C[C@@]12O[C@@H]1[C@@H](O)C(CO)=CC2=O ZINC000014584773 FG Annotated Mild in-man endogenous C=C1CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1C[C@@]12O[C@@H]1C(=O)C(CO)=CC2=O ZINC000014584796 FG Annotated Mild COC(=O)c1cc(OC)c(Cl)c2c1Oc1cc(C)cc(O)c1C(=O)O2 ZINC000014585654 FG Annotated Anodyne C/C=C(\CC)c1c(O)cc2c(c1O)[C@H](O)[C@H](O)[C@@H](c1ccc(O)cc1)O2 ZINC000014587083 FG Annotated Anodyne C/C=C(\CC)c1c(O)cc2c(c1O)[C@H](O)[C@@H](O)[C@H](c1ccc(O)cc1)O2 ZINC000014587085 FG Annotated Anodyne COC1=C(O)c2c(n(C)c3ccccc3c2=O)[C@@](CC=C(C)C)(OC)C1=O ZINC000014587996 FG Annotated Mild COc1c(O)cc(OC/C=C(\C)CCC=C(C)C)c(C(=O)CO)c1O ZINC000014588149 FG Annotated Anodyne O=c1oc2cc(/C=C/c3ccc(O)cc3)oc(=O)c2c2cc(O)c(O)cc12 ZINC000014589300 FG Annotated Clean in-vitro biogenic COC1=CC(=O)c2cccc(-c3cc(OC)c(OC)cc3OC)c2C1=O ZINC000014589504 FG Annotated Mild Cc1c(O)c(C)c2oc(=O)c(C3=CC(=O)C[C@@H](C)O3)cc2c1[C@@H](C)[C@H](C)O ZINC000014594758 FG Annotated Mild C/C=C\C1=CC2=C(CO1)C(=O)[C@@]1(C)OC(=O)[C@H](C(=O)CCCCC)[C@@H]1C2 ZINC000014594767 FG Annotated Mild in-man endogenous C/C=C\C1=CC2=C(CO1)C(=O)[C@@]1(C)OC(=O)[C@@H](C(=O)CCCCC)[C@@H]1C2 ZINC000014594768 FG Annotated Mild in-man endogenous C/C=C\C1=CC2=C(CO1)C(=O)[C@@]1(C)OC(=O)[C@H](C(=O)CCCCC)[C@H]1C2 ZINC000014594769 FG Annotated Mild in-man endogenous C/C=C\C1=CC2=C(CO1)C(=O)[C@@]1(C)OC(=O)[C@@H](C(=O)CCCCC)[C@H]1C2 ZINC000014594770 FG Annotated Mild in-man endogenous COc1cccc(NCc2cc(O)n3nc(-c4ccc(C)cc4)nc3n2)c1 ZINC000014609038 FG Annotated Anodyne COc1c2cc(c(O)c1OC)CCCC[C@H](O)CC(=O)c1ccc(O)c-2c1 ZINC000014611804 FG Annotated Anodyne COc1ccc(Cc2c(Cc3ccc(OC)cc3)n(C)c(=N)n2C)cc1 ZINC000014611961 FG Annotated Anodyne COc1cc2c3c(c1OC)-c1cc4c(cc1C[C@H]3[N+](C)(C)CC2)OCO4 ZINC000014612185 FG Annotated Bother COc1cc2c3c(c1OC)-c1cc4c(cc1C[C@@H]3[N+](C)(C)CC2)OCO4 ZINC000014612186 FG Annotated Bother COc1cc2c3c(cc4cc5c(cc4c3c1OC)OCO5)N(C=O)CC2 ZINC000014612201 FG Annotated Bother COC(=O)c1cncc([C@@H]2CN3CCc4c([nH]c5ccccc45)[C@@]3(C)O2)c1 ZINC000014612619 FG Annotated Anodyne COc1cc(-c2c3c(cc4cc(OC)c(O)cc24)OC(=O)C3)ccc1O ZINC000014612679 FG Annotated Anodyne in-vitro biogenic CC1(C)Oc2cc3c(cc2C[C@@H]1O)[C@@H]1Oc2cc4c(cc2[C@@H]1CO3)OCO4 ZINC000014613191 FG Annotated Anodyne CC1(C)Oc2cc3c(cc2C[C@@H]1O)[C@H]1Oc2cc4c(cc2[C@@H]1CO3)OCO4 ZINC000014613193 FG Annotated Anodyne CC1(C)Oc2cc3c(cc2C[C@@H]1O)[C@H]1Oc2cc4c(cc2[C@H]1CO3)OCO4 ZINC000014613194 FG Annotated Anodyne O=C(O)c1ccc(-c2ccc(C(=O)O)c3c2CCC3=O)c2c1C(=O)CC2 ZINC000014614235 FG Annotated Anodyne C=C1c2ccc3c(c2C[C@@]12c1cc(O)c(OC)cc1CCN2C)OCO3 ZINC000014616089 FG Annotated Mild in-vitro biogenic COc1ccc2c(c1)[C@H](OC)[C@@H]1c3c(cc4c(c3-2)OCO4)CC[N+]1(C)[O-] ZINC000014618039 FG Annotated Bother CC(=O)O[C@H]1c2ccccc2-c2c3c(cc4c2[C@H]1N(C(C)=O)CC4)OCO3 ZINC000014618050 FG Annotated Anodyne CC(=O)O[C@H]1c2ccccc2-c2c3c(cc4c2[C@@H]1N(C(C)=O)CC4)OCO3 ZINC000014618052 FG Annotated Anodyne CC(=O)O[C@@H]1c2ccccc2-c2c3c(cc4c2[C@@H]1N(C(C)=O)CC4)OCO3 ZINC000014618053 FG Annotated Anodyne COc1c(OC)c(OC)c2c3c(cc4ccccc42)N(C)C(=O)C(=O)c13 ZINC000014618765 FG Annotated Bother COc1c(OC)c(OC)c2c3c(cc4c(OC)cccc42)NC(=O)C(=O)c13 ZINC000014618766 FG Annotated Bother COc1cc2c(cc1OC)-c1c(OC)c3c(c4ccnc(c14)C2=O)OCO3 ZINC000014619014 FG Annotated Anodyne COc1cc2c(cc1OC)C1=Cc3ccc(OC)c(OC)c3[C@H](O)N1CC2 ZINC000014620311 FG Annotated Anodyne COc1ccc2c(c1OC)[C@H](OC)N1CCc3cc4c(cc3C1=C2)OCO4 ZINC000014620414 FG Annotated Anodyne Cc1cc2ccc3c(c2c[n+]1[C@@H](CC(C)C)C(=O)O)O[C@@H](C(C)(C)O)C3 ZINC000014636658 FG Annotated Mild O=C1c2cc(O)cc(O)c2[C@H](c2cc(O)cc(O)c2)[C@H]1c1ccc(O)cc1 ZINC000014638034 FG Annotated Anodyne COc1ccc(C(=O)C2=Cc3cc(OC)c(OC)cc3CO2)c(OC)c1 ZINC000014638398 FG Annotated Mild COc1ccc2c(c1)O[C@H]1c3cc(OC)c(OC)cc3CO[C@H]1[C@@H]2OC ZINC000014638429 FG Annotated Anodyne O=C1OCc2c1cc1cc3c(cc1c2-c1cc2c(cc1O)OCO2)OCO3 ZINC000014640879 FG Annotated Anodyne O=C1OCc2c1c(-c1ccc3c(c1)OCO3)c1c3c(ccc1c2O)OCO3 ZINC000014640895 FG Annotated Anodyne O=C1O[C@@H](O)c2c1cc1ccc3c(c1c2-c1ccc2c(c1)OCO2)OCO3 ZINC000014640913 FG Annotated Anodyne O=C1O[C@H](O)c2c1cc1ccc3c(c1c2-c1ccc2c(c1)OCO2)OCO3 ZINC000014640916 FG Annotated Anodyne in-vitro biogenic COc1cc2cc3c(c(-c4cc(O)c(O)c(OC)c4)c2cc1O)C(=O)OC3 ZINC000014640922 FG Annotated Clean COc1cc(OC)c2c(OC)c3c4c(cc5c(c4c2c1)OCO5)C(=O)N3 ZINC000014641222 FG Annotated Bother COc1cc(OC)c2c(c1)OC[C@H](c1ccc(OC)c(OC)c1OC)C2=O ZINC000014645824 FG Annotated Anodyne COc1cc2occ(-c3cc4c(cc3OC)OCO4)c(=O)c2cc1OC ZINC000014645941 FG Annotated Anodyne COc1cc2c(cc1-c1coc3c(OC)c(OC)ccc3c1=O)OCO2 ZINC000014645947 FG Annotated Anodyne COc1cc2c(c(OC)c1OC)OC[C@H]1c3cc4c(cc3O[C@@H]21)OCO4 ZINC000014648579 FG Annotated Anodyne C[C@H]1C(=O)OC[C@@H]1C(c1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2 ZINC000014649597 FG Annotated Anodyne COc1ccc(C)c2c1N[C@](C)([C@]1(C)Nc3c(O)ccc(C)c3C1=O)C2=O ZINC000014649921 FG Annotated Anodyne COc1c(O)c(CCCCCc2ccccc2)c2c(c1OC)NC(=O)C2=O ZINC000014652116 FG Annotated Anodyne in-vitro biogenic COCc1c(O)cc(C)cc1Oc1c(C)c(C(=O)OC)c(O)c(C)c1O ZINC000014653303 FG Annotated Anodyne COC(=O)/C(=C1/OC(=O)C(c2ccc(OC)cc2)=C1OC)c1ccccc1 ZINC000014657356 FG Annotated Anodyne Cc1cc2c(c(C)c1CCOC(=O)Cc1ccccc1)C(=O)[C@@H](C)[C@@H]2O ZINC000014682744 FG Annotated Anodyne COC(=O)c1cccc2c1Nc1c(cc(OC)c(N(C)C)c1C(=O)OC)O2 ZINC000014683909 FG Annotated Anodyne in-vitro biogenic CC(C)c1cc2c3c(c1O)OC(=O)C[C@@]3(C)C1=C(OC(=O)C1(C)C)C2=O ZINC000014683922 FG Annotated Mild in-vitro biogenic COc1c2c(c(O)c3c(=O)c4cccc(O)c4n(C)c13)C=CC(C)(C)O2 ZINC000014684030 FG Annotated Bother CC[C@H](/C=C(C)/C=C/C(=O)c1c(O)c(-c2ccc(O)cc2)c[nH]c1=O)CO ZINC000014684218 FG Annotated Mild CC[C@]12CCCN3CC[C@]4(c5ccc(O)c(O)c5N(C(C)=O)[C@@H]4CC1)[C@@H]32 ZINC000014684247 FG Annotated Clean COC(=O)c1c(C)ccc2c(O)c3c(cc12)C(=O)c1cccc(O)c1C3=O ZINC000014684529 FG Annotated Clean COc1cc2c(cc1OC)[C@H]1Cc3cc4c(cc3[C@@H]2C[N+]1(C)C)OCO4 ZINC000014685309 FG Annotated Bother CC(C)(OC(=O)c1ccccc1)[C@H]1Cc2cc3ccc(=O)oc3c(O)c2O1 ZINC000014689178 FG Annotated Anodyne C=C(C(C)=O)[C@@H]1CC(=O)c2c(O)c(C(C)C)c(O)c3c2[C@@]1(C)CC(=O)O3 ZINC000014690259 FG Annotated Mild C[C@@H]1OC(=O)[C@@](CC(=O)c2ccoc2)(c2cccc3c2COC3=O)[C@@H]1C ZINC000014690266 FG Annotated Anodyne CCC1=CCCN(CCc2c([C@@H](CO)C(=O)OC)[nH]c3ccccc23)C1 ZINC000014693895 FG Annotated Anodyne COC1=CC(=O)c2cc3c4c(ccn3C)cc(OC)c(OC)c4c2C1=O ZINC000014711501 FG Annotated Mild CCCc1cc(OC(=O)c2c(C)cc(OC)cc2O)cc(O)c1C(=O)O ZINC000014718255 FG Annotated Anodyne CC[C@]12C=CC[N+]3([O-])CC[C@]4(C(=C(C(=O)OC)C1)Nc1ccccc14)[C@H]23 ZINC000014719348 FG Annotated Bother COc1ccc2c(c1)c1c(n2C)[C@H]2C[C@H]3C(C=O)=C(C)OC[C@H]3[C@@H](C1)N2C ZINC000014719759 FG Annotated Reactive CC1(C)O[C@H]2Oc3ccc(C(=O)/C=C/c4ccccc4)c(O)c3[C@H]2[C@@H]1O ZINC000014721518 FG Annotated Mild in-vitro biogenic COc1c(-c2ccc(O)c(O)c2)cc(O)c(-c2ccc(O)c(O)c2)c1O ZINC000014721755 FG Annotated Clean in-vitro CC[C@H]1C[n+]2ccc3c([nH]c4cc(OC)c(OC)cc43)c2C[C@@H]1CCO ZINC000014722640 FG Annotated Anodyne CO[C@@H]1C[C@@H](O)C2=C3c4cccc(O)c4C(=O)C[C@H]3c3ccc(O)c1c32 ZINC000014724612 FG Annotated Anodyne CO[C@H]1[C@@H](O)c2c(O)cccc2C2=C3CCC(=O)c4c(O)ccc(c43)[C@H]21 ZINC000014724638 FG Annotated Anodyne COc1cc(OC)c2c(=O)c3c(oc2c1)-c1cc(OC)c(OC)cc1CO3 ZINC000014725565 FG Annotated Anodyne COc1cc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)ccc1OC(=O)C(C)C ZINC000014728321 FG Annotated Anodyne in-man COc1cc([C@H]2CC(=O)c3c(O)cc(O)cc3O2)ccc1OC(=O)C(C)C ZINC000014728322 FG Annotated Anodyne in-man COc1cc(OC)c2c(c1)C(=O)c1cc(O)c(CC=C(C)C)c(O)c1C2=O ZINC000014761015 FG Annotated Clean COc1ccc2c(cc([N+](=O)[O-])c3c(C(=O)O)cc4c(c32)OCO4)c1OC ZINC000014761367 FG Annotated Bother in-vitro biogenic C[C@H](CO)CCC[C@H](CO)[C@@H]1CC[C@@H](C)c2c1cc(C(=O)O)c(O)c2O ZINC000014763677 FG Annotated Clean COc1ccc([C@@]2(CCN(C)C=O)CCc3ncccc3C2)cc1OC ZINC000014768390 FG Annotated Anodyne COc1ccc([C@]2(CCN(C)C(C)=O)CCc3ncccc3C2)cc1OC ZINC000014768404 FG Annotated Anodyne O=Cc1c(Br)c(O)c(O)c(Br)c1Br ZINC000014769534 FG Annotated Clean O=Cc1cc(Br)c(O)c(Br)c1Br ZINC000014769577 FG Annotated Anodyne OCc1cc(Br)c(O)c(Br)c1Br ZINC000014769579 FG Annotated Anodyne C=C(C)[C@H](COc1cc(O)c2c(c1)C(=O)c1cc(C)cc(O)c1C2=O)OC ZINC000014814373 FG Annotated Mild CC(C)CCc1c(C(=O)O)c(O)cc2c1C(=O)c1c(O)cccc1C2=O ZINC000014814688 FG Annotated Clean COC(=O)c1cc(OC)c(OC)c2c1c([N+](=O)[O-])cc1ccc(O)cc12 ZINC000014815444 FG Annotated Bother C=C(C)[C@@H]1[C@H]2OC(=O)CC[C@]1(C)c1c(O)c(O)c(C(C)C)c(O)c1C2=O ZINC000014817260 FG Annotated Mild CCC(=O)c1cc(OC)c2c(c1)C(=O)c1cc(OC)cc(OC)c1C2=O ZINC000014819821 FG Annotated Clean COc1ccc(-c2oc3cc4c(c(O)c3c2C=O)OCO4)c(OC)c1O ZINC000014821286 FG Annotated Anodyne in-vitro biogenic Cc1c(O)c2c(c(C(=O)CCc3ccccc3)c1O)OC(C)(C)[C@@H](O)C2 ZINC000014821423 FG Annotated Anodyne COc1cc2c(cc1OC)[C@@H]1Cc3c(cc4c(c3OC)OCO4)[C@H](C2)N1C ZINC000014822180 FG Annotated Anodyne Oc1cc(O)cc(Oc2c(O)cc(Oc3c(O)cc(O)cc3O)cc2O)c1 ZINC000014823541 FG Annotated Anodyne Oc1cc(Oc2c(O)cc(O)cc2O)cc(Oc2c(O)cc(O)cc2O)c1 ZINC000014823563 FG Annotated Anodyne CC(=O)OC(C)(C)[C@H]1Oc2ccc3ccc(=O)oc3c2[C@@H]1OC(=O)C(C)C ZINC000014826962 FG Annotated Anodyne in-vitro biogenic C/C=C(/C=O)[C@H]1C[C@H]2c3[nH]c4ccccc4c3CCN2C=C1C(=O)OC ZINC000014827337 FG Annotated Reactive CC[C@]12CCCN3CC[C@]4(C(=C(C(=O)OC)C1)N(C)c1ccccc14)[C@@H]32 ZINC000014829264 FG Annotated Anodyne CC[C@]12CCCN3CC[C@]4(C(=C(C(=O)OC)C1)Nc1cc(O)ccc14)[C@@H]32 ZINC000014829267 FG Annotated Anodyne CC[C@]12CCCN3CC[C@]4(C(=C(C(=O)OC)C1)Nc1cc(OC)ccc14)[C@@H]32 ZINC000014829277 FG Annotated Anodyne CC[C@@]12C[C@@]3(C(=O)OC)O[C@@H]1C=CN1CCc4c(n3c3ccccc43)[C@@H]12 ZINC000014829375 FG Annotated Anodyne CN(C)CCc1cc(O)c2nc(C3=NCCc4cc(O)ccc43)sc2c1 ZINC000014829626 FG Annotated Anodyne COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CC[C@@]13CC[C@@H](C[C@H]12)[C@@](O)(CO)C3 ZINC000014857740 FG Annotated Anodyne CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2[C@@H]1C[C@H](O)[C@@H]2C ZINC000014860035 FG Annotated Anodyne in-vitro biogenic C[C@H]1[C@H](c2ccc3c(c2)OCO3)O[C@@]2(c3ccc4c(c3)OCO4)O[C@@]12C ZINC000014860238 FG Annotated Anodyne COc1cc(-c2c3c(cc4cc(OC)c(O)cc24)C(=O)NC3)ccc1O ZINC000014883364 FG Annotated Anodyne in-vitro biogenic COc1cc2c(cc1OC)[C@@H](O)c1c(C=O)cc3ccc(O)c(OC)c3c1-2 ZINC000014883504 FG Annotated Anodyne COc1cc2c(cc1OC)[C@H](O)c1c(C=O)cc3ccc(O)c(OC)c3c1-2 ZINC000014883506 FG Annotated Anodyne CCN(CC)C(=O)[C@@H]1CC(=O)c2sc(NC(=O)c3ccccc3)nc2C1 ZINC000014888053 FG Annotated Anodyne CCN(CC)C(=O)[C@H]1CC(=O)c2sc(NC(=O)c3ccccc3)nc2C1 ZINC000014888056 FG Annotated Anodyne C[C@@H](CO)CCc1cc2c(cc1O)OC[C@H]1c3cc4c(cc3O[C@@H]21)OCO4 ZINC000014917638 FG Annotated Anodyne CN1CC[C@@]2([C@]34CCN(C)[C@H]3Nc3ccccc34)c3ccccc3N(C)[C@@H]12 ZINC000014923148 FG Annotated Anodyne in-man endogenous COc1cc2c(c(OC)c1OC)CCCN1CCC3=CC[C@@H](OC)C[C@]321 ZINC000014929810 FG Annotated Anodyne COc1cc2c(c(OC)c1OC)CCCN1CCC3=CC[C@H](OC)C[C@]321 ZINC000014929812 FG Annotated Anodyne C[C@H]1CC(=O)Oc2c(C(=O)[C@H](C)[C@H](C)O)c(O)c3c(c21)OC(C)(C)C=C3 ZINC000014930291 FG Annotated Anodyne C[C@H]1CC(=O)Oc2c(C(=O)[C@@H](C)[C@H](C)O)c(O)c3c(c21)OC(C)(C)C=C3 ZINC000014930293 FG Annotated Anodyne O=C(NCCC(=O)c1ccccc1F)Nc1ccc(Br)cn1 ZINC000014943878 FG Annotated Anodyne C=CCN1c2cc(OC)ccc2NC(=O)[C@@]1(C#CC1CC1)C(F)(F)F ZINC000014943939 FG Annotated Mild C=CCN1c2cc(OC)ccc2NC(=O)[C@]1(C#CC1CC1)C(F)(F)F ZINC000014943941 FG Annotated Mild C=CCOC(=O)N1c2ccccc2NC(=O)[C@@]1(C#CC1CC1)C(F)(F)F ZINC000014943953 FG Annotated Mild C=CCOC(=O)N1c2ccccc2NC(=O)[C@]1(C#CC1CC1)C(F)(F)F ZINC000014943955 FG Annotated Mild CCOC(=O)N1c2cc(F)ccc2NC(=O)[C@@]1(C#CC1CC1)C(F)(F)F ZINC000014943970 FG Annotated Mild CCOC(=O)N1c2cc(F)ccc2NC(=O)[C@]1(C#CC1CC1)C(F)(F)F ZINC000014943972 FG Annotated Mild Cc1c(C(C)(C)C)s/c(=N\S(=O)(=O)c2cccc(Cl)c2O)n1C ZINC000014944746 FG Annotated Anodyne Cc1c(C(C)(C)C)s/c(=N\S(=O)(=O)c2cc(Cl)ccc2O)n1C ZINC000014944748 FG Annotated Anodyne Cc1c(C(C)(C)C)s/c(=N\S(=O)(=O)c2cc(Cl)ccc2N)n1C ZINC000014944750 FG Annotated Anodyne Cc1c(C(C)C)s/c(=N\S(=O)(=O)c2cc(Cl)ccc2C#N)n1C ZINC000014944763 FG Annotated Mild NC(=O)c1ccc(Nc2ccc(C(=O)c3c(F)cccc3F)c(N)n2)cc1 ZINC000014945635 FG Annotated Anodyne CCOC(=O)/N=c1\sn(C(=O)OCC)c(=S)n1-c1ccccc1 ZINC000014945914 FG Annotated Anodyne COc1cccc(-n2ncc3c(N/N=C/c4cccc(F)c4)ncnc32)c1 ZINC000014946180 FG Annotated Mild O=C(c1ccc2ccccc2c1)[C@@H]1CCCN(C(=O)c2cnsn2)C1 ZINC000014951592 FG Annotated Anodyne O=C(c1ccc2ccccc2c1)[C@H]1CCCN(C(=O)c2cnsn2)C1 ZINC000014951596 FG Annotated Anodyne COC[C@@H]1CCN(C(=O)c2cc(COc3ccc(F)cc3Cl)on2)C1 ZINC000014956055 FG Annotated Anodyne COC[C@H]1CCN(C(=O)c2cc(COc3ccc(F)cc3Cl)on2)C1 ZINC000014956056 FG Annotated Anodyne N#Cc1cccc(C[C@H](N)COc2cncc(/C=C/c3ccncc3)c2)c1 ZINC000014957620 FG Annotated Mild NC(=O)c1ccc(OCC2(NCC(=O)c3ccsc3)CCCC2)cc1 ZINC000014958646 FG Annotated Anodyne Cn1nc(C(F)(F)F)c2c(=O)c3c(Cl)c(Cl)ccc3n(O)c21 ZINC000014959813 FG Annotated Anodyne Cn1nc(C(F)(F)F)c2c(=O)c3cc(Cl)c(Cl)cc3n(O)c21 ZINC000014959816 FG Annotated Anodyne Cc1cc(C)cc(-n2ncc3c2CCC[C@@H]3NC(=O)c2csnn2)c1 ZINC000014963732 FG Annotated Anodyne Cc1cc(C)cc(-n2ncc3c2CCC[C@H]3NC(=O)c2csnn2)c1 ZINC000014963736 FG Annotated Anodyne O=C(Cc1ccsc1)N[C@@H]1CCCc2nc(-c3cccnc3)ncc21 ZINC000014965317 FG Annotated Anodyne O=C(Cc1ccsc1)N[C@H]1CCCc2nc(-c3cccnc3)ncc21 ZINC000014965321 FG Annotated Anodyne COCOc1ccccc1CNC[C@@H](O)c1cc(Br)cs1 ZINC000014966832 FG Annotated Anodyne COCOc1ccccc1CNC[C@H](O)c1cc(Br)cs1 ZINC000014966835 FG Annotated Anodyne N#CCOc1ccccc1CNC[C@H](O)c1cc(Br)cs1 ZINC000014966839 FG Annotated Mild N#CCOc1ccccc1CNC[C@@H](O)c1cc(Br)cs1 ZINC000014966843 FG Annotated Mild O=c1cc(C(F)(F)F)c2cc3c(cc2[nH]1)OCCN3CC(F)(F)F ZINC000014967281 FG Annotated Anodyne COC[C@@H]1CCN(C(=O)c2cc(COc3ccccc3SC)on2)C1 ZINC000014970896 FG Annotated Anodyne COC[C@H]1CCN(C(=O)c2cc(COc3ccccc3SC)on2)C1 ZINC000014970901 FG Annotated Anodyne CC(C)(C)S(=O)(=O)Cc1nc(-c2cc3ccccc3[nH]c2=O)cs1 ZINC000014974788 FG Annotated Anodyne CCn1nc(C)c(CN2CC(=O)N(c3ccccc3SC)[C@H](C)C2)c1C ZINC000014977008 FG Annotated Anodyne CCn1nc(C)c(CN2CC(=O)N(c3ccccc3SC)[C@@H](C)C2)c1C ZINC000014977011 FG Annotated Anodyne COc1ccc(Cc2nc3ccc(C(=O)N4CCC[C@H]4CO)cc3o2)cc1 ZINC000014978909 FG Annotated Anodyne C[C@@H](Cc1cnccn1)NC(=O)CCc1nnc(CCC2CCCCC2)o1 ZINC000014979877 FG Annotated Anodyne C[C@H](Cc1cnccn1)NC(=O)CCc1nnc(CCC2CCCCC2)o1 ZINC000014979880 FG Annotated Anodyne COCc1nc2cccnc2n1C1CCN(C(=O)c2ccc(C)s2)CC1 ZINC000014989807 FG Annotated Anodyne C/C=C(\C)C(=O)N1CCc2c(cnc(C)c2CNC(=O)c2ccoc2C)C1 ZINC000014992853 FG Annotated Anodyne O=C(CC[C@@]1(Cc2cccs2)CCC(=O)N1)NC1Cc2ccccc2C1 ZINC000014995964 FG Annotated Anodyne O=C(CC[C@]1(Cc2cccs2)CCC(=O)N1)NC1Cc2ccccc2C1 ZINC000014995966 FG Annotated Anodyne Cc1nc(C(=O)NC[C@@H]2Cc3cccc(-c4ccncc4)c3O2)cs1 ZINC000014997088 FG Annotated Anodyne Cc1nc(C(=O)NC[C@H]2Cc3cccc(-c4ccncc4)c3O2)cs1 ZINC000014997091 FG Annotated Anodyne NC[C@@H]1CCC[C@@H](CNC(=O)c2ccnc3[nH]c(-c4cccs4)nc23)C1 ZINC000145117290 FG Annotated Anodyne NC[C@H]1CCC[C@@H](CNC(=O)c2ccnc3[nH]c(-c4cccs4)nc23)C1 ZINC000145117534 FG Annotated Anodyne NC[C@@H]1CCC[C@H](CNC(=O)c2ccnc3[nH]c(-c4cccs4)nc23)C1 ZINC000145117707 FG Annotated Anodyne NC[C@H]1CCC[C@H](CNC(=O)c2ccnc3[nH]c(-c4cccs4)nc23)C1 ZINC000145117904 FG Annotated Anodyne CC(=O)OC[C@H](O)COC(=O)[C@@H]1C(C)=CC[C@H]2C(C)(C)CCC[C@]12C ZINC000145317315 FG Annotated Anodyne C[C@H](c1ccccc1)n1c(=O)[nH]c2ncc(-c3ccc4c(c3)OCO4)nc21 ZINC000145349854 FG Annotated Anodyne [C-]#[N+]c1ccc2ncc(-c3noc4cc(C(=O)N5CCOCC5)ccc34)n2c1 ZINC000145630058 FG Annotated Anodyne COc1ccc2[nH]cc([C@]3(O)C(=O)Nc4ccc(Br)cc43)c2c1 ZINC000145791352 FG Annotated Anodyne C[C@@H](Cc1ccc(C(=O)Oc2ccc(C(=N)N)cc2Cl)s1)C(=O)O ZINC000145969147 FG Annotated Anodyne C[C@H](Cc1ccc(C(=O)Oc2ccc(C(=N)N)cc2Cl)s1)C(=O)O ZINC000145969364 FG Annotated Anodyne NC(=O)c1cccnc1COc1cc(Br)cc2ncccc12 ZINC000146019387 FG Annotated Anodyne COc1ccc(-c2cc(O[C@H](C)[C@H]3CNC(=O)C3)c3cccnc3c2)cn1 ZINC000146056815 FG Annotated Anodyne COc1cc(C=O)c(OCc2cccnc2-c2ccnn2C(C)C)cn1 ZINC000146089536 FG Annotated Anodyne in-vitro C[C@H]1SC(N)=N[C@@]2(c3ccc(F)cc3F)CO[C@@H](c3ncco3)C[C@@H]12 ZINC000146158827 FG Annotated Anodyne COc1cc(-c2cc(OC[C@H]3CNC(=O)O3)c3cccnc3c2)ccc1O ZINC000146164957 FG Annotated Anodyne Cc1cc([C@H]2C[C@H]3CSC(N)=N[C@@]3(c3ccc(F)cc3F)CO2)on1 ZINC000146168088 FG Annotated Anodyne Cn1cccc1[C@H]1C[C@H]2CSC(N)=N[C@@]2(c2ccc(F)cc2F)CO1 ZINC000146171891 FG Annotated Anodyne COC(C)(C)[C@@H]1CCCCN1C(=O)[C@@H]1CNC[C@@]12CCCc1ccccc12 ZINC000146558214 FG Annotated Anodyne COC(C)(C)[C@H]1CCCCN1C(=O)[C@@H]1CNC[C@@]12CCCc1ccccc12 ZINC000146558419 FG Annotated Anodyne CC(C)(CO)NC(=O)c1nn(-c2ccc(Cl)cc2)c2c1[C@H]1CC[C@H]2C1 ZINC000146935281 FG Annotated Anodyne CCc1cccc(CC)c1-c1cc(C)c2c(n1)CCN(c1nnnn1C)C2 ZINC000146941050 FG Annotated Anodyne COc1cc2c(cc1O)-c1ccc(O)cc1OC[C@]1(COC(C)(C)O1)C2 ZINC000147098723 FG Annotated Anodyne COc1c(OC)c2c3c(c1OC)[C@H](O)CN[C@@H]3C(C)(C)c1ccccc1-2 ZINC000147219129 FG Annotated Anodyne CSc1nn(-c2ccccc2)c2cc(NC(=O)N[C@@H]3CCNC3)ccc12 ZINC000147341861 FG Annotated Anodyne CSc1nn(-c2ccccc2)c2cc(NC(=O)N[C@H]3CCNC3)ccc12 ZINC000147342006 FG Annotated Anodyne C/C=C(/C)C(=O)O[C@H]1CC[C@@H]2C[C@H]3OC(=O)C(C)=C3C[C@]2(C)[C@H]1C(=O)O ZINC000147363515 FG Annotated Anodyne CC(C)(C)c1cc(NC(=O)[C@@H]2C[C@@H](O)CN2c2ccc(Cl)cc2)on1 ZINC000147435977 FG Annotated Anodyne Cc1cc(S(=O)(=O)c2cc(F)cc(F)c2)cc2c3c(oc12)CCNC3 ZINC000147518646 FG Annotated Anodyne COc1cc(S(=O)(=O)c2ccc(F)cc2)cc2c3c(oc12)CCNC3 ZINC000147530111 FG Annotated Anodyne COc1cc(S(=O)(=O)c2cccc(F)c2)cc2c3c(oc12)CCNC3 ZINC000147535645 FG Annotated Anodyne COc1cc(S(=O)(=O)c2ccccc2F)cc2c3c(oc12)CCNC3 ZINC000147535878 FG Annotated Anodyne CC(=O)Nc1ccncc1N1CCN(c2ccc3ncsc3c2)C1=O ZINC000147539065 FG Annotated Anodyne CCOc1cc(S(=O)(=O)c2ccccc2)cc2c3c(oc12)CCNC3 ZINC000147542058 FG Annotated Anodyne Cc1cc(S(=O)(=O)c2ccc(F)c(F)c2)cc2c3c(oc12)CCNC3 ZINC000147557405 FG Annotated Anodyne N#Cc1cc(S(=O)(=O)c2cc(F)cc(F)c2)cc2c3c(oc12)CCNC3 ZINC000147567616 FG Annotated Anodyne COc1cc(S(=O)(=O)c2ccccc2)cc2c3c(oc12)CC[C@H](O)C3 ZINC000147585072 FG Annotated Anodyne COc1cc(S(=O)(=O)c2ccccc2)cc2c3c(oc12)CC[C@@H](O)C3 ZINC000147585282 FG Annotated Anodyne O=C(c1ccc(Oc2nccnc2-c2cncnc2)cc1)c1ccccn1 ZINC000147585758 FG Annotated Anodyne CC(C)(O)c1ccncc1N1CCN(c2ccc3ncsc3c2)C1=O ZINC000147588713 FG Annotated Anodyne N#Cc1cc(S(=O)(=O)c2ccc(Cl)cc2)cc2c3c(oc12)CCNC3 ZINC000147600463 FG Annotated Anodyne N#Cc1cc(S(=O)(=O)c2cccc(Cl)c2)cc2c3c(oc12)CCNC3 ZINC000147600656 FG Annotated Anodyne CCN1C(=O)CCc2cc(N3CCN(c4cnccc4C)C3=O)ccc21 ZINC000147634431 FG Annotated Anodyne COc1cc(-c2cc(OC[C@H]3CNC(=O)C3)c3cccnc3c2)ccc1O ZINC000147816992 FG Annotated Anodyne COc1cncc(-c2cc(O[C@H](C)[C@H]3CNC(=O)C3)c3cccnc3c2)c1 ZINC000147818836 FG Annotated Anodyne COc1ccc(-c2cc(O[C@H](C)[C@H]3CNC(=O)C3)c3cccnc3c2)nc1 ZINC000147822510 FG Annotated Anodyne COc1cc(-c2cc(O[C@H](C)[C@H]3CNC(=O)C3)c3cccnc3c2)ccn1 ZINC000147822700 FG Annotated Anodyne CCn1cc(-c2cc(OCc3ncccc3C(N)=O)c3cccnc3c2)cn1 ZINC000147822884 FG Annotated Anodyne CCn1cc(-c2cc(O[C@H](C)[C@H]3CNC(=O)C3)c3cccnc3c2)cn1 ZINC000147829066 FG Annotated Anodyne CCCn1cc(-c2cc(O[C@H](C)[C@H]3CNC(=O)C3)c3cccnc3c2)cn1 ZINC000147831571 FG Annotated Anodyne Cc1nc2c(N3CCOCC3)nccn2c1-c1cnc(CC(C)C)s1 ZINC000147977109 FG Annotated Anodyne O=C(NO)c1cc2ccc(CN(CCO)Cc3ccccc3)c(F)c2s1 ZINC000148186759 FG Annotated Anodyne Cc1cc([C@H]2C[C@H]3CSC(N)=N[C@@]3(c3cc(C#N)ccc3F)CO2)on1 ZINC000148287261 FG Annotated Anodyne Cc1coc([C@H]2C[C@H]3CSC(N)=N[C@@]3(c3cc(C#N)ccc3F)CO2)n1 ZINC000148294865 FG Annotated Anodyne Cc1cc(I)c2c(c1)[C@@H]1C=CC[C@H]1[C@@H](C(=O)O)N2 ZINC000148558625 FG Annotated Clean Cc1cc(I)c2c(c1)[C@@H]1C=CC[C@H]1[C@H](C(=O)O)N2 ZINC000148558868 FG Annotated Clean Cc1cc(I)c2c(c1)[C@@H]1C=CC[C@@H]1[C@@H](C(=O)O)N2 ZINC000148559053 FG Annotated Clean Cc1cc(I)c2c(c1)[C@@H]1C=CC[C@@H]1[C@H](C(=O)O)N2 ZINC000148559184 FG Annotated Clean CCc1ncnc(-c2ccc(C(F)(F)F)nc2)c1C#Cc1ccc(N)nc1 ZINC000148587267 FG Annotated Mild CCc1ncnc(N2CCC(O)(C(C)C)CC2)c1C#Cc1ccc(C)nc1 ZINC000148853555 FG Annotated Mild Cc1nnc(CO)n1-c1ccc(Cl)cc1[C@H](N)c1ccccc1Cl ZINC000148889147 FG Annotated Anodyne Cc1nnc(CO)n1-c1ccc(Cl)cc1[C@@H](N)c1ccccc1Cl ZINC000148889352 FG Annotated Anodyne COC(OC)c1ccncc1N1CCN(c2ccc3ncsc3c2)C1=O ZINC000148924098 FG Annotated Anodyne N#C[C@@H]1[C@H](c2ccc(Br)cc2)Nc2ccccc2S1(=O)=O ZINC000148925223 FG Annotated Anodyne in-vivo N#C[C@@H]1[C@@H](c2ccc(Br)cc2)Nc2ccccc2S1(=O)=O ZINC000148925431 FG Annotated Anodyne in-vivo N#C[C@H]1[C@H](c2ccc(Br)cc2)Nc2ccccc2S1(=O)=O ZINC000148925621 FG Annotated Anodyne in-vivo N#C[C@H]1[C@@H](c2ccc(Br)cc2)Nc2ccccc2S1(=O)=O ZINC000148925800 FG Annotated Anodyne in-vivo O=C1N(c2ccc3ncsc3c2)CCN1c1cnccc1CNC1CC1 ZINC000148942262 FG Annotated Anodyne CCc1cn(C2=NCC(=O)N3CCc4c(cccc4-c4ccco4)C3=C2)cn1 ZINC000149042666 FG Annotated Anodyne O=C1CN=C(n2cnc(C(F)F)c2)C=C2c3cccc(C4CC4)c3CCN12 ZINC000149155096 FG Annotated Anodyne CCn1c(=O)cc(C)c2cc(N3CCN(c4cnccc4C)C3=O)ccc21 ZINC000149198833 FG Annotated Anodyne CC(=O)c1cccc2c1CCN1C(=O)CN=C(n3cnc(C4CCC4)c3)C=C21 ZINC000149219616 FG Annotated Anodyne CCOC1CCN(c2ncnc(CC)c2C#Cc2ccc(C)nc2)CC1 ZINC000149456249 FG Annotated Mild COc1ccc([C@H]2C[C@@H]2COc2nc(C)ncc2C2=CC[C@@H](O)CC2)nc1 ZINC000149568434 FG Annotated Anodyne COc1ccc([C@H]2C[C@@H]2COc2nc(C)ncc2C2=CC[C@H](O)CC2)nc1 ZINC000149568629 FG Annotated Anodyne CCCc1cnc(N2CC(c3ccc(C[C@@H](C)NC(C)=O)cc3)C2)nc1 ZINC000149632559 FG Annotated Anodyne CCCc1cnc(N2CC(c3ccc(C[C@H](C)NC(C)=O)cc3)C2)nc1 ZINC000149632770 FG Annotated Anodyne Nc1ncc(-c2ccc(C3(c4noc(-c5cncnc5)n4)CCC3)cc2)cn1 ZINC000149723956 FG Annotated Anodyne Nc1ncc(-c2ccc(C3(c4noc(-c5ccnnc5)n4)CCC3)cc2)cn1 ZINC000149724197 FG Annotated Anodyne COc1ccc2[nH]c(=O)c3sccc3c2c1/C=C/CN1CCC(N)CC1 ZINC000149762377 FG Annotated Anodyne Nc1ncc(-c2ccc(C3(c4noc(-c5cnccn5)n4)CCC3)cc2)cn1 ZINC000149790200 FG Annotated Anodyne Nc1ncc(-c2ccc(C3(c4noc(-c5cocn5)n4)CCC3)cc2)cn1 ZINC000149794871 FG Annotated Anodyne O=C(Nc1ccc(Cl)nc1)Nc1ccc([C@H]2CNCCO2)cc1F ZINC000149835777 FG Annotated Anodyne O=C(Nc1ccc(Cl)nc1)Nc1ccc([C@@H]2CNCCO2)cc1F ZINC000149835983 FG Annotated Anodyne N#Cc1cc(NC(=O)Nc2ccc([C@H]3CNCCO3)cc2F)ccc1F ZINC000149846953 FG Annotated Anodyne N#Cc1cc(NC(=O)Nc2ccc([C@@H]3CNCCO3)cc2F)ccc1F ZINC000149847151 FG Annotated Anodyne O=C(Nc1ccc([C@H]2CNCCO2)c(F)c1)c1ccnc(C(F)(F)F)c1 ZINC000149851033 FG Annotated Anodyne O=C(Nc1ccc([C@@H]2CNCCO2)c(F)c1)c1ccnc(C(F)(F)F)c1 ZINC000149851240 FG Annotated Anodyne O=C(Nc1ccc([C@@H]2CNCCO2)cc1Cl)c1ccc(Cl)nc1 ZINC000149857072 FG Annotated Anodyne O=C(Nc1ccc([C@H]2CNCCO2)cc1Cl)c1ccc(Cl)nc1 ZINC000149857304 FG Annotated Anodyne Nc1ncc(-c2ccc(C3(c4noc(-c5cccnn5)n4)CCC3)cc2)cn1 ZINC000149880771 FG Annotated Anodyne COc1ccc(C#N)cc1NC(=O)Nc1ccc([C@@H]2CNCCO2)cc1F ZINC000149902917 FG Annotated Anodyne COc1ccc(C#N)cc1NC(=O)Nc1ccc([C@H]2CNCCO2)cc1F ZINC000149903147 FG Annotated Anodyne CCOc1ccc(C(=O)Nc2ccc([C@@H]3CNCCO3)c(Cl)c2)cn1 ZINC000149906419 FG Annotated Anodyne CCOc1ccc(C(=O)Nc2ccc([C@H]3CNCCO3)c(Cl)c2)cn1 ZINC000149906652 FG Annotated Anodyne N#Cc1ccc(F)c(NC(=O)Nc2ccc([C@@H]3CNCCO3)cc2F)c1 ZINC000149916048 FG Annotated Anodyne N#Cc1cc(F)cc(NC(=O)Nc2ccc([C@@H]3CNCCO3)cc2F)c1 ZINC000149922923 FG Annotated Anodyne N#Cc1cc(F)cc(NC(=O)Nc2ccc([C@H]3CNCCO3)cc2F)c1 ZINC000149923126 FG Annotated Anodyne CC(=O)N[C@@H](C)c1ccc(C2CN(c3ccc4c(c3)OCCO4)C2)cc1 ZINC000149926587 FG Annotated Clean CC(=O)N[C@H](C)c1ccc(C2CN(c3ccc4c(c3)OCCO4)C2)cc1 ZINC000149969842 FG Annotated Clean Cc1nc2cc(-n3ncc(C(=O)c4cc5ccc(O)cc5[nH]4)c3N)ccc2[nH]1 ZINC000149983640 FG Annotated Anodyne N#Cc1cccc(NC(=O)Nc2ccc([C@@H]3CNCCO3)cc2F)c1F ZINC000149993146 FG Annotated Anodyne Cc1nc2cc(-n3ncc(C(=O)c4nc5ccccc5s4)c3N)ccc2[nH]1 ZINC000149998144 FG Annotated Anodyne O=C(NCc1ccccn1)c1ccc(-n2cc(-c3ccncc3)cn2)cc1 ZINC000001502431 FG Annotated Anodyne in-vitro O=[N+]([O-])/C(C(Cl)=C(Cl)Cl)=C(\N1CCCCC1)n1cncn1 ZINC000001513067 FG Annotated Anodyne C[C@@](O)(C(=O)Nc1ccc(C(=O)c2ccccc2)cc1C#N)C(F)(F)F ZINC000001539874 FG Annotated Mild C[C@@](O)(C(=O)Nc1cccc2c1C(=O)c1sccc1CO2)C(F)(F)F ZINC000001545551 FG Annotated Anodyne CCCCC1=C(C)C(=O)[C@@](C)(CN2c3ccccc3[C@]3(O)CCO[C@H]23)C1=O ZINC000001546065 FG Annotated Mild CCN(CC)CCCN[C@@H]1c2cc(OC)ccc2OCc2ncccc21 ZINC000001552189 FG Annotated Anodyne CNC(=O)OCc1c(COC(=O)NC)c(-c2ccc(C)cc2)n(C)c1C ZINC000001566168 FG Annotated Anodyne CC(=O)/C=C/C=C/c1ccc2c(c1)O[C@@H](CO)[C@H](c1ccc(O)c(O)c1)O2 ZINC000001609147 FG Annotated Mild Cc1oc2c(C)c(O)c3c(c2c1C1(C)OCCO1)C(=O)C=C(Cl)C3=O ZINC000001616140 FG Annotated Mild C[C@]1(C(=O)Nc2ccc3ccccc3c2)C[C@@]2(C)C[C@@](C)(C1)[C@@H](O)NC2=O ZINC000001618032 FG Annotated Anodyne CCOC(=O)C1Cc2ccc3c4c(ccc(c24)C1)CC(C(=O)OCC)C3 ZINC000001619895 FG Annotated Anodyne COC1(OC)C[C@@H]2CCCCC2=C(C)N1S(=O)(=O)c1ccccc1 ZINC000001620041 FG Annotated Anodyne C[C@@]12CCC3(OCCO3)C(OC(=O)c3ccccc3)=C1CCC21OCCO1 ZINC000001620220 FG Annotated Anodyne CCC(=O)C1=C(OC(C)=O)[C@@H]2Cc3c(n(C)c4ccccc34)[C@@H](C1)N2C ZINC000001620360 FG Annotated Mild CCOC(=O)c1c(C(F)(F)F)oc2c1ccc1nc3nonc3nc12 ZINC000001626069 FG Annotated Bother CC(C)N(C(=O)C12C3C4C1C1C2C3C41C(=O)N(C(C)C)C(C)C)C(C)C ZINC000001626442 FG Annotated Anodyne COc1ccc(-c2onc(-c3ccc([N+](=O)[O-])cc3)c2C2=NCCN2)cc1 ZINC000001629435 FG Annotated Bother CCO/[S@](=N/S(=O)(=O)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000001630917 FG Annotated Bother CC(C)[C@@H](CCl)NC(=O)c1cccc(C(=O)N[C@@H](CCl)C(C)C)n1 ZINC000001631703 FG Annotated Reactive C/C=C/CC(S(=O)(=O)c1ccccc1)S(=O)(=O)c1ccccc1 ZINC000001631813 FG Annotated Anodyne COC(=O)c1csc(-c2csc(CCNC(=O)OC(C)(C)C)n2)n1 ZINC000001634789 FG Annotated Anodyne CC(=O)Oc1ccc2c(c1)[nH]c1c3ccc(OC(C)=O)cc3oc(=O)c21 ZINC000001636365 FG Annotated Bother CC(=O)Oc1ccc2c(c1)oc1c3ccc(OC(C)=O)cc3n(C)c(=O)c21 ZINC000001636372 FG Annotated Bother Cn1c(=O)oc2cc(C(=O)CSC(=S)N3CCCCCC3)ccc21 ZINC000001636558 FG Annotated Anodyne Cc1cc2ccccc2c[n+]1CC(=O)CC(O)(C(F)(F)F)C(F)(F)F ZINC000001639273 FG Annotated Mild CC(=O)c1ccc(Br)cc1NC1=CC(=O)c2ncccc2C1=O ZINC000001639342 FG Annotated Mild O=c1c2ccccc2n2c(-c3ccc(O)cc3)nnc2n1-c1ccccc1 ZINC000001642080 FG Annotated Anodyne CC(C)(C)OC(=O)[C@H]1/C(=C/CBr)CN1C(=O)OC(C)(C)C ZINC000001642904 FG Annotated Reactive CC(C)(C)OC(=O)[C@@H]1/C(=C/CBr)CN1C(=O)OC(C)(C)C ZINC000001642906 FG Annotated Reactive CCSC(=O)/C=C1\CN(C(=O)OC(C)(C)C)[C@H]1C(=O)OC(C)(C)C ZINC000001642912 FG Annotated Mild CCSC(=O)/C=C1\CN(C(=O)OC(C)(C)C)[C@@H]1C(=O)OC(C)(C)C ZINC000001642914 FG Annotated Mild C=CCCCN1C(=O)[C@H]2C3c4ccccc4C(C=O)(c4ccccc43)[C@H]2C1=O ZINC000001643699 FG Annotated Mild C=CCCCN1C(=O)[C@H]2C3c4ccccc4C(C=O)(c4ccccc43)[C@@H]2C1=O ZINC000001643700 FG Annotated Mild C=CCCCN1C(=O)[C@H]2[C@H](C1=O)C1c3ccccc3C2(C=O)c2ccccc21 ZINC000001643701 FG Annotated Mild C=CCCCN1C(=O)[C@@H]2C3c4ccccc4C(C=O)(c4ccccc43)[C@@H]2C1=O ZINC000001643702 FG Annotated Mild CCN(CC)CCC(=O)Nc1ccc2sc3ccccc3c(=O)c2n1 ZINC000001644200 FG Annotated Bother O=C(CCN1CCCC1)Nc1ccc2sc3ccccc3c(=O)c2n1 ZINC000001644202 FG Annotated Bother CC(C)(C)c1cc([C@H](CO)OCCOCCO)cc(C(C)(C)C)c1O ZINC000001647609 FG Annotated Anodyne CCN(CC)CCc1c2c(nc3ccccc13)C(=O)c1cccnc1C2=O ZINC000001649604 FG Annotated Clean CN(C)C(=C1c2cc([N+](=O)[O-])ccc2-c2ccc([N+](=O)[O-])cc21)N(C)C ZINC000001649699 FG Annotated Bother O=S(=O)(Nc1nnc2c3ccccc3ccn12)c1ccc(F)cc1S ZINC000001650666 FG Annotated Anodyne O=c1n(-c2ccccc2)c(=O)n2c(-c3ccccc3)c(-c3ccccc3)n12 ZINC000001650756 FG Annotated Anodyne Cc1ccc(C(=O)C2=CN=C3C(=O)N(c4ccccc4)N(C)[C@@]3(C)C2=N)cc1 ZINC000001650940 FG Annotated Mild COc1ccc(N2C=Nn3c(nc4sc5c(c4c3=O)CCCC5)C2)cc1 ZINC000001651331 FG Annotated Anodyne O=c1c2c3c(sc2nc2n1N=CN(c1ccc(F)cc1)C2)CCCC3 ZINC000001651333 FG Annotated Anodyne Cn1c(=O)sc2cc(C(=S)N3CCN(c4ccccc4)CC3)ccc21 ZINC000001652421 FG Annotated Anodyne O=c1[nH]c2ccc(CC(=S)N3CCN(c4ccccc4)CC3)cc2s1 ZINC000001652426 FG Annotated Anodyne COC(=O)[C@H]1CC=C(SC(=O)c2ccccc2)N1C(=O)c1ccccc1 ZINC000001653528 FG Annotated Anodyne CCOC(=O)c1nc2ccccc2nc1Nc1ccc(C(=O)OC)s1 ZINC000001653538 FG Annotated Anodyne Cc1c2c(n(CCc3ccc(Cl)cc3)c1C)NN=C(C#N)S2(=O)=O ZINC000001653545 FG Annotated Mild O=c1c2cc([N+](=O)[O-])cnc2sn1-c1ccc(Br)cc1 ZINC000001654015 FG Annotated Bother CCOC(=O)c1cc(Sc2ccc(N)c(C(=O)OCC)c2)ccc1N ZINC000001654677 FG Annotated Anodyne O=c1[nH]nc(Cc2ccc(Cl)cc2)n1/N=C/c1c[nH]c2ccccc12 ZINC000001654989 FG Annotated Mild CCCC(=O)OCOC(=O)N(C)/N=N/c1ccc(C(=O)OCC)cc1 ZINC000001655133 FG Annotated Reactive NCCCC[C@H](N)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1 ZINC000001655284 FG Annotated Anodyne Cc1cc(S(=O)(=O)Nc2nc3ncccc3[nH]2)c(S)cc1Cl ZINC000001655887 FG Annotated Anodyne CN(C)CCn1c(Cn2nc3ccccc3n2)nc2cc(Cl)ccc21 ZINC000001656592 FG Annotated Anodyne CO[C@@H](c1ccccc1)[C@H](O)[C@](O)(c1ccccc1)P(=O)(OC)OC ZINC000001656848 FG Annotated Anodyne CO[C@H](c1ccccc1)[C@H](O)[C@](O)(c1ccccc1)P(=O)(OC)OC ZINC000001656849 FG Annotated Anodyne CO[C@@H](c1ccccc1)[C@H](O)[C@@](O)(c1ccccc1)P(=O)(OC)OC ZINC000001656856 FG Annotated Anodyne Cc1c(C#N)c2nnn(-c3ccc(Cl)cc3)c(=O)n2c1-c1ccccc1 ZINC000001657792 FG Annotated Mild Cc1c(C#N)c2nnn(-c3cccc(Cl)c3)c(=O)n2c1-c1ccccc1 ZINC000001657793 FG Annotated Mild Cc1c(-c2ccccc2)c(C#N)c2nnn(-c3ccc(Cl)cc3)c(=O)n12 ZINC000001657796 FG Annotated Mild Cc1c(-c2ccccc2)c(C#N)c2nnn(-c3cccc(Cl)c3)c(=O)n12 ZINC000001657797 FG Annotated Mild COC(=O)[C@]1(C)CC(=O)C=C2[C@](C)(CC(=O)c3ccoc3)[C@@H](C)CC[C@@]21O ZINC000001657905 FG Annotated Mild CCOC(=O)N(C)CC[C@H]1CC=CC(=O)[C@H]1c1cccc(OC)c1OC ZINC000001657945 FG Annotated Mild CCOC(=O)N(C)CC[C@@H]1CC=CC(=O)[C@H]1c1cccc(OC)c1OC ZINC000001657946 FG Annotated Mild CCOC(=O)N(C)CC[C@H]1CC=CC(=O)[C@@H]1c1cccc(OC)c1OC ZINC000001657947 FG Annotated Mild CCOC(=O)N(C)CC[C@@H]1CC=CC(=O)[C@@H]1c1cccc(OC)c1OC ZINC000001657948 FG Annotated Mild CN(C)C=C1C(=O)c2c(Br)sc(Br)c2C1=O ZINC000001658692 FG Annotated Mild CSc1nc(NC(C)C)c2c(n1)Sc1nc3ccccc3n1[C@H]2O ZINC000001658792 FG Annotated Anodyne CSc1nc(NC2CC2)c2c(n1)Sc1nc3ccccc3n1N=C2 ZINC000001658795 FG Annotated Anodyne Cc1c2c(OC[C@H]3CCCCO3)nn(C)c(=O)c2c(C)n1-c1ccccc1 ZINC000001659189 FG Annotated Anodyne CCOC(=O)C(C(=O)OCC)[C@@H]1C=CC[C@H]2c3ccccc3COC[C@H]21 ZINC000001659211 FG Annotated Anodyne Cc1cc(C)c2c(=O)n(CN3CCC(O)(c4ccccc4)CC3)sc2n1 ZINC000001659236 FG Annotated Anodyne NCCN1C(=O)c2cc(Cl)c(Cl)cc2[C@]1(O)c1ccc(Cl)cc1 ZINC000001662077 FG Annotated Anodyne O=C(N/N=C/C=C/c1ccc([N+](=O)[O-])o1)c1ccc(Br)s1 ZINC000001663031 FG Annotated Reactive COc1ccc(N2C(=O)/C(=C3\C(=O)Nc4ccccc43)SC2=S)cc1 ZINC000001750209 FG Annotated Clean COc1ccccc1N1C(=O)S/C(=C2/C(=O)Nc3ccccc32)C1=O ZINC000001750691 FG Annotated Anodyne CC(=O)[C@@H]1CC[C@@H]2[C@H]3C[C@H](C)[C@@]4(O)CC(=O)CC[C@]4(C)[C@@H]3[C@@H](O)C[C@@]12C ZINC000001758531 FG Annotated Anodyne O=C(NNc1nncc(-c2ccc(Cl)cc2)n1)C(Cl)(Cl)Cl ZINC000001842281 FG Annotated Reactive C[C@@H](SC(=S)N1CCOCC1)c1cc2oc(=O)n(C)c2cc1Cl ZINC000001851245 FG Annotated Anodyne O=C(O)CCCc1nc2c(n1-c1ccccc1)C(=O)c1ccccc1C2=O ZINC000001855968 FG Annotated Clean Cc1cc2c(cc1Cl)S(=O)(=O)OC(c1ccc([N+](=O)[O-])cc1)=N2 ZINC000001856777 FG Annotated Mild COC(=O)/C=C/CCC#Cc1ccccc1C#CCC/C=C/C(=O)OC ZINC000001856956 FG Annotated Mild CC(C)(C)OC(=O)N1CCc2c(n(C/C=C/c3ccccc3)[nH]c2=O)C1 ZINC000001857105 FG Annotated Anodyne N#Cc1c(N)c2c(c(-c3ccccc3)c1-c1ccccc1)C(=O)N(O)C2=O ZINC000001859601 FG Annotated Mild CNN1C(=O)c2c(N)c(C#N)c(-c3ccccc3)c(-c3ccccc3)c2C1=O ZINC000001859618 FG Annotated Mild CSc1nc(Nc2cccc(C(F)(F)F)c2)c2c(N)nn(C)c2n1 ZINC000001860115 FG Annotated Anodyne CCOC(=O)c1sc2nc(SC)nc(N3CCCCC3)c2c1N ZINC000001860143 FG Annotated Anodyne COc1ccccc1C1(c2c(OC(C)C)c(=O)c2=O)SCCCS1 ZINC000001860379 FG Annotated Anodyne Cc1cccc(N2CCN(S(=O)(=O)c3ccc(Cl)cc3)C2=N)c1C ZINC000001861352 FG Annotated Anodyne O=C1c2cccnc2S(=O)(=O)N1c1ccc(Oc2ccccc2)cc1 ZINC000001862025 FG Annotated Anodyne Cc1ccccc1O[C@@H](C)C(=O)NN1C(=O)CS[C@@H]1c1ccccc1 ZINC000001863305 FG Annotated Anodyne Cc1ccccc1O[C@H](C)C(=O)NN1C(=O)CS[C@@H]1c1ccccc1 ZINC000001863308 FG Annotated Anodyne Cc1ccccc1O[C@@H](C)C(=O)NN1C(=O)CS[C@H]1c1ccccc1 ZINC000001863311 FG Annotated Anodyne Cc1ccccc1O[C@H](C)C(=O)NN1C(=O)CS[C@H]1c1ccccc1 ZINC000001863312 FG Annotated Anodyne CCN(CC)CC#CCN1C(=O)CC(c2ccccc2)(c2ccccc2)C1=O ZINC000001895240 FG Annotated Mild O=C(NN=C/C(Br)=C\c1ccccc1)c1[nH]nc2c1CCC2 ZINC000001907605 FG Annotated Anodyne aggregator COc1ccc2c(c1)O[C@H](c1cc(OC)c(OC)c(OC)c1)C(C=O)=C2 ZINC000001909398 FG Annotated Reactive CCc1c(Cc2cc(C)cc(C)c2)n(COCC=C(C)C)c(=O)[nH]c1=O ZINC000001912790 FG Annotated Anodyne COc1cccc(OCc2cc(C(=O)N(C)CC[C@@H]3CCCCO3)no2)c1 ZINC000015065610 FG Annotated Anodyne COc1cccc(OCc2cc(C(=O)N(C)CC[C@H]3CCCCO3)no2)c1 ZINC000015065611 FG Annotated Anodyne CC(=O)c1ccc(OCc2cc(C(=O)N(C)[C@H](C)c3ccon3)no2)cc1 ZINC000015075117 FG Annotated Anodyne CC(=O)c1ccc(OCc2cc(C(=O)N(C)[C@@H](C)c3ccon3)no2)cc1 ZINC000015075118 FG Annotated Anodyne O=C(c1cccc(-n2cnnc2)c1)N1CCO[C@@H](CC2CCCCC2)C1 ZINC000015076495 FG Annotated Anodyne O=C(c1cccc(-n2cnnc2)c1)N1CCO[C@H](CC2CCCCC2)C1 ZINC000015076497 FG Annotated Anodyne CC(C)(C)c1ccc(C(=O)[C@@H]2CCCN(C(=O)CCn3cncn3)C2)cc1 ZINC000015078177 FG Annotated Anodyne CC(C)(C)c1ccc(C(=O)[C@H]2CCCN(C(=O)CCn3cncn3)C2)cc1 ZINC000015078179 FG Annotated Anodyne C=C1C(=O)C2=C[C@H]1CCC(=O)[C@@]1(C)CC[C@@H](OC(C)=O)C(C)(C)[C@@H]1C[C@H]2O ZINC000015116679 FG Annotated Mild C=C1C(=O)C2=C[C@H]1CCC(=O)[C@@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1C[C@H]2O ZINC000015116681 FG Annotated Mild C=C1C(=O)C2=C[C@H]1CCC(=O)[C@]1(C)CC[C@@H](OC(C)=O)C(C)(C)[C@@H]1C[C@H]2O ZINC000015116683 FG Annotated Mild C=C1C(=O)C2=C[C@@H]1C[C@H](O)C(=O)[C@]1(C)CCCC(C)(C)[C@H]1C[C@H]2OC(C)=O ZINC000015116718 FG Annotated Mild in-vitro biogenic COc1ccc(OC)c(-c2cc(=O)c3c(OC)c(OC)ccc3[nH]2)c1OC ZINC000015119295 FG Annotated Anodyne COCc1c(CO)cc(OC)c(C/C=C(\C)C/C=C/C(C)(C)O)c1O ZINC000015120514 FG Annotated Anodyne COC(=O)C[C@@]1(C/C=C(\C)CCC=C(C)C)C[C@H](O)[C@H](OC)CC1=O ZINC000015120574 FG Annotated Anodyne in-vitro biogenic CO[C@@]12C(=O)c3cc4ccoc4cc3O[C@@H]1COc1cc3c(cc12)OCO3 ZINC000015147380 FG Annotated Anodyne CO[C@]12C(=O)c3cc4ccoc4cc3O[C@@H]1COc1cc3c(cc12)OCO3 ZINC000015147382 FG Annotated Anodyne CO[C@@]12C(=O)c3cc4ccoc4cc3O[C@H]1COc1cc3c(cc12)OCO3 ZINC000015147384 FG Annotated Anodyne CO[C@]12C(=O)c3cc4ccoc4cc3O[C@H]1COc1cc3c(cc12)OCO3 ZINC000015147386 FG Annotated Anodyne CC(=O)O[C@H](Cc1cc2cc3ccoc3cc2oc1=O)C(C)(C)OC(C)=O ZINC000015150241 FG Annotated Anodyne CC(C)=CC[C@@]12C[C@H](C(C)(C)O)[C@@](C)(C1=O)C(O)=C(C(=O)C(C)C)C2=O ZINC000015151226 FG Annotated Mild C/C=C(\C)C(=O)OC[C@]1(c2cc(OC)c(C)cc2OC(=O)C(C)C)CO1 ZINC000015169468 FG Annotated Anodyne C/C=C(\C)C(=O)Oc1cc(C)c(OC)cc1[C@]1(COC(=O)C(C)C)CO1 ZINC000015169474 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@@]23COC(=O)C2=CCC[C@@H]3[C@@]1(C)CC(=O)c1ccoc1 ZINC000015193766 FG Annotated Anodyne COc1cc2c(c(O)c1[C@@H]1COc3cc4occc4cc3C1=O)OCO2 ZINC000015203329 FG Annotated Anodyne COc1cc2c(c(O)c1[C@H]1COc3cc4occc4cc3C1=O)OCO2 ZINC000015203331 FG Annotated Anodyne CC[C@H]1CN(C)C[C@@]2(C(=O)OC)Cc3c([nH]c4ccccc34)C(=O)C[C@@H]12 ZINC000015203396 FG Annotated Anodyne COc1cc2c(cc1OC)[C@H]1Cc3cc4c(cc3[C@@H](C2)[N+]1(C)[O-])OCO4 ZINC000015204427 FG Annotated Bother in-vitro biogenic COc1cc2c(cc1OC)[C@H]1Cc3cc4c(cc3[C@@H](C2)[N+]1(C)C)OCO4 ZINC000015204431 FG Annotated Bother COc1cc([C@H]2Oc3cc(C=O)cc(OC)c3O[C@@H]2C)cc(OC)c1OC ZINC000015211460 FG Annotated Anodyne COc1cc([C@@H]2Oc3cc(C=O)cc(OC)c3O[C@H]2C)cc(OC)c1OC ZINC000015211464 FG Annotated Anodyne C=CCC1=C[C@](OC)([C@@H](C)C(=O)c2ccc3c(c2)OCO3)C(OC)=CC1=O ZINC000015212912 FG Annotated Mild COc1ccc2c3c(c(=O)n(C)c2c1OC[C@H]1OC1(C)C)C=CC(C)(C)O3 ZINC000015216904 FG Annotated Anodyne COc1c2c(c(O)c3c(=O)c4ccc(O)c(O)c4oc13)C(C)(C)[C@H](C)O2 ZINC000015256069 FG Annotated Clean COc1ccc2c(c1)O[C@@H]1c3cc4cc(C(C)(C)O)oc4cc3OC[C@]21O ZINC000015261717 FG Annotated Anodyne in-man COc1ccc2c(c1)O[C@H]1c3cc4cc(C(C)(C)O)oc4cc3OC[C@]21O ZINC000015261718 FG Annotated Anodyne in-man COc1ccc2c(c1)O[C@@H]1c3cc4cc(C(C)(C)O)oc4cc3OC[C@@]21O ZINC000015261719 FG Annotated Anodyne in-man COc1ccc2c(c1)O[C@H]1c3cc4cc(C(C)(C)O)oc4cc3OC[C@@]21O ZINC000015261720 FG Annotated Anodyne in-man COC1=CC(=O)c2cc3c(cc2C1=O)C(=O)c1occ2c1[C@@]3(C)CCC2=O ZINC000015266381 FG Annotated Mild COc1c2c(cc3oc(C)cc(=O)c13)OC(C)(C)[C@H](OC(=O)C(C)C)C2 ZINC000015266975 FG Annotated Anodyne C/C=C(/C)C(=O)O[C@@H]1Cc2c(cc3oc(C)cc(=O)c3c2O)OC1(C)C ZINC000015267003 FG Annotated Anodyne in-vitro biogenic C/C=C(/C)C(=O)O[C@H]1Cc2c(cc3oc(C)cc(=O)c3c2O)OC1(C)C ZINC000015267005 FG Annotated Anodyne CC(C)=CC(=O)O[C@H]1Cc2c(cc3oc(C)cc(=O)c3c2O)OC1(C)C ZINC000015267008 FG Annotated Anodyne Cc1ccc(-n2c(C)nnc2SCC(=O)Nc2ccc(C#N)cc2)cc1 ZINC000015274751 FG Annotated Mild Fc1cc(Br)cnc1Nc1ccc([C@H]2CNCCO2)cc1 ZINC000150035775 FG Annotated Anodyne Cc1nc2cc(-n3ncc(C(=O)c4[nH]c5ccccc5c4F)c3N)ccc2[nH]1 ZINC000150172852 FG Annotated Anodyne CO[C@@H]1C[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@]4(C)[C@H]3C[C@@H](O)[C@]2(C)[C@H]1C(C)=O ZINC000152835559 FG Annotated Mild CN[C@H]1CC[C@@]2(C)C(=C[C@H](O)[C@@H]3[C@@H]2CC[C@]24C(=O)O[C@@H](C)[C@H]2CC[C@@H]34)C1 ZINC000152945806 FG Annotated Anodyne CN[C@H]1CC[C@@]2(C)C(=CC[C@@H]3[C@@H]2[C@H](O)C[C@]24C(=O)O[C@@H](C)[C@H]2CC[C@@H]34)C1 ZINC000152946336 FG Annotated Anodyne O=C(CC(c1ccccc1)c1ccccc1)NNC(=O)c1ccccc1O ZINC000015544171 FG Annotated Reactive in-vitro CCCCc1c(C)nc2nc(NCc3ccc(OCC)cc3)nn2c1O ZINC000015668902 FG Annotated Anodyne COc1cc(CNc2nc3nc(C(C)C)cc(O)n3n2)ccc1OC(C)C ZINC000015668972 FG Annotated Anodyne CCCCOc1ccc(CNc2nc3nc4c(c(O)n3n2)CCC4)cc1 ZINC000015669040 FG Annotated Anodyne CCCCOc1ccc(CNc2nc3nc4c(c(O)n3n2)CCCC4)cc1 ZINC000015669044 FG Annotated Anodyne CC(C)Oc1ccc(CNc2nc3nc4c(c(O)n3n2)CCCC4)cc1 ZINC000015669045 FG Annotated Anodyne COc1cc(C2=NN(C(C)=O)[C@@H](c3cccc(F)c3)O2)cc(OC)c1OC ZINC000015861226 FG Annotated Anodyne COc1cc(C2=NN(C(C)=O)[C@H](c3cccc(F)c3)O2)cc(OC)c1OC ZINC000015861227 FG Annotated Anodyne O=C1c2nc3cc(-c4ccccc4)nn3c(O)c2CN1Cc1ccccc1 ZINC000015923338 FG Annotated Anodyne CCOC(=O)/C=C1\CN([C@@H](C)c2ccccc2)S(=O)(=O)c2ccccc21 ZINC000015933950 FG Annotated Anodyne Cc1cc2cc(C#N)c(SCC(=O)Nc3nonc3C)nc2cc1C ZINC000015935249 FG Annotated Mild CCN1C(C)=C(C(=O)OC)[C@H](c2cccc(F)c2)N/C1=N\Cc1ccco1 ZINC000015935302 FG Annotated Mild O=S1(=O)CCO[C@H]2Cc3ccccc3[C@H]2N1Cc1ccc(Cl)cc1 ZINC000015937151 FG Annotated Anodyne Cc1ccccc1CN1[C@@H](CC2CCCCC2)COCCS1(=O)=O ZINC000015937244 FG Annotated Anodyne O=S1(=O)CCOC[C@H](CC2CCCCC2)N1Cc1cccc(F)c1 ZINC000015937247 FG Annotated Anodyne O=S1(=O)CCOC[C@H](CC2CCCCC2)N1Cc1ccccc1F ZINC000015937308 FG Annotated Anodyne O=S1(=O)CCO[C@H]2Cc3ccccc3[C@H]2N1Cc1cccc(Cl)c1 ZINC000015937335 FG Annotated Anodyne O=S1(=O)CCOC[C@H](CC2CCCCC2)N1Cc1ccc(F)cc1 ZINC000015937337 FG Annotated Anodyne O=C(Nc1ccc2c(c1)OCO2)O[C@H]1C[C@@H]2CCN3C(=O)CCC[C@H](C1)[C@H]23 ZINC000015937340 FG Annotated Anodyne Cc1ccc(CN2[C@@H](CC3CCCCC3)COCCS2(=O)=O)cc1 ZINC000015937342 FG Annotated Anodyne O=S1(=O)CCOC[C@H](c2ccccc2)N1Cc1cccc(Cl)c1 ZINC000015937343 FG Annotated Anodyne O=S1(=O)CCOC[C@H](c2ccccc2)N1Cc1ccc(Cl)cc1 ZINC000015937360 FG Annotated Anodyne COc1ccc(NC(=O)c2[nH]cnc2C(=O)N[C@H](C)c2ccccc2)cc1 ZINC000015952238 FG Annotated Anodyne COc1ccc(NC(=O)c2[nH]cnc2C(=O)N[C@@H](C)c2ccccc2)cc1 ZINC000015952254 FG Annotated Anodyne COc1ccc(OC)c(S(=O)(=O)Oc2ccc(N)c3ccccc23)c1 ZINC000015952487 FG Annotated Anodyne O=C1C=C/C(=C\NNc2nc(-c3cccnc3)nc3ccccc23)C(O)=C1 ZINC000015952527 FG Annotated Mild CCc1nnc(S)n1N/C=C1\C=Nc2ccc(Br)cc21 ZINC000015953009 FG Annotated Anodyne COC1=CC(=C/C(CC(=O)O)=C2/Nc3ccccc3S2)C=C(OC)C1=O ZINC000015953011 FG Annotated Mild COC1=C/C(=C/C(C#N)=C2/Nc3ccccc3S2)C=C([N+](=O)[O-])C1=O ZINC000015953248 FG Annotated Reactive CC(C)Cc1nn2c(N)c(/C=C3\C=Nc4ccccc43)c(=O)nc2s1 ZINC000015953319 FG Annotated Anodyne CSc1ccc(C(=O)[C@@H]2CCCN(C(=O)/C=C/c3cnn(C)c3)C2)cc1 ZINC000015961675 FG Annotated Anodyne CSc1ccc(C(=O)[C@H]2CCCN(C(=O)/C=C/c3cnn(C)c3)C2)cc1 ZINC000015961677 FG Annotated Anodyne COC1=C/C(=C\C=C2\C=Cc3cccc(OC)c3N2)C(=O)C([N+](=O)[O-])=C1 ZINC000015962192 FG Annotated Mild CSc1nsc2nc(=O)c(/C=C3\C(C)=Nc4ccc(C)cc43)c(N)n12 ZINC000015962428 FG Annotated Anodyne CC(C)Sc1nsc2nc(=O)c(/C=C3\C=Nc4ccccc43)c(N)n12 ZINC000015962528 FG Annotated Anodyne CCc1c(C(=O)NN/C=C2\C=NN=C2c2ccc(F)cc2)csc1C ZINC000015973857 FG Annotated Reactive COC1=C/C(=C/NNC(=O)C2c3ccccc3Oc3ccccc32)C=CC1=O ZINC000015974585 FG Annotated Reactive Cc1cc(C(=O)N/N=C\c2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)[nH]n1 ZINC000015979264 FG Annotated Reactive O=[N+]([O-])c1ccc(Cl)c(/C=N\n2c(S)nnc2-c2ccncc2)c1 ZINC000015987608 FG Annotated Mild CCc1n[nH]c(=S)n1/N=C\c1cc(Br)c(OC)cc1OC ZINC000015987964 FG Annotated Mild COc1ccc2ccccc2c1/C=N\NC(=O)c1sc(N)c(C#N)c1C ZINC000015990515 FG Annotated Reactive CC(C)=CC[C@@]12C[C@@H](C(C)(C)O)[C@@](C)(C1=O)C(O)=C(C(=O)C(C)C)C2=O ZINC000156384715 FG Annotated Mild C=C(C)[C@@H]1Cc2oc(cc2C(=O)OC)/C=C(\C)C[C@H]2C=C(CC1=O)C(=O)O2 ZINC000156952482 FG Annotated Mild COc1cc2c(cc1OC)C[N+]1([O-])CCc3cc(OC)c(OC)cc3[C@@H]1C2 ZINC000157403203 FG Annotated Bother Fc1ccc(N2CCN(Cn3nc(-c4ccncc4)oc3=S)CC2)cc1 ZINC000016078657 FG Annotated Anodyne CO[C@@H]1C[C@@]2(CC[C@@]3(O2)[C@H](C)C[C@H]2OC(=O)[C@@]4(C)CCC[C@@]3(C)[C@@H]24)CO1 ZINC000163774563 FG Annotated Anodyne CCN1CC[C@](O)(c2ccc(OC)cc2)[C@@H](C(=O)c2ccc(OC)cc2)C1 ZINC000016957790 FG Annotated Anodyne COc1ccc(N2c3ccccc3-c3cc[nH]c(=O)c3[C@H]2O)cc1OC ZINC000016978038 FG Annotated Anodyne CN1C[C@@H]2CCN(c3ccc(-c4ccc(-n5ncccc5=O)cc4)cc3)[C@H]2C1 ZINC000165075779 FG Annotated Anodyne in-man CCCCCOC(=O)[C@H]1[C@@H]2C=C[C@]3(CN(c4ccccc4C)C(=O)[C@@H]13)O2 ZINC000165569145 FG Annotated Anodyne Cc1cccc(-c2nnc3n2CCN(C(=O)c2ccc(F)cc2)[C@@H]3C)n1 ZINC000165844400 FG Annotated Anodyne COC1=C2C(C)(C)C(=O)CC[C@]2(C)c2c(O)c3c(c(O)c2C1=O)C[C@H](C)O3 ZINC000165945095 FG Annotated Mild CC[C@@H](C)C(=O)O[C@H]1C[C@@]2(C)O[C@]23C[C@@H]2[C@H](C)C(=O)O[C@@H]2C[C@@H](C)[C@H]13 ZINC000165950298 FG Annotated Anodyne COC1=CC(=O)c2cc3c(cc2C1=O)[C@]1(C)CCC(=O)c2coc(c21)C3=O ZINC000166400661 FG Annotated Mild Nc1c(C(=O)c2ccc(F)cc2F)ccc(=O)n1-c1c(F)cccc1F ZINC000166504101 FG Annotated Anodyne CC(C)(Nc1ncc(C(=O)NO)cn1)c1ccc(C(F)(F)F)cc1F ZINC000166685620 FG Annotated Anodyne C=C(CCCC(C)=O)[C@H](C(=O)O)[C@H](CC=O)/C(C=O)=C1/C=CC(C)(C)O1 ZINC000166760071 FG Annotated Reactive Cc1cc(C(F)(F)F)cc(C2(Nc3ncc(C(=O)NO)cn3)CC2)c1 ZINC000166960898 FG Annotated Anodyne Cc1cc(C)c(C(=O)N2C[C@@H]3CN(c4nc(C)cc(C)n4)C[C@@H]3C2)c(C)c1 ZINC000167033039 FG Annotated Anodyne Cc1cc(C)c(C(=O)N2C[C@H]3CN(c4nc(C)cc(C)n4)C[C@@H]3C2)c(C)c1 ZINC000167033169 FG Annotated Anodyne Cc1cc(C)c(C(=O)N2C[C@@H]3CN(c4nc(C)cc(C)n4)C[C@H]3C2)c(C)c1 ZINC000167033272 FG Annotated Anodyne CCc1ccccc1C(=O)N1C[C@@H]2CN(c3cnc4ccccc4n3)C[C@@H]2C1 ZINC000167075246 FG Annotated Anodyne CCc1ccccc1C(=O)N1C[C@H]2CN(c3cnc4ccccc4n3)C[C@@H]2C1 ZINC000167075356 FG Annotated Anodyne CCc1ccccc1C(=O)N1C[C@@H]2CN(c3cnc4ccccc4n3)C[C@H]2C1 ZINC000167075469 FG Annotated Anodyne Cc1ncnc(-c2ccc(C(F)(F)F)nc2)c1C#Cc1ccc(N)nc1 ZINC000167266829 FG Annotated Mild O=CN[C@@H]1CC[C@@H](CCN2CCC(c3cccc4c3CCO4)CC2)CC1 ZINC000168856231 FG Annotated Anodyne CCc1nn(Cc2ccc(NC(=O)C3CCC3)cc2)c(CC)c1CC(=O)O ZINC000168890714 FG Annotated Anodyne CCc1nn(Cc2ccc(NC(=O)C(C)C)cc2)c(CC)c1CC(=O)O ZINC000168892506 FG Annotated Anodyne C[C@]1(Nc2ccc(C(=O)NO)cc2)CCN(c2ccc(Cl)cc2)C1=O ZINC000169075644 FG Annotated Anodyne C[C@@]1(Nc2ccc(C(=O)NO)cc2)CCN(c2ccc(Cl)cc2)C1=O ZINC000169075726 FG Annotated Anodyne Nc1nc2c(c(N3C[C@H]4NCCC[C@@H]4C3)n1)CCCC[C@@H]2c1ccccc1 ZINC000169289624 FG Annotated Anodyne C=C1C(=O)O[C@H]2C[C@](C)(O)CCC[C@](C)(OO)C/C=C\[C@@]3(C)O[C@H]3C[C@@H]12 ZINC000169290226 FG Annotated Reactive CC(=O)O[C@@H]1C/C=C(\C)C[C@H]2O[C@H]3[C@@H]4[C@H]2C(C)=CC(=O)[C@@H]4[C@@H](C)CO[C@]31C ZINC000169290311 FG Annotated Mild C=C1C(=O)O[C@H]2/C=C(\C)C[C@@H]3C=C(C/C=C\[C@@](C)(OO)CC[C@H]12)C(=O)O3 ZINC000169292603 FG Annotated Reactive C=C1C(=O)O[C@H]2/C=C(/C)C[C@@H]3C=C(C/C=C\[C@@](C)(OO)CC[C@H]12)C(=O)O3 ZINC000169292604 FG Annotated Reactive C=C1C(=O)O[C@H]2/C=C(/C)C[C@@H]3C=C(C/C=C/[C@@](C)(OO)CC[C@H]12)C(=O)O3 ZINC000169292605 FG Annotated Reactive CC[C@@H]1C/C=C/Cc2ccccc2[C@@H](C(=O)C[C@@H](O)CC(C)=O)OC1=O ZINC000169293255 FG Annotated Anodyne CC[C@H]1C/C=C/Cc2ccccc2[C@@H](C(=O)C[C@@H](O)CC(C)=O)OC1=O ZINC000169294002 FG Annotated Anodyne O=C(O)[C@@H]1Nc2c(cccc2S(=O)(=O)c2ccccc2)[C@@H]2C=CC[C@H]12 ZINC000169294359 FG Annotated Clean O=C(O)[C@H]1Nc2c(cccc2S(=O)(=O)c2ccccc2)[C@@H]2C=CC[C@H]12 ZINC000169294360 FG Annotated Clean CC1(C)O[C@H]2C3=C([C@H]2O1)[C@@H](c1ccccc1)[C@H](C(C)(C)O)/C=C/C=C3CO ZINC000169295528 FG Annotated Anodyne CC1(C)O[C@H]2C3=C([C@H]2O1)[C@@H](c1ccccc1)[C@H](C(C)(C)O)C=C/C=C/3CO ZINC000169295529 FG Annotated Anodyne CC1(C)O[C@H]2C3=C([C@H]2O1)[C@@H](c1ccccc1)[C@H](C(C)(C)O)/C=C/C=C/3CO ZINC000169295530 FG Annotated Anodyne Nc1cc2c(cc1Cl)NC(=O)Nc1cncc(n1)OCC/C=C\CO2 ZINC000169295618 FG Annotated Anodyne C/C(=N/NC(=N)O)C1=C(O)[C@@H](c2ccccc2)N(C2CCCCC2)C1=O ZINC000169295895 FG Annotated Mild C[C@@H]1CCC[C@@H](C)N1C[C@@H](O)CO/N=C(\Cl)c1nc2ccccc2o1 ZINC000169297361 FG Annotated Mild C[C@H]1CCC[C@@H](C)N1C[C@@H](O)CO/N=C(\Cl)c1nc2ccccc2o1 ZINC000169297363 FG Annotated Mild C[C@H]1CCC[C@H](C)N1C[C@@H](O)CO/N=C(\Cl)c1nc2ccccc2o1 ZINC000169297364 FG Annotated Mild COc1ccc(N2C(=O)[C@@H]3CCCN3[C@@H]2c2cccc(OC)c2OC)cc1 ZINC000169297549 FG Annotated Anodyne COc1c2c(c(C(C)(C)[C@H]3CO3)c3oc(=O)ccc13)OC(C)(C)[C@H]1O[C@@H]21 ZINC000169298178 FG Annotated Anodyne COc1c2c(c(C(C)(C)[C@H]3CO3)c3oc(=O)ccc13)OC(C)(C)[C@H]1O[C@H]21 ZINC000169298180 FG Annotated Anodyne C[C@@H]1C[C@@H](C)CN(C[C@@H](O)CO/N=C(\Cl)c2nc3ccccc3o2)C1 ZINC000169298761 FG Annotated Mild C[C@H]1C[C@@H](C)CN(C[C@@H](O)CO/N=C(\Cl)c2nc3ccccc3o2)C1 ZINC000169298762 FG Annotated Mild C[C@H]1C[C@H](C)CN(C[C@@H](O)CO/N=C(\Cl)c2nc3ccccc3o2)C1 ZINC000169298764 FG Annotated Mild CC[C@@H]1C/C=C/Cc2ccccc2[C@H](C(=O)C[C@@H](O)CC(C)=O)OC1=O ZINC000169299112 FG Annotated Anodyne COc1ccc(NC(=O)[C@H]2C(=O)N(C)[C@]3(C)C[C@@H]2c2ccccc2O3)cc1 ZINC000169299149 FG Annotated Anodyne CC(C)OC(=O)[C@@H]1O[C@@H](CCCCOCc2ccccc2)[C@@H](C)[C@@H]2O[C@@H]21 ZINC000169300798 FG Annotated Anodyne CC(C)OC(=O)[C@H]1O[C@@H](CCCCOCc2ccccc2)[C@@H](C)[C@@H]2O[C@H]12 ZINC000169300799 FG Annotated Anodyne CC(C)OC(=O)[C@@H]1O[C@H](CCCCOCc2ccccc2)[C@@H](C)[C@@H]2O[C@@H]21 ZINC000169300800 FG Annotated Anodyne CC(C)OC(=O)[C@H]1O[C@H](CCCCOCc2ccccc2)[C@@H](C)[C@@H]2O[C@H]12 ZINC000169300801 FG Annotated Anodyne Cc1cc(N2CC[C@@H](N3CCC[C@@H]3C)C2)ccc1NC(=O)[C@@H]1CCCO1 ZINC000169301242 FG Annotated Anodyne Cc1cc(NC(=O)[C@H]2CCCO2)ccc1N1CC[C@@H](N2CCC[C@@H]2C)C1 ZINC000169301297 FG Annotated Anodyne C[C@]12CC[C@H]3[C@@H](C=CC4=CC(=O)CC[C@@]43C)[C@@H]1[C@@H](O)C[C@@]21CCC(=O)O1 ZINC000169302450 FG Annotated Mild C[C@]12CC[C@H]3[C@@H](C=CC4=CC(=O)CC[C@@]43C)[C@@H]1C[C@H](O)[C@@]21CCC(=O)O1 ZINC000169302454 FG Annotated Mild O=C(N[C@@H]1CCCc2c1cnn2-c1ccc(F)cc1F)c1cccc(O)n1 ZINC000169303416 FG Annotated Anodyne O=C(N[C@H]1CCCc2c1cnn2-c1ccc(F)cc1F)c1cccc(O)n1 ZINC000169303417 FG Annotated Anodyne Cc1cccc(C)c1NC(=O)[C@@H]1c2ccccc2OCC(=O)N1C1CC1 ZINC000169303765 FG Annotated Anodyne Cc1cccc(C)c1NC(=O)[C@H]1c2ccccc2OCC(=O)N1C1CC1 ZINC000169303767 FG Annotated Anodyne C[C@H]1C(=O)[C@H](C)[C@@H](c2ccc3c(c2)OCO3)N[C@@H]1c1ccc2c(c1)OCO2 ZINC000169303786 FG Annotated Anodyne COC(=O)c1cc(Cl)cnc1N1CCC(NC2CCCCC2)CC1 ZINC000169303956 FG Annotated Anodyne O=C1C(Nc2ccccc2)=C(N2CCSCC2)C(=O)c2ccccc21 ZINC000169304052 FG Annotated Mild CC(C)[C@H](NC(=O)OC(C)(C)C)c1cc(C(=O)NC2CC2)c(N)s1 ZINC000169304218 FG Annotated Anodyne CC(=O)O[C@H]1C[C@H]2/C=C\CCC[C@H](C)OC(=O)/C=C\[C@@H](OC(C)=O)[C@@H]2C1 ZINC000169305056 FG Annotated Anodyne CC(=O)O[C@H]1C[C@H]2/C=C/CCC[C@H](C)OC(=O)/C=C\[C@@H](OC(C)=O)[C@@H]2C1 ZINC000169305057 FG Annotated Anodyne COc1cccc(N2C(=O)[C@@H]3CCCN3[C@@H]2c2ccc(N(C)C)cc2)c1 ZINC000169305296 FG Annotated Clean S=C1NNC2(N1)[C@H]1CCC[C@H]2[C@@H](c2ccccc2)N[C@@H]1c1ccccc1 ZINC000169306286 FG Annotated Anodyne CCN1C(NCc2ccc(Cl)nc2)=C([N+](=O)[O-])[C@H](C)C[C@@H]1OC(C)C ZINC000169306437 FG Annotated Anodyne CCO[C@@H]1C[C@@H](C)C([N+](=O)[O-])=C(N(CC)Cc2ccc(Cl)nc2)N1C ZINC000169306449 FG Annotated Anodyne CCO[C@@H]1C[C@H](C)C([N+](=O)[O-])=C(N(CC)Cc2ccc(Cl)nc2)N1C ZINC000169306450 FG Annotated Anodyne CS(=O)(=O)c1ccc(-c2cnc3ccc(-c4cccc(C#N)c4)nn23)cc1 ZINC000169306672 FG Annotated Mild CCOC(=O)[C@@H]1CCc2ncc3c(c2C1)C(=O)C1=C(C3=O)C2CCC1CC2 ZINC000169306926 FG Annotated Mild CCOC(=O)[C@H]1CCc2ncc3c(c2C1)C(=O)C1=C(C3=O)C2CCC1CC2 ZINC000169306928 FG Annotated Mild NC(=S)n1nc(-c2ccc([N+](=O)[O-])cc2)c(/N=N/c2cccnc2)c1O ZINC000169306963 FG Annotated Clean C[C@](O)(COc1ccc(Cl)cc1F)C(=O)N1CCc2c(C#N)cccc21 ZINC000169307056 FG Annotated Mild O=C(/C=N/O)c1ccc(OC[C@@H]2CCCCN2Cc2ccccc2)nc1 ZINC000169307266 FG Annotated Mild O=C(/C=N/O)c1ccc(OC[C@H]2CCCCN2Cc2ccccc2)nc1 ZINC000169307269 FG Annotated Mild Cc1ccc(/C=C2\CNC[C@H]3[C@H]2NC(=S)N[C@H]3c2ccc(C)cc2)cc1 ZINC000169308430 FG Annotated Anodyne Cc1ccc(/C=C2\CNC[C@@H]3[C@H]2NC(=S)N[C@H]3c2ccc(C)cc2)cc1 ZINC000169308432 FG Annotated Anodyne Fc1ccc(/C=C2\CNC[C@H]3[C@H]2NC(=S)N[C@H]3c2ccc(F)cc2)cc1 ZINC000169308438 FG Annotated Anodyne Fc1ccc(/C=C2\CNC[C@@H]3[C@H]2NC(=S)N[C@H]3c2ccc(F)cc2)cc1 ZINC000169308440 FG Annotated Anodyne C[C@]12C[C@H](c3ccoc3)OC(=O)[C@H]1CCC1=C(/C=C\CC2=O)C(=O)OC1 ZINC000169309842 FG Annotated Anodyne O=C1C(=O)c2c(oc3cc(O)c(O)cc23)-c2oc3cc(O)c(O)cc3c21 ZINC000169310022 FG Annotated Clean O=C(Cn1cc(-c2ccc(F)cc2F)nn1)NC12CC3CC(CC(C3)C1)C2 ZINC000169310927 FG Annotated Anodyne Fc1ccc(OCCO/N=C2\c3ccccc3OC[C@@H]2n2ccnc2)cc1 ZINC000169311213 FG Annotated Mild Fc1ccc(OCCO/N=C2\c3ccccc3OC[C@H]2n2ccnc2)cc1 ZINC000169311214 FG Annotated Mild Fc1cccc(OCCO/N=C2\c3ccccc3OC[C@@H]2n2ccnc2)c1 ZINC000169311215 FG Annotated Mild Fc1cccc(OCCO/N=C2\c3ccccc3OC[C@H]2n2ccnc2)c1 ZINC000169311217 FG Annotated Mild CCOc1nc(C2CC2)c(C(=O)NC2[C@H]3CC4C[C@@H]2CC(O)(C4)C3)s1 ZINC000169311389 FG Annotated Anodyne COC1=CC(=O)c2c(c(COc3ccc([N+](=O)[O-])c(C)c3)c(C)n2C)C1=O ZINC000169312255 FG Annotated Mild COC1=CC(=O)c2c(c(C)c(COc3ccc([N+](=O)[O-])c(C)c3)n2C)C1=O ZINC000169312256 FG Annotated Mild N#Cc1c(N)nc(SCc2cscn2)nc1-c1ccc2c(c1)OCO2 ZINC000169312325 FG Annotated Mild C=C1C(=O)[C@]23CC[C@H]1C[C@H]2[C@@]12CCC[C@@]4(C)[C@H]5OCCN5[C@H]1O[C@@H]3C[C@@H]24 ZINC000169312917 FG Annotated Mild C=C1C(=O)[C@]23CC[C@H]1C[C@H]2[C@@]12CCC[C@@]4(C)[C@@H]5OCCN5[C@H]1O[C@@H]3C[C@@H]24 ZINC000169312920 FG Annotated Mild Cc1ccn2c(=O)c(NC(=O)N(Cc3ccccc3)C(C)C)cnc2c1 ZINC000169313101 FG Annotated Anodyne COC1=C[C@@H](C(=O)NCc2ccccn2)[C@@H](C)[C@@H](c2ccccc2)CC1=O ZINC000169313951 FG Annotated Mild COC1=C[C@@H](C(=O)NCc2ccccn2)[C@H](C)[C@@H](c2ccccc2)CC1=O ZINC000169313953 FG Annotated Mild O=c1n(CCc2ccccc2)c2cccnc2n1-c1ccc2c(c1)OCO2 ZINC000169316536 FG Annotated Anodyne CN(C)CCCN1C(=O)N[C@@H](c2cc(Cl)c(Cl)cc2Cl)C1=O ZINC000169317129 FG Annotated Anodyne CN(C)CCCN1C(=O)N[C@H](c2cc(Cl)c(Cl)cc2Cl)C1=O ZINC000169317131 FG Annotated Anodyne CCN(CC)Cc1cc(NC(=S)N/N=C(\C)c2ccccn2)ccc1O ZINC000169317601 FG Annotated Mild C/C=C1/C[N+]2([O-])[C@H]3C[C@H]1[C@@H]1[C@H](OC(C)=O)[C@@]4(C[C@@H]12)C3=Nc1ccccc14 ZINC000169318693 FG Annotated Bother CC(=O)C1=C(O)/C(=C(\C)Nc2c(Cl)cccc2Cl)C(=O)OC1=O ZINC000169320189 FG Annotated Reactive COc1ccc2c(c1)CCc1cnn(CCN(CCCl)CCCl)c1-2 ZINC000169320679 FG Annotated Reactive C1CN(C2CCC3(CC2)OOC2(OO3)C3CC4CC(C3)CC2C4)CCO1 ZINC000169321448 FG Annotated Reactive Cc1ccc([C@@H]2[C@@H]([N+](=O)[O-])[C@@H]3CCCN3[C@@]23C(=O)Nc2ccccc23)cc1 ZINC000169322066 FG Annotated Bother Cc1ccc([C@@H]2[C@H]([N+](=O)[O-])[C@@H]3CCCN3[C@@]23C(=O)Nc2ccccc23)cc1 ZINC000169322068 FG Annotated Bother Cc1noc(C)c1-c1ccc2c(c1)[C@@H](OCCCN1CCNCC1)CC2 ZINC000169322590 FG Annotated Anodyne Cc1noc(C)c1-c1ccc2c(c1)[C@H](OCCCN1CCNCC1)CC2 ZINC000169322591 FG Annotated Anodyne COc1ccc(Cc2nccc3ccccc23)c(NC(=O)[C@@H](C)N)c1OC ZINC000169323668 FG Annotated Anodyne COc1ccc(Cc2nccc3ccccc23)c(NC(=O)[C@H](C)N)c1OC ZINC000169323669 FG Annotated Anodyne N=C(NCCCNC(=N)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl ZINC000169323815 FG Annotated Anodyne Cn1/c(=N\N/C=C/c2sc3ccccc3[n+]2C)sc2ccccc21 ZINC000169323930 FG Annotated Anodyne Cn1/c(=N\N/C=C/c2sc3ccc(F)cc3[n+]2C)sc2ccccc21 ZINC000169323936 FG Annotated Anodyne COc1ccccc1[C@H]1N(c2cccc(S(C)(=O)=O)c2)C(=O)C1(C)C ZINC000169324193 FG Annotated Anodyne CCOC(=O)N1CCN(CC2=Cc3c(Cl)ccc(OC)c3CC2)CC1 ZINC000169324757 FG Annotated Anodyne Nc1ncnc2c1C(=O)N(c1ccc(-c3ccccc3Cl)cc1)CCO2 ZINC000169324817 FG Annotated Anodyne CCN(CC)CCOc1ccc(CNC2=NCCc3ccccc32)cc1 ZINC000169325281 FG Annotated Anodyne Cc1[nH]n(-c2ccc(S(=O)(=O)O)cc2)c(=O)c1/N=N\c1ccccc1 ZINC000169325500 FG Annotated Clean Cc1[nH]n(-c2ccc(S(=O)(=O)O)cc2)c(=O)c1/N=N/c1ccccc1 ZINC000169325501 FG Annotated Clean CC(C)Nc1ncc2c(n1)CN(C(=O)NCc1cccc(Cl)c1)CC2 ZINC000169325641 FG Annotated Anodyne CN(C)CCCOc1ccc2nc(O)n(-c3ccc(N(C)C)cc3)c2c1 ZINC000169326295 FG Annotated Anodyne COc1nc2ccccc2cc1/C=C/C(=O)NC1=C(C(=O)O)CCCC1 ZINC000169326324 FG Annotated Anodyne COc1ccc2cc(-c3cn(CC(=O)Nc4cc(C)on4)nn3)ccc2c1 ZINC000169326771 FG Annotated Anodyne COc1cc(F)ccc1Cn1ccc2c3c(ncc21)C(=O)N(O)C(C)(C)C3 ZINC000169326990 FG Annotated Clean COc1cc(F)ccc1Cn1ccc2c3c(ncc21)C(=O)N(O)C3(C)C ZINC000169326996 FG Annotated Anodyne CCOc1cc(F)ccc1Cn1ccc2c3c(ncc21)C(=O)N(O)CC3 ZINC000169327002 FG Annotated Clean CCCc1cc(=O)oc2cc(N3CCNCC3)c3c(c12)OC(C)(C)C=C3 ZINC000169327217 FG Annotated Anodyne O=C1/C(=C/c2ccccc2[N+](=O)[O-])SC(=S)N1Cc1ccncc1 ZINC000169327322 FG Annotated Clean C[N+]1(C)CCN(c2ccc3cc(C#N)c4nc5ccccc5n4c3c2)CC1 ZINC000169327404 FG Annotated Mild COC1=C(OC)/C(=C/Cn2cc(-c3ccc(C(C)(C)C)cc3)nn2)OC1=O ZINC000169327689 FG Annotated Anodyne COC(=O)[C@H]1C[C@@H](c2coc3ccccc3c2=O)N(c2ccccc2)O1 ZINC000169328136 FG Annotated Anodyne C=C(C)COCn1c([C@@H](F)c2cc(C)cc(C)c2)c(CC)c(=O)[nH]c1=O ZINC000169328316 FG Annotated Mild C=C(C)COCn1c([C@H](F)c2cc(C)cc(C)c2)c(CC)c(=O)[nH]c1=O ZINC000169328318 FG Annotated Mild CN(C)CCCOc1ccc2c(c1)nc(N)n2-c1ccc(N(C)C)cc1 ZINC000169328344 FG Annotated Anodyne CN(C)CCCOc1ccc2nc(N)n(-c3cccc(N(C)C)c3)c2c1 ZINC000169328346 FG Annotated Anodyne COc1ccc(Cl)c2c(NCCCN(C)C)c3c(C)nn(C)c3nc12 ZINC000169328568 FG Annotated Anodyne Cn1nc(C(F)(F)F)cc1OC[C@@H]1CN1Cc1cnc2ccccc2c1 ZINC000169328776 FG Annotated Anodyne Cn1nc(C(F)(F)F)cc1OC[C@H]1CN1Cc1cnc2ccccc2c1 ZINC000169328778 FG Annotated Anodyne Cn1nc(C(F)(F)F)cc1OC[C@@H]1CN1Cc1ccnc2ccccc12 ZINC000169328786 FG Annotated Anodyne Cn1nc(C(F)(F)F)cc1OC[C@H]1CN1Cc1ccnc2ccccc12 ZINC000169328788 FG Annotated Anodyne C=C[C@@H]1C(=C)CC[C@H]2[C@H]1C[C@H]1OC(=O)[C@@]3(C)[C@H](OC(C)=O)CC[C@@]2(C)[C@@]13O ZINC000169330486 FG Annotated Mild O=[N+]([O-])c1ccc(CSc2nnnn2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000169331294 FG Annotated Bother CCCCCCn1nnnc1SCc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000169331302 FG Annotated Bother O=[N+]([O-])c1cc(CSc2nnnn2C2CCCCC2)cc([N+](=O)[O-])c1 ZINC000169331304 FG Annotated Bother C[C@@H]1CC[C@@H]2[C@@H](C)[C@](O)(C(F)(F)F)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@]32OO4 ZINC000169331752 FG Annotated Reactive C[C@@H]1CC[C@@H]2[C@@H](C)[C@](O)(C(F)(F)F)O[C@H]3O[C@]4(C)CC[C@@H]1[C@]32OO4 ZINC000169331753 FG Annotated Reactive C[C@@H]1CC[C@H]2[C@@H](C)[C@](O)(C(F)(F)F)O[C@H]3O[C@]4(C)CC[C@@H]1[C@]32OO4 ZINC000169331754 FG Annotated Reactive C[N+]1(C)CCN(c2c(C#N)c3nc4ccccc4n3c3ccccc23)CC1 ZINC000169331984 FG Annotated Mild Nc1nc(-c2cccc(NC(=O)c3cc4cc([N+](=O)[O-])ccc4[nH]3)c2)c[nH]1 ZINC000169331985 FG Annotated Bother CC(=O)[C@H]1CC[C@H]2[C@@H]3C[C@@H](C)[C@]4(O)CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C ZINC000169332170 FG Annotated Anodyne CC(=O)[C@H]1CC[C@H]2[C@@H]3C[C@H](C)[C@]4(O)CC(=O)CC[C@]4(C)[C@H]3[C@@H](O)C[C@]12C ZINC000169332171 FG Annotated Anodyne O=C(O)C1=C[C@@H](O)[C@@H]2C[C@H]3[C@H](CCCc4ccc(O)cc4)[C@H]4C=C[C@@H]1[C@@H]2[C@@H]34 ZINC000169332707 FG Annotated Anodyne COC(=O)[C@@]12Cc3ccccc3[C@@H]1C[C@@H](C)[C@@H](C)N2C(=O)C(F)(F)F ZINC000169333167 FG Annotated Anodyne COC(=O)[C@@]12Cc3ccccc3[C@H]1C[C@@H](C)[C@@H](C)N2C(=O)C(F)(F)F ZINC000169333169 FG Annotated Anodyne COC(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@H](CN1Cc1ccncc1)[C@@H]23 ZINC000169333596 FG Annotated Anodyne COC(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@H](CN1Cc1ccco1)[C@@H]23 ZINC000169333597 FG Annotated Anodyne O=C(O)CCC[C@@H]1[C@H]2CCCN3CCC[C@H](CN1Cc1ccncc1)[C@@H]23 ZINC000169333618 FG Annotated Anodyne O=C(Cc1ccccc1)NC1=C(c2ccoc2)C(=O)c2ccccc2C1=O ZINC000169334566 FG Annotated Mild COc1cc(OC)c(/C=N/NC(=O)Nc2c(C)cccc2C)c(OC)c1 ZINC000169335067 FG Annotated Reactive COC(=O)C[C@@H]1Sc2nc3ccccc3n2[C@@]1(O)c1ccc(Cl)cc1 ZINC000169335469 FG Annotated Anodyne COC(=O)C[C@H]1Sc2nc3ccccc3n2[C@@]1(O)c1ccc(Cl)cc1 ZINC000169335471 FG Annotated Anodyne COC(=O)C[C@@H]1Sc2nc3ccccc3n2[C@]1(O)c1ccc(Cl)cc1 ZINC000169335472 FG Annotated Anodyne COC(=O)C[C@H]1Sc2nc3ccccc3n2[C@]1(O)c1ccc(Cl)cc1 ZINC000169335473 FG Annotated Anodyne Cc1cc([C@H]2C[C@@H]3CSC(N)=N[C@@]3(c3ccc(F)cc3F)CO2)on1 ZINC000169335897 FG Annotated Anodyne Cc1nc2sc([C@@H](c3ccccc3)N3C[C@H](C)O[C@@H](C)C3)c(O)n2n1 ZINC000169335991 FG Annotated Anodyne Cc1nn(-c2ccccc2)c2[nH]c(=O)c(CNCc3cccc(C#N)c3)cc12 ZINC000169336038 FG Annotated Mild COC(=O)C1=CCC[C@H]2[C@@]34C[C@H](c5ccoc5)O[C@H]3O[C@H](O)[C@@]12CC[C@@H]4C ZINC000169336334 FG Annotated Anodyne COC(=O)C1=CCC[C@H]2[C@@]34C[C@H](c5ccoc5)O[C@H]3O[C@@H](O)[C@@]12CC[C@@H]4C ZINC000169336335 FG Annotated Anodyne C=C1C(=O)C2=C[C@@H]1CCC(=O)[C@@]1(C)CC[C@@H](OC(C)=O)C(C)(C)[C@@H]1C[C@@H]2O ZINC000169337199 FG Annotated Mild C=C1C(=O)C2=C[C@H]1CCC(=O)[C@@]1(C)CC[C@@H](OC(C)=O)C(C)(C)[C@@H]1C[C@@H]2O ZINC000169337201 FG Annotated Mild C=C1C(=O)C2=C[C@@H]1CCC(=O)[C@]1(C)CC[C@@H](OC(C)=O)C(C)(C)[C@@H]1C[C@@H]2O ZINC000169337203 FG Annotated Mild C=C1C(=O)C2=C[C@H]1CCC(=O)[C@]1(C)CC[C@@H](OC(C)=O)C(C)(C)[C@@H]1C[C@@H]2O ZINC000169337204 FG Annotated Mild O=c1oc2cccc(OCCCOc3ccccc3)c2c(O)c1[N+](=O)[O-] ZINC000169337528 FG Annotated Bother O=c1oc2c(OCCCOc3ccccc3)cccc2c(O)c1[N+](=O)[O-] ZINC000169337542 FG Annotated Bother CN1CC(COC(=O)NCCCl)=C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21 ZINC000169339647 FG Annotated Reactive N#Cc1c(NCCCNCCCN)c2ccccc2n2c1nc1ccccc12 ZINC000169339758 FG Annotated Mild C[C@@H]1CC[C@@H]2[C@@H](C)C(=O)N(Cc3ccccn3)[C@H]3O[C@@]4(C)CC[C@@H]1[C@]32O4 ZINC000169340713 FG Annotated Anodyne CC(C)NC(=O)OC[C@H]1O[C@H](C#Cc2ccc(C(C)(C)C)cc2)C=C[C@H]1O ZINC000169340772 FG Annotated Mild CCN1CCN(C2=C(Nc3ccccc3)C(=O)c3ccccc3C2=O)CC1 ZINC000169341090 FG Annotated Mild CC[C@@H]1C/C=C/Cc2ccccc2[C@H](C(=O)C[C@H](O)CC(C)=O)OC1=O ZINC000169341262 FG Annotated Anodyne CCN(CC)CCNC1=C(Nc2ccccc2)C(=O)c2ccccc2C1=O ZINC000169341871 FG Annotated Mild CN(C)C[C@@H](Br)c1cccc(I)c1 ZINC000169345629 FG Annotated Reactive CN(C)C[C@H](Br)c1cccc(I)c1 ZINC000169345631 FG Annotated Reactive Nc1cccc(-c2cc(Nc3ccc(CP(=O)(O)O)cc3)ncn2)c1 ZINC000169346760 FG Annotated Anodyne Cn1c([N+](=O)[O-])cnc1[S@@](=O)CCCCCCCCCCC(=O)O ZINC000169347025 FG Annotated Bother Cn1c([N+](=O)[O-])cnc1[S@](=O)CCCCCCCCCCC(=O)O ZINC000169347026 FG Annotated Bother COC(=O)CCCCCCCCCC[S@@](=O)c1ncc([N+](=O)[O-])n1C ZINC000169347028 FG Annotated Bother COC(=O)CCCCCCCCCC[S@](=O)c1ncc([N+](=O)[O-])n1C ZINC000169347029 FG Annotated Bother O=C1C[C@@H](c2ccccc2)CN1c1cnc2c(N3CCNCC3)cccc2c1 ZINC000169347297 FG Annotated Anodyne O=C1C[C@H](c2ccccc2)CN1c1cnc2c(N3CCNCC3)cccc2c1 ZINC000169347298 FG Annotated Anodyne O=C1C[C@@H](c2ccccc2)CN1c1ccc2c(N3CCNCC3)ccnc2c1 ZINC000169347299 FG Annotated Anodyne O=C1C[C@H](c2ccccc2)CN1c1ccc2c(N3CCNCC3)ccnc2c1 ZINC000169347301 FG Annotated Anodyne O=C1O[C@@H](c2ccccc2Cl)CN1c1cccc(N2CCNCC2)c1 ZINC000169347326 FG Annotated Anodyne O=C1O[C@H](c2ccccc2Cl)CN1c1cccc(N2CCNCC2)c1 ZINC000169347327 FG Annotated Anodyne O=C1O[C@@H](c2ccccc2Cl)CN1c1ccc(N2CCNCC2)cc1 ZINC000169347328 FG Annotated Anodyne O=C1O[C@H](c2ccccc2Cl)CN1c1ccc(N2CCNCC2)cc1 ZINC000169347329 FG Annotated Anodyne O=Cc1c(O)ccc2c3c(c(=O)oc12)CN(Cc1ccc(F)cc1)CC3 ZINC000169347638 FG Annotated Anodyne Cc1nc(N/N=C/c2ccc([N+](=O)[O-])o2)n2nc(-c3ccccc3)cc2n1 ZINC000169347809 FG Annotated Mild CCCOc1ccc(C2=NN(C(C)=O)[C@@H](c3ccc([N+](=O)[O-])o3)O2)cc1 ZINC000169348085 FG Annotated Bother CCCOc1ccc(C2=NN(C(C)=O)[C@H](c3ccc([N+](=O)[O-])o3)O2)cc1 ZINC000169348086 FG Annotated Bother O=C(/C=C/C=C/c1ccc2c(c1)OCO2)Nc1ccc([N+](=O)[O-])cc1O ZINC000169348433 FG Annotated Bother COc1ccc(-c2ccc(COc3ncccc3C(N)=O)nc2)c(Cl)c1 ZINC000169348926 FG Annotated Anodyne O=C(NO)c1cc(-c2ccc(Cl)cc2)nn1Cc1ccc(Cl)nc1 ZINC000169349126 FG Annotated Anodyne CC(C)(C)c1cccc(NC2=NS(=O)(=O)c3cc([N+](=O)[O-])ccc32)c1 ZINC000169349252 FG Annotated Bother Cc1c2c[n+](CCOCCN)ccc2c(C)c2c1c1cc(O)ccc1n2C ZINC000169349741 FG Annotated Bother Cc1c2cc[n+](CCOCCN)cc2c(C)c2c1[nH]c1ccc(O)cc12 ZINC000169349743 FG Annotated Bother CC1=C/C(=N\NC(=O)Cc2c[nH]c3ccccc23)c2c(O)cccc2C1=O ZINC000169350136 FG Annotated Reactive O=C1NC(=S)S/C1=C\c1cc2cc3c(cc2nc1Cl)OCO3 ZINC000169350386 FG Annotated Clean N#C/C=C/c1ccc([C@@H](NN)c2ccnc(Nc3ccc(C#N)cc3)n2)cc1 ZINC000169350560 FG Annotated Reactive N#C/C=C/c1ccc([C@H](NN)c2ccnc(Nc3ccc(C#N)cc3)n2)cc1 ZINC000169350562 FG Annotated Reactive Cn1c(=O)c2ccc(-c3cncnc3)cc2n2nc(-c3ccccc3)cc12 ZINC000169350984 FG Annotated Anodyne O=C1CS[C@@H](c2c(Cl)cccc2Cl)N1n1cnc2cncnc21 ZINC000169351051 FG Annotated Anodyne O=C1CS[C@H](c2c(Cl)cccc2Cl)N1n1cnc2cncnc21 ZINC000169351052 FG Annotated Anodyne O=C1NC(CCCN2CC=C(c3ccccc3)CC2)=N[C@H]2CCSC[C@@H]12 ZINC000169351328 FG Annotated Anodyne COc1cc(OC)nc(N2C(=O)CS[C@@H]2c2c(F)cccc2Cl)n1 ZINC000169351452 FG Annotated Anodyne COc1cc(OC)nc(N2C(=O)CS[C@H]2c2c(F)cccc2Cl)n1 ZINC000169351453 FG Annotated Anodyne CC[C@H]1C[C@@H]2Cn3c4c(c5ccc(OC)cc53)CCN[C@H]1[C@@]4(C(=O)OC)C2 ZINC000169352315 FG Annotated Anodyne COC(=O)[C@@]12C[C@@H](C)[C@H]3[C@@H](C)[C@H](c4ccccc4[C@@H]31)N2C(=O)C(F)(F)F ZINC000169352796 FG Annotated Anodyne COC(=O)[C@]12C[C@@H](C)[C@H]3[C@@H](C)[C@H](c4ccccc4[C@@H]31)N2C(=O)C(F)(F)F ZINC000169352797 FG Annotated Anodyne COC(=O)[C@@]12C[C@H](C)[C@H]3[C@@H](C)[C@H](c4ccccc4[C@@H]31)N2C(=O)C(F)(F)F ZINC000169352799 FG Annotated Anodyne COC(=O)[C@]12C[C@H](C)[C@H]3[C@@H](C)[C@H](c4ccccc4[C@@H]31)N2C(=O)C(F)(F)F ZINC000169352801 FG Annotated Anodyne Cc1c(C(=O)N2CCN(C(C)C)CC2)sc2c1[nH]c(=O)c1ccccc12 ZINC000169352958 FG Annotated Anodyne Cc1c(C(=O)N2CCC(N(C)C)CC2)sc2c1[nH]c(=O)c1ccccc12 ZINC000169352959 FG Annotated Anodyne COc1ncc(F)cc1Cn1cc(C(=O)NC[C@H](C)F)c2ncc(C)cc21 ZINC000169353743 FG Annotated Anodyne CCN1C(NCC(C)C)=N[C@H](CCc2ccccc2)[C@@H](C(=O)OC)[C@@H]1C ZINC000169355684 FG Annotated Anodyne CCN1C(NCC(C)C)=N[C@H](CCc2ccccc2)[C@H](C(=O)OC)[C@@H]1C ZINC000169355685 FG Annotated Anodyne Cc1cc2nc3n(c2cc1C)C[C@@H]1C[C@@H](C(=O)NCc2ccccc2)N(C)[C@@H]31 ZINC000169355866 FG Annotated Anodyne CC[C@@H]1C/C=C/Cc2ccccc2[C@@H](C(=O)C[C@H](O)CC(C)=O)OC1=O ZINC000169357671 FG Annotated Anodyne COC(=O)/C=C1/CN2[C@@H]3CC[C@@H]2[C@@H]1[C@@H](c1ccc(Br)cc1)C3 ZINC000169357698 FG Annotated Anodyne COC(=O)/C=C1/CN2[C@H]3CC[C@@H]2[C@@H]1[C@@H](c1ccc(Br)cc1)C3 ZINC000169357699 FG Annotated Anodyne C=C(C(=O)OC)[C@@H]1CC[C@@](C)(O)[C@@H](O)CC/C(C)=C\C/C=C(\C)[C@@H](O)C1 ZINC000169361581 FG Annotated Mild C=C(C(=O)OC)[C@@H]1CC[C@@](C)(O)[C@@H](O)CC/C(C)=C\C/C=C(/C)[C@@H](O)C1 ZINC000169361582 FG Annotated Mild C=C(C(=O)OC)[C@@H]1CC[C@@](C)(O)[C@@H](O)CC/C(C)=C/C/C=C(/C)[C@@H](O)C1 ZINC000169361583 FG Annotated Mild COC(=O)CC[C@@]12C3=CCC[C@@H]3CC[C@@H]3CN4C[C@@H](C)[C@H](CC[C@@]31CO)[C@@H]42 ZINC000169363067 FG Annotated Anodyne CC(=O)SC[C@@H](C)C(=O)N(CC(=O)O)C[C@@H]1C[C@@H]2C[C@@H]([C@@H]1C)C2(C)C ZINC000169363538 FG Annotated Anodyne CC(=O)SC[C@@H](C)C(=O)N(CC(=O)O)C[C@H]1C[C@@H]2C[C@@H]([C@@H]1C)C2(C)C ZINC000169363539 FG Annotated Anodyne O=C1CCC/C=C/C[C@H]2[C@@H](O)C[C@@H](O)[C@H]2/C=C\[C@@H](COc2ccccc2)O1 ZINC000169366108 FG Annotated Anodyne O=C1CCC/C=C\C[C@H]2[C@@H](O)C[C@@H](O)[C@H]2/C=C/[C@@H](COc2ccccc2)O1 ZINC000169366109 FG Annotated Anodyne O=C1CCC/C=C/C[C@H]2[C@@H](O)C[C@@H](O)[C@H]2/C=C/[C@@H](COc2ccccc2)O1 ZINC000169366110 FG Annotated Anodyne C[C@@H](Cc1ccc(OCC(=O)O)cc1)N1CCO[C@@H](c2ccccc2)C1 ZINC000169369558 FG Annotated Anodyne C[C@H](Cc1ccc(OCC(=O)O)cc1)N1CCO[C@@H](c2ccccc2)C1 ZINC000169369559 FG Annotated Anodyne CC1(C)c2[nH]c3cc(Cl)ccc3c2C[C@@]23CN4CCC[C@@]4(C[C@@H]12)C(=O)N3 ZINC000169369955 FG Annotated Anodyne CC1(C)c2[nH]c3cc(Cl)ccc3c2C[C@]23CN4CCC[C@@]4(C[C@@H]12)C(=O)N3 ZINC000169369957 FG Annotated Anodyne O=C1[C@@H]2C=C(I)[C@@H](C[C@@H]2c2ccccc2)[C@]12CO2 ZINC000169370804 FG Annotated Anodyne O=C1[C@@H]2C=C(I)[C@H](C[C@@H]2c2ccccc2)[C@]12CO2 ZINC000169370805 FG Annotated Anodyne C[C@@H]1CC[C@H]2[C@@H](C)C(=O)N(Cc3ccccn3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]23OO4 ZINC000169371525 FG Annotated Reactive C[C@@H]1CC[C@H]2[C@@H](C)C(=O)N(Cc3ccccn3)[C@@H]3O[C@]4(C)CC[C@@H]1[C@]23OO4 ZINC000169371526 FG Annotated Reactive C[C@H]1c2c(O)cc(O)c3c(=O)cc4oc5cccc(O)c5c(c-4c23)[C@@H]1O ZINC000169472660 FG Annotated Bother C=C(C(=O)O)[C@@H]1CC[C@@]2(C)CCC[C@@](C)(O)[C@@H]2[C@H]1OC(=O)/C(C)=C/C ZINC000169640272 FG Annotated Mild CC(=O)O[C@]1(C)/C=C2/C(=O)C(C)=C[C@]2(O)C(=O)[C@H](C)C[C@@H]2[C@H](CC1)C2(C)C ZINC000169645722 FG Annotated Mild COC(=O)[C@H]1C[C@]23C4=C(CC[C@H]41)CC[C@H]1CN4C[C@H](C)[C@](O)(CC[C@]12C)[C@@H]43 ZINC000169648260 FG Annotated Anodyne CC(=O)O[C@H]1C(=O)[C@@H]2[C@H]3OCC4=C3[C@@](C)(CCC4=O)CC[C@]2(C)[C@H]1C(C)C ZINC000169657265 FG Annotated Mild CC[C@H]1OC(=O)C[C@H](O)[C@H](C)C(=O)[C@@H](C)C[C@@H](C)[C@H](O)/C=C/C=C/[C@@H]1C ZINC000169660588 FG Annotated Anodyne C[C@@]12CCC[C@@](C)(C(=O)O)[C@H]1CC[C@]13CC(=O)O[C@](C)(C1)[C@H](O)C[C@@H]23 ZINC000169666523 FG Annotated Anodyne C[C@@H](C(=O)Nc1cc(C2CC2)n[nH]1)c1ccc(-n2c(O)ccc2O)cc1 ZINC000169685082 FG Annotated Anodyne C[C@H](C(=O)Nc1cc(C2CC2)n[nH]1)c1ccc(-n2c(O)ccc2O)cc1 ZINC000169685083 FG Annotated Anodyne NS(=O)(=O)c1ccc(/N=N/c2c(=O)[nH]c3ccc4[nH]cccc4c23)cc1 ZINC000169685144 FG Annotated Clean O=[N+]([O-])c1cccc(-n2ncc3c(/N=N/Cc4ccncc4)ncnc32)c1 ZINC000169685246 FG Annotated Clean Cc1ccc(C(=O)[C@@H]2C(=O)C(=O)N(Cc3ccccc3)[C@@H]2c2cccnc2)o1 ZINC000169686033 FG Annotated Anodyne Cc1ccc(C(=O)[C@H]2C(=O)C(=O)N(Cc3ccccc3)[C@@H]2c2cccnc2)o1 ZINC000169686034 FG Annotated Anodyne Cc1ccc(C(=O)[C@@H]2C(=O)C(=O)N(Cc3ccccc3)[C@H]2c2cccnc2)o1 ZINC000169686035 FG Annotated Anodyne Cc1ccc(C(=O)[C@H]2C(=O)C(=O)N(Cc3ccccc3)[C@H]2c2cccnc2)o1 ZINC000169686036 FG Annotated Anodyne CCCCCCOc1cc(O)c2c(c1)C1=CC(=O)C(=O)C[C@@]1(C)OC2=O ZINC000169686853 FG Annotated Mild CCCCCCOc1cc(O)c2c(c1)C1=CC(=O)C(=O)C[C@]1(C)OC2=O ZINC000169686854 FG Annotated Mild CCOC(=O)[C@@H]1C(C)=NC(=O)N[C@@H]1c1c(C)nn(-c2ccccc2)c1Cl ZINC000169686922 FG Annotated Anodyne CCOC(=O)[C@H]1C(C)=NC(=O)N[C@@H]1c1c(C)nn(-c2ccccc2)c1Cl ZINC000169686924 FG Annotated Anodyne CCOC(=O)[C@@H]1C(C)=NC(=O)N[C@H]1c1c(C)nn(-c2ccccc2)c1Cl ZINC000169686926 FG Annotated Anodyne CCOC(=O)[C@H]1C(C)=NC(=O)N[C@H]1c1c(C)nn(-c2ccccc2)c1Cl ZINC000169686927 FG Annotated Anodyne Oc1ccc(C/N=N/c2cc(N3CCCC3)nc(N3CCCC3)n2)cc1O ZINC000169686946 FG Annotated Clean CCOC(=O)[C@@H]1C(=N)OC2=C(C(=O)CCC2)[C@@H]1c1ccccc1OCC ZINC000169687139 FG Annotated Mild CCOC(=O)[C@H]1C(=N)OC2=C(C(=O)CCC2)[C@@H]1c1ccccc1OCC ZINC000169687140 FG Annotated Mild COC(=O)[C@@H]1C(=N)Oc2cc(N(C)C)ccc2[C@@H]1c1ccccc1OC ZINC000169687141 FG Annotated Anodyne COC(=O)[C@H]1C(=N)Oc2cc(N(C)C)ccc2[C@@H]1c1ccccc1OC ZINC000169687142 FG Annotated Anodyne COc1ccccc1[C@@H]1[C@@H](C(=O)c2ccccc2)C(=O)C(=O)N1CC(C)C ZINC000169687178 FG Annotated Anodyne COc1ccccc1[C@H]1[C@@H](C(=O)c2ccccc2)C(=O)C(=O)N1CC(C)C ZINC000169687179 FG Annotated Anodyne COc1ccccc1[C@@H]1[C@H](C(=O)c2ccccc2)C(=O)C(=O)N1CC(C)C ZINC000169687180 FG Annotated Anodyne COc1ccccc1[C@H]1[C@H](C(=O)c2ccccc2)C(=O)C(=O)N1CC(C)C ZINC000169687181 FG Annotated Anodyne COc1cc([C@@H]2c3ccc(N(C)C)cc3OC(=N)[C@@H]2C#N)cc2c1OCO2 ZINC000169687443 FG Annotated Mild COc1cc([C@H]2c3ccc(N(C)C)cc3OC(=N)[C@@H]2C#N)cc2c1OCO2 ZINC000169687444 FG Annotated Mild C=CCOC(=O)C1=C(C)N=C(C)[C@@H](C(=O)OCC=C)[C@H]1c1ccc(O)cc1 ZINC000169687587 FG Annotated Mild C=CCOC(=O)C1=C(C)N=C(C)[C@H](C(=O)OCC=C)[C@H]1c1ccc(O)cc1 ZINC000169687588 FG Annotated Mild CCN1CCC2=C(C#N)C(=N)C(C#N)(C#N)[C@@H](CCc3ccccc3)[C@@H]2C1 ZINC000169687783 FG Annotated Reactive CC1=Nc2nc(-c3cccc(C)c3)nn2[C@@H](c2cccs2)[C@H]1C(N)=O ZINC000169687838 FG Annotated Anodyne CC1=Nc2nc(-c3cccc(C)c3)nn2[C@H](c2cccs2)[C@H]1C(N)=O ZINC000169687839 FG Annotated Anodyne COc1cc([C@@H]2NC(=O)N=C(C)[C@@H]2C(=O)O[C@@H]2CCC[C@@H](C)C2)ccc1O ZINC000169687881 FG Annotated Anodyne COc1cc([C@H]2NC(=O)N=C(C)[C@@H]2C(=O)O[C@@H]2CCC[C@@H](C)C2)ccc1O ZINC000169687882 FG Annotated Anodyne COc1cc([C@@H]2NC(=O)N=C(C)[C@H]2C(=O)O[C@@H]2CCC[C@@H](C)C2)ccc1O ZINC000169687883 FG Annotated Anodyne COc1cc([C@H]2NC(=O)N=C(C)[C@H]2C(=O)O[C@@H]2CCC[C@@H](C)C2)ccc1O ZINC000169687884 FG Annotated Anodyne CC(=O)N1CCC2(CC1)c1sc3nc(C)cc(C)c3c1OC(=N)[C@@H]2C#N ZINC000169688392 FG Annotated Mild CC(=O)N1CCC2(CC1)c1sc3nc(C)cc(C)c3c1OC(=N)[C@H]2C#N ZINC000169688393 FG Annotated Mild COc1c[c-](/C=C(\C#N)c2nc3ccccc3s2)cc([N+](=O)[O-])c1=O ZINC000169688586 FG Annotated Reactive COc1cc(OC)c([C@@H]2C3=C(C[C@@H](C)CC3=O)OC(=N)[C@@H]2C#N)cc1OC ZINC000169688792 FG Annotated Mild COc1cc(OC)c([C@H]2C3=C(C[C@@H](C)CC3=O)OC(=N)[C@@H]2C#N)cc1OC ZINC000169688793 FG Annotated Mild COc1ccc([C@@H]2C3=C(C[C@@H](C)CC3=O)OC(=N)[C@@H]2C#N)c(OC)c1OC ZINC000169688796 FG Annotated Mild COc1ccc([C@H]2C3=C(C[C@@H](C)CC3=O)OC(=N)[C@@H]2C#N)c(OC)c1OC ZINC000169688797 FG Annotated Mild COc1cc([C@@H]2C3=C(CC(C)(C)CC3=O)OC(=N)[C@@H]2C#N)cc2c1OCO2 ZINC000169688946 FG Annotated Mild COc1cc([C@H]2C3=C(CC(C)(C)CC3=O)OC(=N)[C@@H]2C#N)cc2c1OCO2 ZINC000169688947 FG Annotated Mild COc1cc2c(cc1[C@@H]1C3=C(CC(C)(C)CC3=O)OC(=N)[C@@H]1C#N)OCO2 ZINC000169688956 FG Annotated Mild COc1cc2c(cc1[C@H]1C3=C(CC(C)(C)CC3=O)OC(=N)[C@@H]1C#N)OCO2 ZINC000169688957 FG Annotated Mild CCOc1ccc(C/N=N/c2cc(N3CCOCC3)nc(C)n2)c(O)c1 ZINC000169689048 FG Annotated Clean COc1cc(/C=N/n2c(O)csc2=S)cc(Br)c1O ZINC000169689143 FG Annotated Mild Nc1[nH]n2c(=O)cc(-c3ccccc3)nc2c1/N=N/c1ccc2c(c1)OCO2 ZINC000169689167 FG Annotated Clean Cc1ccc(-n2c(O)c(C/N=N/c3ccccc3)c(=O)[nH]c2=O)cc1C ZINC000169689342 FG Annotated Clean CCOc1ccc(/C=N/NC(=S)N[C@H]2C[C@H]3C[C@H]2[C@H]2C=CC[C@H]32)cc1 ZINC000169689608 FG Annotated Mild CCOc1ccc(/C=N\NC(=S)N[C@H]2C[C@H]3C[C@H]2[C@H]2C=CC[C@H]32)cc1 ZINC000169689609 FG Annotated Mild CCOc1ccc(/C=N\NC(=S)N[C@@H]2C[C@H]3C[C@H]2[C@H]2C=CC[C@H]32)cc1 ZINC000169689611 FG Annotated Mild COC(=O)c1c(NC(=O)[C@@H]2[C@H]3C=C[C@H](CC3)[C@H]2C(=O)O)sc(C)c1C ZINC000169689755 FG Annotated Anodyne COC(=O)c1c(NC(=O)[C@@H]2[C@@H]3C=C[C@H](CC3)[C@H]2C(=O)O)sc(C)c1C ZINC000169689757 FG Annotated Anodyne Oc1ccc(-c2nc3c[nH]ccn-3/c2=N\c2ccc3c(c2)OCCO3)cc1 ZINC000169689797 FG Annotated Anodyne Cc1ccc[n+](-c2[nH]c(=O)sc2C/N=N/c2ccc([N+](=O)[O-])cc2)c1 ZINC000169690346 FG Annotated Clean CCOc1ccc(N2C(=O)/C(=N/c3ccccc3O)[C@@H](Cl)C2=O)cc1 ZINC000169690588 FG Annotated Reactive CCOc1ccc(N2C(=O)/C(=N/c3ccccc3O)[C@H](Cl)C2=O)cc1 ZINC000169690589 FG Annotated Reactive Cc1[nH]nc2c1[C@@H](c1ccc(OC(=O)c3ccco3)cc1)[C@@H](C#N)C(=N)O2 ZINC000169690975 FG Annotated Mild Cc1[nH]nc2c1[C@H](c1ccc(OC(=O)c3ccco3)cc1)[C@@H](C#N)C(=N)O2 ZINC000169690976 FG Annotated Mild COc1ccc(OC)c(-c2n[nH]c3c2[C@@H](c2ccco2)[C@@H](C#N)C(=N)O3)c1 ZINC000169691033 FG Annotated Mild COc1ccc(OC)c(-c2n[nH]c3c2[C@H](c2ccco2)[C@@H](C#N)C(=N)O3)c1 ZINC000169691034 FG Annotated Mild O=C1NCC2=Nc3ccccc3N[C@@H](c3ccc(Br)cc3)[C@@H]12 ZINC000169691156 FG Annotated Anodyne O=C1NCC2=Nc3ccccc3N[C@H](c3ccc(Br)cc3)[C@@H]12 ZINC000169691157 FG Annotated Anodyne O=C1NCC2=Nc3ccccc3N[C@@H](c3ccc(Br)cc3)[C@H]12 ZINC000169691158 FG Annotated Anodyne O=C1NCC2=Nc3ccccc3N[C@H](c3ccc(Br)cc3)[C@H]12 ZINC000169691159 FG Annotated Anodyne Cc1ccc(N(CC(=O)O)c2sc(=O)n(-c3ccc(C)cc3)c2O)cc1 ZINC000169691229 FG Annotated Anodyne COc1cc([N+](=O)[O-])ccc1-n1c(O)cc(Sc2nccc(C)n2)c1O ZINC000169691402 FG Annotated Bother CCOC(=O)C1CCN(c2cc(O)n(-c3cccc(Cl)c3)c2O)CC1 ZINC000169691766 FG Annotated Anodyne C[C@]1(O)C([C@@H]2C(=O)Nc3ccc(Br)cc32)=Nc2ccccc21 ZINC000169692423 FG Annotated Anodyne C[C@@]1(O)C([C@@H]2C(=O)Nc3ccc(Br)cc32)=Nc2ccccc21 ZINC000169692424 FG Annotated Anodyne C[C@]1(O)C([C@H]2C(=O)Nc3ccc(Br)cc32)=Nc2ccccc21 ZINC000169692425 FG Annotated Anodyne C[C@@]1(O)C([C@H]2C(=O)Nc3ccc(Br)cc32)=Nc2ccccc21 ZINC000169692426 FG Annotated Anodyne COc1ccc(COC(=O)[C@@H]2C(C)=NC(=O)N[C@@H]2c2ccc(F)cc2)cc1 ZINC000169693068 FG Annotated Anodyne COc1ccc(COC(=O)[C@H]2C(C)=NC(=O)N[C@@H]2c2ccc(F)cc2)cc1 ZINC000169693069 FG Annotated Anodyne COc1ccc(COC(=O)[C@@H]2C(C)=NC(=O)N[C@H]2c2ccc(F)cc2)cc1 ZINC000169693070 FG Annotated Anodyne COc1ccc(COC(=O)[C@H]2C(C)=NC(=O)N[C@H]2c2ccc(F)cc2)cc1 ZINC000169693071 FG Annotated Anodyne Cc1cc(C(F)(F)F)nc(SCC(=O)Nc2nc(O)c(C)s2)n1 ZINC000169693083 FG Annotated Anodyne C[C@@H](c1c(F)cc2ncccc2c1F)n1nnc2ncc([C@@H](C)N=O)nc21 ZINC000169694294 FG Annotated Anodyne C[C@H](N=O)c1cnc2nnn([C@@H](C)c3c(F)cc4ncccc4c3F)c2n1 ZINC000169694295 FG Annotated Anodyne C[C@@H](N=O)c1cnc2nnn([C@H](C)c3c(F)cc4ncccc4c3F)c2n1 ZINC000169694296 FG Annotated Anodyne C[C@H](N=O)c1cnc2nnn([C@H](C)c3c(F)cc4ncccc4c3F)c2n1 ZINC000169694297 FG Annotated Anodyne COCCN(C)c1n[nH]c2ccc([C@@H]3C(C#N)=C(C)N=C(C)[C@@H]3C#N)cc12 ZINC000169694604 FG Annotated Reactive COCCN(C)c1n[nH]c2ccc([C@H]3C(C#N)=C(C)N=C(C)[C@@H]3C#N)cc12 ZINC000169694605 FG Annotated Reactive O=Cc1c(O)ccc2cc(-c3ccc(C(=O)N4CCOCC4)cc3)ccc12 ZINC000169699713 FG Annotated Anodyne COc1ccc(C/N=C/c2c(Br)ccc(C(=O)O)c2O)cc1 ZINC000169699743 FG Annotated Mild O=C1C=C/C(=C/c2c(-c3ccccc3)[nH]n(-c3ccccc3)c2=O)CC1=O ZINC000169700638 FG Annotated Mild NC1=N[C@@H](CCc2ccc(Nc3cc(C(F)(F)F)ccn3)cc2)CO1 ZINC000169701165 FG Annotated Anodyne NC1=N[C@@H](CCc2ccc(Nc3cccc(C(F)(F)F)n3)cc2)CO1 ZINC000169701168 FG Annotated Anodyne CCO[C@@H]1C[C@@]2(CC[C@H]1O)CCN(c1ccc(OC(F)(F)F)cc1)C2=O ZINC000169702036 FG Annotated Anodyne [C-]#[N+]C1=C(C(F)(F)F)N=C2COC(=O)[C@@H]2[C@@H]1c1ccc2n[nH]c(C)c2c1 ZINC000169703236 FG Annotated Reactive [C-]#[N+]C1=C(C(F)(F)F)N=C2COC(=O)[C@H]2[C@@H]1c1ccc2n[nH]c(C)c2c1 ZINC000169703237 FG Annotated Reactive [C-]#[N+]C1=C(C(F)(F)F)N=C2COC(=O)[C@@H]2[C@H]1c1ccc2n[nH]c(C)c2c1 ZINC000169703238 FG Annotated Reactive [C-]#[N+]C1=C(C(F)(F)F)N=C2COC(=O)[C@H]2[C@H]1c1ccc2n[nH]c(C)c2c1 ZINC000169703239 FG Annotated Reactive CN(C)C(=O)c1cnn2ccc(N3CCC[C@@H]3c3cc(F)ccc3F)nc12 ZINC000169704137 FG Annotated Anodyne COc1cnc(Oc2ccc(-c3c(C)n[nH]c(=O)c3C)cc2)c2c[nH]nc12 ZINC000169705965 FG Annotated Anodyne CSc1nn(-c2ccccc2)c2cc(NCCN3CCNCC3)ccc12 ZINC000169706052 FG Annotated Anodyne CCc1ccc(-c2c(-c3nn(C)c4ncnc(N5CCC5)c34)cnn2C)cc1 ZINC000169706072 FG Annotated Anodyne CCCCn1ccc(C#Cc2ccc(C[C@@H](C)NC(C)=O)cc2)cc1=O ZINC000169706206 FG Annotated Mild CCCCn1ccc(C#Cc2ccc(C[C@H](C)NC(C)=O)cc2)cc1=O ZINC000169706207 FG Annotated Mild CCOc1ccc(C#Cc2ccc(C[C@@H](C)NC(=O)CN(C)C)cc2)cc1 ZINC000169706240 FG Annotated Mild CCOc1ccc(C#Cc2ccc(C[C@H](C)NC(=O)CN(C)C)cc2)cc1 ZINC000169706241 FG Annotated Mild CC(=O)N[C@@H](C)Cc1ccc(C#Cc2ccc(C(=O)NC3CCC3)cc2)cc1 ZINC000169706285 FG Annotated Mild CC(=O)N[C@H](C)Cc1ccc(C#Cc2ccc(C(=O)NC3CCC3)cc2)cc1 ZINC000169706286 FG Annotated Mild CC[C@@H](C)Oc1nccc(C#Cc2ccc(C[C@@H](C)NC(C)=O)cc2)n1 ZINC000169706365 FG Annotated Mild CC[C@H](C)Oc1nccc(C#Cc2ccc(C[C@@H](C)NC(C)=O)cc2)n1 ZINC000169706366 FG Annotated Mild CC[C@@H](C)Oc1nccc(C#Cc2ccc(C[C@H](C)NC(C)=O)cc2)n1 ZINC000169706367 FG Annotated Mild CC[C@H](C)Oc1nccc(C#Cc2ccc(C[C@H](C)NC(C)=O)cc2)n1 ZINC000169706368 FG Annotated Mild COC(=O)N[C@@H](C)Cc1ccc(C#Cc2cnc(NC3CCC3)nc2)cc1 ZINC000169706443 FG Annotated Mild COC(=O)N[C@H](C)Cc1ccc(C#Cc2cnc(NC3CCC3)nc2)cc1 ZINC000169706444 FG Annotated Mild COC(=O)NC[C@@H](C)c1ccc(C#Cc2cnc(OC3CCC3)nc2)cc1 ZINC000169706483 FG Annotated Mild COC(=O)NC[C@H](C)c1ccc(C#Cc2cnc(OC3CCC3)nc2)cc1 ZINC000169706484 FG Annotated Mild CCCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2C(C)C)c1 ZINC000169706950 FG Annotated Anodyne CCCc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2C(C)C)c1 ZINC000169706951 FG Annotated Anodyne CCCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2CC(C)C)c1 ZINC000169706952 FG Annotated Anodyne CCCc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2CC(C)C)c1 ZINC000169706953 FG Annotated Anodyne CCCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2C(C)(C)C)c1 ZINC000169706983 FG Annotated Anodyne CCCc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2C(C)(C)C)c1 ZINC000169706984 FG Annotated Anodyne CCc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2-c2ccccc2)c1 ZINC000169706985 FG Annotated Anodyne CCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2-c2ccccc2)c1 ZINC000169706986 FG Annotated Anodyne O=C1C[C@@H](C(=O)Nc2cc(C3CCCCCC3)n(-c3ccccc3)n2)CN1 ZINC000169707007 FG Annotated Anodyne Cc1nc2c(o1)CN([C@H]1CS[C@@H](c3cc(F)ccc3F)[C@@H](N)C1)C2 ZINC000169708413 FG Annotated Anodyne Cc1nc2c(o1)CN([C@H]1CS[C@H](c3cc(F)ccc3F)[C@@H](N)C1)C2 ZINC000169708414 FG Annotated Anodyne CC1=N[C@@]2(CCOc3ccc(NC(=O)c4ccc(C)s4)cc32)N=C1N ZINC000169708521 FG Annotated Anodyne CC1=N[C@]2(CCOc3ccc(NC(=O)c4ccc(C)s4)cc32)N=C1N ZINC000169708522 FG Annotated Anodyne CC(C)c1cccc(NC(=O)c2cc(N3Cc4cnc(N)nc4C3)ccn2)c1 ZINC000169710077 FG Annotated Anodyne CC(C)c1ccc(NC(=O)c2cc(N3Cc4cnc(N)nc4C3)ccn2)cc1 ZINC000169710079 FG Annotated Anodyne C[C@H]1SC(N)=N[C@@]2(c3cc(Br)ccc3F)COCC[C@@H]12 ZINC000169711639 FG Annotated Anodyne Cc1nc(CC(C)C)c2c(N3CCc4nc(C5CC5)oc4C3)ncnn12 ZINC000169711686 FG Annotated Anodyne Cc1nc(CC(C)C)c2c(N3CCc4noc(C5CC5)c4C3)ncnn12 ZINC000169711725 FG Annotated Anodyne CCCn1c2nc(C34C[C@@H]5CC3C[C@H](C5)C4)nc-2c2n(c1=O)C[C@@H](CC)N2 ZINC000169712117 FG Annotated Anodyne CCCn1c2nc(C34C[C@@H]5CC3C[C@H](C5)C4)nc-2c2n(c1=O)C[C@H](CC)N2 ZINC000169712118 FG Annotated Anodyne CCCCCCS(=O)(=O)c1ccc(Cl)cc1-c1[nH]c(=O)[nH]c1O ZINC000169712817 FG Annotated Anodyne CCc1ccc(CCOc2ccc(Cc3sc(=O)[nH]c3O)cc2)nc1 ZINC000169714672 FG Annotated Anodyne C/C(=C1/C(=O)C(=O)c2ccccc2C1=O)c1c(O)c(O)c2ccccc2c1O ZINC000169714713 FG Annotated Mild COc1cccc([C@@H]2CC(=O)[C@@H]3C(=Nc4ccc(F)cc4S3(=O)=O)C2)c1 ZINC000169715448 FG Annotated Anodyne COc1cccc([C@H]2CC(=O)[C@@H]3C(=Nc4ccc(F)cc4S3(=O)=O)C2)c1 ZINC000169715449 FG Annotated Anodyne COc1cccc([C@@H]2CC(=O)[C@H]3C(=Nc4ccc(F)cc4S3(=O)=O)C2)c1 ZINC000169715450 FG Annotated Anodyne COc1cccc([C@H]2CC(=O)[C@H]3C(=Nc4ccc(F)cc4S3(=O)=O)C2)c1 ZINC000169715451 FG Annotated Anodyne CC1(C)OC(=O)/C(=N/c2ccccc2)[C@@H]1c1ccc(S(C)(=O)=O)cc1 ZINC000169716208 FG Annotated Mild CC1(C)OC(=O)/C(=N/c2ccccc2)[C@H]1c1ccc(S(C)(=O)=O)cc1 ZINC000169716209 FG Annotated Mild CC(C)=CCc1c(Cl)ccc2c(C3C(=O)C(=O)CC(=O)C3=O)c[nH]c12 ZINC000169717688 FG Annotated Clean C[C@@H]1C(=O)S[C@@](C)(Cc2ccc(I)cc2)C1=O ZINC000169717836 FG Annotated Anodyne C[C@@H]1C(=O)S[C@](C)(Cc2ccc(I)cc2)C1=O ZINC000169717837 FG Annotated Anodyne C[C@H]1C(=O)S[C@](C)(Cc2ccc(I)cc2)C1=O ZINC000169717838 FG Annotated Anodyne COC1CCN(c2nccc([C@@H](C#N)c3nc4ccccc4s3)n2)CC1 ZINC000169718883 FG Annotated Mild COC1CCN(c2nccc([C@H](C#N)c3nc4ccccc4s3)n2)CC1 ZINC000169718884 FG Annotated Mild O=S1(=O)NC(O)=CN1c1csc(-c2ccccc2)c1Br ZINC000169719923 FG Annotated Anodyne CCOC(=O)C1=C(c2ccccc2)c2ccc(OC)cc2C1=[N+]([O-])CC ZINC000169720136 FG Annotated Mild C[C@@H]1C(=O)S[C@@](C)(Cc2ccc(-c3ccc(C(N)=O)cc3)cc2)C1=O ZINC000169720223 FG Annotated Anodyne C[C@H]1C(=O)S[C@@](C)(Cc2ccc(-c3ccc(C(N)=O)cc3)cc2)C1=O ZINC000169720224 FG Annotated Anodyne C[C@@H]1C(=O)S[C@](C)(Cc2ccc(-c3ccc(C(N)=O)cc3)cc2)C1=O ZINC000169720225 FG Annotated Anodyne C[C@H]1C(=O)S[C@](C)(Cc2ccc(-c3ccc(C(N)=O)cc3)cc2)C1=O ZINC000169720226 FG Annotated Anodyne COc1ccc(C[C@@H]2C[N+]3=C(NC[C@@H]3C(C)C)N2CC2CCCC2)cc1 ZINC000169721155 FG Annotated Anodyne COc1ccc(C[C@H]2C[N+]3=C(NC[C@@H]3C(C)C)N2CC2CCCC2)cc1 ZINC000169721156 FG Annotated Anodyne COc1ccc(C[C@@H]2C[N+]3=C(NC[C@H]3C(C)C)N2CC2CCCC2)cc1 ZINC000169721157 FG Annotated Anodyne COc1ccc(C[C@H]2C[N+]3=C(NC[C@H]3C(C)C)N2CC2CCCC2)cc1 ZINC000169721158 FG Annotated Anodyne O=C(NCc1ccccn1)c1ccc(-n2c(O)c3c(c2O)[C@H]2C=C[C@@H]3C2)cc1 ZINC000169721989 FG Annotated Anodyne O=C(NCc1ccncc1)c1ccc(-n2c(O)c3c(c2O)[C@H]2C=C[C@@H]3C2)cc1 ZINC000169721991 FG Annotated Anodyne COC(=O)/N=C/Cc1n[nH]c2c(O)c(N(C)c3ccccc3)cc(O)c12 ZINC000169723093 FG Annotated Mild COC(=O)[C@@H]1C(C)=NC(C)=C(C(=O)OC(C)(C)C)[C@@H]1c1cccc(O)c1 ZINC000169723961 FG Annotated Anodyne COC(=O)[C@H]1C(C)=NC(C)=C(C(=O)OC(C)(C)C)[C@@H]1c1cccc(O)c1 ZINC000169723962 FG Annotated Anodyne COC(=O)[C@@H]1C(C)=NC(C)=C(C(=O)OC(C)(C)C)[C@H]1c1cccc(O)c1 ZINC000169723963 FG Annotated Anodyne COC(=O)[C@H]1C(C)=NC(C)=C(C(=O)OC(C)(C)C)[C@H]1c1cccc(O)c1 ZINC000169723964 FG Annotated Anodyne COC(=O)[C@@H]1C(C)=NC(C)=C(C(=O)OC(C)(C)C)[C@@H]1c1ccc(O)cc1 ZINC000169723973 FG Annotated Anodyne COC(=O)[C@H]1C(C)=NC(C)=C(C(=O)OC(C)(C)C)[C@@H]1c1ccc(O)cc1 ZINC000169723974 FG Annotated Anodyne COC(=O)[C@@H]1C(C)=NC(C)=C(C(=O)OC(C)(C)C)[C@H]1c1ccc(O)cc1 ZINC000169723975 FG Annotated Anodyne COC(=O)[C@H]1C(C)=NC(C)=C(C(=O)OC(C)(C)C)[C@H]1c1ccc(O)cc1 ZINC000169723976 FG Annotated Anodyne N=C1OC2=C(C(=O)C[C@@H](c3ccccc3)C2)[C@@H](c2ccccc2)[C@@H]1C(N)=O ZINC000169724145 FG Annotated Mild N=C1OC2=C(C(=O)C[C@H](c3ccccc3)C2)[C@@H](c2ccccc2)[C@@H]1C(N)=O ZINC000169724146 FG Annotated Mild CC1=Nc2[nH]ncc2[C@@H](c2ccco2)[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000169724300 FG Annotated Bother CC1=Nc2[nH]ncc2[C@H](c2ccco2)[C@@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000169724301 FG Annotated Bother CC1=Nc2[nH]ncc2[C@@H](c2ccco2)[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000169724302 FG Annotated Bother CC1=Nc2[nH]ncc2[C@H](c2ccco2)[C@H]1C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000169724303 FG Annotated Bother CC(C)CCNC(=O)[C@H](CC(C)C)/N=C/[C@H]1C(=O)N(C)c2ccccc21 ZINC000169724601 FG Annotated Mild CC(C)CCNC(=O)[C@H](CC(C)C)/N=C/[C@@H]1C(=O)N(C)c2ccccc21 ZINC000169724602 FG Annotated Mild CC(C)N/C(S)=N\[C@@H]1C[C@@H](C(C)(C)CO)Nc2ccc([N+](=O)[O-])cc21 ZINC000169725093 FG Annotated Mild CC(C)N/C(S)=N\[C@@H]1C[C@H](C(C)(C)CO)Nc2ccc([N+](=O)[O-])cc21 ZINC000169725094 FG Annotated Mild CC(C)N/C(S)=N\[C@H]1C[C@H](C(C)(C)CO)Nc2ccc([N+](=O)[O-])cc21 ZINC000169725095 FG Annotated Mild O=c1n(CCCCNCCc2ccc3ccccc3c2)c(O)c2n1CCC2 ZINC000169725355 FG Annotated Anodyne O=c1n(CCCCNCCc2cccc3ccccc23)c(O)c2n1CCC2 ZINC000169725359 FG Annotated Anodyne C[C@@]12CC[C@@](C)(O1)c1c2c(O)n(-c2ccc(C#N)c3nsnc23)c1O ZINC000169727143 FG Annotated Mild C[C@]12CC[C@@](C)(O1)c1c2c(O)n(-c2ccc(C#N)c3nsnc23)c1O ZINC000169727144 FG Annotated Mild C[C@@]12CC[C@](C)(O1)c1c2c(O)n(-c2ccc(C#N)c3nsnc23)c1O ZINC000169727145 FG Annotated Mild O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1C(=O)O[C@@H](c2ccccc2)C1=O ZINC000169727246 FG Annotated Anodyne O=C(Nc1cc(Cl)cc(Cl)c1)[C@@H]1C(=O)O[C@H](c2ccccc2)C1=O ZINC000169727247 FG Annotated Anodyne O=C(Nc1cc(Cl)cc(Cl)c1)[C@H]1C(=O)O[C@H](c2ccccc2)C1=O ZINC000169727248 FG Annotated Anodyne CC(C)C[C@@H]1NC(=O)[C@@H](C(=O)Nc2ccc(C3CCCCC3)cc2)C1=O ZINC000169727261 FG Annotated Anodyne CC(C)C[C@H]1NC(=O)[C@@H](C(=O)Nc2ccc(C3CCCCC3)cc2)C1=O ZINC000169727262 FG Annotated Anodyne CC(C)C[C@H]1NC(=O)[C@H](C(=O)Nc2ccc(C3CCCCC3)cc2)C1=O ZINC000169727263 FG Annotated Anodyne N#C[C@@H]1C(=N)OC2=C(C(=O)CN(Cc3ccccc3)C2)[C@@H]1c1ccccc1 ZINC000169728018 FG Annotated Mild N#C[C@H]1C(=N)OC2=C(C(=O)CN(Cc3ccccc3)C2)[C@@H]1c1ccccc1 ZINC000169728019 FG Annotated Mild Cc1[nH]n(-c2ccc([N+](=O)[O-])cc2)c(=O)c1/N=N/c1ccccc1C(=O)O ZINC000169729719 FG Annotated Clean O=C1N=C2/C(=C/c3ccc(F)cc3)CNC[C@@H]2[C@@H](c2ccc(F)cc2)N1 ZINC000169729991 FG Annotated Anodyne O=C1N=C2/C(=C/c3ccc(F)cc3)CNC[C@H]2[C@@H](c2ccc(F)cc2)N1 ZINC000169729992 FG Annotated Anodyne O=C1N=C2/C(=C/c3ccc(F)cc3)CNC[C@@H]2[C@H](c2ccc(F)cc2)N1 ZINC000169729993 FG Annotated Anodyne O=C1N=C2/C(=C/c3ccc(F)cc3)CNC[C@H]2[C@H](c2ccc(F)cc2)N1 ZINC000169729994 FG Annotated Anodyne O=C1N=C2/C(=C/c3ccccc3F)CNC[C@@H]2[C@@H](c2ccccc2F)N1 ZINC000169730015 FG Annotated Anodyne O=C1N=C2/C(=C/c3ccccc3F)CNC[C@H]2[C@@H](c2ccccc2F)N1 ZINC000169730016 FG Annotated Anodyne O=C1N=C2/C(=C/c3ccccc3F)CNC[C@@H]2[C@H](c2ccccc2F)N1 ZINC000169730017 FG Annotated Anodyne O=C1N=C2/C(=C/c3ccccc3F)CNC[C@H]2[C@H](c2ccccc2F)N1 ZINC000169730018 FG Annotated Anodyne CCOC(=O)[C@@H]1C(=N)Oc2cc(O)ccc2[C@@H]1c1ccc(OC)c(OC)c1 ZINC000169730648 FG Annotated Anodyne CCOC(=O)[C@H]1C(=N)Oc2cc(O)ccc2[C@@H]1c1ccc(OC)c(OC)c1 ZINC000169730649 FG Annotated Anodyne CCOC(=O)[C@@H]1C(=N)Oc2cc(O)ccc2[C@@H]1c1ccc(N(C)C)cc1 ZINC000169730650 FG Annotated Anodyne CCOC(=O)[C@H]1C(=N)Oc2cc(O)ccc2[C@@H]1c1ccc(N(C)C)cc1 ZINC000169730651 FG Annotated Anodyne COc1cc([C@@H]2c3ccc(O)cc3OC(=N)[C@@H]2C#N)cc(OC)c1OC ZINC000169730698 FG Annotated Mild COc1cc([C@H]2c3ccc(O)cc3OC(=N)[C@@H]2C#N)cc(OC)c1OC ZINC000169730699 FG Annotated Mild Oc1c2c(nc3nc(NCc4c(Cl)cccc4Cl)nn13)CCC2 ZINC000017017176 FG Annotated Anodyne C/C=C(\C=O)[C@H]1C[C@H]2c3[nH]c4ccccc4c3CCN2C=C1C(=O)OC ZINC000017128969 FG Annotated Reactive O=C1C=C/C(=C/NNC(=O)C2c3ccccc3Oc3ccccc32)C=C1O ZINC000017136199 FG Annotated Reactive CC(C)N(C(=O)C12[C@H]3C4C5[C@@H]([C@@H]41)C2(C(=O)N(C(C)C)C(C)C)[C@H]53)C(C)C ZINC000017210917 FG Annotated Anodyne CCOC(=O)/C=C1\Nc2ccccc2C(c2ccccc2)=N[C@@H]1OC(C)=O ZINC000017211288 FG Annotated Anodyne CCOC(=O)/C=C1\Nc2ccccc2C(c2ccccc2)=N[C@H]1OC(C)=O ZINC000017211291 FG Annotated Anodyne Cc1ccc(S(=O)(=O)/N=C(\O)NC23C[C@@H]4C[C@@H](CC(F)(C4)C2)C3)cc1 ZINC000017214441 FG Annotated Mild CCO/[S@@](=N/S(=O)(=O)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000017215941 FG Annotated Bother CCCO/[S@@](=N\S(=O)(=O)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000017215944 FG Annotated Bother O=c1[nH]c2c(nc1NC13CC4CC(CC(C4)C1)C3)c(=O)oc1ccccc12 ZINC000017219081 FG Annotated Bother Cc1ccc([C@H]2SC(N)=Nc3c2c(C)nn3C(=O)c2ccncc2)cc1 ZINC000017222169 FG Annotated Anodyne Cc1nn(C(=O)c2ccccc2O)c2c1[C@@H](c1ccccc1)SC(N)=N2 ZINC000017222172 FG Annotated Anodyne Cc1ccc(C(=O)Cc2nc3c([nH]c2=O)c(C)nn3-c2ccccc2)c(C)c1 ZINC000017224284 FG Annotated Anodyne Cc1cc([C@@]23O[C@@H]4COC(C)(C)O[C@@H]4[C@@H]2OC(C)(C)O3)nc2ccccc12 ZINC000017255919 FG Annotated Anodyne Cc1cc([C@]23O[C@@H]4COC(C)(C)O[C@@H]4[C@@H]2OC(C)(C)O3)nc2ccccc12 ZINC000017255923 FG Annotated Anodyne O=C(Cc1nccc2c1[nH]c1ccccc12)O[C@H]1C#CCSCC#C/C=C/1 ZINC000017256970 FG Annotated Mild [N-]=[N+]=NC[C@@H]1OC[C@@H](O)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 ZINC000017258105 FG Annotated Clean [N-]=[N+]=NC[C@@H]1OC[C@H](O)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 ZINC000017258107 FG Annotated Clean [N-]=[N+]=NC[C@H]1OC[C@@H](O)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 ZINC000017258111 FG Annotated Clean [N-]=[N+]=NC[C@H]1OC[C@H](O)[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 ZINC000017258114 FG Annotated Clean C[C@H]1C[C@H]([C@@H]2C[C@@H](CC(=O)NC3CCCCC3)CC(=O)O2)[C@H](O)[C@H](C)C1 ZINC000017260326 FG Annotated Anodyne C[C@@H]1C[C@H]([C@@H]2C[C@@H](CC(=O)NC3CCCCC3)CC(=O)O2)[C@H](O)[C@H](C)C1 ZINC000017260329 FG Annotated Anodyne C[C@H]1C[C@@H](C)C[C@H]([C@@H]2C[C@@H](CC(=O)NC3CCCCC3)CC(=O)O2)[C@@H]1O ZINC000017260333 FG Annotated Anodyne C[C@H]1C[C@H](C)[C@@H](O)[C@@H]([C@@H]2C[C@@H](CC(=O)NC3CCCCC3)CC(=O)O2)C1 ZINC000017260336 FG Annotated Anodyne O=[N+]([O-])c1ccc(S(=O)(=O)NN=Cc2ccc(Cl)c(Cl)c2)cc1 ZINC000017284152 FG Annotated Anodyne CNC(=O)CCC1=[N+]2C(=Cc3ccc(-c4cccs4)n3[B-]2(F)F)C=C1 ZINC000170058130 FG Annotated Anodyne C=CCn1c(SCC(=O)[C@H](C#N)C(C)=N)nc2sc(C)c(C)c2c1=O ZINC000017539589 FG Annotated Mild CC1(C)CC(=O)[C@H]2C(=Nc3nc(S)[nH]c(=O)c3[C@H]2c2ccccc2)C1 ZINC000017730395 FG Annotated Anodyne N#C[C@H](C(=O)COC(=O)c1ccccc1O)c1nc2ccccc2s1 ZINC000017779726 FG Annotated Mild N#C[C@@H](C(=O)COC(=O)c1ccccc1O)c1nc2ccccc2s1 ZINC000017779729 FG Annotated Mild O[C@@H](COCc1ccc(Cl)cc1)[C@H](O)COCc1ccc(Cl)cc1 ZINC000018010725 FG Annotated Anodyne NC(=S)/N=N/c1c(O)n(CC(=O)Nc2ccccc2)c2ccccc12 ZINC000018023433 FG Annotated Clean CC(=O)Nc1ccc(NC2=NNC(=C3C=CC(=O)C=C3)c3ccccc32)cc1 ZINC000018066407 FG Annotated Mild Oc1[nH]c2ccc(Br)cc2c1/N=N\C(=S)N1CCOCC1 ZINC000018107127 FG Annotated Clean CCOC(=O)c1cnc2c(/N=N\c3cccc(Cl)c3)c(N)nn2c1N ZINC000018118569 FG Annotated Clean CC[C@@H](C)OC(=O)/N=c1/cc2c(c(N)[nH]1)N=C(c1ccccc1)[C@H](C)N2 ZINC000018205452 FG Annotated Anodyne O=C(Cc1nccc2c1[nH]c1ccccc12)O[C@H]1C#CCSCC#C/C=C\1 ZINC000018205931 FG Annotated Mild CC1(C)CC(=O)[C@@H]2C(=Nc3[nH]c(S)nc(=O)c3[C@H]2c2ccccc2)C1 ZINC000018255937 FG Annotated Anodyne Cc1cccc(NC(=O)CNC(=O)C23C[C@@H]4C[C@@H](CC(Cl)(C4)C2)C3)n1 ZINC000018270544 FG Annotated Anodyne O=C(NCc1ccccn1)c1ccc([C@@H]2CCCN2C2CCOCC2)s1 ZINC000019110832 FG Annotated Anodyne O=C(NCc1ccccn1)c1ccc([C@H]2CCCN2C2CCOCC2)s1 ZINC000019110835 FG Annotated Anodyne Cc1ncc2c(c1-c1noc(-c3cccc(-c4cn[nH]c4)c3)n1)CCNC2 ZINC000019114074 FG Annotated Anodyne COc1ccc2c(c1)N(C(=O)CSc1nc(C)n[nH]1)C(C)(C)C=C2C ZINC000019134818 FG Annotated Anodyne Cc1ncc2c(c1-c1noc([C@H](C)n3ccnc3C(C)C)n1)CCNC2 ZINC000019144739 FG Annotated Anodyne Cc1ncc2c(c1-c1noc([C@@H](C)n3ccnc3C(C)C)n1)CCNC2 ZINC000019144743 FG Annotated Anodyne Cc1ncc2c(c1-c1noc(-c3ccc(-c4ncc[nH]4)s3)n1)CCNC2 ZINC000019146197 FG Annotated Anodyne Cc1noc(-c2ccc(N3CCc4[nH]nc(-c5ccccc5)c4C3)nc2)n1 ZINC000019146681 FG Annotated Anodyne Fc1ccc(-c2cccc(N3CCC(NC[C@@H]4COCCO4)CC3)c2)cc1 ZINC000019146855 FG Annotated Anodyne Fc1ccc(-c2cccc(N3CCC(NC[C@H]4COCCO4)CC3)c2)cc1 ZINC000019146857 FG Annotated Anodyne COCc1cc(=O)[nH]c(-c2cccc(CN(C)Cc3cccs3)c2)n1 ZINC000019228721 FG Annotated Anodyne Cc1ncc2c(c1-c1noc(CCc3c[nH]c4ccccc34)n1)CCNC2 ZINC000019229238 FG Annotated Anodyne CCCN1CCN(C(=O)CCc2nnc(CCC3CCCCC3)o2)CC1 ZINC000019301158 FG Annotated Anodyne CC(C)[C@H](c1nnnn1Cc1cccs1)N1CCN(C2CCCC2)CC1 ZINC000019446077 FG Annotated Anodyne CC(C)[C@@H](c1nnnn1Cc1cccs1)N1CCN(C2CCCC2)CC1 ZINC000019446079 FG Annotated Anodyne CC(C)S(=O)(=O)N1C[C@@H](c2ccccc2)[C@H]2[C@H]1CCCCCN2C ZINC000019451116 FG Annotated Anodyne CC1=C2C(N)=C(C(=O)Nc3ccccc3)S[C@H]2NC(C(F)(F)F)=C1 ZINC000019461941 FG Annotated Anodyne CO[C@H]1C[C@H](O[Si](C)(C)C(C)(C)C)O[C@@H](C)/C1=C/CN1CCOCC1 ZINC000194861125 FG Annotated Reactive CCCn1ncc(-c2ccnc(N3CCC[C@@H]3c3nonc3C)n2)c1C ZINC000019595684 FG Annotated Anodyne CCCn1ncc(-c2ccnc(N3CCC[C@H]3c3nonc3C)n2)c1C ZINC000019595685 FG Annotated Anodyne Cc1ncc2c(c1-c1noc(COc3ccc(F)c(Cl)c3)n1)CCNC2 ZINC000019632880 FG Annotated Anodyne CN(C)c1cnn(Cc2csc(C34CC5CC(CC(C5)C3)C4)n2)c(=O)c1 ZINC000019635654 FG Annotated Anodyne c1cc(-c2cc3ccccc3[nH]2)cc(N2CCC(NCc3nnn[nH]3)CC2)c1 ZINC000019742437 FG Annotated Anodyne COCCCn1ccc(-c2cccc(-c3ccc(-n4cnnc4)nc3)c2)n1 ZINC000019771536 FG Annotated Anodyne CN(C)C(=O)c1cncc(-c2cccc(-c3ccn(CCCCF)n3)c2)n1 ZINC000019772684 FG Annotated Anodyne CC(C)c1csc(CN2CCN(Cc3ccccc3)[C@@H](CCO)C2)n1 ZINC000019789786 FG Annotated Anodyne CN(Cc1cccc(-c2nc(O)cc(C(F)(F)F)n2)c1)Cc1cc[nH]n1 ZINC000019799242 FG Annotated Anodyne CCC(C)(C)c1nnc(NC(=O)NCCc2cn3ccccc3n2)s1 ZINC000019836086 FG Annotated Anodyne OCC[C@H]1CN(Cc2cccc3cnccc23)CCN1C1CCCCC1 ZINC000019839061 FG Annotated Anodyne CCN(CC)[C@@H]1CCN(Cc2ccc(-c3nc(C)c(F)c(O)n3)cc2)C1 ZINC000019868037 FG Annotated Anodyne CCN(CC)[C@H]1CCN(Cc2ccc(-c3nc(C)c(F)c(O)n3)cc2)C1 ZINC000019868041 FG Annotated Anodyne CC1=C(C(=O)N2CCOCC2)[C@@H](c2ccsc2)C2=C(O)CCCC2=N1 ZINC000019901265 FG Annotated Anodyne CC1=C(C(=O)N2CCOCC2)[C@H](c2ccsc2)C2=C(O)CCCC2=N1 ZINC000019901267 FG Annotated Anodyne CCn1cncc1Cn1ccc(-c2cccc(-c3nccnc3C#N)c2)n1 ZINC000019952951 FG Annotated Mild Cc1cc(C(F)(F)F)nc(CNC(=O)c2ccc([C@@H]3CCCN3)s2)n1 ZINC000019957789 FG Annotated Anodyne Cc1cc(C(F)(F)F)nc(CNC(=O)c2ccc([C@H]3CCCN3)s2)n1 ZINC000019957793 FG Annotated Anodyne CC(C)(C)[SiH2]OCCN(CCO[SiH2]C(C)(C)C)c1ccccc1 ZINC000195066768 FG Annotated Reactive O=C1CCC/C=C/C[C@H]2[C@@H](O)C[C@@H](O)[C@@H]2/C=C\[C@@H](COc2ccccc2)O1 ZINC000195144499 FG Annotated Anodyne O=C1CCC/C=C\C[C@H]2[C@@H](O)C[C@@H](O)[C@@H]2/C=C/[C@@H](COc2ccccc2)O1 ZINC000195144506 FG Annotated Anodyne O=C1CCC/C=C/C[C@H]2[C@@H](O)C[C@@H](O)[C@@H]2/C=C/[C@@H](COc2ccccc2)O1 ZINC000195144514 FG Annotated Anodyne COc1ccc([C@H]2c3c(ccc4ccccc34)O[C@H]3N=CNC(=O)[C@@H]23)cc1 ZINC000195154667 FG Annotated Anodyne COc1ccc([C@@H]2c3c(ccc4ccccc34)O[C@H]3N=CNC(=O)[C@H]32)cc1 ZINC000195154679 FG Annotated Anodyne CC(=O)O[C@@H]1[C@H](C)C[C@H]2[C@H]3[C@@H]1[C@@H]1CC(=O)CCC[C@](C)(OC[C@@H]2C)[C@@H]3O1 ZINC000195209886 FG Annotated Anodyne O=C(OB(c1cccc(Cl)c1)c1cccc(Cl)c1)c1ncccc1O ZINC000195218291 FG Annotated Anodyne COc1ccc(CCN2C(=O)[C@H]3[C@@H]4CC[C@H](C4=C(C)C)[C@H]3C2=O)cc1OC ZINC000195218441 FG Annotated Anodyne COc1ccc(CCN2C(=O)[C@H]3[C@@H]4CC[C@H](C4=C(C)C)[C@@H]3C2=O)cc1OC ZINC000195218457 FG Annotated Anodyne O=C(OB(c1ccc(Cl)cc1)c1ccc(Cl)cc1)c1ncccc1O ZINC000195218965 FG Annotated Anodyne C[C@@H]1CC[C@@H]2[C@@H](C)C(=O)N(Cc3ccccn3)[C@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 ZINC000195306576 FG Annotated Reactive C[C@@H]1CC[C@H]2[C@@H](C)C(=O)N(Cc3ccccn3)[C@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000195306587 FG Annotated Reactive Cc1ccc(B(OC(=O)c2ncccc2O)c2ccc(C)c(Cl)c2)cc1 ZINC000195309298 FG Annotated Anodyne C/C=C1/C[N+]2([O-])[C@H]3C[C@H]1[C@H]1[C@H](OC(C)=O)[C@@]4(C[C@@H]12)C3=Nc1ccccc14 ZINC000195324177 FG Annotated Bother C/C=C1/C[N+]2([O-])[C@H]3C[C@H]1[C@H]1[C@@H]2C[C@@]2(C3=Nc3ccccc32)[C@@H]1OC(C)=O ZINC000195324191 FG Annotated Bother CC(=O)[C@H]1CC[C@H]2[C@@H]3C[C@@H](C)[C@]4(O)CC(=O)CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C ZINC000195338745 FG Annotated Anodyne CC(=O)[C@H]1CC[C@H]2[C@@H]3C[C@H](C)[C@]4(O)CC(=O)CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C ZINC000195338758 FG Annotated Anodyne CC1(C)c2[nH]c3cc(Cl)ccc3c2C[C@@]23CN4CCC[C@@]4(C[C@H]12)C(=O)N3 ZINC000195346629 FG Annotated Anodyne O=C(O)[C@@H]1Nc2c(cccc2S(=O)(=O)c2ccccc2)[C@@H]2C=CC[C@@H]12 ZINC000195353364 FG Annotated Clean O=C(O)[C@H]1Nc2c(cccc2S(=O)(=O)c2ccccc2)[C@@H]2C=CC[C@@H]12 ZINC000195353370 FG Annotated Clean O=C1[C@@H]2C=C(I)[C@H](C[C@H]2c2ccccc2)[C@]12CO2 ZINC000195361445 FG Annotated Anodyne CN1CC[C@]2(CCCCC2=O)[C@@]12C(=O)Nc1ccc(Br)cc12 ZINC000195378471 FG Annotated Anodyne COc1ccc([C@H]2c3ccc4ccccc4c3O[C@@H]3NC(=O)N=C(N)[C@H]32)cc1 ZINC000195384146 FG Annotated Anodyne COc1ccc([C@@H]2c3ccc4ccccc4c3O[C@@H]3NC(=O)N=C(N)[C@H]32)cc1 ZINC000195384151 FG Annotated Anodyne COc1ccc([C@H]2c3c(ccc4ccccc34)O[C@@H]3NC(=O)N=C(N)[C@H]32)cc1 ZINC000195392729 FG Annotated Anodyne COc1ccc([C@@H]2c3c(ccc4ccccc34)O[C@@H]3NC(=O)N=C(N)[C@H]32)cc1 ZINC000195392735 FG Annotated Anodyne COC(=O)c1c(NC(=O)[C@@H]2[C@@H]3C=C[C@H](CC3)[C@@H]2C(=O)O)sc(C)c1C ZINC000195394947 FG Annotated Anodyne COC(=O)c1c(NC(=O)[C@H]2[C@@H]3C=C[C@H](CC3)[C@@H]2C(=O)O)sc(C)c1C ZINC000195394953 FG Annotated Anodyne CC[C@H]1C/C=C/Cc2ccccc2[C@H](C(=O)C[C@@H](O)CC(C)=O)OC1=O ZINC000195396429 FG Annotated Anodyne COc1ccc([C@H]2c3ccc4ccccc4c3O[C@H]3N=CNC(=O)[C@@H]23)cc1 ZINC000195397183 FG Annotated Anodyne COc1ccc([C@@H]2c3ccc4ccccc4c3O[C@H]3N=CNC(=O)[C@H]32)cc1 ZINC000195397190 FG Annotated Anodyne CN(C)c1ccc([C@@H]2[C@@H]3C=C[C@H](C3)[C@@]2(C#N)C(=O)O)c(Br)c1 ZINC000195421729 FG Annotated Mild COC(=O)[C@]12C[C@@H](C)[C@@H]3[C@@H](C)[C@H](c4ccccc4[C@@H]31)N2C(=O)C(F)(F)F ZINC000195427259 FG Annotated Anodyne COC(=O)[C@@]12C[C@@H](C)[C@@H]3[C@@H](C)[C@H](c4ccccc4[C@@H]31)N2C(=O)C(F)(F)F ZINC000195427266 FG Annotated Anodyne COC(=O)[C@]12C[C@H](C)[C@@H]3[C@@H](C)[C@H](c4ccccc4[C@@H]31)N2C(=O)C(F)(F)F ZINC000195427273 FG Annotated Anodyne COC(=O)[C@@]12C[C@H](C)[C@@H]3[C@@H](C)[C@H](c4ccccc4[C@@H]31)N2C(=O)C(F)(F)F ZINC000195427277 FG Annotated Anodyne COc1ccc(NC(=O)[C@H]2C(=O)N(C)[C@@]3(C)C[C@H]2c2ccccc2O3)cc1 ZINC000195428497 FG Annotated Anodyne CCN1C(NCC(C)C)=N[C@H](CCc2ccccc2)[C@H](C(=O)OC)[C@H]1C ZINC000195474138 FG Annotated Anodyne CCN1C(NCC(C)C)=N[C@H](CCc2ccccc2)[C@@H](C(=O)OC)[C@H]1C ZINC000195474144 FG Annotated Anodyne CC(=O)NCC[C@@H]1CN(C(=O)/C=C\C#C[Si](C)(C)C)c2ccccc21 ZINC000195501159 FG Annotated Mild CC(=O)NCC[C@H]1CN(C(=O)/C=C\C#C[Si](C)(C)C)c2ccccc21 ZINC000195501160 FG Annotated Mild C[C@@H](CC(=O)N1[C@@H]2C[C@@H]3CC[C@@]2(CS1(=O)=O)C3(C)C)[Si](C)(C)C ZINC000195505172 FG Annotated Anodyne C[C@H](CC(=O)N1[C@@H]2C[C@@H]3CC[C@@]2(CS1(=O)=O)C3(C)C)[Si](C)(C)C ZINC000195505173 FG Annotated Anodyne C[C@@H](CC(=O)N1[C@H]2C[C@@H]3CC[C@@]2(CS1(=O)=O)C3(C)C)[Si](C)(C)C ZINC000195505176 FG Annotated Anodyne C[C@H](CC(=O)N1[C@H]2C[C@@H]3CC[C@@]2(CS1(=O)=O)C3(C)C)[Si](C)(C)C ZINC000195505179 FG Annotated Anodyne C/C1=C/CC[C@@]2(C)O[C@@H]2[C@H]2OC(=O)[C@@H](CN3CCC(F)(F)C3)[C@@H]2CC1 ZINC000195518451 FG Annotated Anodyne C/C1=C/CC[C@@]2(C)O[C@@H]2[C@H]2OC(=O)[C@@H](CN3CCC[C@@H](F)C3)[C@@H]2CC1 ZINC000195523507 FG Annotated Anodyne C[Si](C)(C)CCOCn1c(Sc2ccccc2)cc(=O)[nH]c1=O ZINC000195523718 FG Annotated Anodyne C/C1=C/CC[C@@]2(C)O[C@@H]2[C@H]2OC(=O)[C@@H](CN3CCC(F)CC3)[C@@H]2CC1 ZINC000195524076 FG Annotated Anodyne C[Si](C)(C)C[C@@](O)(Cn1cncn1)c1ccc(Br)cc1 ZINC000195840476 FG Annotated Anodyne C[Si](C)(C)C[C@](O)(Cn1cncn1)c1ccc(Br)cc1 ZINC000195840481 FG Annotated Anodyne CC(C)(C)[Si](C)(C)O[C@@H]1CC(=O)O[C@H]1CI ZINC000196125054 FG Annotated Reactive CC(=O)Oc1cc(C)c(OC[C@H](C)N2C(=O)c3ccccc3C2=O)c(C)c1 ZINC000196156617 FG Annotated Anodyne in-vitro C[Si](C)(C)C#C[C@@](O)(Cn1cncn1)c1ccc(Cl)cc1Cl ZINC000196214619 FG Annotated Mild C[Si](C)(C)C#C[C@](O)(Cn1cncn1)c1ccc(Cl)cc1Cl ZINC000196214626 FG Annotated Mild CNC(=O)/C(=N/OC)c1ccccc1Oc1ccc([Si](C)(C)C)cc1 ZINC000196276163 FG Annotated Mild Oc1cc(O)c2c(c1)C[C@@H]1c3cc(O)c(O)cc3[C@H]2c2cc(O)cc(O)c21 ZINC000197358280 FG Annotated Clean COC(=O)[C@@H]1C[C@]23C4=C(CC[C@@H]5CN[C@H]2[C@@H](C(C)C)[C@@H](O)C[C@@]53C)CC[C@@H]41 ZINC000197364602 FG Annotated Anodyne C[C@@]1(O)C[C@@]23CC[C@@H]4[C@](C)(C(=O)O)CCC[C@@]4(C(=O)O)[C@@H]2CC[C@@H]1C3 ZINC000197446812 FG Annotated Anodyne CC(/C=C/C=O)=C1/C(=O)C[C@@H]2[C@]1(C)CC[C@H]1[C@@](C)(CO)[C@H](O)CC[C@]21C ZINC000197455946 FG Annotated Reactive COc1cc(C(=O)O[C@@H](c2ccc3c(c2)OCO3)[C@H](C)C(C)=O)ccc1O ZINC000198043281 FG Annotated Anodyne CC1(C)OB(O)c2cc(NC(=O)c3ccc(F)cc3C(F)(F)F)ccc21 ZINC000198072921 FG Annotated Unstable in-vivo C=C1C(=O)O[C@@H]2CC(C)=C([C@@H](C)CCCO)[C@@H](OC(=O)[C@H](C)CC)[C@H]12 ZINC000198550498 FG Annotated Mild C=C1C(=O)O[C@@H]2CC(C)=C([C@@H](C)CCCO)[C@@H](OC(=O)CC(C)C)[C@H]12 ZINC000198550537 FG Annotated Mild CN(C)CCSSCCNC(=O)c1ccc(C#Cc2ccccc2)o1 ZINC000198575343 FG Annotated Reactive C/C=C/C1=CC2=CC3=C(C(=O)CCCCC)C(=O)O[C@@]3(C)[C@@H](O)C2=CO1 ZINC000198586157 FG Annotated Mild CCCC(=O)N1CCc2cc3c(c4c2[C@@H]1[C@H](O)c1ccccc1-4)OCO3 ZINC000198811738 FG Annotated Anodyne CC(C)C[C@@](CN)(C(=O)O)C(=O)OCC1c2ccccc2-c2ccccc21 ZINC000198831524 FG Annotated Anodyne CC(C)C[C@](CN)(C(=O)O)C(=O)OCC1c2ccccc2-c2ccccc21 ZINC000198831543 FG Annotated Anodyne Cc1ccc(N)cc1CN1CCN(c2ncc(Cc3ccccc3)cn2)CC1 ZINC000198922265 FG Annotated Anodyne CC1(C)C=Cc2c(O)c3c(c(C=O)c2O1)O[C@H](c1ccccc1)[C@@H](O)C3=O ZINC000199044697 FG Annotated Anodyne CC1(C)C=Cc2c(O)c(C=O)c3c(c2O1)C(=O)[C@H](O)[C@@H](c1ccccc1)O3 ZINC000199044719 FG Annotated Anodyne Cc1ccc(CN2C(=O)CC[C@@]2(C)c2nnnn2Cc2ccccc2)cc1 ZINC000199214108 FG Annotated Anodyne Cc1ccc(CN2C(=O)CC[C@]2(C)c2nnnn2Cc2ccccc2)cc1 ZINC000199214119 FG Annotated Anodyne O=C1c2ccccc2[C@@H](c2nnnn2Cc2ccccc2)N1Cc1ccco1 ZINC000199224426 FG Annotated Anodyne O=C1c2ccccc2[C@H](c2nnnn2Cc2ccccc2)N1Cc1ccco1 ZINC000199224441 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCc2onc(-c3ccccc3[N+](=O)[O-])c2C1=O ZINC000199229709 FG Annotated Bother Cc1cccc(C)c1NC(=O)[C@]1(C)CSCC(=O)N1Cc1ccco1 ZINC000199230492 FG Annotated Anodyne Cc1cccc(C)c1NC(=O)[C@@]1(C)CSCC(=O)N1Cc1ccco1 ZINC000199230508 FG Annotated Anodyne Cc1ccccc1CN1C(=O)CSC[C@@]1(C)C(=O)NCc1ccccc1 ZINC000199230920 FG Annotated Anodyne Cc1ccccc1CN1C(=O)CSC[C@]1(C)C(=O)NCc1ccccc1 ZINC000199230939 FG Annotated Anodyne CC(C)NC(=O)[C@]1(C)CSCC(=O)N1Cc1cccc(C(F)(F)F)c1 ZINC000199231147 FG Annotated Anodyne CC(C)NC(=O)[C@@]1(C)CSCC(=O)N1Cc1cccc(C(F)(F)F)c1 ZINC000199231161 FG Annotated Anodyne Cc1cccc(C)c1NC(=O)[C@]1(C)CSCC(=O)N1CC(F)(F)F ZINC000199231722 FG Annotated Anodyne Cc1cccc(C)c1NC(=O)[C@@]1(C)CSCC(=O)N1CC(F)(F)F ZINC000199231737 FG Annotated Anodyne Oc1cccc2c1[C@H](O)[C@@H](Cl)[C@@H](O)C21Oc2cccc3cccc(c23)O1 ZINC000199263902 FG Annotated Reactive Oc1cccc2c1[C@@H](O)[C@H](Cl)[C@@H](O)C21Oc2cccc3cccc(c23)O1 ZINC000199263925 FG Annotated Reactive CCCCC[C@H]1OC(=O)[C@H](C)[C@H](OC(C)=O)/C=C/CC[C@@H]1OC(C)=O ZINC000199307403 FG Annotated Anodyne CN1OC[C@@H]2CN(C(=O)C(C)(C)C)[C@H](c3ccc(-n4ccnc4)cc3)C[C@@H]21 ZINC000199387711 FG Annotated Anodyne CC(C)n1c(=O)c2ccccc2n1Cc1cn(Cc2cccs2)nn1 ZINC000199393632 FG Annotated Anodyne O=C(NC1CCCCC1)[C@H](c1ccnc2ccccc12)N1CCOCC1 ZINC000199395173 FG Annotated Anodyne O=C(NC1CCCCC1)[C@@H](c1ccnc2ccccc12)N1CCOCC1 ZINC000199395188 FG Annotated Anodyne Cn1nc(C(C)(C)C)cc1N1C(=O)CC[C@]1(C)C(=O)NC1CCCCC1 ZINC000199397677 FG Annotated Anodyne Cn1nc(C(C)(C)C)cc1N1C(=O)CC[C@@]1(C)C(=O)NC1CCCCC1 ZINC000199397692 FG Annotated Anodyne Cc1ccc(-c2ccc(=O)n(CC(=O)N(C)[C@@H](C)c3ccco3)n2)cc1 ZINC000199403196 FG Annotated Anodyne Cc1ccc(-c2ccc(=O)n(CC(=O)N(C)[C@H](C)c3ccco3)n2)cc1 ZINC000199403210 FG Annotated Anodyne C=CCNC1=N[C@@H](c2cccc(C(F)(F)F)c2)C(C(=O)OC)=C(C)N1C ZINC000199422411 FG Annotated Mild C=CCNC1=N[C@H](c2cccc(C(F)(F)F)c2)C(C(=O)OC)=C(C)N1C ZINC000199422425 FG Annotated Mild C=CCNC1=N[C@@H](c2ccc(C(F)(F)F)cc2)C(C(=O)OC)=C(C)N1C ZINC000199422514 FG Annotated Mild C=CCNC1=N[C@H](c2ccc(C(F)(F)F)cc2)C(C(=O)OC)=C(C)N1C ZINC000199422531 FG Annotated Mild COc1ccc(Cc2coc3c(C=O)c(O)c(C)c(OC)c3c2=O)cc1 ZINC000199428815 FG Annotated Anodyne COc1ccc(C2=C(O)/C(=C(\C(=O)O)c3ccc(OC)cc3)OC2=O)cc1 ZINC000199657511 FG Annotated Anodyne Cc1noc(C)c1S(=O)(=O)N1CCCc2nc(-c3ccccc3)ccc21 ZINC000199725961 FG Annotated Anodyne C=CCN1C(=O)c2n[nH]c(COC)c2[C@H]1c1ccc(Br)cc1 ZINC000199728978 FG Annotated Mild C=CCN1C(=O)c2n[nH]c(COC)c2[C@@H]1c1ccc(Br)cc1 ZINC000199728994 FG Annotated Mild C=CCN1C(=O)c2n[nH]c(COC)c2[C@H]1c1cccc(C(F)(F)F)c1 ZINC000199729128 FG Annotated Mild C=CCN1C(=O)c2n[nH]c(COC)c2[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000199729147 FG Annotated Mild COCc1[nH]nc2c1[C@@H](c1ccc(F)cc1)N(Cc1ccccc1)C2=O ZINC000199731130 FG Annotated Anodyne COCc1[nH]nc2c1[C@H](c1ccc(F)cc1)N(Cc1ccccc1)C2=O ZINC000199731146 FG Annotated Anodyne COCc1[nH]nc2c1[C@@H](c1ccc(F)cc1)N(c1ccc(OC)cc1)C2=O ZINC000199731425 FG Annotated Anodyne COCc1[nH]nc2c1[C@H](c1ccc(F)cc1)N(c1ccc(OC)cc1)C2=O ZINC000199731438 FG Annotated Anodyne O=C(c1ccccc1)N1Cc2cc(Br)ccc2-n2nncc2C1 ZINC000199735780 FG Annotated Anodyne CCNC(=O)N1C[C@H]2CON(C)[C@H]2C[C@H]1c1ccc(N2CCCCC2)cc1 ZINC000199736758 FG Annotated Clean C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@@H]2[C@]1(C)/C(O)=C1\C(=O)[C@H](CO)N(C)C1=O ZINC000199782973 FG Annotated Mild COC(=O)/C1=C\CC[C@](C)(O)/C=C/[C@@]2(C(C)C)CC[C@](C)(O2)[C@@H](O)CC1 ZINC000199852589 FG Annotated Anodyne COC(=O)/C1=C\CC[C@](C)(O)/C=C/[C@]2(C(C)C)CC[C@](C)(O)[C@H](CC1)O2 ZINC000199857688 FG Annotated Anodyne COC(=O)/C1=C\CC[C@@](C)(O)/C=C/[C@]2(C(C)C)CC[C@](C)(O)[C@H](CC1)O2 ZINC000199857746 FG Annotated Anodyne C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)/C(O)=C1\C(=O)N[C@H]([C@H](C)O)C1=O ZINC000199873527 FG Annotated Mild O=C1Nc2ccc(Cl)cc2C(c2ccccc2Cl)=N[C@H]1OCCO ZINC000002006850 FG Annotated Anodyne O=C1Nc2ccc(Cl)cc2C(c2ccccc2Cl)=N[C@@H]1OCCO ZINC000002006851 FG Annotated Anodyne CCOC(=O)N1c2ccccc2NC(=O)[C@@]1(C#CC1CC1)C(F)(F)F ZINC000002008764 FG Annotated Mild Cc1cc2c(s1)CC[C@@H](CN[C@H]1CC[C@@H](Oc3ccccc3)[C@H]1O)C2=O ZINC000002014157 FG Annotated Anodyne Cc1cc2c(s1)CC[C@H](CN[C@H]1CC[C@@H](Oc3ccccc3)[C@H]1O)C2=O ZINC000002014158 FG Annotated Anodyne CCOC(=O)c1c(C)[nH]c2c1-c1cc(Br)ccc1C(=O)C2=O ZINC000002075115 FG Annotated Clean CCCCS(=O)(=O)/C=C/[C@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1S(=O)(=O)CCCC ZINC000002147368 FG Annotated Anodyne CCCCOC(=O)NC(=O)c1coc2ccc(Br)cc2c1=O ZINC000002178738 FG Annotated Anodyne CCCCN(C)C(=O)c1sc2nc(C)nc(N3CCOCC3)c2c1C ZINC000002452357 FG Annotated Anodyne CCOc1ccc(S(=O)(=O)NCc2ccc(F)cc2)c2cccnc12 ZINC000002455812 FG Annotated Anodyne Cn1c(=O)cc(SCC(=O)NCCc2ccsc2)c2ccccc21 ZINC000002456144 FG Annotated Anodyne O=C(Nc1c2c(nn1-c1cccc(Cl)c1)C[S@](=O)C2)C1CCCC1 ZINC000002456747 FG Annotated Anodyne CC(C)CC(=O)Nc1c2c(nn1-c1cccc(Cl)c1)C[S@](=O)C2 ZINC000002456772 FG Annotated Anodyne CCOc1ccc(C(=O)Nc2c3c(nn2C(C)(C)C)C[S@](=O)C3)cc1 ZINC000002456824 FG Annotated Anodyne CC(=O)N(C[C@H]1CCCO1)C1(C(=O)NC2CCCCC2)CCCCC1 ZINC000002457469 FG Annotated Anodyne CC(=O)N(C[C@@H]1CCCO1)C1(C(=O)NC2CCCCC2)CCCCC1 ZINC000002457471 FG Annotated Anodyne CCOc1ccccc1N(CC)S(=O)(=O)c1cccc2nsnc12 ZINC000002457895 FG Annotated Clean CN(CCCNC(=O)[C@]1(C)CON=C1c1ccccc1)c1ccccc1 ZINC000002459521 FG Annotated Anodyne CN(CCCNC(=O)[C@@]1(C)CON=C1c1ccccc1)c1ccccc1 ZINC000002459523 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2oc(C(=O)N3CCCC3)c(C)c2c1 ZINC000002459844 FG Annotated Anodyne CC[C@@H](C)NC(=O)c1oc2ccc(S(=O)(=O)N3CCCC3)cc2c1C ZINC000002459963 FG Annotated Anodyne CC[C@H](C)NC(=O)c1oc2ccc(S(=O)(=O)N3CCCC3)cc2c1C ZINC000002459965 FG Annotated Anodyne CCN(CC)C(=O)c1cn(CC(C)C)c(=O)c2cc(OC)c(OC)cc12 ZINC000002460391 FG Annotated Anodyne C[C@@]1(C(=O)NCCOc2ccccc2)CON=C1c1ccc(Cl)cc1 ZINC000002462915 FG Annotated Anodyne C[C@]1(C(=O)NCCOc2ccccc2)CON=C1c1ccc(Cl)cc1 ZINC000002462917 FG Annotated Anodyne CN(C)CCOC(=O)c1ccc(COc2ccccc2Br)o1 ZINC000002463954 FG Annotated Anodyne C[C@H]1C[C@@H](C)CN(C(=O)c2cn(C)c(=O)c3c2c2ccccc2n3C)C1 ZINC000002465445 FG Annotated Anodyne C[C@@H]1C[C@@H](C)CN(C(=O)c2cn(C)c(=O)c3c2c2ccccc2n3C)C1 ZINC000002465446 FG Annotated Anodyne C[C@H]1C[C@H](C)CN(C(=O)c2cn(C)c(=O)c3c2c2ccccc2n3C)C1 ZINC000002465448 FG Annotated Anodyne Cc1cc(C)cc(-n2c(=O)c3sccc3n(CC(=O)C(C)(C)C)c2=O)c1 ZINC000002466762 FG Annotated Anodyne CN(C(=O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1)C1CCCCC1 ZINC000002467336 FG Annotated Anodyne CCOc1ccccc1C1=NOC[C@]1(C)C(=O)NCCOc1ccccc1 ZINC000002468417 FG Annotated Anodyne CCOc1ccccc1C1=NOC[C@@]1(C)C(=O)NCCOc1ccccc1 ZINC000002468419 FG Annotated Anodyne COc1ccccc1N1C(=O)N[C@@H]2C[C@@]1(C)Oc1ccc([N+](=O)[O-])cc12 ZINC000002468548 FG Annotated Bother COc1ccccc1N1C(=O)N[C@@H]2C[C@]1(C)Oc1ccc([N+](=O)[O-])cc12 ZINC000002468549 FG Annotated Bother COc1ccccc1N1C(=O)N[C@H]2C[C@]1(C)Oc1ccc([N+](=O)[O-])cc12 ZINC000002468552 FG Annotated Bother C[C@@]1(C(=O)NCCOc2ccccc2)CON=C1c1cccc(Cl)c1 ZINC000002471126 FG Annotated Anodyne C[C@]1(C(=O)NCCOc2ccccc2)CON=C1c1cccc(Cl)c1 ZINC000002471129 FG Annotated Anodyne O=S(=O)(O)c1cc(-n2nc3c(c2O)CCC3)ccc1Oc1ccccc1 ZINC000002472573 FG Annotated Anodyne Cc1ccc(S(=O)(=O)n2nc(C)c(Br)c2C)c(C)c1C ZINC000002472598 FG Annotated Anodyne Cc1ccc(S(=O)(=O)Nc2ccc3c4c(cccc24)S(=O)(=O)N3)cc1 ZINC000002474015 FG Annotated Clean CC1(C)CC(=O)[C@H]2C(=Nc3nc(S)[nH]c(=O)c3[C@@H]2c2ccccc2)C1 ZINC000002477858 FG Annotated Anodyne CCOc1ccc(-c2onc(-c3ccc(F)cc3)c2C(=O)NCCO)cc1 ZINC000002480257 FG Annotated Anodyne CCOc1cccc(-c2onc(-c3ccc(F)cc3)c2C(=O)NCCO)c1 ZINC000002480329 FG Annotated Anodyne CCOc1ccccc1-c1onc(-c2ccccc2F)c1C(=O)NCCO ZINC000002483091 FG Annotated Anodyne CCOc1ccc(-c2onc(-c3ccccc3F)c2C(=O)NCCO)cc1 ZINC000002483157 FG Annotated Anodyne COc1cc2c(C(=O)N3CCCC3)c(C)n(C)c2cc1Br ZINC000002485537 FG Annotated Anodyne COCCNC(=O)c1c(C(C)(C)C)noc1-c1ccc(OC)cc1OC ZINC000002485770 FG Annotated Anodyne O=C(CNc1ccccc1)CN1c2cccc3cccc(c23)S1(=O)=O ZINC000002492004 FG Annotated Anodyne Cc1ccc(C2=CC(=O)/C(=N\c3c(C)n(C)n(-c4ccccc4)c3=O)O2)cc1 ZINC000002492230 FG Annotated Mild COCCCN(C(C)=O)[C@H]1CC2(CCCCC2)Oc2ccc(C(N)=O)cc21 ZINC000002492263 FG Annotated Anodyne COCCCN(C(C)=O)[C@@H]1CC2(CCCCC2)Oc2ccc(C(N)=O)cc21 ZINC000002492264 FG Annotated Anodyne C[C@@H](CCc1ccco1)NC(=O)CSc1cc(=O)n(C)c2ccccc12 ZINC000002493975 FG Annotated Anodyne C[C@H](CCc1ccco1)NC(=O)CSc1cc(=O)n(C)c2ccccc12 ZINC000002493977 FG Annotated Anodyne C[C@@H](C(=O)N1CCCc2c1c(=O)oc1ccc(O)cc21)N1CCCCCC1 ZINC000002497643 FG Annotated Anodyne C[C@H](C(=O)N1CCCc2c1c(=O)oc1ccc(O)cc21)N1CCCCCC1 ZINC000002497646 FG Annotated Anodyne CCCN(CCOC)c1ccc2nc(O)c(Cc3ccccc3)nc2n1 ZINC000002497993 FG Annotated Anodyne CCCN(CCOC)c1ccc2nc(O)c(Cc3ccc(F)cc3)nc2n1 ZINC000002497995 FG Annotated Anodyne CN(C)c1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1coc2ccccc2c1=O ZINC000002498142 FG Annotated Reactive CN(C)c1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1coc2ccccc2c1=O ZINC000002498144 FG Annotated Reactive CCCCc1nc2nc(N(C)[C@H](C)[C@@H](O)c3ccccc3)ccc2[nH]c1=O ZINC000002499491 FG Annotated Anodyne CCCCCCN(CCO)c1ccc2[nH]c(=O)c(-c3ccccc3)nc2n1 ZINC000002499678 FG Annotated Anodyne CC1=C(C(=O)N2CCOCC2)[C@@H](c2ccccc2F)C2=C(O)CCCC2=N1 ZINC000020028868 FG Annotated Anodyne CC1=C(C(=O)N2CCOCC2)[C@H](c2ccccc2F)C2=C(O)CCCC2=N1 ZINC000020028869 FG Annotated Anodyne Cc1cc(C)c2cc(C#N)c(NCCCNC(=O)c3ccncc3)nc2c1 ZINC000020151445 FG Annotated Mild Cc1nnn(C23C[C@H]4C[C@H](CC(C(=O)NC5CCCCCC5)(C4)C2)C3)n1 ZINC000020177648 FG Annotated Anodyne Cc1cccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@@H](C)[C@H]3C)C2=O)c1 ZINC000020179033 FG Annotated Anodyne Cc1cccc(CN2CCN(CC(=O)N[C@@H]3CCC[C@H](C)[C@H]3C)C2=O)c1 ZINC000020179036 FG Annotated Anodyne Cc1nn(C)cc1CN(C)Cc1nc(-c2ccc(C(F)(F)F)cc2)no1 ZINC000020205393 FG Annotated Anodyne Oc1ccc(-c2cnccn2)cc1CN1CCN(C2CCCCC2)CC1 ZINC000020206343 FG Annotated Clean COc1ccc(-c2nn(CCC(=O)O)c3nc(C)cc(C)c23)c(OC)c1 ZINC000020213720 FG Annotated Anodyne COc1ccc(/N=C2/SCC(c3ccc(C)cc3)=NN2CCO)cc1 ZINC000020224500 FG Annotated Mild Cc1ncc2c(c1-c1noc(Cc3c(F)cccc3Cl)n1)CCNC2 ZINC000020256054 FG Annotated Anodyne CCn1cc(C2=NO[C@@H](C(=O)NCC34CC5CC(CC(C5)C3)C4)C2)c(C)n1 ZINC000020355849 FG Annotated Anodyne CCn1cc(C2=NO[C@H](C(=O)NCC34CC5CC(CC(C5)C3)C4)C2)c(C)n1 ZINC000020355850 FG Annotated Anodyne COCCCN1C(=O)c2ccccc2C[C@@]1(C)C(=O)NC1CCCCCC1 ZINC000020386727 FG Annotated Anodyne COCCCN1C(=O)c2ccccc2C[C@]1(C)C(=O)NC1CCCCCC1 ZINC000020386733 FG Annotated Anodyne C[C@@]1(C(=O)NC2CCCCC2)Cc2ccccc2C(=O)N1C[C@@H]1CCCO1 ZINC000020387417 FG Annotated Anodyne C[C@]1(C(=O)NC2CCCCC2)Cc2ccccc2C(=O)N1C[C@@H]1CCCO1 ZINC000020387424 FG Annotated Anodyne C[C@@]1(C(=O)NC2CCCCC2)Cc2ccccc2C(=O)N1C[C@H]1CCCO1 ZINC000020387429 FG Annotated Anodyne C[C@]1(C(=O)NC2CCCCC2)Cc2ccccc2C(=O)N1C[C@H]1CCCO1 ZINC000020387436 FG Annotated Anodyne CCCCNC(=O)CCC(=O)N1Cc2ccccc2Oc2ncccc21 ZINC000020413447 FG Annotated Anodyne Cc1nnc(NCc2cccs2)c2c1nnn2Cc1ccc(F)cc1 ZINC000020447483 FG Annotated Anodyne O=C(NCCCn1ncc2ccccc21)c1ccc([C@@H]2CCCN2)s1 ZINC000020455329 FG Annotated Anodyne O=C(NCCCn1ncc2ccccc21)c1ccc([C@H]2CCCN2)s1 ZINC000020455331 FG Annotated Anodyne COC(=O)C1=C2Nc3ccccc3[C@@]23CCN2CC=C[C@@]([C@H](C)Cl)(C1)[C@H]23 ZINC000200011735 FG Annotated Reactive COC(=O)C1=C2Nc3ccccc3[C@@]23CCN2CC=C[C@@]([C@@H](C)Cl)(C1)[C@H]23 ZINC000200011766 FG Annotated Reactive O=C1c2c(nc3ccccn23)NC(c2cccnc2)=N[C@H]1Cc1ccccc1 ZINC000200220582 FG Annotated Anodyne N#Cc1cn(-c2ccc(C(=O)O)c(O)c2)cc1-c1ccc2c(c1)OCCO2 ZINC000200823229 FG Annotated Mild COc1ccc(-c2cn(-c3ccc(C(=O)O)c(O)c3)cc2C#N)cc1OC ZINC000200837702 FG Annotated Mild N#Cc1cn(-c2ccc(C(=O)O)cc2)cc1-c1ccccc1OCCCO ZINC000200847442 FG Annotated Mild C=C1C[C@]23C[C@H]1CC[C@H]2[C@]1(C)CC[C@H](O)[C@](C)(COC(C)=O)[C@H]1C[C@@H]3O ZINC000201128397 FG Annotated Mild CC1CCN(C2=NC(=O)N(c3ccc(Br)cc3)C(=O)C2)CC1 ZINC000201454833 FG Annotated Anodyne Cc1ccc2c(c1)-c1c(cnn1CC(=O)NCCc1ccccc1F)CO2 ZINC000201466555 FG Annotated Anodyne Cc1ccc2c(c1)-c1c(cnn1CC(=O)NCCc1cccc(F)c1)CO2 ZINC000201466599 FG Annotated Anodyne O=C(Nc1ccc(F)cc1)OCc1cn(Cc2cc(F)ccc2F)nn1 ZINC000201478847 FG Annotated Anodyne O=C(NCCc1ccccc1)OCc1cn(-c2cccc(F)c2F)nn1 ZINC000201479093 FG Annotated Anodyne CC(=O)[C@]1(C(=O)NC2CCCC2)CC(c2ccccc2C(F)(F)F)=NO1 ZINC000201487049 FG Annotated Anodyne CC(=O)[C@@]1(C(=O)NC2CCCC2)CC(c2ccccc2C(F)(F)F)=NO1 ZINC000201487085 FG Annotated Anodyne Cc1cc(C)nc(N2CCC(C(=O)N(C)CCc3ccccc3)CC2)n1 ZINC000201487395 FG Annotated Anodyne O=S(=O)(c1cccc(-c2ccccc2)n1)N1CCC(c2cnco2)CC1 ZINC000201756570 FG Annotated Anodyne O=S(=O)(c1cccc(-c2ccccc2)n1)N1CCC[C@H](c2cnc[nH]2)C1 ZINC000201775860 FG Annotated Anodyne O=S(=O)(c1cccc(-c2ccccc2)n1)N1CCC[C@@H](c2cnc[nH]2)C1 ZINC000201775889 FG Annotated Anodyne O=S(=O)(c1cccc(-c2ccccc2)n1)N1CCC(c2cnc[nH]2)CC1 ZINC000201783919 FG Annotated Anodyne O=S(=O)(c1cccc(-c2ccccc2)n1)N1CCCC[C@@H]1c1cnc[nH]1 ZINC000201792548 FG Annotated Anodyne O=S(=O)(c1cccc(-c2ccccc2)n1)N1CCCC[C@H]1c1cnc[nH]1 ZINC000201792574 FG Annotated Anodyne CC(C)[C@H](CO)NCc1nc(-c2ccc(C(F)(F)F)nc2)ccc1F ZINC000202254451 FG Annotated Anodyne CCOCCOc1ccc2c(C#N)cn(-c3ccc(C(=O)O)c(O)c3)c2c1 ZINC000202394167 FG Annotated Mild N#Cc1cn(-c2ccc(C(=O)O)c(O)c2)c2cc(OCCCCO)ccc12 ZINC000202394425 FG Annotated Mild CCC[C@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nnc(C)n1CC ZINC000202519920 FG Annotated Anodyne CCC[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nnc(C)n1CC ZINC000202519944 FG Annotated Anodyne CCn1c(C)nnc1[C@@H](CC1CC1)NS(=O)(=O)c1ccc(Cl)cc1 ZINC000202523211 FG Annotated Anodyne CCn1c(C)nnc1[C@H](CC1CC1)NS(=O)(=O)c1ccc(Cl)cc1 ZINC000202523228 FG Annotated Anodyne CC(=O)O[C@@H]1C(=O)[C@H](C(C)C)[C@@]2(C)CC[C@]3(C)CCC(=O)C4=C3[C@H](OC4)[C@@H]12 ZINC000202804561 FG Annotated Mild CC(/C=C/C(=O)c1c(O)c(-c2ccc(O)cc2)c[nH]c1=O)=C\[C@H](C)[C@H](C)O ZINC000203387281 FG Annotated Mild NC(N)=NC(=O)N1Cc2c(-c3c(F)cccc3F)ccc(F)c2C2(CC2)C1 ZINC000203411873 FG Annotated Mild Cc1nn(Cc2c(Cl)cccc2C2CC2)c2cc(-c3nn[nH]n3)cnc12 ZINC000203424053 FG Annotated Anodyne Cc1cccc(Cl)c1Cn1nc(Cl)c2ncc(-c3nn[nH]n3)cc21 ZINC000203425303 FG Annotated Anodyne O=C(Nc1ccc(F)cc1)OCc1cn(Cc2cccc(F)c2F)nn1 ZINC000203462606 FG Annotated Anodyne O=C(Nc1ccc(F)cc1)OCc1cn(Cc2ccc(F)cc2F)nn1 ZINC000203462613 FG Annotated Anodyne O=C(Nc1ccc(F)cc1)OCc1cn(Cc2ccc(F)c(F)c2)nn1 ZINC000203462628 FG Annotated Anodyne O=C(NCCc1ccccc1)OCc1cn(-c2cccc(Cl)c2)nn1 ZINC000203462684 FG Annotated Anodyne O=C(NCCc1ccccc1)OCc1cn(-c2ccc(F)c(F)c2)nn1 ZINC000203462763 FG Annotated Anodyne O=C(NCCc1ccccc1)OCc1cn(-c2c(F)cccc2F)nn1 ZINC000203462771 FG Annotated Anodyne C[C@]1(c2nnnn2Cc2ccccc2)CCCC(=O)N1Cc1cccs1 ZINC000203465244 FG Annotated Anodyne C[C@@]1(c2nnnn2Cc2ccccc2)CCCC(=O)N1Cc1cccs1 ZINC000203465250 FG Annotated Anodyne COc1ccc2c3c([nH]c2c1)[C@]1(NCC3)C(=O)N(C)c2ccc(Cl)cc21 ZINC000203473151 FG Annotated Anodyne CC(C)[C@H]1Cn2nnc(-c3ccccc3)c2Cn2c3ccccc3c(=O)n21 ZINC000203473856 FG Annotated Anodyne Cc1ccc2c(c1)N(CCCC(=O)N(C)Cc1ccccc1F)C(=O)CO2 ZINC000203474507 FG Annotated Anodyne CN(Cc1ccco1)C(=O)c1cccc2c1C(=O)N(Cc1cccnc1)C2 ZINC000203474624 FG Annotated Anodyne Cc1nn(Cc2cccc(Cl)c2Cl)c2cc(-c3nn[nH]n3)cnc12 ZINC000203701807 FG Annotated Anodyne Cc1nn(Cc2c(Cl)cccc2Cl)c2cc(-c3nn[nH]n3)cnc12 ZINC000203702303 FG Annotated Anodyne Cc1nc(N2CCc3nc(COc4ccccc4)cn3C2=O)ccc1F ZINC000203783584 FG Annotated Anodyne O=c1n(-c2ccc(F)c(F)c2)ccc2nc(COc3ccccc3)cn12 ZINC000204294400 FG Annotated Anodyne Cc1cc(N2CCc3nc(COc4ccccc4)cn3C2=O)ncc1F ZINC000204294589 FG Annotated Anodyne CC(C)[C@H](CO)NCc1nc(N2CCc3ccc(F)cc3C2)ccc1F ZINC000204407481 FG Annotated Anodyne CC(C)[C@@H](CO)NCc1nc(-c2ccc(C(F)(F)F)nc2)ccc1F ZINC000204407865 FG Annotated Anodyne CC(C)[C@H](CO)NCc1nc(-c2ccnc(C(F)(F)F)c2)ccc1F ZINC000204410737 FG Annotated Anodyne OCC1(NCc2ccnc(-c3ccc(C(F)(F)F)nc3)n2)CCCCC1 ZINC000204411116 FG Annotated Anodyne COc1ccc(-c2ccc(C(F)(F)F)nc2)nc1CN[C@@H](CO)C(C)C ZINC000204411983 FG Annotated Anodyne OCC1(NCc2ccnc(-c3ccc(C(F)(F)F)cn3)n2)CCCCC1 ZINC000204413588 FG Annotated Anodyne CC(C)[C@H](CO)NCc1nc(-c2ccc(C(F)(F)F)cc2)ncc1F ZINC000204413952 FG Annotated Anodyne CC(C)[C@H](CO)NCc1nc(-c2ccc(C(F)(F)F)cn2)ccc1F ZINC000204414523 FG Annotated Anodyne CC(C)[C@H](CO)NCc1nc(N2CCC(C(F)(F)F)CC2)ccc1F ZINC000204414671 FG Annotated Anodyne CC(C)[C@H](CO)NCc1nc(N2CCc3cccc(F)c3C2)ccc1F ZINC000204415490 FG Annotated Anodyne CC(C)[C@H](CO)NCc1nc(N2CCC[C@H](C(F)(F)F)C2)ccc1F ZINC000204416018 FG Annotated Anodyne CC(C)[C@H](CO)NCc1nc(N2CCC[C@@H](C(F)(F)F)C2)ccc1F ZINC000204416039 FG Annotated Anodyne CC(C)[C@H](CO)NCc1nc(-c2cccc(-n3cccn3)c2)ccc1F ZINC000204416969 FG Annotated Anodyne CC(C)[C@H](CO)NCc1ccc(F)c(-c2ccc(C(F)(F)F)nc2)n1 ZINC000204417374 FG Annotated Anodyne OCC1(CNCc2ccnc(-c3ccc(C(F)(F)F)cc3)n2)CCC1 ZINC000204418896 FG Annotated Anodyne CC(C)[C@H](CO)NCc1nc(-c2cncc(C(F)(F)F)c2)ccc1F ZINC000204419295 FG Annotated Anodyne COC[C@@H](CO)NCc1nc(-c2ccc(C(F)(F)F)cc2)ccc1F ZINC000204419438 FG Annotated Anodyne COC[C@H](CO)NCc1nc(-c2ccc(C(F)(F)F)cc2)ccc1F ZINC000204419457 FG Annotated Anodyne OC[C@H](NCc1nc(-c2ccc(C(F)(F)F)nc2)ccc1F)C1CC1 ZINC000204419842 FG Annotated Anodyne COc1cc(-c2ccc(F)c(CN[C@@H](CO)C(C)C)n2)cc(F)c1F ZINC000204421925 FG Annotated Anodyne CC(C)[C@H](CO)NCc1nc(N2CCc3c(F)cccc3C2)ccc1F ZINC000204422416 FG Annotated Anodyne C/C=C/C1=CC2=C(CO1)C(=O)[C@]1(C)OC(=O)[C@H]([C@H](O)CCCCC)[C@H]1C2 ZINC000204787032 FG Annotated Mild N#C[C@H]1CCCC[C@@H]1n1cc(C(N)=O)c(Nc2ccc(C(F)F)nc2)n1 ZINC000204937284 FG Annotated Mild N#C[C@@H]1CCCC[C@H]1n1cc(C(N)=O)c(Nc2ccc(C(F)F)nc2)n1 ZINC000204937302 FG Annotated Mild C[C@]1(C#N)CC[C@H](F)C[C@@H]1n1cc(C(N)=O)c(Nc2ccc(F)cc2)n1 ZINC000204956994 FG Annotated Mild C[C@]1(C#N)CC[C@@H](F)C[C@@H]1n1cc(C(N)=O)c(Nc2ccc(F)cc2)n1 ZINC000204957032 FG Annotated Mild O=C(NCc1ccccn1)[C@H](c1ccccc1)N1Cc2ccccc2C1=O ZINC000020530957 FG Annotated Anodyne O=C(NCc1ccccn1)[C@@H](c1ccccc1)N1Cc2ccccc2C1=O ZINC000020530958 FG Annotated Anodyne Fc1cccc([C@@]2(CNc3ccnn3Cc3cccnc3)CCOC2)c1 ZINC000020535704 FG Annotated Anodyne Fc1cccc([C@]2(CNc3ccnn3Cc3cccnc3)CCOC2)c1 ZINC000020535706 FG Annotated Anodyne CN(Cc1cc(-c2ccncc2)no1)C(=O)c1ccc([C@@H]2CCCN2)s1 ZINC000020536359 FG Annotated Anodyne CN(Cc1cc(-c2ccncc2)no1)C(=O)c1ccc([C@H]2CCCN2)s1 ZINC000020536363 FG Annotated Anodyne COCc1cn(CC2CCN(Cc3c(C)[nH]c4ccccc34)CC2)nn1 ZINC000020537780 FG Annotated Anodyne Cc1ncc(CN2CCC(n3cc(-c4ccc(F)cc4)nn3)CC2)cn1 ZINC000020539215 FG Annotated Anodyne CCc1ccc(CNC(=O)CCC(=O)N2CCSc3ncccc32)cc1 ZINC000020565012 FG Annotated Anodyne CC[C@@H](C)NS(=O)(=O)c1ccc(-c2cc(C(F)(F)F)no2)s1 ZINC000020580812 FG Annotated Anodyne CC[C@H](C)NS(=O)(=O)c1ccc(-c2cc(C(F)(F)F)no2)s1 ZINC000020580815 FG Annotated Anodyne COc1cc(-c2cccc(-c3ccn(CCn4ccnc4C)n3)c2)ncn1 ZINC000020586489 FG Annotated Anodyne O=C(Nc1cccc(-c2cscn2)c1)C1CCN(C[C@@H]2CCOC2)CC1 ZINC000020608519 FG Annotated Anodyne O=C(Nc1cccc(-c2cscn2)c1)C1CCN(C[C@H]2CCOC2)CC1 ZINC000020608520 FG Annotated Anodyne Cc1ccc(CS(=O)(=O)CCC(=O)N[C@@H]2CCC[C@@H](C)[C@H]2C)cc1 ZINC000020723623 FG Annotated Anodyne Cc1ccc(CS(=O)(=O)CCC(=O)N[C@@H]2CCC[C@H](C)[C@H]2C)cc1 ZINC000020723627 FG Annotated Anodyne Cc1cc(=O)[nH]c(-c2cccc(CN3CCN(C)C[C@@H]3c3ccccc3)c2)n1 ZINC000020726504 FG Annotated Anodyne COCc1cc(=O)[nH]c(-c2cccc(CN(C)[C@@H](C)c3ccccn3)c2)n1 ZINC000020727235 FG Annotated Anodyne COCc1cc(=O)[nH]c(-c2cccc(CN(C)[C@H](C)c3ccccn3)c2)n1 ZINC000020727240 FG Annotated Anodyne Cc1ncc2c(c1-c1noc(-c3ccccc3-c3nccn3C)n1)CCNC2 ZINC000020775232 FG Annotated Anodyne Cc1ccc(CN2CCC3(CC2)c2ccccc2[C@@H](n2ccnc2)[C@@H]3O)o1 ZINC000020857342 FG Annotated Anodyne COCc1cc(=O)[nH]c(-c2ccc(CN(C)Cc3ccc(C)o3)cc2)n1 ZINC000020869556 FG Annotated Anodyne CN(Cc1ccc2ncccc2c1)[C@@H]1c2ccccc2C2(CCNCC2)[C@H]1O ZINC000020906773 FG Annotated Anodyne Cc1cc(C)c(C(=O)N2CCC3(CC2)c2ccccc2[C@@H](N(C)C)[C@@H]3O)o1 ZINC000020911384 FG Annotated Anodyne Cc1c(CN2CCC(n3cc(CO)nn3)CC2)[nH]c2ccc(Cl)cc12 ZINC000020915800 FG Annotated Anodyne CCOc1ccccc1-c1[nH]nc2c1CN(Cc1nn(C)cc1Cl)CC2 ZINC000020917694 FG Annotated Anodyne CC(C)Cn1cc(NC(=O)NCCN2CCCCC2)c2ccccc2c1=O ZINC000020941517 FG Annotated Anodyne CCN(Cc1ccncc1)[C@@H]1CCCN(Cc2cccc3nonc23)C1 ZINC000020996501 FG Annotated Anodyne CCN(Cc1ccncc1)[C@H]1CCCN(Cc2cccc3nonc23)C1 ZINC000020996503 FG Annotated Anodyne Cc1nc(C(F)(F)F)ccc1-c1n[nH]c2c1CN(c1cnccn1)CC2 ZINC000020998297 FG Annotated Clean Fc1cccc(-c2[nH]ncc2-c2nc3c(cnn3Cc3ccncc3)[nH]2)c1 ZINC000020998959 FG Annotated Anodyne CC(=O)c1ccc(Nc2nn([C@H]3CCCC[C@@H]3C#N)cc2C(N)=O)cc1 ZINC000205072194 FG Annotated Mild COc1ccc(C(=O)N2C[C@H]3ON=C(c4c(F)cccc4Cl)[C@@H]3C2)cc1 ZINC000205216928 FG Annotated Anodyne COc1ccc(C(=O)N2C[C@H]3ON=C(c4c(F)cccc4Cl)[C@H]3C2)cc1 ZINC000205216945 FG Annotated Anodyne COc1ccc(C(=O)N2C[C@H]3C(c4c(F)cccc4Cl)=NO[C@H]3C2)cc1 ZINC000205216963 FG Annotated Anodyne COc1ccc(C(=O)N2C[C@@H]3ON=C(c4c(F)cccc4Cl)[C@H]3C2)cc1 ZINC000205216980 FG Annotated Anodyne CN1O[C@@](C)(CC(=O)NCc2cccc(O)c2)N=C1c1ccccc1Cl ZINC000205221674 FG Annotated Anodyne CN1O[C@](C)(CC(=O)NCc2cccc(O)c2)N=C1c1ccccc1Cl ZINC000205221690 FG Annotated Anodyne COc1ccc(NC(=O)C[C@@]2(C)N=C(c3cccc(Cl)c3)N(C)O2)cn1 ZINC000205221896 FG Annotated Anodyne COc1ccc(NC(=O)C[C@]2(C)N=C(c3cccc(Cl)c3)N(C)O2)cn1 ZINC000205221911 FG Annotated Anodyne COc1ccccc1C(=O)N1C[C@H]2ON=C(c3c(F)cccc3Cl)[C@@H]2C1 ZINC000205225323 FG Annotated Anodyne COc1ccccc1C(=O)N1C[C@H]2ON=C(c3c(F)cccc3Cl)[C@H]2C1 ZINC000205225341 FG Annotated Anodyne COc1ccccc1C(=O)N1C[C@H]2C(c3c(F)cccc3Cl)=NO[C@H]2C1 ZINC000205225358 FG Annotated Anodyne COc1ccccc1C(=O)N1C[C@@H]2ON=C(c3c(F)cccc3Cl)[C@H]2C1 ZINC000205225381 FG Annotated Anodyne O=C(NCc1ccccc1)N1C[C@H]2ON=C(c3c(F)cccc3Cl)[C@@H]2C1 ZINC000205227254 FG Annotated Anodyne O=C(NCc1ccccc1)N1C[C@H]2ON=C(c3c(F)cccc3Cl)[C@H]2C1 ZINC000205227268 FG Annotated Anodyne O=C(NCc1ccccc1)N1C[C@H]2C(c3c(F)cccc3Cl)=NO[C@H]2C1 ZINC000205227283 FG Annotated Anodyne O=C(NCc1ccccc1)N1C[C@@H]2ON=C(c3c(F)cccc3Cl)[C@H]2C1 ZINC000205227295 FG Annotated Anodyne Cn1nc2c3ccccc3n(Cc3ccc(-n4cccn4)cc3)cc-2c1=O ZINC000205424107 FG Annotated Anodyne COCCCc1[nH]nc2cc(NC(=O)N[C@H](C)c3ccccc3)ncc12 ZINC000205440350 FG Annotated Anodyne COc1cc2c(c(O)c1[C@H]1CCCCN1)C(=O)c1c(O)cc(C)cc1C2=O ZINC000205440795 FG Annotated Clean CC[C@H](C)NC(=O)C1=CNN2C1=N[C@@H](c1cccs1)C[C@H]2C(F)(F)F ZINC000205515152 FG Annotated Anodyne Cc1nn(Cc2c(Cl)cccc2Cl)c2nc(Cc3nn[nH]n3)ccc12 ZINC000205654293 FG Annotated Anodyne CC1(C)O[C@@H]2Oc3ccc4c(c3[C@@H]2[C@H]1O)O[C@H](c1ccccc1)CC4=O ZINC000205673032 FG Annotated Anodyne O=C1CCC[C@H]2Cc3nc4cc5c(cc4cc3C[C@]23CCCN13)OCO5 ZINC000205705536 FG Annotated Anodyne COc1ccc(C(=O)N[C@@H]2CC[C@@]34CCCN3C(=O)CCC[C@H]4[C@H]2C)cc1 ZINC000205709041 FG Annotated Anodyne COc1ccc(C(=O)N[C@H]2CC[C@@]34CCCN3C(=O)CCC[C@H]4[C@H]2C)cc1 ZINC000205709327 FG Annotated Anodyne O=C(NCc1cccnc1)O[C@H]1CC[C@@]23CCCN2C(=O)CCC[C@H]3C1 ZINC000205711092 FG Annotated Anodyne C[C@H]1[C@@H](NC(=O)C#Cc2ccccc2)CC[C@@]23CCCN2C(=O)CCC[C@@H]13 ZINC000205711437 FG Annotated Mild C[C@H]1[C@@H](NC(=O)Cc2ccsc2)CC[C@@]23CCCN2C(=O)CCC[C@@H]13 ZINC000205711460 FG Annotated Anodyne C[C@H]1[C@@H](OC(=O)NCc2ccco2)CC[C@@]23CCCN2C(=O)CCC[C@@H]13 ZINC000205711761 FG Annotated Anodyne CNc1ccc(C(=O)C[C@@]2(O)C(=O)Nc3c(Cl)ccc(Cl)c32)cc1 ZINC000205723039 FG Annotated Anodyne CNc1ccc(C(=O)C[C@]2(O)C(=O)Nc3c(Cl)ccc(Cl)c32)cc1 ZINC000205723058 FG Annotated Anodyne CC(C)n1nnnc1[C@@](C)(CCCCC(=O)O)NCc1cccc(F)c1 ZINC000205857473 FG Annotated Anodyne CC(C)n1nnnc1[C@](C)(CCCCC(=O)O)NCc1cccc(F)c1 ZINC000205857490 FG Annotated Anodyne CCCCCn1nnnc1[C@@](C)(CCCCC(=O)O)NCc1ccco1 ZINC000205857998 FG Annotated Anodyne CCCCCn1nnnc1[C@](C)(CCCCC(=O)O)NCc1ccco1 ZINC000205858022 FG Annotated Anodyne CCCCNC(=O)[C@@H](C(C)=O)N(Cc1c(Cl)cccc1Cl)C(C)=O ZINC000205862657 FG Annotated Anodyne CCCCNC(=O)[C@H](C(C)=O)N(Cc1c(Cl)cccc1Cl)C(C)=O ZINC000205862676 FG Annotated Anodyne C[C@H](C(=O)NCC(C)(C)C)N1Cc2ccc(-c3cccc(F)c3)nc2C1=O ZINC000206019061 FG Annotated Anodyne CCNC(=O)[C@]1(C)CCCN(C(=O)COc2ccc(Cl)cc2Cl)C1 ZINC000206020636 FG Annotated Anodyne CCNC(=O)[C@@]1(C)CCCN(C(=O)COc2ccc(Cl)cc2Cl)C1 ZINC000206020661 FG Annotated Anodyne C/C=C/[C@@H]1[C@@H](S(=O)(=O)c2ccccc2)CC(=O)N1Cc1ccccc1 ZINC000206020795 FG Annotated Anodyne CCCN1C(=O)C[C@H](S(=O)(=O)c2ccccc2)[C@H]1c1ccccc1OC ZINC000206020818 FG Annotated Anodyne CCCN1C(=O)C[C@H](S(=O)(=O)c2ccccc2)[C@H]1c1ccc(C#N)cc1 ZINC000206020923 FG Annotated Mild COC(=O)[C@]1(C#N)[C@H](C)C(=O)N(Cc2ccccc2)[C@@H]1/C=C/c1ccccc1 ZINC000206021168 FG Annotated Mild CCOC(=O)c1ccc(CN2C(=O)[C@@H](n3cccc3)c3ccccc32)o1 ZINC000206025431 FG Annotated Anodyne CCOC(=O)c1ccc(CN2C(=O)[C@H](n3cccc3)c3ccccc32)o1 ZINC000206025448 FG Annotated Anodyne COc1cc2onc([C@H]3CCCN3[S@](=O)C(C)(C)C)c2cc1OC ZINC000206030084 FG Annotated Anodyne COc1cc2onc([C@H]3CCCN3[S@@](=O)C(C)(C)C)c2cc1OC ZINC000206030109 FG Annotated Anodyne Cc1cc2onc([C@@H]3CCCN3S(=O)(=O)c3cnoc3C)c2cc1C ZINC000206032163 FG Annotated Anodyne Cc1cc2onc([C@H]3CCCN3S(=O)(=O)c3cnoc3C)c2cc1C ZINC000206032180 FG Annotated Anodyne CCOC(=O)c1cccn1[C@H]1C(=O)N(C)c2ccc(OC(F)(F)F)cc21 ZINC000206032673 FG Annotated Anodyne CCOC(=O)c1cccn1[C@@H]1C(=O)N(C)c2ccc(OC(F)(F)F)cc21 ZINC000206032693 FG Annotated Anodyne CC(C)=C1N(S(=O)(=O)C(F)(F)F)CC[C@@]12CN(C)c1ccccc12 ZINC000206037419 FG Annotated Anodyne CC(C)=C1N(S(=O)(=O)C(F)(F)F)CC[C@]12CN(C)c1ccccc12 ZINC000206037438 FG Annotated Anodyne C[C@H]1[C@@H](NC(=O)NCc2ccccc2)CC[C@@]23CCCN2C(=O)CCC[C@@H]13 ZINC000206044745 FG Annotated Anodyne CC(C)(C)CC(C)(C)NC(=O)[C@@H](C1CC1)N1C(=O)C(=O)c2ccccc21 ZINC000206050242 FG Annotated Anodyne CC(C)(C)CC(C)(C)NC(=O)[C@H](C1CC1)N1C(=O)C(=O)c2ccccc21 ZINC000206050264 FG Annotated Anodyne Cc1cccc(C)c1NC(=O)[C@@H](C(C)C)N1C(=O)C(=O)c2ccccc21 ZINC000206050357 FG Annotated Anodyne Cc1cccc(C)c1NC(=O)[C@H](C(C)C)N1C(=O)C(=O)c2ccccc21 ZINC000206050381 FG Annotated Anodyne CCC(CC)[C@@H](C(=O)NC1CCCCC1)N1C(=O)C(=O)c2ccccc21 ZINC000206050416 FG Annotated Anodyne CCC(CC)[C@H](C(=O)NC1CCCCC1)N1C(=O)C(=O)c2ccccc21 ZINC000206050443 FG Annotated Anodyne CCC[C@@H](c1nnnn1C1CCCCC1)N1C(=O)C(=O)c2ccccc21 ZINC000206050784 FG Annotated Anodyne CCC[C@H](c1nnnn1C1CCCCC1)N1C(=O)C(=O)c2ccccc21 ZINC000206050810 FG Annotated Anodyne CCCNC(=O)c1ccc(Cn2cc(-c3ccc(C)cc3)ncc2=O)cc1 ZINC000206061746 FG Annotated Anodyne O=C(c1ccccn1)N(CCO)[C@@H](c1ccccc1)c1nc2ccccc2[nH]1 ZINC000206062916 FG Annotated Anodyne O=C(c1ccccn1)N(CCO)[C@H](c1ccccc1)c1nc2ccccc2[nH]1 ZINC000206062941 FG Annotated Anodyne C[C@@H]1CCCN1c1cccc2cc(S(=O)(=O)Nc3ncns3)ccc12 ZINC000206154353 FG Annotated Anodyne C[C@H]1CCCN1c1cccc2cc(S(=O)(=O)Nc3ncns3)ccc12 ZINC000206154377 FG Annotated Anodyne CC(=O)n1nc(B2OC(C)(C)C(C)(C)O2)c2cc(C(F)(F)F)ccc21 ZINC000206178057 FG Annotated Mild CC1(C)OB(c2cc(Br)c(N)c(C(F)(F)F)c2)OC1(C)C ZINC000206188254 FG Annotated Mild CC1(C)OB(c2cc(C(F)(F)F)cc(Br)c2N)OC1(C)C ZINC000206188326 FG Annotated Mild CC(C)(C)Oc1ncc(B2OC(C)(C)C(C)(C)O2)cc1Br ZINC000206188633 FG Annotated Mild CC1(C)OB(c2cnc(N3CCCCC3)c(Br)c2)OC1(C)C ZINC000206188945 FG Annotated Mild CC1(C)OB(c2cc(C(F)(F)F)cnc2N2CCCCC2)OC1(C)C ZINC000206190080 FG Annotated Mild COc1ncc(N(C)Cc2ccccc2)cc1B1OC(C)(C)C(C)(C)O1 ZINC000206192305 FG Annotated Mild CNc1ncc(N(C)Cc2ccccc2)cc1B1OC(C)(C)C(C)(C)O1 ZINC000206192722 FG Annotated Mild COc1nc(N(C)Cc2ccccc2)ccc1B1OC(C)(C)C(C)(C)O1 ZINC000206193679 FG Annotated Mild CNc1nc(N(C)Cc2ccccc2)ccc1B1OC(C)(C)C(C)(C)O1 ZINC000206194155 FG Annotated Mild Cc1nc(OC(C)C)c(Br)cc1B1OC(C)(C)C(C)(C)O1 ZINC000206197492 FG Annotated Mild Cc1nc(NC2CC2)c(Br)cc1B1OC(C)(C)C(C)(C)O1 ZINC000206197701 FG Annotated Mild Cc1nc(N2CCCC2)c(Br)cc1B1OC(C)(C)C(C)(C)O1 ZINC000206197833 FG Annotated Mild COc1ncc(B2OC(C)(C)C(C)(C)O2)cc1N(C)Cc1ccccc1 ZINC000206200797 FG Annotated Mild CCOc1ncc(B2OC(C)(C)C(C)(C)O2)cc1N(C)Cc1ccccc1 ZINC000206200980 FG Annotated Mild CCOc1ncc(B2OC(C)(C)C(C)(C)O2)cc1NCc1ccccc1 ZINC000206201160 FG Annotated Mild CN(Cc1ccccc1)c1ncnc(Cl)c1B1OC(C)(C)C(C)(C)O1 ZINC000206203201 FG Annotated Mild CC[C@]12C=CCN3CCc4c([nH]c5ccccc45)[C@](C(=O)OC)(C1)O[C@@H]32 ZINC000206230387 FG Annotated Anodyne Cc1ccc2c(c1)OC(N)=C1C(=O)N(Cc3ccc(Cl)cc3)C(=O)C[C@@H]12 ZINC000206390192 FG Annotated Anodyne Cc1ccc2c(c1)OC(N)=C1C(=O)N(Cc3ccc(Cl)cc3)C(=O)C[C@H]12 ZINC000206390217 FG Annotated Anodyne CC(=O)C[C@@H]1CN(Cc2ccccc2Br)C(=O)c2cccn21 ZINC000206394014 FG Annotated Anodyne Cc1nc(-c2cc(-c3cc(F)c(CO)c(F)c3)c3c(N)ncnn23)cs1 ZINC000206408822 FG Annotated Anodyne Cc1ccc2c(c1)-c1c(cnn1CC(=O)N(C)CCc1ccccc1)CO2 ZINC000206491506 FG Annotated Anodyne CCCCOc1cc(F)c(C(=O)NS(=O)(=O)C2CC2)cc1C1CC1 ZINC000207165635 FG Annotated Anodyne C/C=C/C1=CC2=C(CO1)C(=O)[C@]1(C)OC(=O)[C@H]([C@@H](O)CCCCC)[C@@H]1C2 ZINC000207675489 FG Annotated Mild C/C=C/C1=CC2=C(CO1)C(=O)[C@]1(C)OC(=O)[C@H]([C@H](O)CCCCC)[C@@H]1C2 ZINC000207675579 FG Annotated Mild Cc1ccc(Cl)cc1-n1cc(-c2ncnc3[nH]ccc23)cc1C(N)=O ZINC000208314528 FG Annotated Anodyne CN(C)CCNC(=O)c1cc(-c2cccs2)nn1Cc1ccc(F)cc1 ZINC000021161874 FG Annotated Anodyne C=C[C@@](C)(O)Cc1cc2cc(-c3ccc(O)cc3O)c(=O)oc2cc1O ZINC000210530953 FG Annotated Mild CC1=N[C@@]2(N=C1N)c1cc(OCC(C)C)ccc1CC21CCC(O)CC1 ZINC000210585562 FG Annotated Anodyne CC(C)(C)[Si](F)(CCCn1cc(C[C@H](N)C(=O)O)nn1)C(C)(C)C ZINC000210632948 FG Annotated Unstable CC(C)(C)[Si](F)(CCCn1cc(C[C@@H](N)C(=O)O)nn1)C(C)(C)C ZINC000210632980 FG Annotated Unstable CCOC(=O)/C(O)=C/C(=O)/C=C/c1cccn1Cc1ccc(F)c(F)c1 ZINC000210912861 FG Annotated Mild CC[C@@H]1C(=O)C[C@H]2CCN(S(=O)(=O)c3ccccc3)[C@H]3CCC[C@@H]1[C@@H]32 ZINC000211060259 FG Annotated Anodyne CNC(=O)/C(=N/OC)c1cc([Si](C)(C)C)ccc1Oc1ccccc1 ZINC000211483039 FG Annotated Mild C[C@@H](Cc1cc2c(cc1O)OCO2)[C@H](C)[C@H](O)c1ccc2c(c1)OCO2 ZINC000211992048 FG Annotated Anodyne C=CC[C@@]1([C@@H](C)[C@H](O)c2ccc(OC)c(OC)c2)C[C@H](OC)C=CC1=O ZINC000214187707 FG Annotated Mild CN(CCNC(=O)c1noc2c1CCc1sccc1-2)Cc1ccccc1 ZINC000021538010 FG Annotated Anodyne CN(C)C(=O)c1cc(-c2ccccc2)nc2c1cnn2Cc1ccncc1 ZINC000021768748 FG Annotated Anodyne CS(=O)(=O)NC(=O)c1cc(C2CC2)c(OCC2CCCCC2)cc1F ZINC000216241513 FG Annotated Anodyne CS(=O)(=O)NC(=O)c1cc(Cl)c(OCC2CCCCC2)cc1F ZINC000216241586 FG Annotated Anodyne COc1ccc2c(c1OC)C=[N+](C)[C@H]1c3cc4c(cc3C=C[C@@H]21)OCO4 ZINC000217111043 FG Annotated Anodyne Cc1cc(Nc2ccc(C(=O)NCCF)c(F)c2)nc(-c2cccnc2)n1 ZINC000217362278 FG Annotated Anodyne N[C@@H](CC(=O)N1CCNc2ccccc2C1)[C@H]1CCc2cc(F)c(F)cc21 ZINC000218112625 FG Annotated Anodyne Cc1nc(NCc2cccc(CN3CCCC3)c2)cc(C2CC(O)C2)n1 ZINC000218420693 FG Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](C)c2ccc(CO)cc2)n1 ZINC000218473150 FG Annotated Anodyne COc1cccc(-c2nc(Cc3ccccc3)no2)c1OC1CCNCC1 ZINC000218582929 FG Annotated Anodyne O=C(N[C@H]1CN2CCC1CC2)c1cc2cccc(-c3ccsc3)n2c1 ZINC000218607857 FG Annotated Anodyne O=C(N[C@H]1CN2CCC1CC2)c1cc2ccc(-c3cccs3)cn2c1 ZINC000218608505 FG Annotated Anodyne O=C(N[C@H]1CN2CCC1CC2)c1cc2ccc(-c3ccsc3)cn2c1 ZINC000218633260 FG Annotated Anodyne O[C@@H](CNCc1ccnc(-c2ccc(C(F)(F)F)cc2)n1)C(F)(F)F ZINC000218700611 FG Annotated Anodyne O[C@H](CNCc1ccnc(-c2ccc(C(F)(F)F)cc2)n1)C(F)(F)F ZINC000218700687 FG Annotated Anodyne Cc1nc(-c2nnc3n2CCN(C(=O)c2ccc(F)cc2)[C@@H]3C)cs1 ZINC000218795352 FG Annotated Anodyne O=C(Cn1ncc2c(=O)oc3ccccc3c21)Nc1ccc2ncccc2c1 ZINC000218929922 FG Annotated Anodyne COCc1nc(-n2c(N)nc3ccccc32)nc(NCc2ccccc2)c1C ZINC000218990273 FG Annotated Anodyne Nc1nc2ccccc2n1-c1nc2c(c(NCc3ccccc3)n1)CCC2 ZINC000219003839 FG Annotated Anodyne Cc1ccc(-c2ccc(C[C@@H](C#N)NC(=O)[C@H]3N[C@@H]4CC[C@H]3C4)c(F)c2)o1 ZINC000219309074 FG Annotated Mild N#C[C@H](Cc1ccc(-c2ccsc2)cc1F)NC(=O)[C@H]1N[C@@H]2CC[C@H]1C2 ZINC000219319081 FG Annotated Mild Cc1occc1-c1ccc(C[C@@H](C#N)NC(=O)[C@H]2N[C@@H]3CC[C@H]2C3)c(F)c1 ZINC000219320959 FG Annotated Mild Cc1occc1-c1ccc(C[C@H](C#N)NC(=O)[C@H]2N[C@@H]3CC[C@H]2C3)c(F)c1 ZINC000219320984 FG Annotated Mild Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@H](C)N(C(=O)c1ccc(F)cc1F)C2 ZINC000219337061 FG Annotated Anodyne Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@@H](C)N(C(=O)c1ccc(F)cc1F)C2 ZINC000219337133 FG Annotated Anodyne Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@H](C)N(C(=O)c1ccc(Cl)cc1)C2 ZINC000219337236 FG Annotated Anodyne Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@@H](C)N(C(=O)c1ccc(Cl)cc1)C2 ZINC000219337333 FG Annotated Anodyne Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@H](C)N(C(=O)c1ccccc1Cl)C2 ZINC000219337431 FG Annotated Anodyne Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@@H](C)N(C(=O)c1ccccc1Cl)C2 ZINC000219337510 FG Annotated Anodyne O=c1cc(-c2ccc3[nH]ncc3c2)nc2nc(-c3cccc(Cl)c3)[nH]n12 ZINC000219605563 FG Annotated Anodyne O=c1cc(-c2ccc3c(c2)OCO3)nc2nc(-c3ccc(Cl)cc3)[nH]n12 ZINC000219613261 FG Annotated Anodyne COC(=O)c1ccc(OC[C@H]2COC(C)(C)N2C(=O)OC(C)(C)C)cc1 ZINC000219707286 FG Annotated Anodyne COC[C@@H](NC(=O)Nc1cc2n[nH]c(C3CC3)c2cn1)c1ccc(F)cc1 ZINC000219746909 FG Annotated Anodyne O=C(NCc1ncco1)Nc1cc2[nH]nc(-c3ccc(F)cc3)c2cn1 ZINC000219747707 FG Annotated Anodyne C[C@@H](NC(=O)Nc1cc2n[nH]c([C@@H]3C[C@@H]3C(=O)O)c2cn1)c1ccccc1 ZINC000219767050 FG Annotated Anodyne C[C@@H](NC(=O)Nc1cc2n[nH]c([C@H]3C[C@@H]3C(=O)O)c2cn1)c1ccccc1 ZINC000219767125 FG Annotated Anodyne C[C@@H](NC(=O)Nc1cc2n[nH]c([C@@H]3C[C@H]3C(=O)O)c2cn1)c1ccccc1 ZINC000219767191 FG Annotated Anodyne C[C@@H](NC(=O)Nc1cc2n[nH]c([C@H]3C[C@H]3C(=O)O)c2cn1)c1ccccc1 ZINC000219767259 FG Annotated Anodyne C[C@@H](NC(=O)Nc1cc2n[nH]c(CNCC(F)F)c2cn1)c1ccccc1 ZINC000219772790 FG Annotated Anodyne C[C@@H]1O[C@@H](O[C@H](C)CCCCCCCC/C=C/C(=O)O)[C@H](O)C[C@H]1O ZINC000219950501 FG Annotated Anodyne in-vitro C[C@@H]1O[C@@H](O[C@H](C)CCCCCCCCC/C=C/C(=O)O)[C@H](O)C[C@H]1O ZINC000219950578 FG Annotated Anodyne in-vitro C[C@@H]1O[C@@H](OCCCCCCCCCC/C=C/C(=O)O)[C@H](O)C[C@H]1O ZINC000219955713 FG Annotated Anodyne in-vitro C[C@@H]1O[C@@H](OCCCCCCCCCCCCC(=O)O)[C@H](O)C[C@H]1O ZINC000219955799 FG Annotated Anodyne in-vitro C[C@@H]1O[C@@H](OCCCCCCCCCCC/C=C/C(=O)O)[C@H](O)C[C@H]1O ZINC000219955868 FG Annotated Anodyne in-vitro CN1CCN(C[C@H]2C(=O)Nc3ccccc3S[C@H]2c2ccccc2)CC1 ZINC000022036055 FG Annotated Anodyne CCN1CCC[C@H]1CN[C@H]1c2cc(OC)ccc2OCc2ncccc21 ZINC000022441276 FG Annotated Anodyne CC(=O)Oc1c(C)c(C)c2c(c1C)[C@H](CN1CCN(C)CC1)C(C)(C)O2 ZINC000022443088 FG Annotated Anodyne CC(=O)Nc1cc2nc(-c3ccccc3)nn(-c3ccccc3)c-2cc1=O ZINC000220115154 FG Annotated Anodyne Cc1[nH]nc2c1[C@@H](c1ccc(Cl)cc1)N(c1cc(C)c(=O)n(C)c1)C2=O ZINC000220201269 FG Annotated Anodyne Cc1[nH]nc2c1[C@H](c1ccc(Cl)cc1)N(c1cc(C)c(=O)n(C)c1)C2=O ZINC000220201340 FG Annotated Anodyne CC(C)(C)[Si](C)(C)O[C@@H]1CC(=O)O[C@@H]1CI ZINC000220424340 FG Annotated Reactive CC(C)(C)[Si](C)(C)O[C@H]1CC(=O)O[C@H]1CI ZINC000220424404 FG Annotated Reactive C=C1CC(CNc2ccc(F)c([C@@]3(C(F)F)N=C(N)O[C@@H]4C[C@@H]43)c2)C1 ZINC000220654625 FG Annotated Mild CC#Cc1cncc(-c2ccc(F)c([C@]3(C(F)F)N=C(N)O[C@H]4C[C@H]43)c2)c1 ZINC000220656219 FG Annotated Mild CCC[C@H]1Oc2ccc(Br)cc2[C@@]2(C=C(N)OC2)C12COC2 ZINC000220712799 FG Annotated Anodyne CCC[C@@H]1Oc2ccc(Br)cc2[C@@]2(C=C(N)OC2)C12COC2 ZINC000220712854 FG Annotated Anodyne CCC[C@H]1Oc2ccc(Br)cc2[C@]2(C=C(N)OC2)C12COC2 ZINC000220712925 FG Annotated Anodyne CCC[C@@H]1Oc2ccc(Br)cc2[C@]2(C=C(N)OC2)C12COC2 ZINC000220713001 FG Annotated Anodyne Cc1cc(Nc2cc(C(=O)NCCF)ccc2F)nc(-c2cccnc2)n1 ZINC000220938095 FG Annotated Anodyne CCc1c(-c2ccc(Oc3ncccc3Cl)cc2C)n(C)c(=O)[nH]c1=O ZINC000220966006 FG Annotated Anodyne Cc1ccnc(Oc2ccc(-c3c(C)c(=O)[nH]c(=O)n3C)cc2)c1Cl ZINC000220976163 FG Annotated Anodyne Cc1cc(Oc2ncccc2Cl)ccc1-c1c(C)c(=O)[nH]c(=O)n1C ZINC000220989181 FG Annotated Anodyne O=[N+]([O-])c1ccc(CSc2nnc(-c3ccncc3)o2)c([N+](=O)[O-])c1 ZINC000221035904 FG Annotated Anodyne O=[N+]([O-])c1cc(CSc2nnc(-c3ccncc3)o2)cc([N+](=O)[O-])c1 ZINC000221051129 FG Annotated Anodyne COc1c(O)ccc2c1C[C@@H](C(C)(C)O)[C@@H]2CC(=O)c1ccc(O)cc1O ZINC000221079478 FG Annotated Anodyne N#C[C@H]1CCCC[C@@H]1n1cc(C(N)=O)c(Nc2ccc(C3CC3)nc2)n1 ZINC000221087548 FG Annotated Mild CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](C)c2nc(C(C)(C)C)no2)n1 ZINC000221131364 FG Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@H](C)c2nc(C(C)(C)C)no2)n1 ZINC000221131417 FG Annotated Anodyne O=C(N/N=C/c1ccncc1)c1cc(-c2ccc(F)cc2F)ccc1O ZINC000221353352 FG Annotated Reactive O=C(N/N=C/c1cccnc1)c1cc(-c2ccc(F)cc2F)ccc1O ZINC000221353496 FG Annotated Reactive O=C(N/N=C/c1ccccn1)c1cc(-c2ccc(F)cc2F)ccc1O ZINC000221353659 FG Annotated Reactive Cc1cc(Nc2ccc(C(=O)NCCF)cc2F)nc(-c2cccnc2)n1 ZINC000221578889 FG Annotated Anodyne O=C(NCCF)c1ccc(Nc2ccnc(-c3cccnc3)n2)cc1F ZINC000221581139 FG Annotated Anodyne O=C(NCCF)c1ccc(Nc2ccnc(-c3cccnc3)n2)c(F)c1 ZINC000221582857 FG Annotated Anodyne Cc1cc(Nc2ccc(C(=O)NCCF)cc2)nc(-c2cccnc2)n1 ZINC000221583846 FG Annotated Anodyne O=C(NCCF)c1cc(Nc2ccnc(-c3cccnc3)n2)ccc1F ZINC000221586415 FG Annotated Anodyne CCc1ccc(B(OC(C)(C)C(C)(C)O)OC(C)(C)C(C)(C)O)cc1 ZINC000221637809 FG Annotated Mild O=C(c1ccc(Cl)cc1Cl)c1cccn1-c1ccc2c(c1)B(O)OC2 ZINC000221693231 FG Annotated Anodyne CC(C)(C)n1nc(-c2cnc3cc(OC4CC4)ccc3c2)c(C(N)=O)c1N ZINC000221703456 FG Annotated Anodyne CCCOc1ccc2cc(-c3nn(C(C)(C)C)c(N)c3C(N)=O)cnc2c1 ZINC000221703607 FG Annotated Anodyne CC(C)(C)n1nc(-c2ccc3nc(OC4CC4)ccc3c2)c(C(N)=O)c1N ZINC000221703686 FG Annotated Anodyne CC(C)Oc1ccc2cc(-c3nn(C(C)(C)C)c(N)c3C(N)=O)cnc2c1 ZINC000221717317 FG Annotated Anodyne CCOc1ccc2cc(-c3nn(CC(C)(C)C)c(N)c3C(N)=O)cnc2c1 ZINC000221719529 FG Annotated Anodyne CCOc1ccc2cc(-c3nn(C4CCCC4)c(N)c3C(N)=O)cnc2c1 ZINC000221719764 FG Annotated Anodyne COCCOc1ccc2nc(-c3cn(-c4ccc(O)cc4)nn3)ccc2c1 ZINC000221805387 FG Annotated Anodyne in-vitro COc1ccc(-c2cc(=O)[nH]c(=S)n2CCOC(C)C)c(OC)c1 ZINC000221861721 FG Annotated Anodyne COc1ccc(C(=O)C[C@@]2(O)C(=O)Nc3cc(Cl)c(Cl)cc32)cc1 ZINC000221943527 FG Annotated Anodyne COc1ccc(C(=O)C[C@]2(O)C(=O)Nc3cc(Cl)c(Cl)cc32)cc1 ZINC000221943590 FG Annotated Anodyne N#Cc1ccc(C(=O)C[C@@]2(O)C(=O)Nc3c(Cl)ccc(Cl)c32)cc1 ZINC000221946035 FG Annotated Mild N#Cc1ccc(C(=O)C[C@]2(O)C(=O)Nc3c(Cl)ccc(Cl)c32)cc1 ZINC000221946087 FG Annotated Mild NC(N)=Nc1ccc(-c2cc(C(=O)Nc3cccc4ccccc34)[nH]n2)cc1 ZINC000222131716 FG Annotated Mild Cc1cc(C(=O)NCCO)ccc1-c1cc(C(F)(F)F)cc2[nH]ncc12 ZINC000222321549 FG Annotated Anodyne O=C(NCCO)c1ccc(-c2cc(C(F)(F)F)cc3[nH]ncc23)c(F)c1 ZINC000222362725 FG Annotated Anodyne COC1CCN(c2nccc(Nc3cc4c(cn3)ncn4C(C)C)n2)CC1 ZINC000222717402 FG Annotated Anodyne Cc1cc([C@H]2C[C@H]3CSC(N)=N[C@]3(c3cc(C#N)ccc3F)CO2)on1 ZINC000223175838 FG Annotated Mild Cc1coc([C@H]2C[C@H]3CSC(N)=N[C@]3(c3cc(C#N)ccc3F)CO2)n1 ZINC000223177535 FG Annotated Mild COc1ccccc1NC(=O)c1c(NO)cc(-c2ccccc2)oc1=O ZINC000223245003 FG Annotated Anodyne Cc1c(C2CC2)nc2ccc(-n3ccc(OCc4cncnc4)cc3=O)cn12 ZINC000223395720 FG Annotated Anodyne c1cc(-c2nc(N3C[C@@H]4C[C@H]3CN4)c3c4c(sc3n2)CCCC4)ccn1 ZINC000223659128 FG Annotated Anodyne c1cc(-c2nc(N[C@H]3CCNC3)c3c4c(sc3n2)CCCC4)ccn1 ZINC000223659177 FG Annotated Anodyne c1cc(-c2nc(N3CCNCC3)c3c4c(sc3n2)CCCCC4)ccn1 ZINC000223659699 FG Annotated Anodyne c1cc(-c2nc(O[C@H]3CCNC3)c3c4c(sc3n2)CCCC4)ccn1 ZINC000223660081 FG Annotated Anodyne CC(C)Nc1cc(-c2nc(N[C@@H]3CCNC3)c3sccc3n2)ccn1 ZINC000223663950 FG Annotated Anodyne Cc1[nH]ncc1-c1nc(NC[C@@H](N)Cc2ccccc2)c2sccc2n1 ZINC000223665632 FG Annotated Anodyne c1cc(-c2nc(O[C@@H]3CCNC3)c3c4c(sc3n2)CCCC4)ccn1 ZINC000223667372 FG Annotated Anodyne c1cnc2sc3c(N4CCCNCC4)nc(-c4ccncc4)nc3c2c1 ZINC000223668816 FG Annotated Anodyne c1cc(-c2nc(N[C@@H]3CCNC3)c3sccc3n2)cc(NC2CC2)n1 ZINC000223671827 FG Annotated Anodyne c1cc(-c2nc(N[C@@H]3CCNC3)c3sccc3n2)cc(NCC2CC2)n1 ZINC000223672405 FG Annotated Anodyne CNCCNc1nc(-c2ccncc2)nc2c(Br)csc12 ZINC000223675619 FG Annotated Anodyne C[C@H](N)CNc1nc(-c2ccncc2)nc2c(Br)csc12 ZINC000223680046 FG Annotated Anodyne C[C@H]1CN(c2nc(-c3ccncc3)nc3sc4c(c23)CCCC4)CCN1 ZINC000223685360 FG Annotated Anodyne Cc1n[nH]c(C)c1-c1nc(N[C@@H]2CCNC2)c2c3c(sc2n1)CCCC3 ZINC000223687035 FG Annotated Anodyne Cc1n[nH]c(C)c1-c1nc(NC[C@@H](C)N)c2c3c(sc2n1)CCCC3 ZINC000223691422 FG Annotated Anodyne Cc1n[nH]c(C)c1-c1nc(NC[C@H](C)N)c2c3c(sc2n1)CCCC3 ZINC000223691716 FG Annotated Anodyne Cc1c(C#N)nc2ccc(-n3ccc(OCc4ccc(F)cc4)cc3=O)cn12 ZINC000224384047 FG Annotated Anodyne Nc1ccc(-c2ccc(C3CCC3)c(Oc3cc(=O)[nH]cn3)c2F)nn1 ZINC000224547400 FG Annotated Anodyne Nc1cnc(-c2ccc(C3CCC3)c(Oc3nccnc3N)c2F)cn1 ZINC000224549499 FG Annotated Anodyne Nc1ncc(-c2ccc(C3CCC3)c(Oc3cc(=O)[nH]cn3)c2F)cn1 ZINC000224555107 FG Annotated Anodyne CC(C)(C)c1ccc(-c2cnc(N)nc2)c(F)c1Oc1nccc(N)n1 ZINC000224555466 FG Annotated Anodyne Cc1noc(COc2c(C3CCC3)ccc(-c3cnc(N)cn3)c2F)n1 ZINC000224558037 FG Annotated Anodyne CC(C)(C)c1ccc(-c2cnc(N)cn2)c(F)c1Oc1cc(N)ncn1 ZINC000224558799 FG Annotated Anodyne Cn1cnc(COc2c(C3CCC3)ccc(-c3cnc(N)cn3)c2F)c1 ZINC000224559209 FG Annotated Anodyne Nc1cnc(-c2ccc(C3CCC3)c(Oc3nccc(N)n3)c2F)cn1 ZINC000224559284 FG Annotated Anodyne Cn1ccnc1COc1c(C2CCC2)ccc(-c2cnc(N)cn2)c1F ZINC000224560776 FG Annotated Anodyne Nc1cnc(-c2ccc(C3CCC3)c(Oc3cc(=O)[nH]cn3)c2F)cn1 ZINC000224562965 FG Annotated Anodyne Cn1cncc1COc1c(C2CCC2)ccc(-c2cnc(N)cn2)c1F ZINC000224569659 FG Annotated Anodyne CC(C)(C)c1ccc(-c2cnc(N)cn2)c(F)c1Oc1nccc(N)n1 ZINC000224572053 FG Annotated Anodyne Nc1cnc(-c2ccc(C3CCC3)c(Oc3cc(N)ncn3)c2F)cn1 ZINC000224573228 FG Annotated Anodyne CC(C)(C)c1ccc(-c2cnc(N)nc2)c(F)c1Oc1cc(N)ncn1 ZINC000224574161 FG Annotated Anodyne CC(C)Cc1ccc(-c2cnc(N)cn2)c(F)c1Oc1nccc(N)n1 ZINC000224582300 FG Annotated Anodyne CC(C)S(=O)(=O)c1ncccc1-c1ccc(-c2cnc(N)nc2)c(F)c1 ZINC000224686487 FG Annotated Anodyne Nc1cnc(-c2ccc(-c3ccccc3S(=O)(=O)C3CC3)cc2F)cn1 ZINC000224698114 FG Annotated Anodyne Cc1c(-c2ccccc2NS(C)(=O)=O)ccc(-c2cnc(N)cn2)c1F ZINC000224701923 FG Annotated Anodyne CC(C)S(=O)(=O)c1ncccc1-c1ccc(-c2cnc(N)cn2)c(F)c1 ZINC000224716672 FG Annotated Anodyne Nc1cnc(-c2ccc(-c3cccnc3OC3CCOCC3)cc2F)cn1 ZINC000224739485 FG Annotated Anodyne CCS(=O)(=O)Cc1ccccc1-c1ccc(-c2cnc(N)cn2)c(F)c1 ZINC000224742837 FG Annotated Anodyne Nc1ncc(-c2ccc(-c3ccccc3S(=O)(=O)C3CC3)cc2F)cn1 ZINC000224748714 FG Annotated Anodyne CS(=O)(=O)Cc1ccccc1-c1ccc(-c2cnc(N)cn2)c(F)c1 ZINC000224790816 FG Annotated Anodyne Nc1ncc(-c2ccc(-c3cccnc3OC3CCOCC3)cc2F)cn1 ZINC000224791271 FG Annotated Anodyne CS(=O)(=O)c1ccccc1-c1ccc(-c2cnc(N)cn2)c(F)c1F ZINC000224808422 FG Annotated Anodyne CCS(=O)(=O)c1ccccc1-c1ccc(-c2cnc(N)cn2)c(F)c1 ZINC000224819733 FG Annotated Anodyne NCCOCCN1CCN([C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000224920931 FG Annotated Anodyne CCc1nc(-c2cc(-c3ccc(CO)cc3)c3c(N)ncnn23)cs1 ZINC000224965739 FG Annotated Anodyne CN1CCc2sc3nc(C(=O)Nc4ccc(F)cc4)c(N)cc3c2C1 ZINC000022708802 FG Annotated Anodyne CCCCc1nc(CN2CCN(Cc3ccc(C)cc3)[C@H](CCO)C2)c[nH]1 ZINC000022851549 FG Annotated Anodyne CCN(CCN(C)C)C[C@@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000022871053 FG Annotated Anodyne CCN(CCN(C)C)C[C@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000022871056 FG Annotated Anodyne CC(C)=CCN1CCN(Cc2c[nH]nc2C2CCCCC2)C[C@@H]1CCO ZINC000022914240 FG Annotated Anodyne OCC[C@@H]1CN(Cc2c[nH]nc2C2CCCCC2)CCN1C1CCCC1 ZINC000022926533 FG Annotated Anodyne OCC[C@H]1CN(Cc2c[nH]nc2C2CCCCC2)CCN1C1CCCC1 ZINC000022926537 FG Annotated Anodyne CC(=O)c1cc(CN2CCN(C3CCCCC3)[C@@H](CCO)C2)cs1 ZINC000022932795 FG Annotated Anodyne OCC[C@@H]1CN(Cc2nc3c(s2)CCCC3)CCN1Cc1ccccc1 ZINC000022933551 FG Annotated Anodyne OCC[C@H]1CN(Cc2nc3c(s2)CCCC3)CCN1Cc1ccccc1 ZINC000022933553 FG Annotated Anodyne CC(=O)Oc1c(C)c(C)c2c(c1C)[C@@H](CN1CCN(C)CC1)C(C)(C)O2 ZINC000022934278 FG Annotated Anodyne CCCCN(Cc1ccccc1)C(=O)[C@@H](NC[C@@H](N)CS)[C@@H](C)CC ZINC000022937676 FG Annotated Mild CNC[C@H](CC1CCCCC1)NC[C@H](NCCC1CCCC1)[C@H](C)O ZINC000022938867 FG Annotated Anodyne CCCCc1ncc(CN2CCN(Cc3ccc(C)cc3)[C@@H](CCO)C2)[nH]1 ZINC000022939381 FG Annotated Anodyne CCN1CCC[C@@H]1CN[C@H]1c2cc(OC)ccc2OCc2ncccc21 ZINC000022942254 FG Annotated Anodyne Cn1cccc1-c1nccc2cc(S(=O)(=O)Nc3nccs3)ccc12 ZINC000225055213 FG Annotated Anodyne COc1ccc(OC2CCNCC2)c(-c2nc(Cc3ccccc3)no2)c1 ZINC000225206518 FG Annotated Anodyne COc1cc2c(cc3c4c(cc5c(c42)OCO5)C(=O)N3)c(OC)c1OC ZINC000225288328 FG Annotated Bother CC(=O)OC[C@]1(O)C[C@]23CC[C@H]4[C@@](C)(O)CCC[C@]4(C)[C@H]2CC[C@H]1C3 ZINC000225400006 FG Annotated Anodyne Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@H](C)N(C(=O)c1ccc(F)cc1C)C2 ZINC000225938250 FG Annotated Anodyne Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@@H](C)N(C(=O)c1ccc(F)cc1C)C2 ZINC000225938261 FG Annotated Anodyne Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@H](C)N(C(=O)c1cccc(C)c1F)C2 ZINC000225939987 FG Annotated Anodyne Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@@H](C)N(C(=O)c1cccc(C)c1F)C2 ZINC000225939998 FG Annotated Anodyne Cc1ccc(C(=O)N2Cc3nc(C)nc(-c4ccn[nH]4)c3C[C@@H]2C)c(C)c1 ZINC000225942370 FG Annotated Anodyne Cc1ccc(C(=O)N2Cc3nc(C)nc(-c4ccn[nH]4)c3C[C@H]2C)c(C)c1 ZINC000225942386 FG Annotated Anodyne Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@H](C)N(C(=O)c1cccc(C)c1C)C2 ZINC000225945492 FG Annotated Anodyne Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@@H](C)N(C(=O)c1cccc(C)c1C)C2 ZINC000225945504 FG Annotated Anodyne Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@H](C)N(C(=O)c1cccc(F)c1C)C2 ZINC000225958529 FG Annotated Anodyne Cc1nc2c(c(-c3ccn[nH]3)n1)C[C@@H](C)N(C(=O)c1cccc(F)c1C)C2 ZINC000225958545 FG Annotated Anodyne COc1c(F)cccc1C(=O)N1[C@H]2CC[C@H]1[C@H](Nc1nc(C)cc(C)n1)C2 ZINC000226037786 FG Annotated Anodyne COc1c(F)cccc1C(=O)N1[C@H]2CC[C@H]1[C@@H](Nc1nc(C)cc(C)n1)C2 ZINC000226037791 FG Annotated Anodyne COc1c(F)cccc1C(=O)N1[C@H]2CC[C@H]1[C@H](COc1ccc(F)cn1)C2 ZINC000226037960 FG Annotated Anodyne Cc1ccn2ccnc2c1C(=O)N1[C@H]2CC[C@H]1[C@H](COc1ccccn1)C2 ZINC000226042751 FG Annotated Anodyne Cc1ccc2nccn2c1C(=O)N1[C@H]2CC[C@H]1[C@H](COc1ccccn1)C2 ZINC000226050368 FG Annotated Anodyne CCOc1nccc(C)c1C(=O)N1[C@H]2CC[C@H]1[C@H](COc1ccccn1)C2 ZINC000226050997 FG Annotated Anodyne COc1c(F)cccc1C(=O)N1[C@H]2CC[C@H]1[C@H](Nc1ccc(F)cn1)C2 ZINC000226053718 FG Annotated Anodyne Cc1nc2sccn2c1C(=O)N1[C@H]2CC[C@H]1[C@H](COc1ccccn1)C2 ZINC000226054124 FG Annotated Anodyne CCOc1nc(C)ccc1C(=O)N1[C@H]2CC[C@H]1[C@H](COc1ccccn1)C2 ZINC000226071742 FG Annotated Anodyne CC#Cc1cncc(-c2ccc(F)c([C@@]3(C(F)F)N=C(N)O[C@@H]4C[C@@H]43)c2)c1 ZINC000226076692 FG Annotated Mild COCCN(C)c1n[nH]c2ccc([C@H]3C(C#N)=C(C)N=C(C)[C@H]3C#N)cc12 ZINC000226386790 FG Annotated Reactive COCCN(C)c1n[nH]c2ccc([C@@H]3C(C#N)=C(C)N=C(C)[C@H]3C#N)cc12 ZINC000226386798 FG Annotated Reactive Cc1cc(N2C(=O)[C@@H]3CCCN3[C@@H]2c2cccc(Br)c2)no1 ZINC000227346010 FG Annotated Anodyne NCc1cn(C2CCN(Cc3ccc(-c4cccc(Cl)c4)o3)CC2)nn1 ZINC000023129173 FG Annotated Anodyne CN(Cc1cc(-c2cccnc2)no1)C(=O)c1ccc([C@@H]2CCCN2)s1 ZINC000023145655 FG Annotated Anodyne CN(Cc1cc(-c2cccnc2)no1)C(=O)c1ccc([C@H]2CCCN2)s1 ZINC000023145660 FG Annotated Anodyne OC1(c2cn(C3CCN(c4nc5ccccc5o4)CC3)nn2)CCCC1 ZINC000023153257 FG Annotated Anodyne O[C@H]1[C@H](N2CCc3[nH]c4ccccc4c3C2)c2ccccc2C12CCNCC2 ZINC000023153385 FG Annotated Anodyne Cc1nc2sc([C@H](c3ccccc3)N3C[C@@H](C)O[C@H](C)C3)c(O)n2n1 ZINC000023156800 FG Annotated Anodyne Cc1nc2sc([C@@H](c3ccccc3)N3C[C@@H](C)O[C@H](C)C3)c(O)n2n1 ZINC000023156803 FG Annotated Anodyne COc1ccc([C@H](c2sc3nc(C)nn3c2O)N2CCCCC2)cc1 ZINC000023157244 FG Annotated Anodyne COc1ccc([C@@H](c2sc3nc(C)nn3c2O)N2CCCCC2)cc1 ZINC000023157247 FG Annotated Anodyne COc1ccc(NC(=O)N2CCC(Cn3cc(C4CC4)nn3)CC2)c(C)c1 ZINC000023158579 FG Annotated Anodyne Cc1nc[nH]c1CN1CCc2c(cnc(C)c2-c2noc(C3CCC3)n2)C1 ZINC000023159472 FG Annotated Anodyne Cc1nn(CC(=O)Nc2cnn(C(C)C)n2)c(C)c1-c1cccc(F)c1 ZINC000023214053 FG Annotated Anodyne COCc1cc(=O)[nH]c(-c2ccc(CN3CCC[C@@H]3C(F)(F)F)cc2)n1 ZINC000023214055 FG Annotated Anodyne COCc1cc(=O)[nH]c(-c2ccc(CN3CCC[C@H]3C(F)(F)F)cc2)n1 ZINC000023214057 FG Annotated Anodyne Cc1nn(C(C)C)c(C)c1CNC(=O)Nc1nnc(C(F)(F)F)s1 ZINC000023214063 FG Annotated Anodyne Cn1ccnc1CN1CCC(n2cc(-c3ccccc3Cl)nn2)CC1 ZINC000023232514 FG Annotated Anodyne COc1ccc([C@@H](Nc2nccc(-c3cnn(C)c3)n2)c2ccncc2)cc1 ZINC000023250305 FG Annotated Anodyne COc1ccc([C@H](Nc2nccc(-c3cnn(C)c3)n2)c2ccncc2)cc1 ZINC000023250308 FG Annotated Anodyne O=C(Nc1ccc2c(c1)CN(CC#Cc1ccccc1)CC2)[C@@H]1CCCO1 ZINC000023337475 FG Annotated Mild O=C(Nc1ccc2c(c1)CN(CC#Cc1ccccc1)CC2)[C@H]1CCCO1 ZINC000023337477 FG Annotated Mild C[C@@H](Cn1cncn1)NC1CCN(c2cccc(-c3ccco3)c2)CC1 ZINC000023367959 FG Annotated Anodyne C[C@H](Cn1cncn1)NC1CCN(c2cccc(-c3ccco3)c2)CC1 ZINC000023367963 FG Annotated Anodyne CN(C[C@H]1Cc2ccccc2CN1C)C(=O)Nc1nnc(C2CCC2)s1 ZINC000023368330 FG Annotated Anodyne CN(C[C@@H]1Cc2ccccc2CN1C)C(=O)Nc1nnc(C2CCC2)s1 ZINC000023368334 FG Annotated Anodyne Cc1nc(C2CCN(C(=O)c3cc4c(s3)CCCCC4)CC2)cc(=O)[nH]1 ZINC000023368675 FG Annotated Anodyne CNC(=O)c1ccc([C@@H]2CCCN2C(=O)Cc2sc(C)nc2C)s1 ZINC000023379679 FG Annotated Anodyne CNC(=O)c1ccc([C@H]2CCCN2C(=O)Cc2sc(C)nc2C)s1 ZINC000023379681 FG Annotated Anodyne CCN(C)[C@@H]1c2ccccc2C2(CCN(c3ccc(Cl)nn3)CC2)[C@H]1O ZINC000023379792 FG Annotated Anodyne CN(Cc1ccoc1)Cc1cccc(-c2nc([C@@H]3CCOC3)cc(=O)[nH]2)c1 ZINC000023399036 FG Annotated Anodyne CN(Cc1ccoc1)Cc1cccc(-c2nc([C@H]3CCOC3)cc(=O)[nH]2)c1 ZINC000023399041 FG Annotated Anodyne Cc1nc(CCNC(=O)Nc2nnc(C(F)(F)F)s2)sc1Cl ZINC000023399132 FG Annotated Anodyne O[C@@H](c1ccccc1)c1cn(C2CCN(Cc3ccsc3)CC2)nn1 ZINC000023429065 FG Annotated Anodyne O[C@H](c1ccccc1)c1cn(C2CCN(Cc3ccsc3)CC2)nn1 ZINC000023429071 FG Annotated Anodyne CCCn1ncc(NC(=O)Cn2nc(C)c(-c3cccc(C)c3)c2C)n1 ZINC000023430231 FG Annotated Anodyne O=C(Nc1cccs1)N1CCC[C@@H](Cn2cc(-c3ccccn3)nn2)C1 ZINC000023430379 FG Annotated Anodyne O=C(Nc1cccs1)N1CCC[C@H](Cn2cc(-c3ccccn3)nn2)C1 ZINC000023430383 FG Annotated Anodyne Cc1nn(C)c(C)c1-c1ccnc(NCc2c[nH]nc2-c2ccccc2)n1 ZINC000023478297 FG Annotated Anodyne O=C(NCCc1cn2ccsc2n1)Nc1nnc(-c2ccccc2)s1 ZINC000023478844 FG Annotated Anodyne C(=C/c1n[nH]c2c1CN(c1cc(-n3cccn3)ncn1)CC2)\c1ccccc1 ZINC000023479255 FG Annotated Anodyne CN1CC[C@]2([C@@]34CCN(C)[C@@H]3N(C)c3ccccc34)c3ccccc3N[C@@H]12 ZINC000230067363 FG Annotated Anodyne in-man C=C1CC[C@@H]2C(C)(C)CCC[C@@]2(C)[C@@H]1C[C@@]12O[C@@H]1[C@@H](O)C(CO)=CC2=O ZINC000230067840 FG Annotated Mild in-man C=C1CC[C@@H]2C(C)(C)CCC[C@]2(C)[C@@H]1C[C@@]12O[C@@H]1[C@@H](O)C(CO)=CC2=O ZINC000230067845 FG Annotated Mild in-man C=C(C)[C@@H]1C[C@@]2(C)C(=CC1=O)CC[C@@H](OC(=O)/C=C/[S@@](C)=O)[C@@H]2C ZINC000230072317 FG Annotated Mild in-man C=C(C)[C@H]1C[C@@]2(C)C(=CC1=O)CC[C@@H](OC(=O)/C=C/[S@@](C)=O)[C@@H]2C ZINC000230072323 FG Annotated Mild in-man C=C(C)[C@H]1C[C@]2(C)C(=CC1=O)CC[C@@H](OC(=O)/C=C/[S@@](C)=O)[C@@H]2C ZINC000230072333 FG Annotated Mild in-man C=C1[C@H]2CC[C@H]3[C@](C)(CC(=O)O)[C@H](C(C)(C)C(=O)O)CC[C@]3(C2)[C@@H]1O ZINC000230093938 FG Annotated Mild in-man C=C1[C@@H]2CC[C@H]3[C@](C)(CC(=O)O)[C@H](C(C)(C)C(=O)O)CC[C@]3(C2)[C@@H]1O ZINC000230093942 FG Annotated Mild in-man C=C1[C@H]2CC[C@H]3[C@](C)(CC(=O)O)[C@H](C(C)(C)C(=O)O)CC[C@@]3(C2)[C@@H]1O ZINC000230093946 FG Annotated Mild in-man C=C1[C@@H]2CC[C@H]3[C@](C)(CC(=O)O)[C@H](C(C)(C)C(=O)O)CC[C@@]3(C2)[C@@H]1O ZINC000230093950 FG Annotated Mild in-man O=C(CCc1ccc2c(c1)OCO2)N[C@@H](c1cccs1)C1CC(O)C1 ZINC000230494976 FG Annotated Anodyne CC[C@@H](NC(=O)c1cc(OC)c(OC(C)C)cc1Cl)C1CC(O)C1 ZINC000230523050 FG Annotated Anodyne Cc1ccccc1CNC(=O)CN(Cc1ccccn1)Cc1ccccn1 ZINC000230558726 FG Annotated Anodyne COc1ccc([C@@H](NC(=O)c2scc3c2CCCC3)C2CC(O)C2)cn1 ZINC000230569996 FG Annotated Anodyne COc1ccc(C2(C(=O)N[C@H](c3cccs3)C3CC(O)C3)CC2)cc1 ZINC000230580817 FG Annotated Anodyne CCCCc1cc(=O)[nH]c(-c2cccc(CN(C)Cc3cnccn3)c2)n1 ZINC000023505169 FG Annotated Anodyne CN(CCSc1ccccc1)[C@@H]1c2ccccc2C2(CCNCC2)[C@H]1O ZINC000023505363 FG Annotated Anodyne C[C@@]1(C(=O)N2CCc3[nH]nc(CCc4ccccc4)c3C2)CCCCO1 ZINC000023505853 FG Annotated Anodyne C[C@]1(C(=O)N2CCc3[nH]nc(CCc4ccccc4)c3C2)CCCCO1 ZINC000023505856 FG Annotated Anodyne CCCCCc1nnc(NC(=O)N2CCN(c3ccnc(C)c3)CC2)s1 ZINC000023506402 FG Annotated Anodyne CCS(=O)(=O)N1CCc2[nH]nc(-c3cccc(C(F)(F)F)c3C)c2C1 ZINC000023506612 FG Annotated Anodyne O=C(c1cn[nH]c1-c1cccs1)N1CCc2[nH]nc(C3CCC3)c2C1 ZINC000023542942 FG Annotated Anodyne O=C(Nc1nncs1)N1CC[C@@](O)(c2ccccc2)[C@H]2CCCC[C@H]21 ZINC000023543655 FG Annotated Anodyne Cc1ccccc1Cc1nnc(NC(=O)N(C)CC2(CO)CCCC2)s1 ZINC000023619081 FG Annotated Anodyne Cc1ccc2c(C)c(C(=O)N3CCC(c4cc(=O)[nH]cn4)CC3)oc2c1 ZINC000023619291 FG Annotated Anodyne COC(=O)[C@@H]1C[C@@]23C4=C(CC[C@@H]5CN6C[C@H](C)[C@@H](CC[C@@]52CO)[C@@H]63)CC[C@@H]41 ZINC000238730642 FG Annotated Anodyne C[C@@H]1C[C@H](O)[C@@]2(C)[C@H](C(=O)O)CCC[C@@H]2[C@@]1(C)CCC1=CC(=O)OC1 ZINC000238730815 FG Annotated Anodyne C=C1C(=O)O[C@H]2C[C@@H](C)[C@@H]3CCO[C@@H](OC(=O)[C@H](C)CC)[C@@]3(C)C[C@H]12 ZINC000238731289 FG Annotated Mild COC(=O)C[C@]12C[C@H](O[C@@H]1/C=C(\C)CCC=C(C)C)[C@@H](OC)CC2=O ZINC000238731697 FG Annotated Anodyne C[C@]12C[C@@H](c3ccoc3)OC(=O)C1=C(O)C[C@@]13COC(=O)C1=CCC[C@@H]32 ZINC000238731987 FG Annotated Anodyne C=CC[C@]12CC(OC)=C[C@@H](OC)[C@]1(O)O[C@@H](c1ccc3c(c1)OCO3)[C@@H]2C ZINC000238732048 FG Annotated Mild CC[C@H]1CN2[C@H]3C[C@@H]1[C@@H](C(=O)OC)[C@@H]2Cc1c3n(C)c2cc(OC)ccc12 ZINC000238732377 FG Annotated Anodyne COC(=O)CCC(=O)c1cnc2c(c1)[C@]13C[C@@H](C)C[C@H](C2)[C@@H]1CCCN3 ZINC000238732441 FG Annotated Anodyne C/C=C1/CN2C[C@H]3c4c(n(C)c5ccc(O)cc45)[C@@H]2C[C@@H]1[C@@H]3C(=O)OC ZINC000238732675 FG Annotated Anodyne CC(C)=CCC[C@@](C)(O[C@@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1O)[C@@H]1CC=C(C)CC1 ZINC000238732717 FG Annotated Anodyne COc1ccc([C@H]2Oc3c(C)c(O)c(C)c(OC)c3[C@H](OC)[C@@H]2O)cc1 ZINC000238733042 FG Annotated Anodyne C[N+]1(C)CCc2cc3c(cc2C(=O)CCc2cc4c(cc21)OCO4)OCO3 ZINC000238733209 FG Annotated Clean CO[C@H]1c2ccccc2O[C@H](c2ccc(OC(C)=O)cc2)[C@H]1OC(C)=O ZINC000238733535 FG Annotated Anodyne CC1(C)CCC[C@@]2(C)[C@H]1C[C@H]1O[C@@]1(CO)[C@]21CC[C@@](C)(CC(=O)O)O1 ZINC000238733607 FG Annotated Anodyne C=CC[C@]12CC=C[C@@H](O)[C@]1(OC)O[C@@H](Cc1ccc3c(c1)OCO3)[C@@H]2C ZINC000238733710 FG Annotated Mild COc1cc(OC)c2c(c1)O[C@H](c1c(OC)cccc1OC)[C@@H](OC)C2=O ZINC000238734049 FG Annotated Anodyne CC(C)=CCC[C@](C)(O[C@H]1O[C@H](C)[C@@H](O)[C@@H](O)[C@@H]1O)[C@H]1CC=C(C)CC1 ZINC000238734171 FG Annotated Anodyne CC1=C[C@H](OC(=O)c2ccc(O)cc2)[C@@H]2[C@](C)(CC[C@@]2(O)C(C)C)C[C@@H]1O ZINC000238734191 FG Annotated Anodyne C=CCC1=C[C@@]2(OC)[C@H](C)[C@@H](c3ccc4c(c3)OCO4)O[C@]2(O)[C@@H](OC)C1 ZINC000238734549 FG Annotated Mild C=C(C)[C@@H]1Cc2oc(cc2C(=O)OC)/C=C(/C)C[C@H]2C=C(CC1=O)C(=O)O2 ZINC000238734675 FG Annotated Mild C/C=C(/CC)c1c(O)cc2c(c1O)[C@H](O)[C@@H](O)[C@H](c1ccc(O)cc1)O2 ZINC000238734713 FG Annotated Anodyne COc1ccc2c(c1O)[C@H]1Cc3c(ccc(OC)c3OC)C[C@H]1[N+](C)([O-])C2 ZINC000238734915 FG Annotated Bother C=C(C=O)[C@H]1Oc2ccc([C@@H](C)OC(=O)/C(C)=C\C)cc2[C@@H]1OC(C)=O ZINC000238734960 FG Annotated Reactive CCCCCCCCCCCC[C@H](O)[C@]1(O)C(=O)C=C[C@@H]1OC(C)=O ZINC000238735019 FG Annotated Mild CC(=O)O[C@]1(C)/C=C2/C(=O)C(C)=C[C@@]2(O)C(=O)[C@H](C)C[C@@H]2[C@H](CC1)C2(C)C ZINC000238735020 FG Annotated Mild C=C1C(=O)O[C@H]2C[C@]3(COC(C)=O)CC[C@@]4(C)C[C@H]5O[C@@]5(C)CC[C@@H]4[C@H]3[C@@H]12 ZINC000238735223 FG Annotated Mild C/C=C(/C)C(=O)O[C@@H]1c2c(C)coc2C[C@@]2(O)CCC[C@H](C(=O)O)[C@@]12C ZINC000238735292 FG Annotated Anodyne C=CCCCCC[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H](O)C#CC#CCCC ZINC000238736369 FG Annotated Mild C=C1[C@H]2CC[C@@H]3[C@](CC[C@@H](C(C)(C)C(=O)O)[C@@]3(C)CC(=O)O)(C2)[C@H]1O ZINC000238736670 FG Annotated Mild CC[C@H]1OC(=O)C[C@@H](O)[C@H](C)C(=O)[C@@H](C)C[C@@H](C)C(=O)/C=C/C=C/[C@@H]1C ZINC000238736933 FG Annotated Mild C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)/C(O)=C1\C(=O)N[C@@H](OC)C1=O ZINC000238737054 FG Annotated Mild C[C@@H]1CN2C[C@H]3CCC4=C5[C@H](CC4)[C@H](C(=O)O)C[C@@]54C(=O)[C@@]12CC[C@@]34C ZINC000238737618 FG Annotated Anodyne C=CC[C@@]12C=C(OC)[C@](C)(O)[C@@H](C1=O)[C@H](c1ccc(OC)c(OC)c1)[C@@H]2C ZINC000238737636 FG Annotated Mild C=C1C(=O)O[C@H]2C(=O)[C@@H](C)CCC[C@@](C)(OO)/C=C/C[C@]3(C)O[C@H]3C[C@H]12 ZINC000238738254 FG Annotated Reactive C=C(C)[C@H]1Oc2cc(O)c(C(C)=O)cc2[C@H]1OC(=O)/C(=C\C)COC(C)=O ZINC000238738270 FG Annotated Mild C=CC[C@@H]1C(=O)C=C(OC)[C@@]2(OC)[C@H]1O[C@@H](c1ccc3c(c1)OCO3)[C@@H]2C ZINC000238738351 FG Annotated Mild C=C1[C@H]2CC[C@@H]3[C@@]4(C)CCC[C@@](C)(CO)[C@@H]4C[C@H](OC(C)=O)[C@@]3(C2)[C@H]1O ZINC000238738492 FG Annotated Mild COC1=CC(=O)c2cc(OC)cc(-c3ccc(OC)c(OC)c3)c2C1=O ZINC000238738581 FG Annotated Mild CC[C@H]1C[C@@H]2C[C@@]3(C(=O)OC)c4[nH]c5ccccc5c4CCN([C@@H]13)[C@@H]2OC ZINC000238739327 FG Annotated Anodyne C=C(C=O)[C@H]1Oc2ccc([C@H](C)OC(C)=O)cc2[C@H]1OC(=O)CC(C)C ZINC000238739901 FG Annotated Reactive C=CC[C@@]1(OC)C=C2C(=CC1=O)O[C@H](c1cc(OC)c3c(c1)OCO3)[C@H]2C ZINC000238739929 FG Annotated Mild C=C1C[C@]23C[C@H]1CC[C@@H]2[C@]1(C(=O)O)CCC[C@@](C)(C(=O)O)[C@H]1[C@@H]3C(=O)O ZINC000238740342 FG Annotated Mild C=CC[C@]12C[C@@H](OC)C(=O)C=C1O[C@@H](Cc1ccc3c(c1)OCO3)[C@@H]2C ZINC000238740591 FG Annotated Mild C/C=C1/CN2CCc3c4n(c5ccc(OC)cc35)[C@H](C(=O)OC)[C@H]1C[C@@H]42 ZINC000238740714 FG Annotated Anodyne C=C1C(=O)O[C@H]2[C@H](OC(=O)CC(C)C)[C@@]3(C)CCC[C@H](C)[C@@H](C[C@H]12)O3 ZINC000238740828 FG Annotated Mild CC/C=C\C[C@H](O)/C=C/[C@H]1[C@H](O)C[C@@H]2O/C(=C/CCCC(=O)OC)C[C@@H]21 ZINC000238740940 FG Annotated Anodyne C=C1C(=O)O[C@H]2C3=CC[C@@H]4C(C)(C)[C@@H](O)CC[C@@]4(C)[C@@H]3[C@@H](OC(C)=O)C[C@@H]12 ZINC000238741161 FG Annotated Mild C=C1CC/C=C(\C(=O)O)C[C@@H](OC(C)=O)CC(C)(C)C[C@@H]1OC(C)=O ZINC000238741284 FG Annotated Mild CC(C)[C@]1(O)CC[C@]2(C)C=C[C@](C)(O)C[C@H](OC(=O)c3ccc(O)cc3)[C@H]21 ZINC000238741933 FG Annotated Anodyne CC[C@@]12CCCN3CC[C@]4(c5ccc(O)c(O)c5N(C(C)=O)[C@@H]4CC1)[C@H]32 ZINC000238742074 FG Annotated Clean C=CC[C@@]1(C)C(=O)Oc2c(O)c3c(c(C)c21)C(=O)C(O)=C(C(C)C)C3=O ZINC000238742117 FG Annotated Mild CC(=O)CC[C@H](/C=C/[C@@](C)(O)C[C@@H](O)/C=C(\C)CCC(=O)O)C(C)C ZINC000238742135 FG Annotated Anodyne CC1=CC[C@]2(C)[C@@H]([C@@H](OC(=O)c3ccc(O)cc3)C1)[C@](O)(C(C)C)C[C@H]2O ZINC000238742162 FG Annotated Anodyne COC(=O)N1c2ccccc2[C@]23CCN4CC=C[C@]45CC[C@]12[C@@H](C5)C(=O)C3 ZINC000238742216 FG Annotated Anodyne O=C(OCC1=CCN2CC[C@@H](C(=O)Oc3ccccc3)[C@H]12)c1ccccc1 ZINC000238742309 FG Annotated Anodyne CC[C@]12C=CCN3CCc4c(n(c5ccccc45)[C@@](O)(OC(C)=O)C1)[C@@H]32 ZINC000238742370 FG Annotated Anodyne C[C@@]12CCC[C@@H](O1)c1cc3c(cc1O2)C(=O)c1cc(O)cc(O)c1C3=O ZINC000238742375 FG Annotated Clean Oc1cc(O)cc(Oc2c(O)ccc(Oc3c(O)cc(O)cc3O)c2O)c1 ZINC000238742776 FG Annotated Anodyne C=C1C[C@]23C[C@H]1CC[C@H]2[C@]1(C)CC[C@@H](O)[C@](C)(COC(C)=O)[C@@H]1C[C@@H]3O ZINC000238742818 FG Annotated Mild CC[C@@]12CCCN3CC[C@@]4(C(=C(C(=O)OC)C1)Nc1cc(OC)ccc14)[C@H]32 ZINC000238742985 FG Annotated Anodyne C/C=C1/CN2[C@H]3C[C@@H]1[C@H]1[C@@H]2C[C@@]2(C3=Nc3ccc(OC)cc32)[C@H]1OC(C)=O ZINC000238743335 FG Annotated Anodyne CC(=O)N1C=C([C@@H]2[C@@H]3C[C@@H](CN4CCCC[C@@H]34)[C@H]3CCCCN23)CCC1 ZINC000238743345 FG Annotated Anodyne C=C1C(=O)O[C@@H]2[C@H]3O[C@H](C[C@H]12)[C@@](C)(O)C/C=C/[C@](C)(OO)CCC[C@@H]3C ZINC000238743622 FG Annotated Reactive C/C(O)=C/CC(=O)O[C@H]1CCC2=CC(=O)C([C@@H](C)C(=O)O)=C[C@]2(C)[C@H]1C ZINC000238743643 FG Annotated Mild C=CC[C@]12C[C@H](OC)C(=O)C=C1O[C@@H](Cc1ccc3c(c1)OCO3)[C@H]2C ZINC000238743999 FG Annotated Mild CC/C(C)=C/C(=O)O[C@@H]1CC(C)=C2C(=O)C=C(C)[C@@H]2[C@@H]2OC(=O)[C@H](C)[C@H]21 ZINC000238744067 FG Annotated Mild C/C=C(/C)C(=O)O[C@@H]1C2=C(C[C@H]3CCC[C@H](C(=O)O)[C@@]13C)OC(=O)[C@H]2C ZINC000238744074 FG Annotated Anodyne C=C1C[C@]23C[C@H]1CC[C@H]2[C@]1(C)CC[C@@H](OC(C)=O)[C@](C)(CO)[C@@H]1C[C@H]3O ZINC000238744200 FG Annotated Mild CCO[C@H]1Cc2c(O)ccc3c2C(=C2c4cccc(O)c4C(=O)C[C@@H]23)[C@H]1O ZINC000238744334 FG Annotated Anodyne O=C(O)C[C@H]1[C@@H]2C[C@H]3C(=O)C=C(c4ccc5c(c4)OCO5)[C@@H]4C=C[C@H]1[C@H]2[C@@H]43 ZINC000238744381 FG Annotated Mild CC(C)=C1C[C@H]2[C@](C)(O)[C@H](OC/C=C(/C)C(=O)O)CC[C@]2(C)CC1=O ZINC000238744393 FG Annotated Mild COC(=O)[C@@H]1C[C@@]23C4=C(CC[C@@H]5CN6C[C@@H](C)[C@@H](C[C@@H](O)[C@@]52C)[C@H]63)CC[C@@H]41 ZINC000238744407 FG Annotated Anodyne CC(=O)OC[C@@]12CC[C@@]3(C)C[C@@H](O)[C@@]4(C)C[C@H]4[C@@H]3[C@H]1[C@@H](C(C)C)[C@@H](O)C2 ZINC000238744448 FG Annotated Anodyne C=CC[C@@]12C(=O)C=C(OC)[C@@]3(OC)[C@@H]1[C@@]3(C)[C@H]2c1ccc(OC)c(OC)c1 ZINC000238744471 FG Annotated Mild COc1cc(-c2oc3c(OC)cc(/C=C/CO)cc3c2CO)ccc1O ZINC000238744651 FG Annotated Anodyne C[C@H](O)Cc1c(O)c(O)c2c(c1O)C(=O)C(O)=C1C(C)(C)CCC[C@@]12C ZINC000238744818 FG Annotated Mild CCCC[C@H]1C(=O)[C@@](C)(CN2c3ccccc3[C@]3(O)CCO[C@H]23)C(=O)[C@@H]1C ZINC000238744835 FG Annotated Anodyne CC/C(C)=C/C(=O)O[C@H]1CC=C2C[C@H]3OC(=O)C(C)=C3[C@@H](O)[C@]2(C)[C@H]1C ZINC000238745038 FG Annotated Anodyne C/C=C(/C)C(=O)O[C@H]1CC[C@]2(C)CC(=O)C(C(C)(C)OO)=C[C@@H]2[C@@]1(C)O ZINC000238745103 FG Annotated Reactive CC(C)CC(=O)OC[C@@]1(c2ccc(C=O)cc2OC(=O)CC(C)C)CO1 ZINC000238745117 FG Annotated Anodyne C=C([C@@H]1C[C@@H](O)[C@]2(C)[C@H]3CC[C@@H](C)[C@H]3[C@@H]12)[C@H]1O[C@@H]1/C=C(\C)COC(C)=O ZINC000238745309 FG Annotated Mild C/C=C1/C[N+]2([O-])CCc3c4n(c5ccc(OC)cc35)[C@H](C(=O)OC)[C@H]1C[C@@H]42 ZINC000238745488 FG Annotated Bother C=C1[C@H]2CC[C@@]3([C@H]1O)[C@@H](C2)[C@@]12CCC[C@@](C)(CN(/C=C/O)C1)[C@H]2C[C@H]3O ZINC000238745857 FG Annotated Mild C=CCCCCC[C@H](OC(C)=O)[C@@H](O)[C@H](C#CC#CCCC)OC(C)=O ZINC000238745932 FG Annotated Mild CC(=C/[C@H](C)[C@H](C)O)/C=C/C(=O)c1c(O)c(-c2ccc(O)cc2)c[nH]c1=O ZINC000238746086 FG Annotated Mild C=C1CC[C@H]2CC[C@@]34O[C@]3(C2(C)C)[C@](O)(C/C(C)=C/C(=O)C1)O[C@@H]4OC ZINC000238746225 FG Annotated Mild CC[C@@]12CCN[C@@H]3CC[C@]4(c5ccc(OC)c(O)c5N(C(C)=O)[C@H]4CC1)[C@H]32 ZINC000238746252 FG Annotated Anodyne CO[C@@]1(C(C)(C)O)C=C2C(=O)C[C@H]3[C@](C)(C(=O)O)CCC[C@]3(C)[C@H]2CC1 ZINC000238746602 FG Annotated Mild C=C(C)[C@@H]1Oc2cc(O)c(C(C)=O)cc2[C@@H]1OC(=O)/C(=C\C)COC(C)=O ZINC000238746790 FG Annotated Mild COC(=O)c1cc2c(c3c1c([N+](=O)[O-])cc1cc(O)c(OC)cc13)OCO2 ZINC000238747476 FG Annotated Bother CC[C@]1(CCC(=O)OC)CCCN2CC[C@@]3(C(=O)N(C)c4ccccc43)[C@@H]21 ZINC000238747606 FG Annotated Anodyne C=CC[C@]12CC=CC(=O)[C@@]1(O)O[C@@H](c1cc(OC)c(OC)c(OC)c1)[C@H]2C ZINC000238747633 FG Annotated Mild C=C1C[C@]23C[C@H]1CC[C@H]2[C@]1(C)CC[C@@H](O)[C@](C)(COC(C)=O)[C@@H]1C[C@H]3O ZINC000238747840 FG Annotated Mild C[C@H](CC[C@@]1(C)[C@H](C)CC[C@@]23COC(=O)C2=C[C@@H](O)C[C@@H]31)CC(=O)O ZINC000238748088 FG Annotated Anodyne COC(=O)[C@@H]1C[C@@]23C4=C(CC[C@@H]41)CC[C@H]1CN4C[C@H](C)[C@@H](CC[C@@]12CO)[C@H]43 ZINC000238748092 FG Annotated Anodyne COC(=O)[C@@H]1C[C@@]23C4=C(CC[C@@H]5CN6C[C@@H](C)[C@@H](C[C@H](O)[C@@]52C)[C@H]63)CC[C@@H]41 ZINC000238748128 FG Annotated Anodyne CC1(C)CCC[C@]2(C)C3=C(CC[C@@H]12)C[C@]1(O)C(=O)C(CO)=CC(=O)[C@H]1C3 ZINC000238748129 FG Annotated Mild C=CC[C@H]1CC=C(OC)[C@@]2(OC)[C@@H]1O[C@@H](c1ccc3c(c1)OCO3)[C@]2(C)O ZINC000238748335 FG Annotated Mild C/C=C(/C)C(=O)O[C@H]1CC[C@]2(C)CC(=O)C(C(C)(C)OO)=C[C@H]2[C@@]1(C)O ZINC000238748384 FG Annotated Reactive C=C(C=O)[C@@H]1Oc2ccc([C@@H](C)OC(=O)/C(C)=C/C)cc2[C@H]1OC(C)=O ZINC000238748412 FG Annotated Reactive C=C1C(=O)O[C@H]2[C@H](OC(=O)[C@H](C)CC)[C@@]3(C)CCC[C@H](C)[C@@H](C[C@H]12)O3 ZINC000238748917 FG Annotated Mild CO[C@H]1C[C@]2(CC[C@@]3(O2)[C@H](C)[C@@H](O)C(=O)[C@H]2C(C)(C)CCC[C@@]23C)CO1 ZINC000238748919 FG Annotated Anodyne COc1cc([C@H]2c3cc(O)c(OC)cc3C[C@H]3[C@H](OC)OC[C@H]23)ccc1O ZINC000238748972 FG Annotated Anodyne CC[C@H]1CN2C[C@H]3c4c(n(C)c5cc(OC)ccc45)[C@@H]2C[C@@H]1[C@H]3C(=O)OC ZINC000238749094 FG Annotated Anodyne C=C(C)[C@H]1Oc2cc(O)c(C(C)=O)cc2[C@@H]1OC(=O)/C(=C\C)COC(C)=O ZINC000238749098 FG Annotated Mild C=CC[C@H]1C(OC)=C[C@H](OC)[C@@]2(O)O[C@H](c3ccc4c(c3)OCO4)[C@@H](C)[C@@H]12 ZINC000238749276 FG Annotated Mild C=CCC1=C[C@@]2(OC)[C@H](C)[C@@H](c3ccc4c(c3)OCO4)O[C@]2(OC)CC1=O ZINC000238749436 FG Annotated Mild COc1c(OC(C)=O)ccc2c1oc(=O)c1c3cc4c(cc3oc21)OCO4 ZINC000238749497 FG Annotated Bother C=C1C[C@]2(C(=O)OC)C[C@H]1CC[C@H]2[C@]1(C)CCC[C@@]2(C)C(=O)OC(=O)[C@@H]12 ZINC000238749506 FG Annotated Reactive C/C=C1\CN2[C@H]3C[C@@H]1[C@]1(C(=O)OC)CO[C@H](c4c3n(C)c3ccccc43)[C@H]21 ZINC000238749521 FG Annotated Anodyne C[C@@]12C[C@H](O)C[C@@](C)(CO)[C@H]1CCC1=C[C@@](C)([C@@H]3COC(=O)O3)CC[C@H]12 ZINC000238750425 FG Annotated Anodyne COc1cc(OCC=C(C)C)c(/C=C\C(=O)O)c2c1C[C@@H](C(C)(C)O)O2 ZINC000238750462 FG Annotated Anodyne CC(=O)O[C@@H]1CC[C@H](C)[C@]2(C)C1=C1OC(=O)C(C)=C1[C@@H]2OC(=O)C(C)C ZINC000238750489 FG Annotated Anodyne C/C=C(/C)C(=O)O[C@@H]1CC[C@]2(C)CC(=O)C(C(C)(C)OO)=C[C@H]2[C@]1(C)O ZINC000238750870 FG Annotated Reactive CC[C@H](/C=C(C)\C=C/C(=O)c1c(O)c(-c2ccc(O)cc2)c[nH]c1=O)CO ZINC000238750886 FG Annotated Mild C=C(C=O)[C@H]1Oc2ccc([C@H](C)OC(C)=O)cc2[C@@H]1OC(=O)CC(C)C ZINC000238750923 FG Annotated Reactive COC(=O)[C@]12C=C[C@H]3O[C@H](O)[C@@]4(CCc5ccoc5)[C@@H](C)CC[C@@]1(C2)[C@@H]34 ZINC000238750973 FG Annotated Anodyne CC[C@@H](C)C(=O)OCC(O)(COC(=O)[C@H](C)CC)c1ccc(C)cc1O ZINC000238751005 FG Annotated Anodyne C/C=C1/CN2C[C@H]3c4c(n(C)c5ccc(OC)cc45)[C@@H]2C[C@@H]1[C@@H]3C(=O)OC ZINC000238751097 FG Annotated Anodyne C=C1[C@H](O)[C@@]23CC[C@H](C(C)(C)C(=O)O)[C@@](C)(CC(=O)O)[C@@H]2CC[C@@H]1C3 ZINC000238751153 FG Annotated Mild COC(=O)[C@@H]1C[C@@]23C4=C(CC[C@@H]5CN6C[C@@H](C)[C@@H](C=C[C@@]52C)[C@]63O)CC[C@@H]41 ZINC000238751226 FG Annotated Anodyne COC[C@H]1C(=O)O[C@H]2[C@H](O)/C(C)=C/CC/C(C)=C/CC[C@@]3(C)O[C@@H]3C[C@H]12 ZINC000238751335 FG Annotated Anodyne COC[C@@H]1C(=O)O[C@@H]2C/C(C)=C/CC/C(C)=C/CC[C@]3(CO)O[C@H]3C[C@H]21 ZINC000238751350 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@]2(C)[C@H]3CC/C(=C\C(=O)O)[C@@H](C)[C@@H]3[C@@H](O)C[C@@H]12 ZINC000238751477 FG Annotated Anodyne C=C1C(=O)O[C@@H]2C(=O)[C@@H](C)CCC[C@@](C)(OO)/C=C/C[C@]3(C)O[C@H]3C[C@H]12 ZINC000238751801 FG Annotated Reactive C[C@@]12C[C@@H](c3ccoc3)OC(=O)[C@H]1CCC1=C(/C=C\CC2=O)C(=O)OC1 ZINC000238752132 FG Annotated Anodyne COC(=O)[C@]1(O)CCC[C@@H]2[C@@]1(C)[C@H](O)C[C@@H](C)[C@@]2(C)CCc1ccoc1 ZINC000238752164 FG Annotated Anodyne C=C(C(=O)OC)[C@@H]1CC[C@@](C)(OCC)[C@@H]2C[C@H](OC(C)=O)C(C)=C[C@@H]12 ZINC000238752239 FG Annotated Mild CC[C@@]12CCCN3C[C@H](OC)[C@@]4(C(=C(C(=O)OC)C1)Nc1ccccc14)[C@@H]32 ZINC000238752271 FG Annotated Anodyne C=C1C(=O)O[C@]2(C)CC[C@@H]1C[C@@H]1O[C@@]1(C)C/C=C\[C@@](C)(OO)CC[C@H]2O ZINC000238752283 FG Annotated Reactive C=CCCCCC[C@H](OC(C)=O)[C@@H](O)[C@@H](C#CC#CCCC)OC(C)=O ZINC000238752421 FG Annotated Mild C#C/C=C/C[C@@H](Cl)[C@H]1C[C@@H](OC(C)=O)[C@H](OC(C)=O)C=C[C@@H](CC)O1 ZINC000238752515 FG Annotated Reactive CC/C(C)=C/C(=O)O[C@H]1[C@H]2CC(=O)C[C@H](C)[C@@]2(C)C[C@H]([C@]2(C)CO2)[C@H]1O ZINC000238752574 FG Annotated Anodyne C=C1CC[C@H]2CC[C@@]34O[C@]3(C2(C)C)[C@](O)(C/C(C)=C/[C@H](O)C1)O[C@H]4OC ZINC000238752608 FG Annotated Mild C/C(CO)=C1/CC[C@@H](C)[C@]2(C[C@@H](c3ccoc3)OC2=O)[C@H]1CCC(=O)O ZINC000238752706 FG Annotated Anodyne COc1ccc([C@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)cc1OC ZINC000238752778 FG Annotated Reactive C=CCC1=C(O)C(=O)C2=C(C=C[C@H]3[C@@](C)(COC=O)CCC[C@]23C)C1=O ZINC000238752779 FG Annotated Mild C/C=C1/C(=O)NC=C(C(=O)OC)[C@@H]1Cc1nccc2c1[nH]c1ccccc12 ZINC000238753248 FG Annotated Anodyne COC1=C(C(C)C)C(=O)[C@]23O[C@@]2(C1=O)[C@@]1(C)CCCC(C)(C)[C@H]1CC3=O ZINC000238753508 FG Annotated Mild C=C(C(=O)O)[C@H]1CC[C@](C)(O)C(=O)CC/C(C)=C/CC[C@]2(C)O[C@@H]2C1 ZINC000238754350 FG Annotated Mild C=CCCCCC[C@@H](O)[C@@H](OC(C)=O)[C@H](C#CC#CCCC)OC(C)=O ZINC000238754364 FG Annotated Mild C=C1[C@H](O)[C@]23C[C@H]1CC[C@H]2[C@]1(C)CCC[C@](C)(CO)[C@H]1C[C@@H]3OC(C)=O ZINC000238754447 FG Annotated Mild COC(=O)[C@@H]1C[C@@]23C4=C(CC[C@@H]5CN6C[C@H](C)[C@H](CC[C@@]52CO)[C@H]63)CC[C@@H]41 ZINC000238754958 FG Annotated Anodyne CC(C)CC(=O)OCC1=CO[C@@H](OC(=O)CC(C)C)[C@H]2[C@@H]1C[C@@H](O)[C@@H]2C ZINC000238755380 FG Annotated Anodyne C=CC[C@]12C[C@@H](OC)C(=O)C=C1O[C@@H](OCc1ccc3c(c1)OCO3)[C@H]2C ZINC000238755396 FG Annotated Mild CC[C@H]1C[C@@H]2C[C@@]3(C(=O)OC)c4[nH]c5ccccc5c4C=CN(C2=O)[C@@H]13 ZINC000238755433 FG Annotated Anodyne CC[C@@H](C)/C=C(C)\C=C\C(=O)C1=C(O)[C@H](Cc2ccc(O)cc2)NC1=O ZINC000238755448 FG Annotated Mild CC(=O)O[C@H]1[C@@]2(C)C=C[C@@]13[C@@H](O)C[C@@H]1[C@@](C)(CO)CCC[C@@]1(C)[C@@H]3CC2 ZINC000238755835 FG Annotated Anodyne C[C@]12C[C@H](c3ccoc3)OC(=O)C1=C(O)C[C@@]13COC(=O)C1=CCC[C@@H]32 ZINC000238756003 FG Annotated Anodyne C/C(=C/Cc1cc2c(cc1O)OC[C@H]1c3cc4c(cc3O[C@@H]21)OCO4)CO ZINC000238756270 FG Annotated Anodyne CC1(C)C=Cc2cc([C@H]3COc4cc(O)cc(O)c4C3=O)cc(O)c2O1 ZINC000238756296 FG Annotated Anodyne CC(=O)O[C@@H]1C(=O)C2=CC3=C(C=O)[C@@H](O)CC[C@@]3(C)CC[C@]2(C)[C@H]1C(C)C ZINC000238756403 FG Annotated Reactive C=CCC1=C[C@]2(OC)[C@@H](C)[C@@H](c3ccc4c(c3)OCO4)O[C@]2(OC)CC1=O ZINC000238756800 FG Annotated Mild C=CC[C@]12C[C@@H](OC)C(=O)C=C1O[C@@H](Cc1ccc3c(c1)OCO3)[C@H]2C ZINC000238756907 FG Annotated Mild COc1cc(O)ccc1[C@H](O)C(=O)Cc1ccc2c(c1)C=CC(C)(C)O2 ZINC000238756942 FG Annotated Anodyne C=CCC1=C(O)C(=O)C2=C(C=C[C@H]3C(C)(C)[C@H](OC=O)CC[C@]23C)C1=O ZINC000238757072 FG Annotated Mild COc1ccc([C@@H]2Oc3c(OC)cc(/C=C/C=O)cc3[C@H]2CO)cc1OC ZINC000238757261 FG Annotated Reactive CC(=O)O[C@@H]1C[C@@H](C)[C@]23C=CC(=O)[C@@]2(C)[C@@H](OC(=O)C(C)C)C(C)(C)[C@H]13 ZINC000238757294 FG Annotated Mild CC[C@@H](C)C(=O)O[C@H]1C[C@@](C)(O)C2=C1[C@H](C)C[C@H]1OC(=O)[C@@H](C)[C@H]1C2 ZINC000238757355 FG Annotated Anodyne CC[C@H]1OC(=O)C[C@H](O)[C@H](C)C(=O)[C@@H](C)C[C@@H](C)C(=O)/C=C/C=C/[C@@H]1C ZINC000238757362 FG Annotated Mild CC(C)=CC(=O)C/C(C)=C/CC/C(C)=C/CC[C@H]1C(=O)O[C@H](O)[C@H]1O ZINC000238757582 FG Annotated Mild C=CCC1=C[C@@]2(OC)[C@@H](C)[C@H](c3ccc4c(c3)OCO4)O[C@@]2(OC)C[C@H]1O ZINC000238757615 FG Annotated Mild CC(=O)[C@@H](C)[C@H](OC(=O)c1ccc2c(c1)OCO2)c1ccc2c(c1)OCO2 ZINC000238757660 FG Annotated Anodyne COc1ccc2c(c1O)-c1c(OC)c(OC)cc3c1[C@@H](C2)C[N+](C)(C)C3 ZINC000238757759 FG Annotated Bother COc1cc(C)c2c(c1)[C@@H](OC)[C@H]1C(=O)C(O)=C(C(C)C)C(=O)C1=CC2 ZINC000238757838 FG Annotated Mild CCCOC(=O)[C@]1(Cc2ccccc2)OC(=O)C(O)=C1c1ccccc1 ZINC000238757840 FG Annotated Anodyne CC/C(C)=C/C(=O)O[C@H]1C[C@@H](C)[C@]2(C)CC3=C(C)C(=O)O[C@H]3C[C@@H]2[C@H]1O ZINC000238758195 FG Annotated Anodyne COc1ccc2c3c([nH]c2c1)[C@@H]1C[C@H]2C(C(C)=O)=COC[C@H]2[C@H](C3)N1C ZINC000238758653 FG Annotated Mild COc1c(C)c(OCC=C(C)C)cc(COC(C)=O)c1COC(C)=O ZINC000238759337 FG Annotated Anodyne C=C(C[C@@H](O)/C(C)=C/CC/C(=C/CC/C(=C\CO)CO)CO)C(C)C ZINC000238759603 FG Annotated Mild COC1=CC(=O)C[C@H]2/C=C/c3ccc4c(c3CN/C=C(/O)[C@H]12)O[C@@H](C)O4 ZINC000238759787 FG Annotated Mild COC1=CC(=O)C[C@H]2/C=C/c3ccc4c(c3CN/C=C(\O)[C@H]12)O[C@@H](C)O4 ZINC000238759800 FG Annotated Mild Cc1cc(O)c2c(c1)C(=O)C=C(c1c(C)cc3c(c1O)C(=O)C=CC3=O)C2=O ZINC000238760063 FG Annotated Mild CCCCC[C@H](O)CC[C@@H]1C(=O)NC(=O)[C@H]1C/C=C\C[C@H](C)CC(=O)O ZINC000238760091 FG Annotated Anodyne CC(=O)O[C@]12C=C(C)C(=O)/C1=C/[C@](C)(O)CC[C@@H]1[C@H](C[C@H](C)C2=O)C1(C)C ZINC000238760287 FG Annotated Mild C=CC[C@@]12C=C(OC)[C@H](O)[C@@H](C1=O)[C@@H](c1ccc(OC)c(OC)c1)[C@@H]2C ZINC000238760514 FG Annotated Mild COc1cc2c(cc1Br)[nH]c1c(C3=C[C@@H](OC)CN3)nccc12 ZINC000238760856 FG Annotated Anodyne C/C=C(/C)C(=O)O[C@H]1CC[C@]2(C)CC(=O)C(C(C)(C)OO)=C[C@H]2[C@]1(C)O ZINC000238760935 FG Annotated Reactive C[C@@]12CCC[C@@](C)(C(=O)O)[C@H]1[C@H](C(=O)O)[C@@]13CC[C@@H](C[C@@H]21)[C@@H](CO)C3 ZINC000238760971 FG Annotated Anodyne COc1cc([C@@H]2OC[C@@]3(O)[C@H](c4ccc(C)c(C)c4)OC[C@@H]23)ccc1O ZINC000238761045 FG Annotated Anodyne C=C1C[C@H](OC(=O)c2ccc(O)cc2)[C@@H]2[C@](C)(CC[C@@]2(O)C(C)C)C[C@H]1O ZINC000238761161 FG Annotated Mild CC(C)[C@@]12C=C3CC[C@@H]4[C@](C)(C(=O)O)[C@@H](O)CC[C@]4(C)[C@]3(CC1)OO2 ZINC000238761328 FG Annotated Reactive CO[C@@H]1C[C@]2(CC[C@@]3(O2)[C@H](C)[C@@H](O)C(=O)[C@H]2C(C)(C)CCC[C@@]23C)CO1 ZINC000238761547 FG Annotated Anodyne C=CCC1=C[C@@]2(OC)[C@@H](C)[C@H](c3ccc4c(c3)OCO4)O[C@@]2(OC)CC1=O ZINC000238761594 FG Annotated Mild C=C1CC[C@@H](C(C)C)/C=C/C[C@@](C)(O)C[C@@H](O)[C@@H](O)C(=C)CC[C@@H]1O ZINC000238761736 FG Annotated Mild C=C(C(=O)OC)[C@@H]1CC[C@@](C)(O)[C@@H](O)CC/C(C)=C/CC[C@]2(C)O[C@H]2C1 ZINC000238761755 FG Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@H](OC(=O)[C@H](C)CC)CC[C@@](C)(O)[C@@H]3C[C@H]12 ZINC000238761924 FG Annotated Mild C=CC[C@H]1C[C@@]2([C@@H](C)Cc3cc(OC)c4c(c3)OCO4)OCOC2=CC1=O ZINC000238762013 FG Annotated Mild COc1cc([C@@H]2OC[C@@H]3[C@H]2CO[C@H]3c2ccc(O)cc2)ccc1OC(C)=O ZINC000238762102 FG Annotated Anodyne C[C@]1(c2ccc3c(c2)OCO3)OC[C@@H]2[C@H]1CO[C@H]2c1ccc2c(c1)OCO2 ZINC000238762233 FG Annotated Anodyne C/C=C(/C)C(=O)O[C@H]1[C@@H]2O[C@]2(C)CC[C@H]2O[C@]2(C)CC[C@H]1C(C)(C)O ZINC000238762384 FG Annotated Anodyne CC1=C[C@@H](OC(=O)c2ccc(O)cc2)[C@@H]2[C@](C)(CC[C@@]2(O)C(C)C)C[C@@H]1O ZINC000238762426 FG Annotated Anodyne COc1c(O)c2c3c(c1O)C(=O)[C@H]1C(=C3C(C)=CC2=O)O[C@@H](C)C1(C)C ZINC000238762737 FG Annotated Mild C=C(C=O)[C@@H]1Oc2ccc([C@@H](C)OC(=O)/C(C)=C\C)cc2[C@@H]1OC(C)=O ZINC000238762742 FG Annotated Reactive CC(=O)Oc1ccc(/C=C\C(=O)OC[C@H]2CCCN3CCCC[C@H]23)cc1 ZINC000238762848 FG Annotated Anodyne CC(=O)O[C@H]1[C@@]2(C)C=C[C@@]13CC[C@H]1[C@@](C)(CC[C@@H](O)[C@]1(C)CO)[C@@H]3CC2 ZINC000238763026 FG Annotated Anodyne CC[C@@]12CCCN3CC[C@@]4(c5ccc(O)c(OC)c5N(C(C)=O)[C@H]4CC1)[C@H]32 ZINC000238763198 FG Annotated Anodyne C=C(C)[C@@H]1Oc2cc(O)c(C(C)=O)cc2[C@@H]1OC(=O)/C(C)=C\COC(C)=O ZINC000238763234 FG Annotated Mild CC(=O)O[C@H]1C[C@H]2[C@@](C)(CO)CCC[C@@]2(C)[C@@H]2CC[C@@H]3C[C@]12C=C3CO ZINC000238763367 FG Annotated Anodyne COC(=O)C1=CO[C@@H](C)[C@@H]2C[N+]3([O-])CCc4c([nH]c5ccccc45)[C@H]3C[C@H]12 ZINC000238763413 FG Annotated Bother COC(=O)[C@@H]1CC2=C3C=C[C@H]4C(=O)N(C[C@H]3CCC3=C2[C@@H]1CC3)C[C@H]4C ZINC000238763501 FG Annotated Anodyne COC(=O)[C@@H]1CC2=C3/C=C/[C@H]4C(=O)N(C[C@H]3CCC3=C2[C@@H]1CC3)C[C@H]4C ZINC000238763517 FG Annotated Anodyne CO[C@@H]1c2ccccc2O[C@H](c2ccc(OC(C)=O)cc2)[C@H]1OC(C)=O ZINC000238763636 FG Annotated Anodyne C/C=C(/C)C(=O)O[C@]1(C2=CC(=O)c3c(O)ccc(O)c3C2=O)CCC1(C)C ZINC000238763637 FG Annotated Mild COC(=O)C1=CCC[C@@H]2[C@@](C)(CCC3=CC(=O)OC3)[C@H](C)CC(=O)[C@@]12C ZINC000238763932 FG Annotated Anodyne C[C@@]1([C@H]2C[C@@H](c3ccoc3)OC2=O)C[C@@H]2OC(=O)C3=CCC[C@H](O1)[C@@]32C ZINC000238764018 FG Annotated Anodyne COC(=O)[C@@H]1C[C@@]23C4=C(CC[C@@H]5CN6C[C@@H](C)[C@@H](CC[C@@]52C)[C@]63O)CC[C@@H]41 ZINC000238764139 FG Annotated Anodyne CCC(=O)N1c2c(O)cccc2[C@]23CCN4CCC[C@]5(CCO[C@]425)CC[C@H]13 ZINC000238764155 FG Annotated Anodyne C=C1C[C@]23C[C@H]1CC[C@H]2[C@]1(C)CCC[C@@]2(COC(C)=O)C(=O)O[C@H]([C@@H]12)[C@@H]3O ZINC000238764400 FG Annotated Mild CC/C(=N\Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cc2c(cc1O)OCO2 ZINC000238764637 FG Annotated Mild CC(=O)[C@](O)(C[C@H]1OC1(C)C)[C@H]1CC[C@](C)(Cl)[C@@H](Br)C1 ZINC000238764866 FG Annotated Reactive COC(=O)[C@H]1C[C@@]23C(=O)[C@@]45CC[C@]2(C)[C@@H](CCC2=C3[C@H]1CC2)CN4C[C@@H]5C ZINC000238765139 FG Annotated Anodyne C[C@H](CO)CCC[C@@H](C)C1=CC[C@](C)(O)[C@@H]1CC1=C(O)[C@H](O)CCC1=O ZINC000238765356 FG Annotated Mild C=C1CC[C@H]2CC[C@@]34O[C@]3(C2(C)C)[C@](O)(C/C(C)=C/[C@H](O)C1)O[C@@H]4OC ZINC000238765384 FG Annotated Mild CC(=O)CC[C@H](/C=C/[C@](C)(O)C[C@@H](O)/C=C(\C)CCC(=O)O)C(C)C ZINC000238765651 FG Annotated Anodyne C=C1C(=O)O[C@]2(C)CC[C@@H]1C[C@@H]1O[C@@]1(C)C/C=C\[C@@](C)(OO)CCC2=O ZINC000238765943 FG Annotated Reactive CC(=O)O[C@H]1CC[C@@]2(C)[C@@H]([C@H](OC=O)C[C@@H](C)[C@]23CCC(=O)O3)C1(C)C ZINC000238766568 FG Annotated Anodyne COC(=O)[C@H]1COCC[C@@H]2Cn3ccc4c5ccccc5nc-4c3C[C@H]21 ZINC000238766574 FG Annotated Anodyne C[C@@H]1OC=C(C(=O)O)[C@H]2C[C@H]3c4[nH]c5ccccc5c4CC[N+]3(C)C[C@@H]12 ZINC000238766595 FG Annotated Bother COC(=O)[C@]12CCC[C@]3([C@H]4Cc5occc5[C@H](C)[C@@H]4CC[C@@H]13)[C@H](O)OC2 ZINC000238766722 FG Annotated Anodyne C=Cc1ccc(Oc2cc3cc(O)c(OC)cc3oc2=O)cc1OC=O ZINC000238766768 FG Annotated Anodyne CC[C@]1(CCC(=O)OC)CCCN2CC[C@@]3(C(=O)N(C)c4ccccc43)[C@H]21 ZINC000238767090 FG Annotated Anodyne C#C/C=C\C[C@@H](Cl)[C@H]1C[C@@H](OC(C)=O)[C@H](OC(C)=O)C=C[C@@H](CC)O1 ZINC000238767142 FG Annotated Reactive C=C(C=O)[C@@H]1Oc2ccc([C@@H](C)OC(=O)/C(C)=C\C)cc2[C@H]1OC(C)=O ZINC000238767289 FG Annotated Reactive C/C=C1/CN2COC[C@H]3[C@@H]2Cc2c([nH]c4ccc(OC)cc24)C(=O)C[C@@H]13 ZINC000238767502 FG Annotated Anodyne C/C(=C\CC[C@H](C)CCO)C(=O)O[C@@H]1C[C@H]2[C@@H](C)CN(C)C[C@H]2[C@@H]1C ZINC000238767966 FG Annotated Anodyne C=CC[C@@]1([C@@H](C)[C@H](O)Cc2ccc(OC)c(OC)c2)C[C@H](OC)C=CC1=O ZINC000238768188 FG Annotated Mild C=C(C=O)[C@H]1Oc2ccc([C@@H](C)OC(=O)/C(C)=C\C)cc2[C@H]1OC(C)=O ZINC000238768487 FG Annotated Reactive CN1[C@H]2c3cc4c(cc3C[C@H]3O[C@@H]1c1c(ccc5c1OCO5)[C@@]23C)OCO4 ZINC000238768504 FG Annotated Anodyne C[C@H](O)[C@@H](C)C(=O)c1c(O)c2c(c3c1OC(=O)C[C@H]3C)OC(C)(C)C=C2 ZINC000238768596 FG Annotated Anodyne COC(=O)[C@@H]1C[C@@]23C4=C(CC[C@@H]5CN6C[C@@H](C)[C@@](O)(CC[C@@]52C)[C@H]63)CC[C@@H]41 ZINC000238768628 FG Annotated Anodyne CO[C@H]1C[C@@]23COC(=O)C2=CCC[C@@H]3[C@@](C)(CC[C@H]2COC(=O)C2)[C@@H]1C ZINC000238768636 FG Annotated Anodyne CC(C)[C@]1(O)CC[C@]2(C)C=C[C@](C)(O)C[C@H](OC(=O)c3ccc(O)cc3)[C@@H]21 ZINC000238768722 FG Annotated Anodyne C[C@H]1CN2C[C@@H]3CC[C@@H]4CCC=C4[C@]4(CCC(=O)O)[C@H]2[C@H]1CC[C@]34CO ZINC000238768940 FG Annotated Anodyne CC[C@@H]1CN(C)C[C@H]2[C@H](C(=O)OC)c3c([nH]c4ccccc34)C(=O)C[C@@H]12 ZINC000238769078 FG Annotated Anodyne C[C@H]1CN2C[C@@H]3CC[C@H]4CCC=C4[C@]4(CCC(=O)O)[C@H]2[C@H]1CC[C@]34CO ZINC000238769124 FG Annotated Anodyne COc1cc(O)cc(C[C@H]2COC[C@H]2C(=O)c2ccc(OC)c(OC)c2)c1 ZINC000238769405 FG Annotated Anodyne C/C=C(/C)C(=O)OCOC/C=C/c1cc(OC)c(OC(C)=O)c(OC)c1 ZINC000238769451 FG Annotated Anodyne C[C@H](O)C[C@H](C)c1c(O)ccc(C(=O)/C=C/c2ccc(O)cc2O)c1O ZINC000238769692 FG Annotated Mild CC[C@@H](C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)[C@@](C)(O)[C@H](O)[C@H]2CO1 ZINC000238769805 FG Annotated Mild CC[C@@]12CCCN3CC[C@@]4(C(=C(C(=O)OC)C1)N(C)c1ccccc14)[C@H]32 ZINC000238769880 FG Annotated Anodyne C=C(C)[C@H]1Oc2ccc(C(C)=O)cc2[C@@H]1OC(=O)/C(C)=C\COC(C)=O ZINC000238769978 FG Annotated Mild CC[C@H]1OC(=O)C[C@@H](O)[C@H](C)C(=O)[C@@H](C)C[C@@H](C)[C@H](O)/C=C/C=C/[C@@H]1C ZINC000238770321 FG Annotated Anodyne C=C(C)[C@H]1Oc2ccc(C(C)=O)cc2[C@@H]1OC(=O)/C(=C\C)COC(C)=O ZINC000238770424 FG Annotated Mild COc1c2c3c(ccc2c2ccc4cc5c(cc4c2[n+]1C)OCO5)OCO3 ZINC000238770493 FG Annotated Bother CC1=C[C@H](OC(=O)c2ccc(O)cc2)[C@@H]2[C@@](C)(CC[C@@]2(O)C(C)C)C[C@H]1O ZINC000238770643 FG Annotated Anodyne C=C(C)[C@@H]1Oc2cc(O)c(C(C)=O)cc2[C@H]1OC(=O)/C(=C\C)COC(C)=O ZINC000238770937 FG Annotated Mild COc1ccc([C@@H]2Oc3c(OC)cc([C@@H](O)[C@@H](C)O)cc3[C@H]2C)cc1OC ZINC000238770972 FG Annotated Anodyne CC(=O)OC[C@]1(c2ccc(COCC(C)C)cc2OC(=O)C(C)C)CO1 ZINC000238770982 FG Annotated Anodyne COC(=O)C[C@@]1(C)CC[C@]2(O1)C(CO)=CC(=O)[C@@H]1C(C)(C)CCC[C@]12C ZINC000238771084 FG Annotated Mild COc1cc(C(=O)O)c(Oc2cc(C)cc(O)c2C(=O)O)c(O)c1Cl ZINC000238771131 FG Annotated Anodyne CC(C)[C@@]12C=C3[C@@H](O)C[C@@H]4[C@](C)(CCC[C@@]4(C)C(=O)O)[C@]3(CC1)OO2 ZINC000238771166 FG Annotated Reactive CO[C@H]1C(=O)C2=C(C(=O)C=C(C(C)C)C2=O)[C@@]2(C)CCCC(C)(C)[C@]12OC ZINC000238771358 FG Annotated Mild COC(=O)[C@H]1C[C@@]23C4=C(CC[C@@H]5CN6C[C@H](C)[C@@H](CC[C@@]52CO)[C@H]63)CC[C@@H]41 ZINC000238771735 FG Annotated Anodyne O=C1OC[C@H](Cc2ccc3c(c2)OCO3)[C@H]1CCc1ccc2c(c1)OCO2 ZINC000238771915 FG Annotated Anodyne C/C=C(/C)C(=O)O[C@H]1CC[C@@H]2C[C@]3(OC)NC(=O)C(C)=C3C[C@]2(C)[C@H]1C ZINC000238772048 FG Annotated Anodyne Cc1cc(O)c2c(c1)CC=C(C1=CC(=O)c3cc(C)cc(O)c3C1=O)C2=O ZINC000238772583 FG Annotated Mild CN1CCc2c(n([C@]34CCN(C)[C@@H]3Nc3ccccc34)c3ccccc23)C1 ZINC000238772856 FG Annotated Anodyne CC[C@@H]1CN(C)[C@H]2Cc3c([nH]c4ccccc34)C(=O)C[C@H]1[C@@H]2OC(C)=O ZINC000238772925 FG Annotated Anodyne COC(=O)/C=C(/C)CC[C@@H]1[C@@](O)(C=O)CC[C@@H]2C(C)(C)[C@H](O)CC[C@]21C ZINC000238773655 FG Annotated Mild C=C1c2cc(O)c(C)c(O)c2O[C@H](C(C)(C)O)C[C@H]1OC(=O)/C(C)=C\C ZINC000238773696 FG Annotated Mild CC(=O)O[C@]1(C)CC[C@@H]2[C@](C)(CCC[C@@]2(C)C(=O)O)[C@H]1CCC(=O)O ZINC000238773754 FG Annotated Anodyne COc1ccc([C@H]2OC[C@@H]3[C@H](c4ccc(OC)c(OC)c4)OC[C@H]23)cc1O ZINC000238773859 FG Annotated Anodyne C=C1[C@H]2CC[C@@H]3[C@@]4(C)CCC[C@@](C)(CO)[C@@H]4C[C@@H](OC(C)=O)[C@@]3(C2)[C@@H]1O ZINC000238774432 FG Annotated Mild C=C(C)C(=O)O[C@@H]1C[C@H]2O[C@]23Cc2occ(C)c2[C@@H](OC(C)=O)[C@]3(C)[C@H]1C ZINC000238774679 FG Annotated Mild C/C(C[C@H]1OC(=O)C2=CCCC(=O)[C@@]21C)=C1/C[C@H](c2ccoc2)OC1=O ZINC000238774715 FG Annotated Anodyne C/C(C[C@H]1OC(=O)C2=CCCC(=O)[C@@]21C)=C1\C[C@H](c2ccoc2)OC1=O ZINC000238774724 FG Annotated Anodyne COc1cc(O)c2c(=O)c3c(OC)cc4c(c3oc2c1)[C@@H]1C=CO[C@@H]1O4 ZINC000238774760 FG Annotated Bother COC(=O)[C@@]1(C)CCC[C@]2(C)C3=C([C@@H](O)C[C@@H]12)[C@H](C)/C(=C/C(=O)O)CC3 ZINC000238774774 FG Annotated Anodyne C=C1[C@@H]2CC[C@@H]3[C@](C2)([C@@H](OC(C)=O)C[C@@H]2[C@@](C)(CO)CCC[C@]23C)[C@@H]1O ZINC000238774947 FG Annotated Mild COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@@H](CO)[C@@H](C1)[C@H](O)C[C@@H]23 ZINC000238775255 FG Annotated Anodyne C[C@](O)(CCO)[C@H]1CC[C@H]2C3=CC(=O)[C@H]4CC(=CC[C@H](O)C4)[C@H]3CC[C@]12C ZINC000238775826 FG Annotated Mild COc1ccc2cc3n(c(=O)c2c1OC)CCc1cc2c(cc1-3)OCCO2 ZINC000238775827 FG Annotated Anodyne C/C=C(\C)C(=O)O[C@H]1C[C@@H](C)[C@H](O)C/C=C2\C[C@H](OC2=O)[C@H]1C(C)C ZINC000238775852 FG Annotated Anodyne C/C=C(/C)C(=O)O[C@H]1C=C2[C@@H](OC)O[C@H](O)[C@@H]3CC[C@@H]4C(C)(C)[C@@H]1C[C@]234 ZINC000238776566 FG Annotated Anodyne COc1cc2c(cc1OC)C(=O)CCc1cc3c(cc1N(C)CC2)OCO3 ZINC000238776708 FG Annotated Clean COC1=C[C@]2(C=CC1=O)c1c(cc3c(c1OC)OCO3)[C@@H]1O[C@H]2[C@@H](C)[C@@H]1C ZINC000238776750 FG Annotated Mild C[C@H]1CN2C[C@H]3CC[C@H]4CCC=C4[C@@]4(CCC(=O)O)[C@@H]2[C@@H]1CC[C@@]34CO ZINC000238776909 FG Annotated Anodyne COC1=C2CCCC/C=C/Cc3ccc(O)c(c3)C(=C(OC)C1=O)C2=O ZINC000238777054 FG Annotated Mild C=C1CC[C@@H](Cl)[C@](O)(CO)C[C@H]2O[C@]23[C@@H](C(C)(C)O)CC[C@]3(C)CC1 ZINC000238777241 FG Annotated Reactive C=C1CC[C@@H](C(C)C)/C=C/C[C@@](C)(O)C[C@@H](O)[C@H](O)C(=C)CC[C@@H]1O ZINC000238777591 FG Annotated Mild COc1cccc2c1N(C(C)=O)[C@@H]1CC[C@@]34CCCN5CC[C@@]21[C@]53OCC4 ZINC000238777852 FG Annotated Anodyne CC[C@@H](C)C(=O)O[C@H]1C[C@@]2(C)O[C@]23C[C@H]2[C@@H](C[C@@H](C)[C@H]13)OC(=O)[C@@H]2C ZINC000238777907 FG Annotated Anodyne CC(=O)O[C@@H]1CC[C@]2(C)[C@H](CC[C@@]34C=C[C@@](C)(CC[C@@H]23)[C@@H]4O)[C@@]1(C)CO ZINC000238777942 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@]2(C)C3=C([C@@H](O)C[C@@H]12)[C@H](C)/C(=C\C(=O)O)CC3 ZINC000238778209 FG Annotated Anodyne C/C(=C/CO[C@H]1CC[C@]2(C)CC(=O)C(C(C)C)=C[C@H]2[C@]1(C)O)C(=O)O ZINC000238778281 FG Annotated Mild C=C1C(=O)O[C@]2(C)CC[C@@H]1C[C@@H]1O[C@@]1(C)C/C=C\[C@@](C)(OO)CC[C@@H]2O ZINC000238778304 FG Annotated Reactive COC(=O)[C@@]1(C)CCC[C@]2(C)[C@H]3CC/C(=C/C(=O)O)[C@@H](C)[C@@H]3[C@@H](O)C[C@@H]12 ZINC000238778467 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@]2(C)C3=C([C@@H](O)C[C@@H]12)[C@@H](C)/C(=C/C(=O)O)CC3 ZINC000238778491 FG Annotated Anodyne CCOC(=O)/C=C/c1ccc2c(c1)OC(=O)C[C@H](c1ccc(O)c(O)c1)O2 ZINC000238778503 FG Annotated Clean CC1=C2CC[C@](C)(O)[C@@H]2[C@H](O)[C@H](C(C)C)[C@@H](OC(=O)c2ccc(O)cc2)C1 ZINC000238778993 FG Annotated Anodyne C/C=C(/C)C(=O)O[C@H]1[C@@H]2O[C@]2(C)CC[C@H]2O[C@@]2(C)CC[C@H]1C(C)(C)O ZINC000238779086 FG Annotated Anodyne C=CC[C@]12C[C@@]3(OCOC3=CC1=O)[C@H](C)[C@H]2c1cc(OC)c2c(c1)OCO2 ZINC000238779304 FG Annotated Mild COC(=O)/C=C(\C=O)[C@@H]1C[C@@H]2[C@](C)(CC(=O)[C@@H]3C(C)(C)CCC[C@@]23C)O1 ZINC000238779324 FG Annotated Reactive COc1cc2c(cc1OC)[C@H]1Cc3c(cc(OC)c4c3OCO4)[C@@H](C2)N1C ZINC000238779463 FG Annotated Anodyne COc1cc(C(=O)[C@H](C)c2cc(OC)c(O)c(OC)c2)cc(OC)c1O ZINC000238779467 FG Annotated Anodyne COc1ccc2c3c([nH]c2c1)[C@@H]1C[C@H]2C(C=O)=C(C)OC[C@H]2[C@H](C3)N1C ZINC000238779662 FG Annotated Reactive C/C=C1/[C@@H]2CCN3CC[C@]4(c5ccc(OC)c(O)c5N(C(=O)CC)[C@@H]4C2)[C@@H]13 ZINC000238779763 FG Annotated Anodyne CC[C@@H](C)/C=C(C)/C=C/C(=O)C1=C(O)[C@@H](Cc2ccc(O)cc2)NC1=O ZINC000238780007 FG Annotated Mild CC[C@]12C=CCN3CCc4c(n(c5ccccc45)[C@](O)(OC(C)=O)C1)[C@@H]32 ZINC000238780182 FG Annotated Anodyne C=C(COC(C)=O)[C@H]1Oc2cc(O)c(C(C)=O)cc2[C@H]1OC(=O)/C(C)=C\C ZINC000238780578 FG Annotated Mild C=C(C)[C@H]1Oc2cc(O)c(C(C)=O)cc2[C@@H]1OC(=O)/C(C)=C\COC(C)=O ZINC000238780665 FG Annotated Mild C=C1C(=O)O[C@@H]2C(=O)[C@@H](C)CCC[C@](C)(OO)/C=C/C[C@]3(C)O[C@H]3C[C@H]12 ZINC000238780710 FG Annotated Reactive CC[C@H](C)/C=C(C)/C=C\C1=CC2=CC(=O)[C@](C)(O)[C@H](OC(C)=O)[C@H]2CO1 ZINC000238781238 FG Annotated Mild C=C(C(=O)OC)[C@H]1C=C2[C@](C)(CC[C@H](OC(=O)/C(C)=C\C)[C@]2(C)O)CC1 ZINC000238781241 FG Annotated Mild CC[C@H](C)/C=C(C)\C=C/C1=CC2=CC(=O)[C@](C)(O)[C@H](OC(C)=O)[C@H]2CO1 ZINC000238781242 FG Annotated Mild CCC(=O)N1c2c(O)cccc2[C@@]23CCN4CCC[C@]5(CCO[C@@]452)CC[C@@H]13 ZINC000238781541 FG Annotated Anodyne C=CCCCCC[C@H](OC(C)=O)[C@H](OC(C)=O)[C@@H](O)C#CC#CCCC ZINC000238781598 FG Annotated Mild C=CC[C@@]1(OC)C=C2C(=CC1=O)O[C@@H](c1cc(OC)c3c(c1)OCO3)[C@H]2C ZINC000238781733 FG Annotated Mild CC(C)[C@]1(O)CC[C@]2(C)C=C[C@@](C)(O)C[C@H](OC(=O)c3ccc(O)cc3)[C@H]21 ZINC000238781815 FG Annotated Anodyne CCN1C[C@@]23C(=CCC[C@@]45C[C@H](OC)[C@@H](C[C@@H]24)C5=O)[C@@](C)(CC[C@@H]3OC)C1 ZINC000238782031 FG Annotated Anodyne COC(=O)C1=CO[C@@H](C)[C@@]2(C)C[n+]3ccc4c([nH]c5ccccc54)c3C[C@H]12 ZINC000238782059 FG Annotated Anodyne C=C(C)[C@@H]1C[C@@]2(C)C(=CC1=O)CC[C@@H](OC(=O)/C=C\[S@@](C)=O)[C@@H]2C ZINC000238782179 FG Annotated Mild CC[C@@H](C)[C@H]1[C@](C)(O)C(=O)[C@H]2C[C@](C)(O)C[C@@H](C)[C@H]2[C@@]1(C)C(=O)/C=C/O ZINC000238782214 FG Annotated Mild C=C1CC[C@@H]2CCC(=O)[C@@](O)(C(=O)C/C(C)=C/[C@@H](OC(C)=O)C1)C2(C)C ZINC000238782273 FG Annotated Mild CC(=O)OCC1=CC(=O)[C@@H]2[C@H](CC[C@@H]3[C@]4(CC[C@]32C)OC4(C)C)[C@H]1[C@H]1CO1 ZINC000238782667 FG Annotated Mild COC(=O)[C@H]1CC[C@]23COC(=O)C2=CCC[C@H]3[C@]1(C)CC(=O)c1ccoc1 ZINC000238782755 FG Annotated Anodyne C=C1CC[C@H]2[C@@](C)(C(=O)OC)CCC[C@]2(C=O)[C@H]1CCC1=CCOC1=O ZINC000238782852 FG Annotated Mild COC(=O)C1=CC[C@H](O)[C@H]2[C@@]1(C)CC[C@@H](C=O)[C@]2(C)CCc1ccoc1 ZINC000238782890 FG Annotated Mild C=CC[C@H]1[C@H]2C[C@@H](CN1C)[C@H]1CCCCN1[C@@H]2C1=CN(C(C)=O)CCC1 ZINC000238782989 FG Annotated Mild C/C1=C\[C@H](O)C[C@](C)(O)C/C=C/[C@H](C(C)C)CC[C@@](C)(O)[C@@H](O)CC1 ZINC000238782990 FG Annotated Anodyne COc1cc2oc(=O)c3c4cc5c(cc4oc3c2cc1OC(C)=O)OCO5 ZINC000238783127 FG Annotated Bother CC[C@H](/C=C(C)/C=C\C(=O)c1c(O)c(-c2ccc(O)cc2)c[nH]c1=O)CO ZINC000238783630 FG Annotated Mild CC[C@H](/C=C(C)\C=C\C(=O)c1c(O)c(-c2ccc(O)cc2)c[nH]c1=O)CO ZINC000238783634 FG Annotated Mild Cc1cc(O)c2c(c1)C(=O)C=C(c1cc3c(cc1C)C(=O)C=CC3=O)C2=O ZINC000238783665 FG Annotated Mild CC(C)CC(=O)OCC1=CO[C@H](OC(=O)CC(C)C)[C@H]2[C@H](C)[C@H](O)C[C@@H]12 ZINC000238783911 FG Annotated Anodyne CCCCC[C@H]1OC(=O)[C@H](C)[C@H](OC(C)=O)/C=C\CC[C@@H]1OC(C)=O ZINC000238784102 FG Annotated Anodyne C/C=C(/C)C(=O)O[C@@H]1C2=C(C[C@H]3CCC[C@H](C(=O)O)[C@@]13C)OC(=O)[C@@H]2C ZINC000238784312 FG Annotated Anodyne CC1(C)CCC[C@@]2(C)[C@@H]1CC[C@@]1(C)O[C@H]([C@@](O)(CO)[C@@H](Cl)CO)C[C@H]21 ZINC000238784380 FG Annotated Reactive C=C(C=O)[C@@H]1Oc2ccc([C@@H](C)OC(=O)/C(C)=C/C)cc2[C@@H]1OC(C)=O ZINC000238784424 FG Annotated Reactive COC(=O)C1=CCC[C@H]2[C@@](C)(C[C@H](O)c3ccoc3)[C@@H]3C[C@@H](OC3=O)[C@@]12C ZINC000238784846 FG Annotated Anodyne C=C1c2ccoc2C[C@H]2[C@H]1[C@@H](O)C[C@@]1(O)C(C)(C)CC[C@H](OC(C)=O)[C@]21C ZINC000238784895 FG Annotated Mild CC1(C)C=Cc2c(cc(O)c3c(=O)c(O)c(-c4ccc(O)cc4O)oc23)O1 ZINC000238785214 FG Annotated Anodyne CC[C@]12CCC[N+]3([O-])CC[C@]4(C(=C(C(=O)OC)C1)Nc1ccccc14)[C@H]23 ZINC000238785396 FG Annotated Bother CN1CCc2cn(c3ccccc23)[C@]23CCN(C)[C@H]2N(C1)c1ccccc13 ZINC000238785568 FG Annotated Anodyne CO[C@@H]1/C=C(/C(C)C)CCC2=CCC[C@](C)(OC2=O)[C@H](O)CC[C@@]1(C)O ZINC000238785699 FG Annotated Anodyne C/C=C(\C)C(=O)O[C@H]1C[C@@H](C)[C@@H](O)C/C=C2\C[C@H](OC2=O)[C@H]1C(C)C ZINC000238786063 FG Annotated Anodyne O=C(O)CCn1cc2c3c(c(-c4ccccc4)ccc3c1=O)C(=O)C(O)=C2 ZINC000238786377 FG Annotated Mild COc1cccc2c1[C@@H](c1ccc3c(c1)C(=O)C[C@@](C)(O)C3)O[C@H]2OC ZINC000238786378 FG Annotated Anodyne COc1ccc2c(c1OC)-c1c(OC)c(O)cc3c1[C@H](C2)[N+](C)([O-])CC3 ZINC000238786942 FG Annotated Bother CC(C)(O)CCc1cc([C@@H]2CC(=O)c3c(O)cc(O)cc3O2)ccc1O ZINC000238787137 FG Annotated Anodyne COc1cc([C@@H]2CC(=O)c3c(O)c(C)c(O)c(C)c3O2)cc(OC)c1O ZINC000238787256 FG Annotated Anodyne C=C(C)C(=O)O[C@H]1C[C@H]2O[C@]23Cc2occ(C)c2[C@@H](OC(C)=O)[C@]3(C)[C@H]1C ZINC000238787305 FG Annotated Mild CC(/C=C\C(=O)c1c(O)c(-c2ccc(O)cc2)c[nH]c1=O)=C\[C@H](C)[C@H](C)O ZINC000238787640 FG Annotated Mild CC(/C=C\C(=O)c1c(O)c(-c2ccc(O)cc2)c[nH]c1=O)=C/[C@H](C)[C@H](C)O ZINC000238787641 FG Annotated Mild COC(=O)[C@@]12CCCC3=C1[C@H](C[C@@H](C)[C@]31C[C@@H](c3ccoc3)OC1=O)OC2 ZINC000238788342 FG Annotated Anodyne CC1=CC(=O)c2c(ccc(-c3ccc4c(c3O)C(=O)C=CC4=O)c2O)C1=O ZINC000238788750 FG Annotated Mild C=C(C(=O)O)[C@@H]1CC[C@@](C)(O)[C@@H](O)CC/C(C)=C/CC[C@]2(C)O[C@H]2C1 ZINC000238788752 FG Annotated Mild CC(=O)C[C@@H]1OC(=O)C2=CCC[C@@H]([C@H]3C[C@H](c4ccoc4)OC3=O)[C@]21C ZINC000238788931 FG Annotated Anodyne COc1c(O)ccc2c1C[C@@H](C(C)(C)O)[C@@H]2CC(=O)c1ccc(O)cc1 ZINC000238789016 FG Annotated Anodyne CC(=O)O[C@H]1CCC(C)(C)[C@]2(O)[C@@H](O)Cc3c(cc4occc4c3C)[C@@]12C ZINC000238789098 FG Annotated Anodyne CC[C@@H](C)/C=C(C)/C=C\C(=O)C1=C(O)[C@H](Cc2ccc(O)cc2)NC1=O ZINC000238789426 FG Annotated Mild CC[C@@H](C)/C=C(C)\C=C/C(=O)C1=C(O)[C@H](Cc2ccc(O)cc2)NC1=O ZINC000238789427 FG Annotated Mild CC[C@@H](C)/C=C(C)/C=C/C(=O)C1=C(O)[C@H](Cc2ccc(O)cc2)NC1=O ZINC000238789428 FG Annotated Mild CO[C@H]1C2=C(C(=O)C(O)=C(C(C)C)C2=O)[C@@]2(C)CCCC(C)(C)[C@@H]2[C@@H]1O ZINC000238789557 FG Annotated Mild C=C1C(=O)O[C@@H]2CC(=C)[C@H]3[C@@H](OC(=O)CC(C)C)C[C@@](C)(O)[C@]3(C)C[C@H]12 ZINC000238789570 FG Annotated Mild C=C1c2cc3c(cc2C[C@@]12c1cc(OC)c(OC)cc1CCN2C)OCO3 ZINC000238789865 FG Annotated Mild Cc1ccc(/N=C2\SCCCN2C(=O)C2=COCCO2)cc1Cl ZINC000024764830 FG Annotated Mild CN(c1ccccc1)[C@@H](c1ccc(F)cc1)c1nnnn1C[C@H]1CCCO1 ZINC000245230049 FG Annotated Anodyne C[C@@H]1CCCC[C@H]1NC(=O)[C@H]1CCCN(c2nnc(-n3cccc3)s2)C1 ZINC000247998234 FG Annotated Anodyne C[C@@H]1CCCC[C@@H]1NC(=O)[C@H]1CCCN(c2nnc(-n3cccc3)s2)C1 ZINC000247998238 FG Annotated Anodyne CN1CCN(Cc2nc(COc3ccccc3)no2)C[C@H]1c1ccccc1 ZINC000248018149 FG Annotated Anodyne CSCCc1nc2nc(N3CCC[C@H]4CCCC[C@H]43)ccc2[nH]c1=O ZINC000002500075 FG Annotated Anodyne O=c1[nH]c2ccc(N3CCc4ccccc4C3)nc2nc1Cc1ccccc1 ZINC000002500125 FG Annotated Anodyne CCN(Cc1ccccc1)c1ccc2[nH]c(=O)c(CCSC)nc2n1 ZINC000002500155 FG Annotated Anodyne N#CC1=C2N=C(N)c3ccccc3N2C2=C(C(=O)CCC2)[C@@H]1c1cccnc1 ZINC000002500567 FG Annotated Reactive N#CC1=C2N=C(N)c3ccccc3N2C2=C(C(=O)CCC2)[C@H]1c1cccnc1 ZINC000002500568 FG Annotated Reactive O=S(=O)(c1ccccc1)N1c2ccccc2-c2ccccc2S1(=O)=O ZINC000002501408 FG Annotated Anodyne CCCCN(c1nc(C)cc(OC)n1)S(=O)(=O)c1ccccc1Cl ZINC000002501575 FG Annotated Anodyne CC1(C)[C@@H](CNC(=O)N2CCCCC2)C[C@H]1CNC(=O)N1CCCCC1 ZINC000002502259 FG Annotated Anodyne CC1(C)[C@@H](CNC(=O)N2CCCCC2)C[C@@H]1CNC(=O)N1CCCCC1 ZINC000002502260 FG Annotated Anodyne CC1(C)[C@H](CNC(=O)N2CCCCC2)C[C@H]1CNC(=O)N1CCCCC1 ZINC000002502261 FG Annotated Anodyne CCc1c(C)sc(NC(=O)c2cc3ccccc3c(=O)o2)c1C(N)=O ZINC000002503176 FG Annotated Anodyne CC(=O)OC(C)(C)[C@H]1Oc2ccc3ccc(=O)oc3c2[C@H]1OC(=O)C(C)C ZINC000002561216 FG Annotated Anodyne CCOC(=O)c1cc(-c2ccncc2)nc2c1c(C)nn2-c1ccccn1 ZINC000002616985 FG Annotated Anodyne N#Cc1ccc(COc2ccc(CCO)cc2-n2nc3ccccc3n2)cc1 ZINC000002638979 FG Annotated Mild CCOc1cc(/C=C2/SC(=S)N(C[C@H]3CCCO3)C2=O)ccc1O ZINC000002682609 FG Annotated Clean CCOc1cc(/C=C2/SC(=S)N(C[C@@H]3CCCO3)C2=O)ccc1O ZINC000002682611 FG Annotated Clean Cc1ccccc1C(=O)Nc1c2c(nn1-c1ccc(F)cc1)C[S@](=O)C2 ZINC000002724951 FG Annotated Anodyne Cc1c(C(=O)N2CCCC2)sc2ncn(Cc3ccccc3F)c(=O)c12 ZINC000002911033 FG Annotated Anodyne COc1ccc([C@H]2C[C@@H](c3ccc(OC(F)F)cc3)n3nnnc3N2)cc1 ZINC000002918170 FG Annotated Anodyne COc1ccc([C@@H]2C[C@@H](c3ccc(OC(F)F)cc3)n3nnnc3N2)cc1 ZINC000002918172 FG Annotated Anodyne COc1ccc([C@H]2C[C@H](c3ccc(OC(F)F)cc3)n3nnnc3N2)cc1 ZINC000002918174 FG Annotated Anodyne CCN(CC)C(=O)c1sc2ncn(Cc3cccc(F)c3)c(=O)c2c1C ZINC000002921751 FG Annotated Anodyne CCOC(=O)c1cc(-c2ccc(F)cc2)n(CC(=O)N2CCCC2)c1C ZINC000002929790 FG Annotated Anodyne O=C(NC1CC1)C1CCC(Cn2c(=S)[nH]c3ccsc3c2=O)CC1 ZINC000002932265 FG Annotated Anodyne O=c1c2sccc2nc(SC/C(O)=N/C[C@H]2CCCO2)n1C1CC1 ZINC000002932285 FG Annotated Mild O=c1c2sccc2nc(SC/C(O)=N/C[C@@H]2CCCO2)n1C1CC1 ZINC000002932287 FG Annotated Mild CC[C@H](Oc1ccc2c(c1)C(=O)CC(C)(C)O2)C(=O)NCc1ccco1 ZINC000002933332 FG Annotated Anodyne CC[C@@H](Oc1ccc2c(c1)C(=O)CC(C)(C)O2)C(=O)NCc1ccco1 ZINC000002933334 FG Annotated Anodyne Cc1cc(=O)nc2c3ccccc3n([C@@H](C)C(=O)N(C)Cc3ccccc3)n12 ZINC000002947787 FG Annotated Anodyne Cc1cc(=O)nc2c3ccccc3n([C@H](C)C(=O)N(C)Cc3ccccc3)n12 ZINC000002947789 FG Annotated Anodyne O=c1[nH]c2ccccc2c(=O)n1-c1ccc(C/C(O)=N/C2CCCC2)cc1 ZINC000002952597 FG Annotated Mild Cc1ccc(CS(=O)(=O)Cc2ccc(C(=O)NCc3ccco3)o2)cc1 ZINC000002966665 FG Annotated Anodyne COC(=O)c1ccc2c(=O)n(C3CCCCC3)c(SCC#N)nc2c1 ZINC000002969836 FG Annotated Mild C/C(O)=N\CCn1c(SCC(=O)C(C)(C)C)nc2ccccc2c1=O ZINC000002971316 FG Annotated Mild O=C1CCCN1CCCn1c(=S)[nH]c2cc3ccccc3cc2c1=O ZINC000002974086 FG Annotated Bother CCOc1cc2[nH]c(=S)n(C[C@H]3CCCO3)c(=O)c2cc1OCC ZINC000002976553 FG Annotated Anodyne CCOc1cc2[nH]c(=S)n(C[C@@H]3CCCO3)c(=O)c2cc1OCC ZINC000002976554 FG Annotated Anodyne CN1C(=O)[C@H](C(=O)NC(C)(C)C)[C@H]2c3ccccc3O[C@@]13CCCC[C@H]23 ZINC000250728532 FG Annotated Anodyne CN1C(=O)[C@@H](C(=O)NC(C)(C)C)[C@H]2c3ccccc3O[C@@]13CCCC[C@H]23 ZINC000250728535 FG Annotated Anodyne Cc1nnn(C23C[C@H]4C[C@@H](CC(C(=O)N[C@H](C)c5ccccc5)(C4)C2)C3)n1 ZINC000250837276 FG Annotated Anodyne O=C(N[C@H](C(=O)c1ccccc1)n1c(O)ccnc1=S)c1ccccc1 ZINC000253500974 FG Annotated Anodyne O=C(N[C@@H](C(=O)c1ccccc1)n1c(O)ccnc1=S)c1ccccc1 ZINC000253500976 FG Annotated Anodyne CCCc1cc(O)nc(-c2cccc(CN3CCN4CCC[C@H]4C3)c2)n1 ZINC000253529411 FG Annotated Anodyne CC[C@]12CCCN3CC[C@]4(c5ccc(OC)c(O)c5N(C(C)=O)[C@H]4CC1)[C@@H]32 ZINC000253604782 FG Annotated Anodyne CC[C@]12CCCN3CC[C@]4(c5ccc(OC)c(O)c5N(C(C)=O)[C@@H]4CC1)[C@H]32 ZINC000253604783 FG Annotated Anodyne CC[C@]12CCCN3CC[C@]4(c5ccc(OC)c(O)c5N(C(C)=O)[C@H]4CC1)[C@H]32 ZINC000253604784 FG Annotated Anodyne CCOc1cc2nc(=S)n(C[C@H]3CCCO3)c(O)c2cc1OCC ZINC000253621260 FG Annotated Anodyne CCOc1cc2nc(=S)n(C[C@@H]3CCCO3)c(O)c2cc1OCC ZINC000253621261 FG Annotated Anodyne Nc1nc2c(c(N3C[C@@H]4CCCN[C@H]4C3)n1)CCCC[C@H]2c1ccccc1 ZINC000253633312 FG Annotated Anodyne Nc1nc2c(c(N3C[C@@H]4CCCN[C@H]4C3)n1)CCCC[C@@H]2c1ccccc1 ZINC000253633314 FG Annotated Anodyne O[C@@H]1CCCC[C@@H]1N1CCC(C2CCN([C@H]3CCCC[C@H]3O)CC2)CC1 ZINC000253634670 FG Annotated Anodyne O[C@H]1CCCC[C@@H]1N1CCC(C2CCN([C@H]3CCCC[C@H]3O)CC2)CC1 ZINC000253634672 FG Annotated Anodyne CCN1CC[C@H](OC(=O)c2[nH]cc(C(=O)O[C@H](C)C(C)(C)C)c2C)C1 ZINC000253635251 FG Annotated Anodyne CCN1CC[C@@H](OC(=O)c2[nH]cc(C(=O)O[C@H](C)C(C)(C)C)c2C)C1 ZINC000253635256 FG Annotated Anodyne C[C@@H]1CCC(=NNc2cccc3ccccc23)c2ncc(C(=O)O)c(=O)n21 ZINC000253636589 FG Annotated Mild C[C@H]1CCC(=NNc2cccc3ccccc23)c2ncc(C(=O)O)c(=O)n21 ZINC000253636590 FG Annotated Mild C[C@@H]1CCC(=NNc2ccc3ccccc3c2)c2ncc(C(=O)O)c(=O)n21 ZINC000253636810 FG Annotated Mild C[C@H]1CCC(=NNc2ccc3ccccc3c2)c2ncc(C(=O)O)c(=O)n21 ZINC000253636813 FG Annotated Mild Cc1cc(C)c(NN=C2CC[C@@H](C)n3c2ncc(C(=O)O)c3=O)c(C)c1 ZINC000253636940 FG Annotated Mild Cc1cc(C)c(NN=C2CC[C@H](C)n3c2ncc(C(=O)O)c3=O)c(C)c1 ZINC000253636941 FG Annotated Mild O=C(N[C@@H]1CC[C@@H](c2ccc(O)cc2)CC1)[C@H]1Cc2ccccc2CN1 ZINC000253656688 FG Annotated Anodyne O=C(N[C@@H]1CC[C@@H](c2ccc(O)cc2)CC1)[C@@H]1Cc2ccccc2CN1 ZINC000253656693 FG Annotated Anodyne CC(C)OC(=O)[C@@H]1O[C@H](CCCCOCc2ccccc2)[C@H](C)[C@@H]2O[C@H]21 ZINC000253673051 FG Annotated Anodyne CC(C)OC(=O)[C@@H]1O[C@H](CCCCOCc2ccccc2)[C@H](C)[C@@H]2O[C@@H]21 ZINC000253673054 FG Annotated Anodyne CC(C)OC(=O)[C@@H]1O[C@H](CCCCOCc2ccccc2)[C@H](C)[C@H]2O[C@@H]12 ZINC000253673060 FG Annotated Anodyne CC(C)OC(=O)[C@@H]1O[C@H](CCCCOCc2ccccc2)[C@H](C)[C@H]2O[C@H]12 ZINC000253673064 FG Annotated Anodyne CCOC(=O)c1c(N=Cc2cccc(OC)c2O)sc2c1CCN(C)C2 ZINC000253679128 FG Annotated Mild Cc1cccc(Nc2nc3nonc3[nH]c2=NN=Cc2cccs2)c1C ZINC000253683643 FG Annotated Mild O=C(COc1cccc(Br)c1)NN=Cc1ccccc1F ZINC000253685681 FG Annotated Reactive CCN(CC)CCO[C@@H]1CC[C@@H]([C@@H]2CC[C@@](O)(CC(=O)O)CC2)CC1 ZINC000253690911 FG Annotated Anodyne Cc1cccc(Cl)c1NN=C1CC[C@H](C)n2c1ncc(C(=O)O)c2=O ZINC000253691345 FG Annotated Mild Cc1cccc(Cl)c1NN=C1CC[C@@H](C)n2c1ncc(C(=O)O)c2=O ZINC000253691350 FG Annotated Mild C[C@H](C(=O)NCC(=O)O)c1ccc2c(c1)SC[C@@H]1CCCC[C@H]1C2=O ZINC000253693688 FG Annotated Anodyne Cc1cn([C@@H]2O[C@H](COCc3ccccc3)[C@H](F)[C@H]2F)c(O)nc1=S ZINC000253708562 FG Annotated Anodyne Cc1cn([C@@H]2O[C@H](COCc3ccccc3)[C@@H](F)[C@H]2F)c(O)nc1=S ZINC000253708566 FG Annotated Anodyne Cc1cn([C@@H]2O[C@H](COCc3ccccc3)[C@H](F)[C@@H]2F)c(O)nc1=S ZINC000253708568 FG Annotated Anodyne Oc1c2c(nn1-c1ccc(Cl)cc1)[C@@H]1CN(CC3CC3)CC[C@H]1N=C2 ZINC000253756735 FG Annotated Anodyne CCCCCCC/C=C/C(=O)N1[C@H](CC(C)C)C(=O)[C@@H]([C@H](C)O)[C@H]1O ZINC000253761202 FG Annotated Mild CCCCCCC/C=C/C(=O)N1[C@H](CC(C)C)C(=O)[C@H]([C@H](C)O)[C@H]1O ZINC000253761208 FG Annotated Mild CC(=O)SC[C@@H](C)C(=O)N(CC(=O)O)C[C@H]1C[C@H]2C[C@@H]([C@H]1C)C2(C)C ZINC000253791498 FG Annotated Anodyne C[C@H](O)[C@H](C)C(=O)c1c(O)c2c(c3c1OC(=O)C[C@H]3C)OC(C)(C)C=C2 ZINC000253798652 FG Annotated Anodyne C/C=C1/C[N@+]2([O-])[C@H]3C[C@H]1[C@H]1[C@H](OC(C)=O)[C@@]4(C[C@@H]12)C3=Nc1ccccc14 ZINC000253809653 FG Annotated Bother C/C=C1/C[N@+]2([O-])[C@H]3C[C@H]1[C@H]1[C@@H]2C[C@@]2(C3=Nc3ccccc32)[C@@H]1OC(C)=O ZINC000253809656 FG Annotated Bother C/C=C1/C[N@+]2([O-])[C@H]3C[C@H]1[C@@H]1[C@H](OC(C)=O)[C@@]4(C[C@@H]12)C3=Nc1ccccc14 ZINC000253809660 FG Annotated Bother C/C=C1/C[N@+]2([O-])[C@H]3C[C@H]1[C@@H]1[C@@H]2C[C@@]2(C3=Nc3ccccc32)[C@@H]1OC(C)=O ZINC000253809665 FG Annotated Bother CC(=O)O[C@@]1(C)CC[C@H]2C[C@H]1OO[C@@]2(C)C[S@](=O)c1ccccc1 ZINC000253852952 FG Annotated Reactive CC(=O)O[C@]1(C)CC[C@H]2C[C@H]1OO[C@@]2(C)C[S@](=O)c1ccccc1 ZINC000253852956 FG Annotated Reactive CC(=O)O[C@]1(C)CC[C@H]2C[C@H]1OO[C@@]2(C)C[S@@](=O)c1ccccc1 ZINC000253852959 FG Annotated Reactive CC(=O)O[C@@]1(C)CC[C@H]2C[C@H]1OO[C@@]2(C)C[S@@](=O)c1ccccc1 ZINC000253852961 FG Annotated Reactive C[C@H]1Nc2ccccc2N1C[C@H](CCc1ccccc1)OS(=O)(=O)O ZINC000253853799 FG Annotated Anodyne C[C@@H]1Nc2ccccc2N1C[C@H](CCc1ccccc1)OS(=O)(=O)O ZINC000253853803 FG Annotated Anodyne COc1ccc([C@@H]2c3c(ccc4ccccc34)O[C@@H]3N=CNC(=O)[C@H]32)cc1 ZINC000253883953 FG Annotated Anodyne CC(C)n1c(O)c(N=NC(=O)CNC(=O)c2cccnc2)c2ccccc21 ZINC000253915984 FG Annotated Clean COc1ccc([C@@H]2c3c(ccc4ccccc34)O[C@H]3NC(=O)N=C(N)[C@H]32)cc1 ZINC000253917055 FG Annotated Anodyne COc1ccc([C@@H]2c3ccc4ccccc4c3O[C@H]3NC(=O)N=C(N)[C@H]32)cc1 ZINC000253917786 FG Annotated Anodyne CC(=O)SC[C@H](C)C(=O)N(CC(=O)O)C[C@@H]1C[C@H]2C[C@@H]([C@H]1C)C2(C)C ZINC000253918454 FG Annotated Anodyne CC(=O)SC[C@H](C)C(=O)N(CC(=O)O)C[C@@H]1C[C@H]2C[C@@H]([C@@H]1C)C2(C)C ZINC000253918458 FG Annotated Anodyne COc1ccc([C@@H]2c3ccc4ccccc4c3O[C@@H]3N=CNC(=O)[C@H]32)cc1 ZINC000253918654 FG Annotated Anodyne COc1cc(N=Nc2cccc(S(N)(=O)=O)c2)c2ccccc2c1N ZINC000253921175 FG Annotated Clean CCOC(=O)OC[C@@H]1O[C@H](c2ccccc2)C=C[C@H]1OC(=O)OCC ZINC000253928516 FG Annotated Anodyne CCN1CCC[C@H]1CN[C@@H]1c2cc(OC)ccc2OCc2ncccc21 ZINC000253929986 FG Annotated Anodyne COC(=O)/C=C1/CN2[C@H]3CC[C@H]2[C@H]1[C@@H](c1ccc(Br)cc1)C3 ZINC000253952366 FG Annotated Anodyne COC(=O)/C=C1/CN2[C@H]3CC[C@H]2[C@H]1[C@H](c1ccc(Br)cc1)C3 ZINC000253952370 FG Annotated Anodyne C[C@H](C(=O)N=Nc1c(O)[nH]c2ccccc12)n1cnc2ccccc2c1=O ZINC000253961167 FG Annotated Clean C[C@@H](C(=O)N=Nc1c(O)[nH]c2ccccc12)n1cnc2ccccc2c1=O ZINC000253961171 FG Annotated Clean C=CCn1c(O)c(N=NC(=O)CNC(=O)c2ccco2)c2ccccc21 ZINC000253966568 FG Annotated Mild CCOc1cccc(C=NN=C(S)Nc2ccccc2[N+](=O)[O-])c1O ZINC000253966726 FG Annotated Mild Cc1cc(F)ccc1O[C@@H]1C=C[C@@H](c2ccc3c(c2)OCO3)O[C@H]1CO ZINC000253977241 FG Annotated Anodyne Cc1cc(F)ccc1O[C@@H]1C=C[C@H](c2ccc3c(c2)OCO3)O[C@H]1CO ZINC000253977250 FG Annotated Anodyne CCOC(=O)OC[C@@H]1O[C@H](C#CC(C)(C)C)C=C[C@H]1OC(=O)OCC ZINC000253977862 FG Annotated Mild CCCn1c(O)c(N=NC(=O)CNC(=O)c2ccncc2)c2ccccc21 ZINC000253979183 FG Annotated Clean CCn1c(O)c(N=NC(=O)CNC(=O)/C=C/c2ccco2)c2ccccc21 ZINC000253979225 FG Annotated Clean COc1ccc(O[C@@H]2[C@@H](O)CO[C@H]2/C=C/C#Cc2ccc(F)cc2F)cc1 ZINC000253979263 FG Annotated Mild CC(=O)OC[C@@H]1O[C@H](C#Cc2ccc(C(C)(C)C)cc2)C=C[C@H]1OC(C)=O ZINC000253981730 FG Annotated Mild NC(=S)N=Nc1c(O)n([C@H]2OC(=O)c3ccccc32)c2ccccc12 ZINC000253981810 FG Annotated Clean NC(=S)N=Nc1c(O)n([C@@H]2OC(=O)c3ccccc32)c2ccccc12 ZINC000253981811 FG Annotated Clean COc1ccc(O[C@@H]2C=C[C@@H](C#Cc3ccc(F)cc3F)O[C@H]2CO)cc1 ZINC000253982989 FG Annotated Mild COc1ccc(O[C@@H]2C=C[C@H](C#Cc3ccc(F)cc3F)O[C@H]2CO)cc1 ZINC000253982991 FG Annotated Mild Oc1[nH]c2ccc(Br)cc2c1N=NC(=S)N1CCOCC1 ZINC000253989112 FG Annotated Clean C[C@H]1C=CCC(=O)NCc2cccc(c2)CNC(=O)N[C@H]1c1ccccc1 ZINC000253993180 FG Annotated Anodyne aggregator CCCn1c(O)c(N=NC(=O)CNC(=O)c2cccnc2)c2ccccc21 ZINC000253994987 FG Annotated Clean CCn1c(O)c(N=NC(=O)CNC(=O)Cc2ccccc2)c2ccccc21 ZINC000253995128 FG Annotated Clean Cc1cc(C(=O)NN=Cc2ccc(OC(=O)c3ccco3)cc2)c(C)o1 ZINC000254005369 FG Annotated Reactive COC(=O)[C@]12Cc3ccccc3[C@@H]1C[C@H](C)[C@H](C)N2C(=O)C(F)(F)F ZINC000254014521 FG Annotated Anodyne COC(=O)[C@]12Cc3ccccc3[C@@H]1C[C@@H](C)[C@H](C)N2C(=O)C(F)(F)F ZINC000254014527 FG Annotated Anodyne CN(C(=O)c1ccno1)[C@@H]1CC[C@@H]([C@H](N)Cc2cc(F)ccc2F)CC1 ZINC000254016281 FG Annotated Anodyne CCCCC(=O)NS(=O)(=O)c1ccc(N=NN2CCCCC2)cc1 ZINC000254017640 FG Annotated Clean COc1ccc(O[C@@H]2C=C[C@H](c3ccccc3)O[C@H]2CO)c(C(C)=O)c1 ZINC000254036039 FG Annotated Anodyne COc1ccc(O[C@@H]2C=C[C@@H](c3ccccc3)O[C@H]2CO)c(C(C)=O)c1 ZINC000254036043 FG Annotated Anodyne COc1cc(CO[C@@H]2C=C[C@@H](c3ccccc3)O[C@H]2CO)cc(OC)c1 ZINC000254042287 FG Annotated Anodyne COc1cc(CO[C@@H]2C=C[C@H](c3ccccc3)O[C@H]2CO)cc(OC)c1 ZINC000254042291 FG Annotated Anodyne CC(=NNC(=S)N1CCN(C2CCCCCC2)CC1)c1ccccn1 ZINC000254047424 FG Annotated Mild CC(C)=CCN1CCN(Cc2c[nH]nc2C2CCCCC2)C[C@H]1CCO ZINC000254047462 FG Annotated Anodyne CC(=O)[C@@H]1CC[C@@H]2[C@H]3C[C@H](C)[C@@]4(O)CC(=O)CC[C@]4(C)[C@@H]3[C@H](O)C[C@@]12C ZINC000254047919 FG Annotated Anodyne CC(=O)[C@@H]1CC[C@@H]2[C@H]3C[C@H](C)[C@@]4(O)CC(=O)CC[C@]4(C)[C@@H]3[C@H](O)C[C@]12C ZINC000254047924 FG Annotated Anodyne CC(=O)[C@@H]1CC[C@@H]2[C@H]3C[C@H](C)[C@@]4(O)CC(=O)CC[C@]4(C)[C@@H]3[C@@H](O)C[C@]12C ZINC000254047928 FG Annotated Anodyne CCOC(=O)Nc1ccc2c(c1)C(=NNC(=S)NC)c1ccccc1-2 ZINC000254103517 FG Annotated Mild CCOC(=O)C(C(=O)OCC)[C@@H]1C=CC[C@@H]2c3ccccc3COC[C@H]21 ZINC000254130887 FG Annotated Anodyne C[C@@H]1CC[C@@H]([C@](C)(NC(=O)c2ccsc2)c2cn(CC#N)nn2)CC1 ZINC000254132326 FG Annotated Mild O=C1CSC(=S)N1N=Cc1c[nH]c2ccc(Br)cc12 ZINC000254134041 FG Annotated Mild COc1ccc([C@@H](C2=C(O)C[C@H](C)OC2=O)C2=C(O)C[C@@H](C)OC2=O)cc1 ZINC000254239085 FG Annotated Anodyne Cc1cc([C@]23O[C@@H]4COC(C)(C)O[C@@H]4[C@H]2OC(C)(C)O3)nc2ccccc12 ZINC000254240962 FG Annotated Anodyne Cc1cc([C@]23O[C@@H]4COC(C)(C)O[C@H]4[C@H]2OC(C)(C)O3)nc2ccccc12 ZINC000254240963 FG Annotated Anodyne C=CCn1c(=NC(=O)c2ccco2)sc2cc(C(=O)OCC)ccc21 ZINC000254308124 FG Annotated Mild COc1ccc(C(=O)N=c2sc3c(C)ccc(OC)c3n2C)cc1OC ZINC000254397622 FG Annotated Anodyne CC(C)n1c(=NC(=O)c2ccco2)c(C#N)cc2c(=O)n3ccccc3cc21 ZINC000254399414 FG Annotated Mild aggregator CCN(CC)S(=O)(=O)c1cccc(N=Nc2sc(N)nc2C)c1 ZINC000254404672 FG Annotated Clean CCOC(=O)c1sc(=NC(=O)c2ccc(OC(C)C)cc2)n(C)c1C ZINC000254480523 FG Annotated Anodyne Cn1c(=NC(=O)c2cc(=O)c3ccccc3o2)sc2cccc(F)c21 ZINC000254489048 FG Annotated Anodyne CCOC(=O)c1sc(=NC(=O)CCSc2ccccc2)n(C)c1C ZINC000254508564 FG Annotated Anodyne COC(=O)c1cc(=O)n(-c2ccc(F)cc2)c(=Nc2ccc(F)cc2)s1 ZINC000254559496 FG Annotated Anodyne O=C(NN=C/C=C/c1ccc(Br)cc1)[C@H](O)c1ccccc1 ZINC000254633007 FG Annotated Reactive aggregator O=C(NN=C/C=C/c1ccc(Br)cc1)[C@@H](O)c1ccccc1 ZINC000254633013 FG Annotated Reactive aggregator O=C(CN1CCCc2ccccc21)NN=Cc1c(O)ccc2ccccc12 ZINC000254698565 FG Annotated Reactive aggregator CC(=NNS(=O)(=O)c1cccc([N+](=O)[O-])c1)c1cc2ccccc2o1 ZINC000254712793 FG Annotated Mild aggregator CN(C)c1ccc(C=Nn2c(COc3ccccc3)n[nH]c2=S)cc1 ZINC000254740689 FG Annotated Mild aggregator COc1cc(OC)cc(C(=O)N=c2sc3c(C)ccc(OC)c3n2C)c1 ZINC000254748688 FG Annotated Anodyne O=C(Nc1ccc(F)cc1)[C@H]1CC(O)=N/C(=N\N=Cc2ccco2)S1 ZINC000254808420 FG Annotated Mild aggregator O=C(Nc1ccc(F)cc1)[C@@H]1CC(O)=N/C(=N\N=Cc2ccco2)S1 ZINC000254808422 FG Annotated Mild aggregator COC(=O)c1cc(=O)n(Cc2cccs2)c(=Nc2ccccc2)s1 ZINC000254834048 FG Annotated Anodyne Cc1ccc(NC(=O)[C@@H]2CC(O)=N/C(=N/N=Cc3ccco3)S2)cc1 ZINC000254875691 FG Annotated Mild aggregator Cc1ccc(NC(=O)[C@H]2CC(O)=N/C(=N/N=Cc3ccco3)S2)cc1 ZINC000254875692 FG Annotated Mild aggregator COc1ccnc2c1[C@H](SCCN1CCOCC1)c1ccccc1O2 ZINC000025969133 FG Annotated Anodyne COc1ccnc2c1[C@@H](SCCN1CCOCC1)c1ccccc1O2 ZINC000025969141 FG Annotated Anodyne COc1cnc2c(c1)[C@H](SCCN1CCOCC1)c1ccccc1O2 ZINC000025970394 FG Annotated Anodyne COc1cnc2c(c1)[C@@H](SCCN1CCOCC1)c1ccccc1O2 ZINC000025970401 FG Annotated Anodyne COC(=O)[C@H]1C[C@@]23[C@H]4[C@H]5CC[C@]2(C)[C@H]2CC[C@@H]6CC[C@@H]1[C@]63O[C@H]2N4C[C@@H]5C ZINC000255201899 FG Annotated Anodyne CC1(C)C(=O)[C@@H](O)C[C@H]2C1=CC[C@@H]1[C@]3(C)CC(=O)C[C@@]3(C)CC(=O)[C@@]21C ZINC000255219386 FG Annotated Anodyne CO[C@@H]1C[C@@H]2[C@@H]3C=CC4=CC(=O)CC[C@]4(C)[C@@H]3C[C@@H](O)[C@]2(C)[C@H]1C(C)=O ZINC000255223372 FG Annotated Mild CC1(C)SC(=Nc2ccccc2)N(S(=O)(=O)c2ccccc2)C1=O ZINC000257173653 FG Annotated Mild Cc1noc(C)c1-c1cccc(C[C@@H]2CCN(Cc3cn(C)cn3)C2)n1 ZINC000257240782 FG Annotated Anodyne Cc1noc(C)c1-c1cccc(C[C@H]2CCN(Cc3cn(C)cn3)C2)n1 ZINC000257240783 FG Annotated Anodyne C[C@@H]1CC2=C(C[C@@H]3[C@](C)(CC[C@@H]4C(C)(C)[C@@H]5O[C@H]5C(=O)[C@]34C)O2)C(=O)O1 ZINC000257371451 FG Annotated Anodyne C[C@@H]1CC2=C(C[C@@H]3[C@](C)(CC[C@@H]4C(C)(C)[C@@H]5O[C@@H]5C(=O)[C@@]34C)O2)C(=O)O1 ZINC000257371452 FG Annotated Anodyne C[C@@H]1CC2=C(C[C@@H]3[C@](C)(CC[C@@H]4C(C)(C)[C@@H]5O[C@@H]5C(=O)[C@]34C)O2)C(=O)O1 ZINC000257371453 FG Annotated Anodyne C[C@@H]1CC2=C(C[C@@H]3[C@](C)(CC[C@@H]4C(C)(C)[C@@H]5O[C@H]5C(=O)[C@@]34C)O2)C(=O)O1 ZINC000257371454 FG Annotated Anodyne C[C@@H]1CC2=C(C[C@@H]3[C@](C)(CC[C@]4(O)C(C)(C)C=CC(=O)[C@]34C)O2)C(=O)O1 ZINC000257371608 FG Annotated Mild C[C@@H]1CC2=C(C[C@@H]3[C@](C)(CC[C@@]4(O)C(C)(C)C=CC(=O)[C@@]34C)O2)C(=O)O1 ZINC000257371609 FG Annotated Mild C[C@@H]1CC2=C(C[C@@H]3[C@](C)(CC[C@]4(O)C(C)(C)C=CC(=O)[C@@]34C)O2)C(=O)O1 ZINC000257371610 FG Annotated Mild C=C1[C@H]2CC[C@@H]3[C@](C)(CC(=O)O)[C@H](C(C)(C)C(=O)O)CC[C@@]3(C2)[C@@H]1O ZINC000257406333 FG Annotated Mild C=C1[C@H]2CC[C@@H]3[C@](C)(CC(=O)O)[C@@H](C(C)(C)C(=O)O)CC[C@@]3(C2)[C@@H]1O ZINC000257406334 FG Annotated Mild C=C1[C@H]2CC[C@@H]3[C@](C)(CC(=O)O)[C@@H](C(C)(C)C(=O)O)CC[C@@]3(C2)[C@H]1O ZINC000257406335 FG Annotated Mild C=C1[C@H]2CC[C@H]3[C@](CC[C@@H](C(C)(C)C(=O)O)[C@@]3(C)CC(=O)O)(C2)[C@H]1O ZINC000257406336 FG Annotated Mild CN1CC[C@]2([C@]34CCN(C)[C@@H]3N(C)c3ccccc34)c3ccccc3N[C@@H]12 ZINC000257428874 FG Annotated Anodyne CN1CC[C@]2([C@]34CCN(C)[C@@H]3N(C)c3ccccc34)c3ccccc3N[C@H]12 ZINC000257428875 FG Annotated Anodyne CN1CC[C@]2([C@]34CCN(C)[C@H]3N(C)c3ccccc34)c3ccccc3N[C@@H]12 ZINC000257428876 FG Annotated Anodyne C=C1CC[C@@H]2C(C)(C)CCC[C@]2(C)[C@@H]1C[C@]12O[C@H]1[C@@H](O)C(CO)=CC2=O ZINC000257504780 FG Annotated Mild C=C1CC[C@@H]2C(C)(C)CCC[C@]2(C)[C@@H]1C[C@]12O[C@@H]1[C@H](O)C(CO)=CC2=O ZINC000257504781 FG Annotated Mild C=C1CC[C@@H]2C(C)(C)CCC[C@]2(C)[C@@H]1C[C@]12O[C@H]1[C@H](O)C(CO)=CC2=O ZINC000257504782 FG Annotated Mild C=C1CC[C@@H]2C(C)(C)CCC[C@]2(C)[C@@H]1C[C@]12O[C@@H]1[C@@H](O)C(CO)=CC2=O ZINC000257504783 FG Annotated Mild c1cc(NC2=NCCN2)ccc1Cc1ccc(OCC2CCOCC2)cc1 ZINC000026004325 FG Annotated Anodyne c1cc(NC2=NCCN2)ccc1Cc1ccc(OC2CCOCC2)cc1 ZINC000026004330 FG Annotated Anodyne [O-][N+]1(Cn2c(SCc3ccccn3)nc3ccccc32)CCOCC1 ZINC000026005855 FG Annotated Bother O=C(OCN1C(=O)C[C@H]1Sc1nc2ccccc2o1)c1ccccc1 ZINC000026009462 FG Annotated Anodyne O=C(OCN1C(=O)C[C@@H]1Sc1nc2ccccc2o1)c1ccccc1 ZINC000026009468 FG Annotated Anodyne COc1ccc2c(c1OC)[C@H](C#N)N1CCc3cc4c(cc3C1=C2)OCO4 ZINC000026024692 FG Annotated Mild COc1ccc2c(c1OC)[C@@H](C#N)N1CCc3cc4c(cc3C1=C2)OCO4 ZINC000026024698 FG Annotated Mild CC1(C)C[C@@H]1C(=O)N/C(=C\CCCCSc1ncccc1O)C(=O)O ZINC000026026312 FG Annotated Anodyne CC1(C)C[C@H]1C(=O)N/C(=C\CCCCSc1ncccc1O)C(=O)O ZINC000026026319 FG Annotated Anodyne CC(C)c1cccc2sc(NC(=O)c3csc(N=C(N)N)n3)nc12 ZINC000026143319 FG Annotated Mild CC(C)c1ccc2nc(NC(=O)c3csc(N=C(N)N)n3)sc2c1 ZINC000026146950 FG Annotated Mild O=C(O)CCCCc1cc(=O)oc2c(CN3CCCCC3)c(O)ccc12 ZINC000026150000 FG Annotated Clean CCOCC[C@H](C(=O)Oc1c(OC)cccc1OC)N1CCCCCC1 ZINC000026155501 FG Annotated Anodyne CCOCC[C@@H](C(=O)Oc1c(OC)cccc1OC)N1CCCCCC1 ZINC000026155510 FG Annotated Anodyne O=S(=O)(O)O[C@@H](COc1nc2ccccc2s1)Cc1ccccc1 ZINC000026160285 FG Annotated Anodyne O=S(=O)(O)O[C@H](COc1nc2ccccc2s1)Cc1ccccc1 ZINC000026160291 FG Annotated Anodyne Cc1cc(NC(=O)[C@@H]2C(=O)N3c4ccc(F)cc4Cc4cccc2c43)no1 ZINC000026161376 FG Annotated Anodyne NC(N)=Nc1ccc(NC(=O)c2cc3cc4ccccc4cc3cc2O)cn1 ZINC000026166326 FG Annotated Mild CSCCNC(=O)[C@@H]1C(=O)N2c3ccccc3CCc3cccc1c32 ZINC000026168118 FG Annotated Anodyne C[C@@H]1Nc2ccccc2N1C[C@@H](CCc1ccccc1)OS(=O)(=O)O ZINC000026168299 FG Annotated Anodyne C[C@H]1Nc2ccccc2N1C[C@@H](CCc1ccccc1)OS(=O)(=O)O ZINC000026168303 FG Annotated Anodyne CC(C)OP(=O)(COCCn1cnc2c(S)ncnc21)OC(C)C ZINC000026175001 FG Annotated Anodyne CCC(=O)N(C)C[C@H](O)c1cccc(OCc2nc3ccccc3n2C)c1 ZINC000026181784 FG Annotated Anodyne C=CCc1c(OC(C)=O)c2cccnc2n(-c2cccc(OC)c2)c1=O ZINC000026185704 FG Annotated Mild O=C(CCCC(=O)Oc1ccc(/C=C/[N+](=O)[O-])cc1)OCc1ccco1 ZINC000026187181 FG Annotated Anodyne O=C(CCCC(=O)Oc1ccc(/C=C/[N+](=O)[O-])cc1)NCc1ccccc1 ZINC000026187598 FG Annotated Anodyne C=CCc1c(OC(C)=O)c2cccnc2n(-c2ccccc2OC)c1=O ZINC000026189879 FG Annotated Mild CCN1CC[C@@H](OC(=O)c2[nH]cc(C(=O)O[C@@H](C)C(C)(C)C)c2C)C1 ZINC000026253553 FG Annotated Anodyne CCN1CC[C@H](OC(=O)c2[nH]cc(C(=O)O[C@@H](C)C(C)(C)C)c2C)C1 ZINC000026253561 FG Annotated Anodyne COc1c(C2([C@H]3COC(=O)C3)SCCCS2)ccc2c1OCO2 ZINC000026255894 FG Annotated Anodyne C=CCc1c(OC(C)=O)c2cc(OC)cnc2n(-c2ccccc2)c1=O ZINC000026257626 FG Annotated Mild C=CCc1c(OC(C)=O)c2cccnc2n(-c2ccc(OC)cc2)c1=O ZINC000026263317 FG Annotated Mild CC(=O)NC[C@H]1CN(c2ccc(/C=C(/F)c3cccnc3)c(F)c2)C(=O)O1 ZINC000026263742 FG Annotated Anodyne Cc1nccn1CCC(C(N)=O)(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000026267358 FG Annotated Anodyne Cc1sc(/C(O)=N/c2nn[nH]n2)c(SC(C)C)c1Br ZINC000026284380 FG Annotated Mild O=C(CCSc1nnc(-c2cccnc2)o1)Nc1ccc([N+](=O)[O-])cc1 ZINC000026368597 FG Annotated Bother N[P@@](=O)(OCc1ccc([N+](=O)[O-])s1)N(CCCl)CCCl ZINC000026379337 FG Annotated Reactive N[P@](=O)(OCc1ccc([N+](=O)[O-])s1)N(CCCl)CCCl ZINC000026379340 FG Annotated Reactive CCOC(=O)n1c2cc(C)ccc2c2oc(C(=O)N3CCOCC3)cc21 ZINC000026379893 FG Annotated Anodyne CC(C)C1=Cc2cc(OCC(=O)O)c(Cl)c(Cl)c2S1(=O)=O ZINC000026380736 FG Annotated Anodyne CCCC1=Cc2cc(OCC(=O)O)c(Cl)c(Cl)c2S1(=O)=O ZINC000026380739 FG Annotated Anodyne CCCOC(=O)n1c2cc(F)ccc2c2oc(C(=O)N3CCOCC3)cc21 ZINC000026381094 FG Annotated Anodyne COc1cc(N)c(/C(N)=N/c2cccc(Br)c2)cc1OC ZINC000026381633 FG Annotated Mild CC(C)OC(=O)n1c2cc(F)ccc2c2oc(C(=O)N3CCOCC3)cc21 ZINC000026382210 FG Annotated Anodyne CC(C)OC(=O)n1c2ccccc2c2oc(C(=O)N3CCOCC3)cc21 ZINC000026384647 FG Annotated Anodyne CCOC(=O)n1c2cc(F)ccc2c2oc(C(=O)N3CCOCC3)cc21 ZINC000026385276 FG Annotated Anodyne COC(=O)n1c2cc(Cl)ccc2c2oc(C(=O)N3CCOCC3)cc21 ZINC000026386209 FG Annotated Anodyne CCCc1nc(-c2ncn3c2CN(C)C(=O)c2c(Cl)cccc2-3)no1 ZINC000026388244 FG Annotated Anodyne CC(C)c1noc(-c2ncn3c2CN(C)C(=O)c2c(Cl)cccc2-3)n1 ZINC000026388255 FG Annotated Anodyne CCCc1noc(-c2ncn3c2CN(C)C(=O)c2c(Cl)cccc2-3)n1 ZINC000026388258 FG Annotated Anodyne COc1cc(/C=N/OCc2ccccc2)c(OC)c2c1C(=O)C=CC2=O ZINC000026397351 FG Annotated Mild CCOCC(CO)(CO)NCc1ccc2ccc3cccc4ccc1c2c34 ZINC000026466392 FG Annotated Bother CC(C)N1C[C@@H]2CC(NC(=O)N3CC(C)(C)c4ccccc43)C[C@H](C1)N2C ZINC000026466403 FG Annotated Anodyne C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(Sc3ccc4ccccc4c3)[C@H](C)[C@H]12 ZINC000026497290 FG Annotated Anodyne CS(=O)(=O)NC(=O)c1cc(Cl)c(OCCC2CCCC2)cc1F ZINC000261072775 FG Annotated Anodyne Cc1cc(N2CC[C@H](N3CCC[C@H]3C)C2)ccc1NC(=O)[C@H]1CCCO1 ZINC000261081132 FG Annotated Anodyne Cc1cc(N2CC[C@H](N3CCC[C@H]3C)C2)ccc1NC(=O)[C@@H]1CCCO1 ZINC000261081133 FG Annotated Anodyne C[C@]12CC[C@@H]3[C@@H]4CCC(=O)C=C4[C@H](CO)C[C@@H]3[C@@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000261084163 FG Annotated Mild C[C@]12CC[C@@H]3[C@@H]4CCC(=O)C=C4[C@H](CO)C[C@@H]3[C@@H]1[C@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000261084167 FG Annotated Mild C[C@]12CC[C@@H]3[C@@H]4CCC(=O)C=C4[C@H](CO)C[C@@H]3[C@@H]1[C@@H]1C[C@H]1[C@@]21CCC(=O)O1 ZINC000261084172 FG Annotated Mild C[C@]12CC[C@@H]3[C@@H]4CCC(=O)C=C4[C@H](CO)C[C@@H]3[C@@H]1[C@H]1C[C@H]1[C@@]21CCC(=O)O1 ZINC000261084176 FG Annotated Mild COc1cc(Oc2ccc(-c3c(C)c(O)nc(=O)n3C)c(C)c2)ncc1C ZINC000261096458 FG Annotated Anodyne Cc1cc(NC(=O)[C@@H]2CCCO2)ccc1N1CC[C@H](N2CCC[C@H]2C)C1 ZINC000261102316 FG Annotated Anodyne Cc1cc(NC(=O)[C@@H]2CCCO2)ccc1N1CC[C@@H](N2CCC[C@H]2C)C1 ZINC000261102317 FG Annotated Anodyne CS(=O)(=O)NC(=O)c1cc(Cl)c(COC2CCCCC2)cc1F ZINC000261109304 FG Annotated Anodyne COC[C@@H](NC(=O)Nc1cc2[nH]nc(C(F)F)c2cn1)c1ccccc1 ZINC000261115657 FG Annotated Anodyne COc1cc(Oc2ccc(-c3c(C)c(O)nc(=O)n3C)c(C)c2)ncc1F ZINC000261115818 FG Annotated Anodyne C[C@]12CC[C@@H]3[C@H]4CCC(=O)C=C4[C@H](CO)C[C@H]3[C@@H]1CC[C@@]21C=CC(=O)O1 ZINC000261117243 FG Annotated Mild Fc1ccc(/C=C2\CNC[C@@H]3[C@@H]2NC(=S)N[C@H]3c2ccc(F)cc2)cc1 ZINC000261117900 FG Annotated Anodyne C[C@@H]1CN(C(=O)N=C(N)N)Cc2c(-c3c(F)cccc3F)ccc(F)c21 ZINC000261121413 FG Annotated Mild C[C@H]1CN(C(=O)N=C(N)N)Cc2c(-c3c(F)cccc3F)ccc(F)c21 ZINC000261121415 FG Annotated Mild CCCNC(=O)c1c(NC(=O)[C@H]2C[C@H]3CC[C@H]2C3)sc2c1CCOC2 ZINC000261126916 FG Annotated Anodyne CCCNC(=O)c1c(NC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)sc2c1CCOC2 ZINC000261126917 FG Annotated Anodyne CC(C)[C@@H](CO)NCc1nc(CCc2ccc(F)c(F)c2)ccc1F ZINC000261128456 FG Annotated Anodyne Cn1c(CN2C[C@@H]3[C@H](COc4ccc(Cl)cn4)[C@@H]3C2)nc2ccccc21 ZINC000261141632 FG Annotated Anodyne Cn1c(CN2C[C@@H]3[C@@H](COc4ccc(Cl)cn4)[C@@H]3C2)nc2ccccc21 ZINC000261141633 FG Annotated Anodyne O=C(NCc1ccno1)Nc1cc2[nH]nc(-c3ccc(F)cc3)c2cn1 ZINC000261145870 FG Annotated Anodyne Cc1nnc(-c2n[nH]c3cc(NC(=O)N[C@H](C)c4ccccc4)ncc23)o1 ZINC000261152300 FG Annotated Anodyne C[C@H]1CC(c2n[nH]c3cc(NC(=O)N[C@H](C)c4ccccc4)ncc23)=NO1 ZINC000261164416 FG Annotated Anodyne C[C@@H]1CC(c2n[nH]c3cc(NC(=O)N[C@H](C)c4ccccc4)ncc23)=NO1 ZINC000261164417 FG Annotated Anodyne C[C@@]12CC3CC(C(=O)NNc4nc(Cl)nc5nc[nH]c45)(C1)C[C@](C)(C3)C2 ZINC000261164525 FG Annotated Reactive COC[C@@H](NC(=O)Nc1cc2[nH]nc(C3CC3)c2cn1)c1ccccc1 ZINC000261174317 FG Annotated Anodyne O=C(NCC[C@@H]1CCOC1)Nc1cc2[nH]nc(-c3ccc(F)cc3)c2cn1 ZINC000261178030 FG Annotated Anodyne O=C(NCC[C@H]1CCOC1)Nc1cc2[nH]nc(-c3ccc(F)cc3)c2cn1 ZINC000261178031 FG Annotated Anodyne C[C@@H](NC(=O)Nc1cc2[nH]nc(-c3ccn(C)n3)c2cn1)c1ccccc1 ZINC000261179743 FG Annotated Anodyne COC(=O)c1cccnc1Oc1ccc(-c2c(C)n[nH]c(=O)c2C)c(C)c1 ZINC000261181045 FG Annotated Anodyne Cc1cc(Oc2nccc(C)c2F)ccc1-c1c(C)c(O)nc(=O)n1C ZINC000261183563 FG Annotated Anodyne Cc1cc(NC(=O)C2CCOCC2)ccc1N1CC[C@H](N2CCC[C@H]2C)C1 ZINC000261184519 FG Annotated Anodyne Cc1ccc(/C=C2\CNC[C@@H]3[C@@H]2NC(=S)N[C@H]3c2ccc(C)cc2)cc1 ZINC000261189608 FG Annotated Anodyne [C-]#[N+][C@H]1CCCC[C@@H]1n1cc(C(N)=O)c(Nc2ccc(/C=N/OC)cc2)n1 ZINC000261191104 FG Annotated Reactive CCCc1ccc(S(=O)(=O)N2C[C@H]3C(c4ccccc4)=NO[C@H]3C2)cc1 ZINC000263590341 FG Annotated Anodyne CCCc1ccc(S(=O)(=O)N2C[C@@H]3ON=C(c4ccccc4)[C@H]3C2)cc1 ZINC000263590342 FG Annotated Anodyne CC(C)c1ccc(S(=O)(=O)N2C[C@H]3C(c4ccccc4)=NO[C@H]3C2)cc1 ZINC000263590406 FG Annotated Anodyne CC(C)c1ccc(S(=O)(=O)N2C[C@@H]3ON=C(c4ccccc4)[C@H]3C2)cc1 ZINC000263590407 FG Annotated Anodyne NC(=S)NN=C1c2cc(Cl)ccc2-c2c1cc(Cl)cc2[N+](=O)[O-] ZINC000263591229 FG Annotated Mild Cc1ccc(N=C2SCCCN2C(=O)C2=COCCO2)cc1Cl ZINC000263591678 FG Annotated Mild COc1ccc(N=C2SCC(c3ccc(C)cc3)=NN2CCO)cc1 ZINC000263591785 FG Annotated Mild CC(=O)ON/C=C1\C(=O)N2C=CC=C(C)C2=NC1=Nc1cccc(Cl)c1 ZINC000263591805 FG Annotated Mild C=CCNC(=O)[C@@H]1C[C@H]2Cn3c(nc4cc(Cl)c(Cl)cc43)[C@H]2N1C ZINC000263591864 FG Annotated Mild C=CCNC(=O)[C@@H]1C[C@@H]2Cn3c(nc4cc(Cl)c(Cl)cc43)[C@H]2N1C ZINC000263591865 FG Annotated Mild CN1[C@H](C(=O)NCC2CC2)C[C@@H]2Cn3c(nc4cc5ccccc5cc43)[C@H]21 ZINC000263591881 FG Annotated Anodyne CN1[C@H](C(=O)NCC2CC2)C[C@H]2Cn3c(nc4cc5ccccc5cc43)[C@H]21 ZINC000263591882 FG Annotated Anodyne Cc1ccc(N=c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)n2O)cc1C ZINC000263592008 FG Annotated Bother Cc1cc(C)cc(N=c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)n2O)c1 ZINC000263592024 FG Annotated Bother CCc1cccc(N=c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)n2O)c1 ZINC000263592112 FG Annotated Bother CCN=c1scc(-c2cccs2)n1N/C=C1\C=C(OC)C=CC1=O ZINC000263592194 FG Annotated Mild Cc1cc(C)cc(N=c2c([N+](=O)[O-])nn(-c3cccc(Cl)c3)n2O)c1 ZINC000263592275 FG Annotated Bother Cc1cc2ccnc(N[C@@H]3CCNC[C@H]3OCC3CCCCC3)c2nc1O ZINC000263620370 FG Annotated Anodyne Cc1cc(CNC(=O)c2cc(CSc3nc(C)cc(C)n3)on2)ccn1 ZINC000263620428 FG Annotated Anodyne Cn1nccc1-c1nc(Nc2n[nH]c3ccccc23)c2c(n1)C(C)(C)OC2 ZINC000263620516 FG Annotated Anodyne CC(=O)c1cc(-c2cccc3nccn23)c2cc(N3CCOCC3)ccn12 ZINC000263620687 FG Annotated Anodyne Cc1ccc(Cl)cc1-n1cc(-c2ncnn3cccc23)cc1C(N)=O ZINC000263620690 FG Annotated Anodyne O=C(c1cccc(Cl)c1)[C@H]1CNC[C@@H]1c1ccc2c(O)ncnc2c1 ZINC000263621062 FG Annotated Anodyne COc1ccccc1[C@H]1COC[C@@]2(C1)OCCN[C@H]2c1ccc(F)cc1 ZINC000026500970 FG Annotated Anodyne COc1ccccc1[C@H]1COC[C@]2(C1)OCCN[C@H]2c1ccc(F)cc1 ZINC000026500973 FG Annotated Anodyne C[C@@H](O)[C@H]1C(=O)N2C(C(=O)O)=C(Sc3cccc4ccccc34)[C@H](C)[C@H]12 ZINC000026502202 FG Annotated Anodyne C[C@@H]1OC2(CCN(C)CC2)C/C1=N\NC(=O)Cc1ccc2ccccc2c1 ZINC000026506102 FG Annotated Reactive C[C@H]1OC2(CCN(C)CC2)C/C1=N\NC(=O)Cc1ccc2ccccc2c1 ZINC000026506107 FG Annotated Reactive COc1cccc([C@H]2COC[C@@]3(C2)OCCN[C@H]3c2ccc(F)cc2)c1 ZINC000026568590 FG Annotated Anodyne COc1cccc([C@H]2COC[C@]3(C2)OCCN[C@H]3c2ccc(F)cc2)c1 ZINC000026568593 FG Annotated Anodyne COc1ccc(-c2cc3c(OC)cc(OC)c4c3n(c2=O)CCC4=O)cc1 ZINC000026569474 FG Annotated Anodyne COc1cc(OC)c2cc(-c3ccc(OC(C)=O)cc3)c(=O)n(C)c2c1 ZINC000026572562 FG Annotated Anodyne COc1ccc(-c2cc3c(OC)cc(OC)cc3n(CC#N)c2=O)cc1 ZINC000026575071 FG Annotated Mild COC(=O)[C@@]1(C)CCC[C@@]2(C)[C@@H]1CC[C@H](O)[C@@H]2CCC1=CCOC1=O ZINC000026577376 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@@]2(C)[C@@H]1CC[C@]1(CO1)[C@@H]2CCC1=CCOC1=O ZINC000026578802 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@]2(C)[C@@H](CCC3=CCOC3=O)[C@@H](CO)CC[C@H]12 ZINC000026579279 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@@]2(C)[C@@H]1CCC(=O)[C@@H]2CC[C@@H]1CCOC1=O ZINC000026579407 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@@]2(C)[C@@H]1CCC(=O)[C@@H]2CC[C@H]1CCOC1=O ZINC000026579408 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@]2(C)C(CCC3=CCOC3=O)=C(CO)CC[C@H]12 ZINC000026579548 FG Annotated Anodyne CN(C)c1ccc(NS(=O)(=O)c2c(F)c(F)c(F)c(F)c2F)cc1 ZINC000026580215 FG Annotated Anodyne O=C(O)[C@@H]1Cc2cc([C@@H]3NOc4ccccc43)c(Cl)c(Cl)c2O1 ZINC000026650591 FG Annotated Anodyne O=C(O)[C@H]1Cc2cc([C@@H]3NOc4ccccc43)c(Cl)c(Cl)c2O1 ZINC000026650596 FG Annotated Anodyne O=C(O)[C@@H]1Cc2cc([C@H]3NOc4ccccc43)c(Cl)c(Cl)c2O1 ZINC000026650601 FG Annotated Anodyne O=C(O)[C@H]1Cc2cc([C@H]3NOc4ccccc43)c(Cl)c(Cl)c2O1 ZINC000026650606 FG Annotated Anodyne O=C(O)[C@@H]1Nc2cc(Cl)cc(Cl)c2S(=O)(=O)N1c1ccccc1 ZINC000026656667 FG Annotated Anodyne O=C(O)[C@H]1Nc2cc(Cl)cc(Cl)c2S(=O)(=O)N1c1ccccc1 ZINC000026656672 FG Annotated Anodyne COC1=CC(=O)c2c(c(COC(=O)c3ccccc3)c(C3CC3)n2C)C1=O ZINC000026657647 FG Annotated Mild CC(=O)O[C@H](CCc1c(C)ccc2c1C(=O)C(=O)C(C(C)C)=C2)C(C)(C)O ZINC000026657949 FG Annotated Mild CC(=O)O[C@@H](CCc1c(C)ccc2c1C(=O)C(=O)C(C(C)C)=C2)C(C)(C)O ZINC000026657954 FG Annotated Mild CC1(C)Oc2ccc(Br)cc2C(Oc2ccc(O)nn2)=C1O ZINC000026658833 FG Annotated Anodyne CSCCn1/c(=N/C(C)=O)sc2cc(OC(F)(F)F)ccc21 ZINC000026716710 FG Annotated Anodyne CNC(=O)Oc1ccc2c(c1)[C@@]1(C)CCN(C)[C@@H]1N2Cc1ccccc1 ZINC000026734064 FG Annotated Anodyne COc1ccc(/C=C2\CN(C)C/C(=C\c3ccc(OC)cc3)C2O)cc1 ZINC000026735158 FG Annotated Anodyne CC(C)(C)c1ccccc1-n1c(=O)n(Cc2ccccc2)c(=O)c2[nH]cnc21 ZINC000026738196 FG Annotated Anodyne COc1ccc(/C=C/C(=O)N2C[C@H]3C[C@@]34C2=CC(=O)c2[nH]c(C)cc24)cc1 ZINC000026740083 FG Annotated Mild CC(C)(C)OC(=O)/N=C(/NCCCc1cnc[nH]1)NCC1CCCCC1 ZINC000026741860 FG Annotated Mild O=C(CCN1CCN2Cc3ccccc3C[C@@H]2C1)Nc1ccccc1Cl ZINC000026750816 FG Annotated Anodyne CCc1ccccc1NC(=O)CCN1CCN2Cc3ccccc3C[C@@H]2C1 ZINC000026751809 FG Annotated Anodyne CCC[n+]1ccn(CCC(C(N)=O)(c2ccccc2)c2ccccc2)c1C ZINC000026817792 FG Annotated Anodyne CC[C@@H](OCCCCNCCSS(=O)(=O)O)C1CCCCC1 ZINC000026821307 FG Annotated Reactive CC[C@H](OCCCCNCCSS(=O)(=O)O)C1CCCCC1 ZINC000026821312 FG Annotated Reactive CCCc1n(CCC(C(N)=O)(c2ccccc2)c2ccccc2)cc[n+]1C ZINC000026824021 FG Annotated Anodyne C[C@@H]1CC[C@@H]2[C@@H](C)C(=O)N(Cc3ccccn3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23O4 ZINC000026824032 FG Annotated Anodyne C[C@@H]1CC[C@H]2[C@@H](C)C(=O)N(Cc3ccccn3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23O4 ZINC000026824037 FG Annotated Anodyne C[C@@H]1CC[C@H]2[C@@H](C)C(=O)N(Cc3ccccn3)[C@H]3O[C@@]4(C)CC[C@@H]1[C@@]23O4 ZINC000026824045 FG Annotated Anodyne CN(C)CCN1C(=O)c2cccc3c2c(cc2c([N+](=O)[O-])cccc23)C1=O ZINC000026830242 FG Annotated Bother C[n+]1c(COc2ccc(/C=N/Nc3nccs3)cc2)cn2ccccc21 ZINC000026830303 FG Annotated Mild C/N=C(/N/N=C/c1ccc(-c2cn3ccc(C)cc3[n+]2C)cc1)SC ZINC000026830779 FG Annotated Mild CC(=O)N1CCCN(C(=O)c2cc3c(cn2)sc2ccccc23)CC1 ZINC000026831485 FG Annotated Anodyne COC(=O)c1ccc(N(C)C(=O)c2cnc3c(n2)C(C)(C)CC3(C)C)cc1 ZINC000026832595 FG Annotated Anodyne CCN(CC)CCN[C@H]1c2cc(N(C)C)ccc2OCc2ncccc21 ZINC000026833572 FG Annotated Clean CCN(CC)CCN[C@@H]1c2cc(N(C)C)ccc2OCc2ncccc21 ZINC000026833576 FG Annotated Clean CCN(CC)CCN[C@H]1c2cc(OC)c(OC)cc2OCc2ncccc21 ZINC000026833580 FG Annotated Anodyne CCN(CC)CCN[C@@H]1c2cc(OC)c(OC)cc2OCc2ncccc21 ZINC000026833584 FG Annotated Anodyne C[n+]1c(-c2ccc(/C=C/C=N/NC(=N)N3CCCC3)cc2)cn2ccccc21 ZINC000026835765 FG Annotated Mild COc1ccc(-n2c(-c3cc(OC)c(OC)c(OC)c3)coc2=O)cc1 ZINC000026836505 FG Annotated Anodyne CN(C)CCN1C(=O)c2cccc3c2c(cc2cccc([N+](=O)[O-])c23)C1=O ZINC000026838085 FG Annotated Bother COc1ccc(-c2coc(=O)n2-c2cc(OC)c(OC)c(OC)c2)cc1 ZINC000026838697 FG Annotated Anodyne C[n+]1c(COc2ccc(/C=N/Nc3ccccn3)cc2)cn2ccccc21 ZINC000026839312 FG Annotated Mild CS(=O)(=O)Nc1ccc([C@@H](O)CCCN2CCCCCCC2)cc1 ZINC000026849470 FG Annotated Anodyne CS(=O)(=O)Nc1ccc([C@H](O)CCCN2CCCCCCC2)cc1 ZINC000026849479 FG Annotated Anodyne CCOC(=O)Nc1cc2c(c(N)n1)N=C(COc1ccccc1)[C@H](C)N2 ZINC000026851961 FG Annotated Anodyne COC(=O)/N=c1\[nH]c2cc(Cl)cc3c2n1C[C@@H](C)N(CC=C(C)C)C3 ZINC000026954476 FG Annotated Anodyne CO[C@@]12CCCCC[C@@H]1c1ccccc1/C2=N/OC[C@@H](O)CNC(C)C ZINC000026957819 FG Annotated Mild CO[C@]12CCCCC[C@@H]1c1ccccc1/C2=N/OC[C@@H](O)CNC(C)C ZINC000026957828 FG Annotated Mild CO[C@@]12CCCCC[C@H]1c1ccccc1/C2=N/OC[C@@H](O)CNC(C)C ZINC000026957831 FG Annotated Mild CO[C@]12CCCCC[C@H]1c1ccccc1/C2=N/OC[C@@H](O)CNC(C)C ZINC000026957841 FG Annotated Mild O=C1c2nccc(Cl)c2C(=O)c2c(-c3ccccc3[N+](=O)[O-])ccnc21 ZINC000026959768 FG Annotated Clean CN(C)CCCNc1onc2c1C(=O)/C(=N\c1ccc(F)cc1)C=C2O ZINC000026963509 FG Annotated Mild COc1ccc(C(=O)O)cc1-c1ccc2c(Cl)cnc(N=C(N)N)c2c1 ZINC000026965135 FG Annotated Mild C[C@]12CC[C@@](C)(O)C[C@@H]1CC[C@H]1[C@@H]3CCCN(C(=O)CO)[C@@]3(C)CC[C@H]12 ZINC000026965391 FG Annotated Anodyne C[C@]12CC[C@@](C)(O)C[C@@H]1CC[C@@H]1[C@H]2CC[C@@]2(C)[C@@H]1CCCN2C(=O)CO ZINC000026965400 FG Annotated Anodyne C[C@]12CC[C@@](C)(O)C[C@@H]1CC[C@@H]1[C@@H]2CC[C@@]2(C)[C@@H]1CCCN2C(=O)CO ZINC000026965410 FG Annotated Anodyne Cc1[nH]cnc1Cn1cccc(-c2ccc(Br)s2)c1=O ZINC000026972241 FG Annotated Anodyne CCOC(=O)c1c2c(n(-c3ccccc3)c1C)C(=O)C(C)=C(OC)C2=O ZINC000026982721 FG Annotated Mild CCOC(=O)c1c2c(n(-c3ccc(F)cc3)c1C)C(=O)C=C(OC)C2=O ZINC000026989612 FG Annotated Mild O=C1C(Nc2ccccc2Br)=C(Cl)C(=O)c2ncncc21 ZINC000027073538 FG Annotated Mild O=C1C(Nc2ccc(Br)cc2)=C(Cl)C(=O)c2ncncc21 ZINC000027077364 FG Annotated Mild O=C1c2ccccc2[C@](O)(c2ccc(F)cc2)C2=NC3(CCCC3)CN12 ZINC000027077661 FG Annotated Anodyne O=C1c2ccccc2[C@@](O)(c2ccc(F)cc2)C2=NC3(CCCC3)CN12 ZINC000027077667 FG Annotated Anodyne Oc1c2c(nn1-c1ccc(OC(F)F)cc1)[C@H]1CSCC[C@H]1N=C2 ZINC000027084235 FG Annotated Anodyne Oc1c2c(nn1-c1ccc(OC(F)F)cc1)[C@H]1CSCC[C@@H]1N=C2 ZINC000027084241 FG Annotated Anodyne Oc1c2c(nn1-c1ccc(OC(F)F)cc1)[C@@H]1CSCC[C@H]1N=C2 ZINC000027084247 FG Annotated Anodyne Oc1c2c(nn1-c1ccc(OC(F)F)cc1)[C@@H]1CSCC[C@@H]1N=C2 ZINC000027084254 FG Annotated Anodyne Oc1c2c(nn1-c1ccc(Cl)cc1)[C@H]1CN(CC3CC3)CC[C@H]1N=C2 ZINC000027087242 FG Annotated Anodyne Oc1c2c(nn1-c1ccc(Cl)cc1)[C@H]1CN(CC3CC3)CC[C@@H]1N=C2 ZINC000027087249 FG Annotated Anodyne O=C1CC[C@H]2CN([C@@H]3c4ccc(Cl)cc4CCc4cccnc43)CCN12 ZINC000027092657 FG Annotated Anodyne O=C1CC[C@H]2CN([C@H]3c4ccc(Cl)cc4CCc4cccnc43)CCN12 ZINC000027092664 FG Annotated Anodyne O=C(O)CCCCCC[C@@H]1SCC(=O)N1CCC1(O)CCCCC1 ZINC000027093336 FG Annotated Anodyne O=C(O)CCCCCC[C@H]1SCC(=O)N1CCC1(O)CCCCC1 ZINC000027093340 FG Annotated Anodyne CCNCCn1[nH]c2c3cc(OC)ccc3nc3c([N+](=O)[O-])ccc1c32 ZINC000027093437 FG Annotated Bother Cc1nc2ccc(/C(=N/O)c3ccccc3)cc2n1S(=O)(=O)C(C)C ZINC000027096235 FG Annotated Mild CC(=O)N1CCN([C@@H]2c3ccc(Cl)cc3C=Cc3cccnc32)CC1 ZINC000027099927 FG Annotated Anodyne CC(=O)N1CCN([C@H]2c3ccc(Cl)cc3C=Cc3cccnc32)CC1 ZINC000027099932 FG Annotated Anodyne CN(C)CCn1[nH]c2c3cc(N(C)C)ccc3nc3c([N+](=O)[O-])ccc1c32 ZINC000027101197 FG Annotated Bother O=P(O)(O)[C@H](F)c1ccc2ccc([C@H](F)P(=O)(O)O)cc2c1 ZINC000027103581 FG Annotated Anodyne O=P(O)(O)[C@H](F)c1ccc2ccc([C@@H](F)P(=O)(O)O)cc2c1 ZINC000027103585 FG Annotated Anodyne O=P(O)(O)[C@@H](F)c1ccc2ccc([C@H](F)P(=O)(O)O)cc2c1 ZINC000027103589 FG Annotated Anodyne CN(C)CCCn1[nH]c2c3cc(O)ccc3nc3c([N+](=O)[O-])ccc1c32 ZINC000027105429 FG Annotated Bother CC(=O)N1CCN([C@@H]2c3ccc(Cl)cc3CCc3cccnc32)C[C@@H]1C ZINC000027105755 FG Annotated Anodyne CC(=O)N1CCN([C@H]2c3ccc(Cl)cc3CCc3cccnc32)C[C@@H]1C ZINC000027105758 FG Annotated Anodyne Nc1ccc(/C=C(\C[P@@](=O)(O)[C@@H](N)CC2CCCCC2)C(=O)O)cc1 ZINC000027106489 FG Annotated Anodyne Nc1ccc(/C=C(\C[P@@](=O)(O)[C@H](N)CC2CCCCC2)C(=O)O)cc1 ZINC000027106491 FG Annotated Anodyne CC(=O)Oc1cc2c(c(Cl)c1OC(C)=O)CCNC[C@@H]2c1ccccc1 ZINC000027107607 FG Annotated Anodyne CC(=O)Oc1cc2c(c(Cl)c1OC(C)=O)CCNC[C@H]2c1ccccc1 ZINC000027107610 FG Annotated Anodyne CS[C@@H]1NC(=O)n2cnc(CCCCCOCc3ccccc3)c2N1 ZINC000027108095 FG Annotated Anodyne CS[C@H]1NC(=O)n2cnc(CCCCCOCc3ccccc3)c2N1 ZINC000027108098 FG Annotated Anodyne O=C1C(Br)=C(Nc2ccc(Cl)cc2)C(=O)c2[nH]cnc21 ZINC000027108412 FG Annotated Mild Nc1ccc(/C=C(/C[P@@](=O)(O)[C@@H](N)CC2CCCCC2)C(=O)O)cc1 ZINC000027179313 FG Annotated Anodyne Nc1ccc(/C=C(/C[P@@](=O)(O)[C@H](N)CC2CCCCC2)C(=O)O)cc1 ZINC000027179319 FG Annotated Anodyne CCn1c2c(c3cc(OC)c(OC)cc3c1=O)Cc1cc3c(cc1-2)OCO3 ZINC000027188065 FG Annotated Anodyne Cc1cc(C(=N)N)cn2cc(-c3ccc(-c4ccc(C(=N)N)cc4)o3)nc12 ZINC000027190689 FG Annotated Anodyne CCOC(=O)N1CCN(/C(=N\C2CCCCC2)NC2CCCCC2)CC1 ZINC000027195584 FG Annotated Mild CC(=O)Oc1cccc2c1C(OC(C)=O)c1c(cccc1OC(C)=O)C2 ZINC000027203055 FG Annotated Anodyne CCCC[C@H]1CN(C(=O)c2cccc3ccccc23)CCN1C[C@@H](N)S ZINC000027206978 FG Annotated Mild CN(C)CCNc1ccc2nc3c4c(nccc4c2c1)-c1ncccc1C3=O ZINC000027207028 FG Annotated Bother CCNCCCNCCCCN(CCCCC1CC1)CCCNCC ZINC000027301066 FG Annotated Anodyne Oc1n[nH]c(C(F)(F)F)c1Cc1ccc(I)cc1 ZINC000027306015 FG Annotated Anodyne CCCCN(Cc1ccccc1)C(=O)[C@@H](NC[C@@H](N)CS)[C@H](C)CC ZINC000027315893 FG Annotated Mild COC(=O)CCC(=O)Nc1cccc(OCc2nc3ccccc3o2)c1 ZINC000027326472 FG Annotated Anodyne CN(C)Cc1nnc2n1-c1ccc(Cl)cc1[C@H](c1ccccc1)NC2 ZINC000027329177 FG Annotated Anodyne CN(C)Cc1nnc2n1-c1ccc(Cl)cc1[C@@H](c1ccccc1)NC2 ZINC000027329181 FG Annotated Anodyne CCCC(=O)SC[C@H](CO[P@](=O)(O)OC)SC(=O)CCC ZINC000027330726 FG Annotated Anodyne O=C1c2cc(Br)cc(Br)c2OC[C@H]1n1ccnc1 ZINC000027407048 FG Annotated Anodyne O=C1c2cc(Br)cc(Br)c2OC[C@@H]1n1ccnc1 ZINC000027407051 FG Annotated Anodyne O=C1O[C@@H](COc2ccncc2)CN1c1ccc(C2=CCOCC2)c(F)c1 ZINC000027410397 FG Annotated Anodyne CC(=O)c1ccc(CCCOc2c(C)cc(-c3nnn(C)n3)cc2C)o1 ZINC000027412723 FG Annotated Anodyne O=Cc1cccc(-c2cc(-c3cccc(C=O)c3)c(O)c(=O)c(O)c2O)c1 ZINC000027418364 FG Annotated Anodyne CCCc1cc(CCC)n2nc(S(=O)(=O)Cc3ccc(C)cc3)nc2n1 ZINC000027419873 FG Annotated Anodyne N#CCCCOc1ccc(/C=C2/Oc3c(ccc(O)c3O)C2=O)c(O)c1 ZINC000027420068 FG Annotated Mild Cc1cc(OC[C@H]2CN(c3ccc(C4=CCOCC4)c(F)c3)C(=O)O2)no1 ZINC000027421969 FG Annotated Anodyne O=C1O[C@@H](COc2ccon2)CN1c1ccc(C2=CCOCC2)c(F)c1 ZINC000027422311 FG Annotated Anodyne O=C1O[C@@H](COc2cccnc2)CN1c1ccc(C2=CCOCC2)c(F)c1 ZINC000027423839 FG Annotated Anodyne COCc1ccc(/C(=N\O)c2cccc(NS(=O)(=O)C(C)C)c2)cc1 ZINC000027426810 FG Annotated Mild CCCc1cc(CCC)n2nc(S(=O)(=O)Cc3ccccc3)nc2n1 ZINC000027427271 FG Annotated Anodyne CC1(C)Oc2cc(C(=O)c3ccccc3)sc2[C@@H](N2CCCC2=O)[C@@H]1O ZINC000027440953 FG Annotated Anodyne O=C1C[C@@H](NCCc2ccccc2)C(=O)N1c1ccccc1C(F)(F)F ZINC000027489541 FG Annotated Anodyne COc1ccc([C@@H]2OC(c3ccc(N(C)C)cc3)=NN2C(C)=O)cc1OC ZINC000027517367 FG Annotated Anodyne COc1ccc([C@H]2OC(c3ccc(N(C)C)cc3)=NN2C(C)=O)cc1OC ZINC000027517369 FG Annotated Anodyne COc1cc([C@@H]2CN=C(c3ccc4nc(O)oc4c3)O2)cc(OC)c1OC ZINC000027517651 FG Annotated Anodyne COc1cc([C@H]2CN=C(c3ccc4nc(O)oc4c3)O2)cc(OC)c1OC ZINC000027517652 FG Annotated Anodyne COc1cc([C@@H]2CN=C(c3ccc4c(c3)CCN4C)O2)cc(OC)c1OC ZINC000027518514 FG Annotated Anodyne COc1cc([C@H]2CN=C(c3ccc4c(c3)CCN4C)O2)cc(OC)c1OC ZINC000027518515 FG Annotated Anodyne CCN(CC)CNC[C@@H]1CN=C(c2ccccc2F)c2ccccc2N1C ZINC000027519643 FG Annotated Anodyne CCN(CC)CNC[C@H]1CN=C(c2ccccc2F)c2ccccc2N1C ZINC000027519644 FG Annotated Anodyne CC1=C(C(=O)O)[C@@H](C#Cc2ccccc2)C(C(=O)O)=C(c2ccccc2)N1 ZINC000027519959 FG Annotated Mild CC1=C(C(=O)O)[C@H](C#Cc2ccccc2)C(C(=O)O)=C(c2ccccc2)N1 ZINC000027519961 FG Annotated Mild COc1cc(NC(C)=O)c([N+](=O)[O-])cc1-c1nc(C)c(-c2cccnc2)[nH]1 ZINC000027520806 FG Annotated Bother COc1cc(OC)c(-c2nc(C)c(-c3cccnc3)[nH]2)cc1NC(C)=O ZINC000027522800 FG Annotated Anodyne O=C1c2nccnc2C(=O)c2nc(-c3ccccc3)c(-c3ccccc3)nc21 ZINC000027524602 FG Annotated Clean O=C(O)c1cn2c3c(c(Cl)c(N4CCCC4)cc3c1=O)SCC2 ZINC000027524648 FG Annotated Anodyne COC[C@@](C)(Oc1ccc(CC(=O)Nc2cc(C)cc(C)c2)cc1)C(=O)O ZINC000027525507 FG Annotated Anodyne COC[C@](C)(Oc1ccc(CC(=O)Nc2cc(C)cc(C)c2)cc1)C(=O)O ZINC000027525509 FG Annotated Anodyne O=C(O)c1cn2c3c(cc(N4CCCC4)c(Cl)c3c1=O)SCC2 ZINC000027525634 FG Annotated Anodyne COC(=O)c1cc2c(cc1C(=O)OC)[C@@]1(C)CCC[C@](C)(C(=O)O)[C@H]1C=C2 ZINC000027526090 FG Annotated Anodyne COC(=O)c1cc2c(cc1C(=O)OC)[C@@]1(C)CCC[C@](C)(C(=O)O)[C@@H]1C=C2 ZINC000027526092 FG Annotated Anodyne C[C@@H]1Sc2c(C(=O)O)c(=O)c3cc(F)c(N4CCSCC4)cc3n21 ZINC000027526134 FG Annotated Anodyne C[C@H]1Sc2c(C(=O)O)c(=O)c3cc(F)c(N4CCSCC4)cc3n21 ZINC000027526136 FG Annotated Anodyne O=[N+]([O-])c1ccc2c3c1[nH]c1ccc(O)cc1c3nn2CCN1CCCC1 ZINC000027526230 FG Annotated Bother O=[N+]([O-])c1ccc2c(c1)N[P@](=O)(N(CCCl)CCCl)OC2 ZINC000027526499 FG Annotated Reactive O=[N+]([O-])c1ccc2c(c1)N[P@@](=O)(N(CCCl)CCCl)OC2 ZINC000027526500 FG Annotated Reactive COc1cc2c(c([N+](=O)[O-])c1O)C/C(=C\c1cc(C)c(O)c(C)c1)C2=O ZINC000027526563 FG Annotated Mild CN(C)CCCn1[nH]c2c3ccc(O)cc3nc3c([N+](=O)[O-])ccc1c32 ZINC000027527025 FG Annotated Bother COC1=C(OC)C[C@H]2C(=C1)[C@@H]1c3cc(OC)c(OC)cc3C[C@H]2N(C)[C@H]1C ZINC000027527074 FG Annotated Anodyne Cn1c2ccccc2c(=O)c2ccc3c(c21)[C@H]1OC(=O)O[C@H]1C(C)(C)O3 ZINC000027548785 FG Annotated Bother CC(=O)c1cccc2cc3cccc4c3c(c12)C(=O)N(CCN(C)C)C4=O ZINC000027554200 FG Annotated Bother Cc1csc(-c2ccc3c(c2)[C@H](N2CCCC2=O)[C@H](O)C(C)(C)O3)n1 ZINC000027554953 FG Annotated Anodyne Cc1csc(-c2ccc3c(c2)[C@@H](N2CCCC2=O)[C@H](O)C(C)(C)O3)n1 ZINC000027554955 FG Annotated Anodyne O=C(O)CCN1CCC(=C2c3ccc(F)cc3OCc3ncccc32)CC1 ZINC000027558514 FG Annotated Anodyne O=C(O)CCN1CCC(=C2c3cc(F)ccc3OCc3ncccc32)CC1 ZINC000027558854 FG Annotated Anodyne C[C@@H](C(=O)NCC(=O)O)c1ccc2c(c1)SC[C@H]1CCCC[C@H]1C2=O ZINC000027559092 FG Annotated Anodyne C[C@H](C(=O)NCC(=O)O)c1ccc2c(c1)SC[C@H]1CCCC[C@H]1C2=O ZINC000027559094 FG Annotated Anodyne C[C@@H](C(=O)NCC(=O)O)c1ccc2c(c1)SC[C@H]1CCCC[C@@H]1C2=O ZINC000027559096 FG Annotated Anodyne C[C@H](C(=O)NCC(=O)O)c1ccc2c(c1)SC[C@H]1CCCC[C@@H]1C2=O ZINC000027559098 FG Annotated Anodyne CCC(C)(C)C(=O)OC[C@H]1CCCC[C@@H]1CC[C@@H](O)C[C@@H](O)CC(=O)O ZINC000027560479 FG Annotated Anodyne CCC(C)(C)C(=O)OC[C@H]1CCCC[C@@H]1CC[C@H](O)C[C@@H](O)CC(=O)O ZINC000027560481 FG Annotated Anodyne O=C(O)CCN1CCC(=C2c3ccccc3OCc3ncccc32)CC1 ZINC000027560779 FG Annotated Anodyne Oc1c(CN2CCOCC2)cc(COCc2ccccc2)c2cccnc12 ZINC000027570034 FG Annotated Clean CCN(CC)CCCN1C(=O)C[C@@]2(CCCc3ccc(Cl)cc32)C1=O ZINC000027617826 FG Annotated Anodyne CCN(CC)CCCN1C(=O)C[C@]2(CCCc3ccc(Cl)cc32)C1=O ZINC000027617830 FG Annotated Anodyne CCN(CC)[C@@H](C)CCN1C(=O)C[C@@]2(CCCc3cc(OC)ccc32)C1=O ZINC000027618146 FG Annotated Anodyne CCN(CC)[C@H](C)CCN1C(=O)C[C@@]2(CCCc3cc(OC)ccc32)C1=O ZINC000027618154 FG Annotated Anodyne CCN(CC)[C@H](C)CCN1C(=O)C[C@]2(CCCc3cc(OC)ccc32)C1=O ZINC000027618165 FG Annotated Anodyne C[C@H]1C[C@H](C)[C@H](O)[C@H]([C@@H]2C[C@@H](CC(=O)NCc3ccccc3)CC(=O)O2)C1 ZINC000027624430 FG Annotated Anodyne C[C@H]1C[C@H](C)[C@H](O)[C@@H]([C@@H]2C[C@@H](CC(=O)NCc3ccccc3)CC(=O)O2)C1 ZINC000027624436 FG Annotated Anodyne C[C@H]1C[C@H](C)[C@H](O)[C@H]([C@H]2C[C@@H](CC(=O)NCc3ccccc3)CC(=O)O2)C1 ZINC000027624442 FG Annotated Anodyne C[C@H]1C[C@H](C)[C@H](O)[C@@H]([C@H]2C[C@@H](CC(=O)NCc3ccccc3)CC(=O)O2)C1 ZINC000027624447 FG Annotated Anodyne CN1CCO[C@@](OCCCO[N+](=O)[O-])(c2ccc(-c3ccccc3)cc2)C1 ZINC000027627446 FG Annotated Anodyne N[P@@](=O)(OCCc1noc2ccccc12)N(CCCl)CCCl ZINC000027627573 FG Annotated Reactive N[P@](=O)(OCCc1noc2ccccc12)N(CCCl)CCCl ZINC000027627576 FG Annotated Reactive Cc1sc(/N=C(\N)NCc2ccccc2)nc1-c1ccc(O)c(O)c1 ZINC000027633203 FG Annotated Mild C=C(C)COCn1c(CC2=CC=C[C@@H]3C=CC=C[C@H]23)c(CC)c(=O)[nH]c1=O ZINC000027639362 FG Annotated Mild C=C(C)COCn1c(CC2=CC=C[C@H]3C=CC=C[C@H]23)c(CC)c(=O)[nH]c1=O ZINC000027639368 FG Annotated Mild C=C(C)COCn1c(CC2=CC=C[C@@H]3C=CC=C[C@@H]23)c(CC)c(=O)[nH]c1=O ZINC000027639374 FG Annotated Mild C=C(C)COCn1c(CC2=CC=C[C@H]3C=CC=C[C@@H]23)c(CC)c(=O)[nH]c1=O ZINC000027639380 FG Annotated Mild Cn1cc(C(=O)CCCCOc2ccc(C3=NCCO3)cc2)cc1C=O ZINC000027647778 FG Annotated Anodyne COc1ccc2c3c1O[C@H]1C[C@@H](OC(=O)CC(C)C)C=C[C@@]31CCN(C)C2 ZINC000027648036 FG Annotated Anodyne C=C(C)COCn1c(Cc2cc(C)cc(C)c2)c(C(C)C)c(=O)[nH]c1=O ZINC000027650326 FG Annotated Mild O=C(Nc1ccccc1)Nc1ccc2c(c1)Cc1c-2[nH]c(=O)c2nccn12 ZINC000027651876 FG Annotated Anodyne Cc1nc(C)c(/C=C/[C@@H]2C[C@@H](O)CC(=O)O2)c(-c2ccc(Cl)cc2)n1 ZINC000027655486 FG Annotated Anodyne Cc1nc(C)c(/C=C/[C@H]2C[C@@H](O)CC(=O)O2)c(-c2ccc(Cl)cc2)n1 ZINC000027655489 FG Annotated Anodyne NCc1cc(Cc2cc3c(c(Cl)c2Cl)O[C@H](CO)C3)ccc1O ZINC000027656253 FG Annotated Clean NCc1cc(Cc2cc3c(c(Cl)c2Cl)O[C@@H](CO)C3)ccc1O ZINC000027656255 FG Annotated Clean Cc1c[nH]c2c1[C@]13C[C@H]1CN(C(=O)c1ccc4ccccc4n1)C3=CC2=O ZINC000027657199 FG Annotated Mild Cc1c[nH]c2c1[C@@]13C[C@@H]1CN(C(=O)c1ccc4ccccc4n1)C3=CC2=O ZINC000027657200 FG Annotated Mild Cc1c[nH]c2c1[C@]13C[C@H]1CN(C(=O)c1cc4ccccc4n1C)C3=CC2=O ZINC000027704865 FG Annotated Mild Cc1c[nH]c2c1[C@@]13C[C@@H]1CN(C(=O)c1cc4ccccc4n1C)C3=CC2=O ZINC000027704868 FG Annotated Mild C/N=C1/CCc2c1n(C)c1ccc(OC(=O)NC)c(Br)c21 ZINC000027712237 FG Annotated Mild COc1cc(CN(CCCN)Cc2cc(OC)cc(OC)c2)cc(OC)c1 ZINC000027715273 FG Annotated Anodyne CC/N=C1/CCc2c1n(C)c1ccc(OC(=O)NC)c(Br)c21 ZINC000027718864 FG Annotated Mild CCOC(=O)Nc1cc2c([nH]c(=S)n2/N=C/c2ccccc2)c(N)n1 ZINC000027722292 FG Annotated Mild CC(=O)SC[C@H](C)C(=O)N(CC(=O)O)C[C@H]1C[C@H]2C[C@@H]([C@@H]1C)C2(C)C ZINC000027725109 FG Annotated Anodyne CC(=O)SC[C@@H](C)C(=O)N(CC(=O)O)C[C@H]1C[C@H]2C[C@@H]([C@@H]1C)C2(C)C ZINC000027725116 FG Annotated Anodyne CCCOc1cccc2c(N)c3cccc(C(=O)NCCN(C)C)c3nc12 ZINC000027731001 FG Annotated Clean COc1ccc2c3c(c(=O)oc2c1)CN(CCN1CC2CCC1CC2)CC3 ZINC000027733129 FG Annotated Anodyne N#Cc1ccccc1CN1c2c(sc3ccccc23)C(O)=NS1(=O)=O ZINC000027735405 FG Annotated Mild CCCCc1ccc(N(CC(=O)O)C(=O)[C@@H](C)CSC(C)=O)cc1 ZINC000027735940 FG Annotated Anodyne CCCCc1ccc(N(CC(=O)O)C(=O)[C@H](C)CSC(C)=O)cc1 ZINC000027735947 FG Annotated Anodyne CCCN(CC)[C@@H](C)CN1CCc2c(c(=O)oc3cc(OC)ccc23)C1 ZINC000027738277 FG Annotated Anodyne CCCN(CC)[C@H](C)CN1CCc2c(c(=O)oc3cc(OC)ccc23)C1 ZINC000027738283 FG Annotated Anodyne Nc1nc(O)c(N=O)c(NCCCOc2ccc(C(F)(F)F)cc2)n1 ZINC000027738617 FG Annotated Anodyne O=S(=O)(CC#Cc1cc2ccccc2cc1C#CCO)c1ccccc1 ZINC000027740506 FG Annotated Mild Nc1nc(O)c(N=O)c(NCCCOc2cc(Cl)cc(Cl)c2)n1 ZINC000027740584 FG Annotated Anodyne O=S(=O)(CC#Cc1ccccc1C#CCO)c1ccc2ccccc2c1 ZINC000027746519 FG Annotated Mild COc1cc(C2=C(c3ccc([N+](=O)[O-])cc3)COC2=O)cc(OC)c1OC ZINC000027748355 FG Annotated Bother CCCN(CCC)CCN1CCc2c(c(=O)oc3ccc(OC)cc23)C1 ZINC000027748450 FG Annotated Anodyne CC(=O)Oc1cc(C(=O)[C@H](C)c2ccccc2)cc([N+](=O)[O-])c1OC(C)=O ZINC000027754668 FG Annotated Bother CC(=O)Oc1cc(C(=O)[C@@H](C)c2ccccc2)cc([N+](=O)[O-])c1OC(C)=O ZINC000027754677 FG Annotated Bother N#Cc1ccc(CN2c3c(sc4ccccc34)C(O)=NS2(=O)=O)cc1 ZINC000027758082 FG Annotated Mild O=C1CN=C(c2ccccc2Cl)c2cc(F)ccc2N1C1CCNCC1 ZINC000027761326 FG Annotated Anodyne CN1CCC(N2C(=O)CN=C(c3ccc(F)cc3)c3ccccc32)CC1 ZINC000027769871 FG Annotated Anodyne COc1ccccc1C1=C(c2cc(OC)c(OC)c(OC)c2)C(=O)OC1 ZINC000027846045 FG Annotated Anodyne CN1CCC(N2C(=O)CN=C(c3ccccc3F)c3ccc(F)cc32)CC1 ZINC000027847152 FG Annotated Anodyne CCN1C(=O)c2c(N3CCOCC3)c(-c3ccc(Cl)cc3)cn2C1=O ZINC000027849072 FG Annotated Anodyne CCOC(=O)[C@@](CC)(CCC/C=C/I)C(=O)O ZINC000027854741 FG Annotated Anodyne CCOC(=O)[C@](CC)(CCC/C=C/I)C(=O)O ZINC000027854749 FG Annotated Anodyne COC(=O)c1c(N2CCOCC2)c(-c2ccc(Cl)cc2)cn1C(C)=O ZINC000027854963 FG Annotated Anodyne CN(C)CCNC(=O)c1cccc2nc3ccc4c(C#N)cccc4c3nc12 ZINC000027860819 FG Annotated Mild CSc1cnc(-c2nn(Cc3ccccc3F)c3ncccc23)nc1N ZINC000027872814 FG Annotated Anodyne C[N+]1(CCO[P@](=O)(O)OCCOC2CCCCC2)CCCCC1 ZINC000027874591 FG Annotated Bother N#CCCc1cnc(-c2nn(Cc3ccccc3F)c3ncccc23)nc1N ZINC000027877176 FG Annotated Mild CCN(CC)CCN(C(C)=O)[C@H]1c2ccccc2OCc2ncccc21 ZINC000027877956 FG Annotated Anodyne CCN(CC)CCN(C(C)=O)[C@@H]1c2ccccc2OCc2ncccc21 ZINC000027877962 FG Annotated Anodyne CN(C)Cc1cc(Nc2nncc3ccccc23)cc(CN(C)C)c1O ZINC000027893066 FG Annotated Clean C#C[C@](O)(CC=C(C)C)[C@@H](C)CCC[C@]1(C)OC/C(=C/CO)CC[C@H]1O ZINC000027893463 FG Annotated Mild C#C[C@](O)(CC=C(C)C)[C@H](C)CCC[C@]1(C)OC/C(=C/CO)CC[C@H]1O ZINC000027893465 FG Annotated Mild C#C[C@@](O)(CC=C(C)C)[C@@H](C)CCC[C@]1(C)OC/C(=C/CO)CC[C@H]1O ZINC000027893467 FG Annotated Mild C#C[C@@](O)(CC=C(C)C)[C@H](C)CCC[C@]1(C)OC/C(=C/CO)CC[C@H]1O ZINC000027893470 FG Annotated Mild COc1cc2c(cc1OC)C1=C(c3ccccc3Cl)C(=O)C(=O)N1CC2 ZINC000027899106 FG Annotated Mild O=C(c1ccc(F)cc1)c1c(Br)cc2n1CC[C@H]2C(=O)O ZINC000027899551 FG Annotated Anodyne O=C(c1ccc(F)cc1)c1c(Br)cc2n1CC[C@@H]2C(=O)O ZINC000027899553 FG Annotated Anodyne CCC(=O)N(c1ccccc1)C1(COC)CCN(CCn2cccc2)CC1 ZINC000027900928 FG Annotated Anodyne CC[C@H](c1ccc(O)cc1)[C@@H](C(=O)OCCN1CC1)c1ccc(O)cc1 ZINC000027901500 FG Annotated Anodyne O=C(Oc1cccc(O)c1)c1cc(/N=C/c2cc(O)ccc2O)ccc1O ZINC000027981138 FG Annotated Mild CC(C)SCC[C@@H](N)[C@H](O)C(=O)N(C)Cc1cccc2ccccc12 ZINC000027985440 FG Annotated Anodyne CCCc1c(CNc2ccc(Cc3nnn[nH]3)cc2)ccc(C(C)=O)c1O ZINC000027999583 FG Annotated Anodyne CCCCN/C(=N\c1nnc(-c2ccccc2C)s1)NCCCN(C)C ZINC000028001920 FG Annotated Mild C[C@@H]1CN(C(=O)C2CC2)N=C(c2ccc(N)cc2)c2cc3c(cc21)OCO3 ZINC000028004085 FG Annotated Anodyne C[C@H]1CN(C(=O)C2CC2)N=C(c2ccc(N)cc2)c2cc3c(cc21)OCO3 ZINC000028004090 FG Annotated Anodyne CSc1ccc2c(c1)c(N)c(C(=O)N(C)c1ccccc1)c(=O)n2C ZINC000028004311 FG Annotated Anodyne C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3C[C@@H](C)NC[C@@H]3C)[C@@H]12 ZINC000028004537 FG Annotated Anodyne C[C@H]1CN(CCC[C@@H]2[C@H]3CCCC[C@@H]3C[C@@H]3C(=O)O[C@@H](C)[C@@H]32)[C@@H](C)CN1 ZINC000028004542 FG Annotated Anodyne CCc1cc(NCC(=O)Nc2c(O)cc(Cl)cc2Cl)c(=O)[nH]c1C ZINC000028007921 FG Annotated Anodyne CCOC(=O)N1COCc2c1ccc1cc3ccc(NC)c(CO)c3nc21 ZINC000028008259 FG Annotated Bother Oc1nnc(-c2ccccc2)c2nc(Br)c(Br)n12 ZINC000028014241 FG Annotated Anodyne CN(C1=NC(C)(C)CN1)c1nnc(-c2ccccc2C(F)(F)F)s1 ZINC000028014635 FG Annotated Anodyne CCc1cc(OCC(=O)Nc2c(O)cc(Cl)cc2Cl)c(=O)[nH]c1C ZINC000028019825 FG Annotated Anodyne FC(F)(F)C(F)(F)C(F)(F)CNc1ccc(Cc2nnn[nH]2)cc1 ZINC000028086771 FG Annotated Mild COc1ccc2c(OC(C)C)c(/C(O)=N/c3nn[nH]n3)sc2c1Cl ZINC000028093102 FG Annotated Mild CC(=O)N1Cc2c(ccc(Cl)c2-c2ccccc2)N2CCN(C)C[C@H]2C1 ZINC000028095685 FG Annotated Anodyne CN1CCN(c2ccc(-c3nc4cc(N=C=S)ccc4o3)cn2)CC1 ZINC000028100393 FG Annotated Reactive Cc1nn(C)c2c1C(c1cccc(Cl)c1)=NCCN2CCN1CCCC1 ZINC000028101485 FG Annotated Anodyne CN(C)CCCCCNCc1ccc2c(n1)N(C)c1ncccc1N2C ZINC000028104363 FG Annotated Anodyne CN(Cc1ccccc1)c1nc(=O)nc(Nc2ccc3scnc3c2)[nH]1 ZINC000028106485 FG Annotated Anodyne COCCCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cc(C)cc(C)c1 ZINC000028108805 FG Annotated Anodyne CCN(CC)CC#CCN1C(=O)CC2(C1=O)c1ccccc1-c1ccccc12 ZINC000028110836 FG Annotated Mild CCc1c(Sc2ccccc2)n(COCc2cccs2)c(=O)[nH]c1=O ZINC000028111907 FG Annotated Anodyne COc1ccc(-c2c3c(cc4ccc5c(c24)OCO5)C(=O)NC3)cc1OC ZINC000028112491 FG Annotated Anodyne CC(C)OC(=O)c1c(C=O)n(S(=O)(=O)c2ccccc2)c2ccccc12 ZINC000028117991 FG Annotated Anodyne Cc1c(Sc2ccccc2)n(COCc2cccs2)c(=O)[nH]c1=O ZINC000028124398 FG Annotated Anodyne Nc1ccc(S(=O)(=O)n2cc(C3CCNCC3)c3cc(F)ccc32)cc1 ZINC000028129783 FG Annotated Anodyne O=S(=O)(c1ccccc1F)n1cc(C2=CCNCC2)c2ccccc21 ZINC000028130465 FG Annotated Anodyne CCc1c(Sc2ccccc2)n(COCc2ccco2)c(=O)[nH]c1=O ZINC000028130556 FG Annotated Anodyne N#CCCN(C(=O)CNC(=O)c1cc2cc(Cl)ccc2[nH]1)C1CCCC1 ZINC000028138173 FG Annotated Mild CCCCn1cnc2c1C(=O)N1CCN=C1N2Cc1ccc(Cl)cc1 ZINC000028219161 FG Annotated Anodyne CCc1cc(Br)ccc1C/N=c1\c(O)c(O)\c1=N/C(C)(C)C ZINC000028226371 FG Annotated Anodyne Cc1cc(C#N)cc(Cl)c1C/N=c1\c(O)c(O)\c1=N/[C@H](C)C(C)(C)C ZINC000028227494 FG Annotated Mild Cc1cc(C#N)cc(Cl)c1C/N=c1\c(O)c(O)\c1=N/[C@@H](C)C(C)(C)C ZINC000028227498 FG Annotated Mild CCN(CC)CCS/C(=N\O)C(=O)c1ccc(Br)cc1 ZINC000028227566 FG Annotated Mild O=[N+]([O-])c1ccc(N(CCBr)CCBr)cc1 ZINC000028227992 FG Annotated Reactive CCCN(C1=NCCN1)c1c(Br)cccc1Br ZINC000028228258 FG Annotated Anodyne O=C(O)CC/C=C\CC1=CCC[C@@H]1CNS(=O)(=O)c1ccc(F)cc1 ZINC000028232026 FG Annotated Anodyne CCN(CC)Cc1ccc(-c2cc(S(=O)(=O)CC)ccc2OC)[nH]1 ZINC000028240751 FG Annotated Anodyne Cc1noc(C)c1[C@@H](c1ccc(C(C)C)cc1)N1CCN(CCO)CC1 ZINC000028246396 FG Annotated Anodyne Cc1noc(C)c1[C@H](c1ccc(C(C)C)cc1)N1CCN(CCO)CC1 ZINC000028246403 FG Annotated Anodyne Cc1cc([C@@H](c2ccc(C(C)C)cc2)N2CCN(CCO)CC2)sn1 ZINC000028250947 FG Annotated Anodyne Cc1cc([C@H](c2ccc(C(C)C)cc2)N2CCN(CCO)CC2)sn1 ZINC000028250954 FG Annotated Anodyne Cc1cnsc1[C@@H](c1ccc(CC(C)C)cc1)N1CCN(CCO)CC1 ZINC000028251321 FG Annotated Anodyne Cc1cnsc1[C@H](c1ccc(CC(C)C)cc1)N1CCN(CCO)CC1 ZINC000028251327 FG Annotated Anodyne COc1ccccc1C(=O)n1c(=O)oc2c3ncccc3c(Cl)cc21 ZINC000028251462 FG Annotated Anodyne Cc1cnsc1[C@@H](c1ccc(C(C)C)cc1)N1CCN(CCO)CC1 ZINC000028254321 FG Annotated Anodyne Cc1cnsc1[C@H](c1ccc(C(C)C)cc1)N1CCN(CCO)CC1 ZINC000028254327 FG Annotated Anodyne O=C(O)CCCCCC(=O)N1CCC2(CC1)CCN(c1ccncc1)CC2 ZINC000028264240 FG Annotated Anodyne CC[C@@H](C)[C@H](N)C(=O)N1CCCN1C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000028330573 FG Annotated Anodyne CC[C@H](C)[C@H](N)C(=O)N1CCCN1C(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000028330578 FG Annotated Anodyne CCCOc1cccc(O)c1-c1cc([C@@H]2CCCNC2)c(C#N)c(N)n1 ZINC000028332396 FG Annotated Mild CCCOc1cccc(O)c1-c1cc([C@H]2CCCNC2)c(C#N)c(N)n1 ZINC000028332402 FG Annotated Mild CC[C@@H](c1ccc(F)c(F)c1)n1c(C(=O)N2CCOCC2)c[nH]c1=S ZINC000028338746 FG Annotated Anodyne CC[C@H](c1ccc(F)c(F)c1)n1c(C(=O)N2CCOCC2)c[nH]c1=S ZINC000028338751 FG Annotated Anodyne O=C(O)C[C@H](c1cnc[nH]1)N(CCc1cccs1)Cc1ccccn1 ZINC000028339817 FG Annotated Anodyne O=C(O)C[C@@H](c1cnc[nH]1)N(CCc1cccs1)Cc1ccccn1 ZINC000028339825 FG Annotated Anodyne O=[N+]([O-])c1ccc(S(=O)(=O)NC2[C@H]3CC[C@@H]2Cc2ccccc2C3)cc1 ZINC000028340403 FG Annotated Bother C[C@@H](Nc1nc(N)nc(NCCc2cccs2)n1)c1ccc(F)cc1 ZINC000028342073 FG Annotated Anodyne C[C@H](Nc1nc(N)nc(NCCc2cccs2)n1)c1ccc(F)cc1 ZINC000028342079 FG Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(N(CC)CC)c1 ZINC000028342803 FG Annotated Anodyne O=C1Nc2c(Cl)ccc(OCc3noc(O)n3)c2C2(CCCCC2)N1 ZINC000028348475 FG Annotated Anodyne CC[C@@H](c1ccc(Cl)c(Cl)c1)n1c(C(N)=O)c(C(N)=O)[nH]c1=S ZINC000028351910 FG Annotated Anodyne CC[C@H](c1ccc(Cl)c(Cl)c1)n1c(C(N)=O)c(C(N)=O)[nH]c1=S ZINC000028351917 FG Annotated Anodyne Cc1ccc(S(=O)(=O)N(N)C(=O)c2ccc(Cl)cc2Cl)s1 ZINC000028355990 FG Annotated Reactive Cc1csc(S(=O)(=O)N(N)C(=O)c2ccc(Cl)cc2Cl)c1 ZINC000028356583 FG Annotated Reactive O=C1[C@H]2[C@H]3C=C[C@H]([C@@H]4C[C@H]34)[C@H]2C(=O)N1c1ccc([N+](=O)[O-])c2ccccc12 ZINC000028357050 FG Annotated Bother O=C1[C@H]2[C@@H]3C=C[C@@H]([C@@H]4C[C@H]34)[C@H]2C(=O)N1c1ccc([N+](=O)[O-])c2ccccc12 ZINC000028357056 FG Annotated Bother CC(C)CC[C@@H](C)N1CCC(N2c3ccccc3NS2(=O)=O)CC1 ZINC000028359994 FG Annotated Anodyne CC(C)CC[C@H](C)N1CCC(N2c3ccccc3NS2(=O)=O)CC1 ZINC000028360001 FG Annotated Anodyne CCCN(CCO)c1nc(C)nc(C(=O)c2c(C)cc(C)cc2C)c1C ZINC000028360877 FG Annotated Anodyne CC(C)COc1cccc(O)c1-c1cc([C@@H]2CCCNC2)c(C#N)c(N)n1 ZINC000028363794 FG Annotated Mild CC(C)COc1cccc(O)c1-c1cc([C@H]2CCCNC2)c(C#N)c(N)n1 ZINC000028363800 FG Annotated Mild N#Cc1c([C@@H]2CCCNC2)cc(-c2c(O)cccc2OCC2CC2)nc1N ZINC000028366149 FG Annotated Mild N#Cc1c([C@H]2CCCNC2)cc(-c2c(O)cccc2OCC2CC2)nc1N ZINC000028366153 FG Annotated Mild Cn1nc(-c2ccc(Cl)cc2)s/c1=N\c1cccc(-c2nnn[nH]2)c1 ZINC000028373121 FG Annotated Anodyne Cc1ncc(CNc2ccc(-c3ccc(C(=N)N)cc3)cc2)c(CO)c1O ZINC000028376289 FG Annotated Anodyne Cn1nc(-c2ccc(Cl)cc2)s/c1=N\c1ccc(O)c(C(=O)O)c1 ZINC000028382732 FG Annotated Anodyne CC(=O)NCn1cc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)c(=O)o1 ZINC000028382768 FG Annotated Anodyne Fc1cc(Sc2cccnc2)cc(-n2nnc(-c3ccccn3)n2)c1 ZINC000028386056 FG Annotated Anodyne CC(C)CC[C@@H](C)N1CCC(N2c3ccccc3CNS2(=O)=O)CC1 ZINC000028388117 FG Annotated Anodyne CC(C)CC[C@H](C)N1CCC(N2c3ccccc3CNS2(=O)=O)CC1 ZINC000028388122 FG Annotated Anodyne CCO/N=C/c1ccc(OCCCN2CCN(c3ccncc3)C2=O)cc1 ZINC000028388560 FG Annotated Mild C[C@@H](CNCc1ccc2c(c1)OCO2)Oc1cccc2ccc(N)nc12 ZINC000028390504 FG Annotated Anodyne C[C@H](CNCc1ccc2c(c1)OCO2)Oc1cccc2ccc(N)nc12 ZINC000028390510 FG Annotated Anodyne Cc1nc(N)c2ccc(-c3nn(C)/c(=N/C4CCCCC4)s3)cc2n1 ZINC000028391269 FG Annotated Anodyne O=[N+]([O-])c1ccccc1-c1cc(F)cc(-n2nnc(-c3ccccn3)n2)c1 ZINC000028391427 FG Annotated Bother COc1cccc2c(S(=O)(=O)c3ccccc3)cn(CCN(C)C)c12 ZINC000028396176 FG Annotated Anodyne N#Cc1c(Cl)n([C@H]2C[C@H](O)[C@@H](CO)O2)c2cc(Cl)c(Cl)cc12 ZINC000028396808 FG Annotated Mild COc1cc(CN(C)CCc2ccc([N+](=O)[O-])cc2)cc(N(C)C)c1O ZINC000028397435 FG Annotated Bother Fc1cc(-n2nnc(-c3ccccn3)n2)cc(-n2ccc3ccncc32)c1 ZINC000028456551 FG Annotated Anodyne COC(=O)C1=C(c2ccc(I)cc2)C[C@H]2CC[C@@H]1O2 ZINC000028456661 FG Annotated Anodyne COC(=O)C1=C(c2ccc(I)cc2)C[C@@H]2CC[C@H]1O2 ZINC000028456664 FG Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(C[C@@H](C)C#N)c1 ZINC000028456793 FG Annotated Mild CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(C[C@H](C)C#N)c1 ZINC000028456796 FG Annotated Mild CCOC(=O)c1cnc2c(c(C)nn2C)c1Nc1ccc(C(C)=O)cc1 ZINC000028456953 FG Annotated Anodyne C[C@H](COC(=O)c1ccccc1O)CC1=C(O)C(=O)c2ccccc2C1=O ZINC000028458738 FG Annotated Mild CCOC(=O)c1cnc2c(c(C)nn2C)c1Nc1ccc([N+](=O)[O-])cc1 ZINC000028460625 FG Annotated Bother O=C(CSC1=CC(=O)c2ccccc2C1=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000028461005 FG Annotated Mild C=CC[n+]1ccc(CCC(=O)[C@@H]2Cc3cc(OC)c(OC)cc3S2)cc1 ZINC000028461047 FG Annotated Mild C=CC[n+]1ccc(CCC(=O)[C@H]2Cc3cc(OC)c(OC)cc3S2)cc1 ZINC000028461049 FG Annotated Mild CC[n+]1ccc(CCC(=O)[C@@H]2Cc3cc(OC)c(OC)cc3S2)cc1 ZINC000028461750 FG Annotated Anodyne CC[n+]1ccc(CCC(=O)[C@H]2Cc3cc(OC)c(OC)cc3S2)cc1 ZINC000028461754 FG Annotated Anodyne O=C(Nc1nccs1)c1ncsc1CCOC(=O)C1CCCC1 ZINC000028464215 FG Annotated Anodyne CC1=C(CCCCCc2nnnn2CCC#N)C(=O)c2ccccc2C1=O ZINC000028469780 FG Annotated Mild CC(C)(C)CCN[C@@H]1C(=O)C(=O)/C1=C\c1ccc(Br)cc1 ZINC000028471531 FG Annotated Mild COC(=O)c1cc2c(s1)C(=O)C(Cl)=C(Nc1ccc(O)cc1)C2=O ZINC000028474699 FG Annotated Mild CCc1cc(CC)c(C(=O)C[C@@H](SCC(=O)O)C(=O)O)c(CC)c1 ZINC000028476279 FG Annotated Anodyne CCc1cc(CC)c(C(=O)C[C@H](SCC(=O)O)C(=O)O)c(CC)c1 ZINC000028476282 FG Annotated Anodyne Cc1nc2cc3c4c(cccc4c2s1)C(=O)N(CCCN(C)C)C3=O ZINC000028476305 FG Annotated Anodyne C[C@H](CO)N(c1cc(F)ccc1F)S(=O)(=O)c1ccc(Cl)cc1 ZINC000028478185 FG Annotated Anodyne O=C1[C@@H]2CC=CC[C@H]2C(=O)N1CCOC(=S)Nc1ccc(Cl)cc1 ZINC000028520820 FG Annotated Anodyne O=C1C(Nc2ccc(Br)cc2)=CC(=O)c2sc(CO)cc21 ZINC000028520993 FG Annotated Mild Cc1ccc(NC(=S)O[C@@H](C)CN2C(=O)c3ccccc3C2=O)cc1 ZINC000028521783 FG Annotated Anodyne Cc1ccc(NC(=S)O[C@H](C)CN2C(=O)c3ccccc3C2=O)cc1 ZINC000028521786 FG Annotated Anodyne O=[N+]([O-])c1ccc(-c2nnc(N3CCN(c4ccccc4)CC3)s2)o1 ZINC000028522610 FG Annotated Bother Cc1[nH]c2nc(N)nc(O)c2c1Sc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000028522977 FG Annotated Bother O=C1NC(CCCN2CC=C(c3ccccc3)CC2)=N[C@@H]2CCSC[C@H]12 ZINC000028523076 FG Annotated Anodyne O=C1NC(CCCN2CC=C(c3ccccc3)CC2)=N[C@H]2CCSC[C@H]12 ZINC000028523077 FG Annotated Anodyne CCCn1c(S)nnc1-c1ccc(S(=O)(=O)c2ccccc2)cc1 ZINC000028523515 FG Annotated Anodyne Nc1ccc(C2=Nn3cc(C(=O)O)nc3Cc3ccc(Cl)cc32)cc1 ZINC000028524230 FG Annotated Anodyne CC(=O)NCn1cc(-c2ccc(-c3ccc(C(C)=O)cc3)cc2)c(=O)o1 ZINC000028525514 FG Annotated Anodyne O=S(=O)(c1ccccc1F)n1cc(C2=CCCNC2)c2ccccc21 ZINC000028525895 FG Annotated Anodyne O=S(=O)(c1cccc(F)c1)n1cc(C2=CCCNC2)c2ccccc21 ZINC000028526359 FG Annotated Anodyne O=S(=O)(c1ccc(F)cc1)n1cc(C2=CCCNC2)c2ccccc21 ZINC000028526550 FG Annotated Anodyne CN1CCC[C@H]1Cc1cn(S(=O)(=O)c2ccc(N)cc2)c2ccccc12 ZINC000028527038 FG Annotated Anodyne COc1ccc(N2CCN(c3cccc(F)c3)C2=O)cc1OCCN(C)C ZINC000028528455 FG Annotated Anodyne CCOc1cc(OCC)cc([C@@H](Nc2ccc(C(=N)NO)cc2)C(=O)O)c1 ZINC000028529335 FG Annotated Anodyne CCOc1cc(OCC)cc([C@H](Nc2ccc(C(=N)NO)cc2)C(=O)O)c1 ZINC000028529337 FG Annotated Anodyne COc1cc2c(cc1-c1cnco1)C(=O)N(C)[C@]1(Cc3ccsc3C1)N2 ZINC000028529621 FG Annotated Anodyne COc1cc2c(cc1-c1cnco1)C(=O)N(C)[C@@]1(Cc3ccsc3C1)N2 ZINC000028529623 FG Annotated Anodyne CCC(=O)N[C@H](c1nc(-c2nc(C(=O)OC)c(C)o2)cs1)C(C)C ZINC000028529742 FG Annotated Anodyne CC(C)(C)NC(=O)NC(=S)NC(=O)[C@@H]1[C@@H](C=C(Cl)Cl)C1(C)C ZINC000028565977 FG Annotated Anodyne CC(C)(CO)CCCCOP(=O)(O)OCCCCC(C)(C)CO ZINC000028567374 FG Annotated Anodyne COc1cc(OC)cc(-c2cn(-c3c(O)c(F)cc(F)c3F)nn2)c1 ZINC000028567479 FG Annotated Anodyne COc1ccc(-c2cn(-c3c(O)c(F)cc(F)c3F)nn2)cc1OC ZINC000028567683 FG Annotated Anodyne CC(C)(CC(=O)O)Cc1nc(CCCc2ccc3c(n2)NCCC3)no1 ZINC000028568872 FG Annotated Anodyne CCOC(=O)/C=C/c1ccc2c(-c3ccc(OCC(=O)O)cc3)nocc1-2 ZINC000028568963 FG Annotated Anodyne CCN(c1ccccc1Br)S(=O)(=O)c1ccc(O)cc1 ZINC000028569024 FG Annotated Anodyne O=c1[nH]c(Nc2ccc3c(c2)CCC3)nc(O)c1CCOc1ccccc1 ZINC000028569856 FG Annotated Anodyne O=c1[nH]c(Nc2ccc3c(c2)CCC3)nc(O)c1CCCN1CCCCC1 ZINC000028570722 FG Annotated Anodyne CO[C@@H]1[C@H](c2ccccc2)O[C@@H]2CO[C@@H](c3ccccc3)O[C@H]2[C@@H]1OC ZINC000028571110 FG Annotated Anodyne CO[C@@H]1[C@@H](c2ccccc2)O[C@@H]2CO[C@@H](c3ccccc3)O[C@H]2[C@@H]1OC ZINC000028571111 FG Annotated Anodyne CO[C@H]1[C@H](Cc2ccccc2)O[C@@H]2CO[C@@H](c3ccccc3)O[C@H]2[C@@H]1OC ZINC000028571399 FG Annotated Anodyne CC(C)(O)c1cnn2c(-c3ccc(F)c(-c4ccc(F)cn4)c3)cnc2n1 ZINC000028571517 FG Annotated Anodyne CC(C)(O)c1cnn2c(-c3ccc(F)c(-c4ncccc4F)c3)cnc2n1 ZINC000028571518 FG Annotated Anodyne CO[C@H]1[C@H](c2ccccc2)O[C@@H]2CO[C@@H](c3ccc(F)cc3)O[C@H]2[C@@H]1OC ZINC000028571637 FG Annotated Anodyne CC(C)(O)c1cnn2c(-c3ccc(F)c(-c4ccncc4C#N)c3)cnc2n1 ZINC000028571725 FG Annotated Mild CO[C@H]1[C@H](c2ccccc2)O[C@@H]2CO[C@@H](C3CCCCC3)O[C@H]2[C@@H]1OC ZINC000028571902 FG Annotated Anodyne CO[C@H]1[C@H](c2ccccc2)O[C@@H]2CO[C@@H](Cc3ccccc3)O[C@H]2[C@@H]1OC ZINC000028571903 FG Annotated Anodyne CO[C@H]1[C@H](c2ccccc2)O[C@@H]2CO[C@@H](c3ccccc3)O[C@H]2[C@@H]1OC ZINC000028572108 FG Annotated Anodyne CO[C@H]1[C@H](c2ccccc2)O[C@@H]2CO[C@@H](c3cccs3)O[C@H]2[C@@H]1OC ZINC000028572118 FG Annotated Anodyne CN(CCO)C(=O)N1CC(c2cc(F)ccc2F)=C[C@H]1c1cccc(O)c1 ZINC000028572290 FG Annotated Anodyne CO[C@H]1[C@H](c2ccccc2)O[C@@H]2CO[C@@H](c3ccccc3)O[C@@H]2[C@@H]1OC ZINC000028572629 FG Annotated Anodyne Cc1ccc(C)c(COc2cc([N+](=O)[O-])ccc2NS(C)(=O)=O)c1 ZINC000028604280 FG Annotated Bother COc1ccc([C@H]2[C@@H]3CCc4ccc([N+](=O)[O-])cc4C3=NN2C(C)=O)cc1 ZINC000028634787 FG Annotated Bother COc1ccc([C@H]2[C@H]3CCc4ccc([N+](=O)[O-])cc4C3=NN2C(C)=O)cc1 ZINC000028634789 FG Annotated Bother COc1ccc([C@H]2[C@H]3C[C@H](N)c4ccc(OC)cc4C3=NN2C(C)=O)cc1 ZINC000028635828 FG Annotated Anodyne CCOC(=O)C1=CCCC[C@@H]1S(=O)(=O)Nc1ccc(Cl)cc1F ZINC000028637594 FG Annotated Anodyne CCOC(=O)C1=CCCC[C@H]1S(=O)(=O)Nc1ccc(Cl)cc1F ZINC000028637597 FG Annotated Anodyne CS(=O)(=O)Nc1ccc(C2=C(c3ccc(Cl)cc3)C(=O)OC2)cc1 ZINC000028640204 FG Annotated Anodyne O=C(NNc1nc2cccc(F)c2n2cccc12)c1cnc2ccccc2n1 ZINC000028640945 FG Annotated Reactive COc1ccc(-n2c(=O)[nH]c3c(-c4ccccc4C)ncnc32)c(OC)c1 ZINC000028642830 FG Annotated Anodyne CN(C)c1ccc(/C=C/c2cnc(OCCO)c(Br)c2)cc1 ZINC000028644640 FG Annotated Clean O=C(O)C[C@@H]1C[C@@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)c(O)c1 ZINC000028648161 FG Annotated Anodyne O=C(O)C[C@H]1C[C@@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)c(O)c1 ZINC000028648164 FG Annotated Anodyne O=C(O)C[C@@H]1C[C@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)c(O)c1 ZINC000028648167 FG Annotated Anodyne O=C(O)C[C@H]1C[C@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)c(O)c1 ZINC000028648170 FG Annotated Anodyne O=C(O)C[C@@H]1C[C@@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)nc1 ZINC000028648179 FG Annotated Anodyne O=C(O)C[C@H]1C[C@@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)nc1 ZINC000028648181 FG Annotated Anodyne O=C(O)C[C@@H]1C[C@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)nc1 ZINC000028648184 FG Annotated Anodyne O=C(O)C[C@H]1C[C@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)nc1 ZINC000028648186 FG Annotated Anodyne O=C(O)CC[C@@H]1C[C@@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)nc1 ZINC000028648187 FG Annotated Anodyne O=C(O)CC[C@H]1C[C@@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)nc1 ZINC000028648190 FG Annotated Anodyne O=C(O)CC[C@@H]1C[C@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)nc1 ZINC000028648192 FG Annotated Anodyne O=C(O)CC[C@H]1C[C@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)nc1 ZINC000028648195 FG Annotated Anodyne O=c1c2ccccc2n2c(CN3CCCCC3)nnc2n1Cc1ccccc1 ZINC000028648711 FG Annotated Anodyne Cc1nc2ccc(N3C(=O)CS[C@@H]3c3ccc4c(c3)OCO4)cc2[nH]1 ZINC000028652015 FG Annotated Anodyne Cc1nc2ccc(N3C(=O)CS[C@H]3c3ccc4c(c3)OCO4)cc2[nH]1 ZINC000028652019 FG Annotated Anodyne COC(=O)/C=C/c1cc(Br)c(OC)c(Br)c1O ZINC000028652130 FG Annotated Anodyne COC(=O)CCc1cc(Br)c(OC)c(Br)c1O ZINC000028652138 FG Annotated Anodyne CCc1c(C(=O)c2cccc3ccccc23)n(CC2CC=CC2)c(=O)[nH]c1=O ZINC000028652497 FG Annotated Anodyne Cc1noc(-c2ccc(N3CCC(Oc4ccccc4C)CC3)nn2)n1 ZINC000028655428 FG Annotated Anodyne C[C@@H](c1ccsc1)n1nc(O)c2[nH]c3cc(Cl)ccc3c(=O)c2c1=O ZINC000028655974 FG Annotated Bother C[C@H](c1ccsc1)n1nc(O)c2[nH]c3cc(Cl)ccc3c(=O)c2c1=O ZINC000028655977 FG Annotated Bother Cc1ccsc1Cn1nc(O)c2[nH]c3cc(Cl)ccc3c(=O)c2c1=O ZINC000028655980 FG Annotated Bother CC1CCN(CCN(CCNCC(C)(C)S)CC(C)(C)S)CC1 ZINC000028705873 FG Annotated Mild O=c1[nH]c(N2CCC(c3ccccc3)CC2)c(Cc2ccccc2)c(=O)[nH]1 ZINC000028707987 FG Annotated Anodyne Cc1noc(=O)n1CCCCCCCCCCCCn1c(C)noc1=O ZINC000028709053 FG Annotated Anodyne CC(=O)NC[C@H]1CN(c2ccc(/C=C/C(=O)c3ccccc3)cc2)C(=O)O1 ZINC000028709358 FG Annotated Mild O=Cc1ccc(-c2cc(-c3cccc(C=O)c3)c(O)c(=O)c(O)c2O)cc1 ZINC000028709525 FG Annotated Anodyne Cc1ccc(O)c(Cn2c(NC3CCN(C)CC3)nc3c(C)cccc32)n1 ZINC000028710364 FG Annotated Anodyne CNCCCNc1nc2c(C)cc(C)cc2n1Cc1nc(C)ccc1O ZINC000028710374 FG Annotated Anodyne C[C@@]1(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CC(C(F)(F)F)=NN1 ZINC000028710419 FG Annotated Mild C[C@]1(C(=O)Nc2ccc(C#N)c(C(F)(F)F)c2)CC(C(F)(F)F)=NN1 ZINC000028710420 FG Annotated Mild C=CCN1C(=O)/C(=C/c2ccc(-c3ccc(C(N)=O)cc3)o2)SC1=S ZINC000028710839 FG Annotated Mild S=C(N/N=C\c1c[nH]c2ccccc12)N1CCN(c2ccccc2)CC1 ZINC000028712749 FG Annotated Mild COc1ccc(-c2nnc3n2ccc2nnc(-c4ccc(OC)cc4)n23)cc1 ZINC000028712769 FG Annotated Anodyne O=C1CO[C@H](COc2ccc([N+](=O)[O-])cc2)CN1c1ccc(Cl)cc1 ZINC000028714042 FG Annotated Bother O=C1CO[C@@H](COc2ccc([N+](=O)[O-])cc2)CN1c1ccc(Cl)cc1 ZINC000028714043 FG Annotated Bother COc1ccc(-n2c3cssc-3c(NC(C)=O)c2=O)c(OC)c1 ZINC000028714458 FG Annotated Anodyne C[C@@H](CNC(=O)C1CCC2(CC1)CCN(c1ccncc1)CC2)CC(=O)O ZINC000028754757 FG Annotated Anodyne C[C@H](CNC(=O)C1CCC2(CC1)CCN(c1ccncc1)CC2)CC(=O)O ZINC000028754760 FG Annotated Anodyne CCOC(=O)c1c(C)cc2cnn(-c3ccc([N+](=O)[O-])cc3)c(=O)c2c1C ZINC000028757349 FG Annotated Bother COc1ccc(C(=O)c2ccc3c(c2)oc(=O)n3CCc2ccncc2)cc1 ZINC000028757787 FG Annotated Anodyne CCc1[nH]c(=O)[nH]c1C(=O)c1ccc(-n2ccnc2CCC(C)C)cc1 ZINC000028764578 FG Annotated Anodyne CC(=O)c1cc2c(s1)[C@@H](NC(=O)c1ccccc1F)[C@H](O)C(C)(C)O2 ZINC000028770563 FG Annotated Anodyne C[C@@H]1OC(c2ccccc2)(c2ccccc2)OC[C@@H]1CN1CCN(C)CC1 ZINC000028816378 FG Annotated Anodyne C[C@H]1OC(c2ccccc2)(c2ccccc2)OC[C@@H]1CN1CCN(C)CC1 ZINC000028816380 FG Annotated Anodyne C[C@@H]1OC(c2ccccc2)(c2ccccc2)OC[C@H]1CN1CCN(C)CC1 ZINC000028816382 FG Annotated Anodyne C[C@H]1OC(c2ccccc2)(c2ccccc2)OC[C@H]1CN1CCN(C)CC1 ZINC000028816383 FG Annotated Anodyne CCc1ccc(/C=C2\SC(N[C@@H](C(=O)O)c3ccc(F)cc3)=NC2=O)o1 ZINC000028816621 FG Annotated Clean CCc1ccc(/C=C2\SC(N[C@H](C(=O)O)C3CCCCC3)=NC2=O)o1 ZINC000028816644 FG Annotated Clean CCc1ccc(/C=C2\SC(N[C@H](CC(=O)O)c3cccnc3)=NC2=O)o1 ZINC000028816678 FG Annotated Clean Cc1cc(-c2ccc(N3C[C@H](CNc4ccon4)OC3=O)cc2F)on1 ZINC000028818897 FG Annotated Anodyne Cn1c(=O)c(C#N)c(N)c2c(-c3ccc(Br)cc3)csc21 ZINC000028819376 FG Annotated Mild COc1cc(OC)c2c(c1)O[C@@H](c1ccc(OC)c(OC)c1)[C@H](OC)C2 ZINC000028820375 FG Annotated Anodyne COc1cc(OC)c2c(c1)O[C@@H](c1ccc(OC)c(OC)c1)[C@@H](OC)C2 ZINC000028820376 FG Annotated Anodyne CC(C)n1c(=O)n(Cc2nc3ccccc3n2CCCC#N)c2cnccc21 ZINC000028820862 FG Annotated Mild N#CCCCn1c(Cn2c(=O)n(C3CC3)c3ccncc32)nc2ccccc21 ZINC000028820866 FG Annotated Mild C=C(C)n1c(=O)n(Cc2nc3ccccc3n2CCCC#N)c2cnccc21 ZINC000028820997 FG Annotated Mild CN(C)C1(CNCCc2ccc(Cl)cc2)COc2ccccc2OC1 ZINC000028821257 FG Annotated Anodyne c1ccc(CCNCC2(N3CCCC3)COc3ccccc3OC2)cc1 ZINC000028821266 FG Annotated Anodyne Cc1nc(NCc2ccc(F)c(F)c2)nc(-n2ccnc2C)c1[N+](=O)[O-] ZINC000028821419 FG Annotated Bother Cc1nc(NCc2cc(F)ccc2F)nc(-n2ccnc2C)c1[N+](=O)[O-] ZINC000028821422 FG Annotated Bother C=C(C)n1c(=O)n(Cc2nc3ccccc3n2CCCC#N)c2cccnc21 ZINC000028821614 FG Annotated Mild C=C(C)n1c(=O)n(Cc2nc3ccccc3n2CCCC#N)c2ncccc21 ZINC000028821623 FG Annotated Mild NC(N)=NC(=O)c1oc(-c2cc(Cl)ccc2Cl)cc1N1CCCC1 ZINC000028822474 FG Annotated Mild Oc1ccc(CCn2nnnc2CCCC[C@@H]2CCSS2)cc1O ZINC000028823707 FG Annotated Reactive Oc1ccc(CCn2nnnc2CCCC[C@H]2CCSS2)cc1O ZINC000028823708 FG Annotated Reactive O=C1Nc2ccc(OC(F)(F)F)cc2[C@]12NN=C(c1ccccc1)S2 ZINC000028824722 FG Annotated Clean O=C1Nc2ccc(OC(F)(F)F)cc2[C@@]12NN=C(c1ccccc1)S2 ZINC000028824723 FG Annotated Clean CCCc1ccc2c(c1)NC(=O)[C@@]21NN=C(c2ccc(OC)cc2)S1 ZINC000028824743 FG Annotated Clean CCCc1ccc2c(c1)NC(=O)[C@]21NN=C(c2ccc(OC)cc2)S1 ZINC000028824744 FG Annotated Clean CNCc1cc(C#CCCN2CCOCC2)ccc1Oc1cccc(F)c1 ZINC000028825131 FG Annotated Mild CC/C=C/c1c(C(=O)O)c(OC)cc2c1C(=O)c1c(O)cccc1C2=O ZINC000028825654 FG Annotated Clean CC(C)OC(=O)C(=Cc1cc(O)nnc1-c1ccccc1)C(=O)OC(C)C ZINC000028825805 FG Annotated Anodyne NCCCN(C/C=C/c1ccccc1)C(=O)C(=O)c1c[nH]c2ccccc12 ZINC000028825838 FG Annotated Anodyne CN(C)CCN1C(=O)c2cccc3c2c(cc2[nH]c(-c4ccoc4)nc23)C1=O ZINC000028825874 FG Annotated Anodyne CN(C)CCN1C(=O)c2cccc3c2c(cc2[nH]c(-c4ccco4)nc23)C1=O ZINC000028825876 FG Annotated Anodyne CCC[C@H](NC(=O)C(=O)C(C)(C)C)C(=O)Nc1ncc(C(C)C)s1 ZINC000028827429 FG Annotated Anodyne Cc1cc2c(cc1C)[n+]([O-])c(C(F)(F)F)c(C(=O)c1cccs1)[n+]2[O-] ZINC000028861750 FG Annotated Anodyne O=C(c1cccs1)c1c(C(F)(F)F)[n+]([O-])c2ccc(Cl)cc2[n+]1[O-] ZINC000028861781 FG Annotated Anodyne O=S(=O)(c1ccc(Cl)cc1)c1cn([C@@H]2CCNC2)c2ncccc12 ZINC000028862181 FG Annotated Anodyne O=S(=O)(c1ccc(Cl)cc1)c1cn([C@H]2CCNC2)c2ncccc12 ZINC000028862183 FG Annotated Anodyne CCN1CC[C@@H](n2cc(S(=O)(=O)c3cccc(F)c3)c3cccnc32)C1 ZINC000028862249 FG Annotated Anodyne CCN1CC[C@H](n2cc(S(=O)(=O)c3cccc(F)c3)c3cccnc32)C1 ZINC000028862251 FG Annotated Anodyne CN1CCC[C@@H](n2cc(S(=O)(=O)c3cccc(F)c3)c3cccnc32)C1 ZINC000028862373 FG Annotated Anodyne CN1CCC[C@H](n2cc(S(=O)(=O)c3cccc(F)c3)c3cccnc32)C1 ZINC000028862375 FG Annotated Anodyne COC1=CC(=O)c2c(c(COc3c(F)cc(F)cc3F)c(C)n2C)C1=O ZINC000028864325 FG Annotated Mild COC1=CC(=O)c2c(COc3c(F)cc(F)cc3F)c(C)n(C)c2C1=O ZINC000028864328 FG Annotated Mild COC1=CC(=O)c2c(c([C@@H](C)Oc3ccc([N+](=O)[O-])cc3)c(C)n2C)C1=O ZINC000028864350 FG Annotated Mild COC1=CC(=O)c2c(c([C@H](C)Oc3ccc([N+](=O)[O-])cc3)c(C)n2C)C1=O ZINC000028864352 FG Annotated Mild Cc1c(Cc2c(F)cccc2N2CCCC2)nc(N2CCCC2)[nH]c1=O ZINC000028866312 FG Annotated Anodyne Cc1c([C@H](C)c2c(F)cccc2F)nc(N2CCSCC2)[nH]c1=O ZINC000028866770 FG Annotated Anodyne Cc1c([C@@H](C)c2c(F)cccc2F)nc(N2CCSCC2)[nH]c1=O ZINC000028866773 FG Annotated Anodyne CCCCC[C@H](O)c1ccccc1/C=C/[C@@H](O)[C@@H](O)CCCC(=O)OC ZINC000028869278 FG Annotated Anodyne CCCCC[C@@H](O)c1ccccc1/C=C/[C@@H](O)[C@@H](O)CCCC(=O)OC ZINC000028869279 FG Annotated Anodyne CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@@H]1Nc1cccc([N+](=O)[O-])c1 ZINC000028870982 FG Annotated Mild CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@H]1Nc1cccc([N+](=O)[O-])c1 ZINC000028870985 FG Annotated Mild Cc1nc2c3c(c(C(=O)N(C)C)cn2c1CO)CC[C@H](c1ccccc1)C3 ZINC000028871463 FG Annotated Anodyne Cc1nc2c3c(c(C(=O)N(C)C)cn2c1CO)CC[C@@H](c1ccccc1)C3 ZINC000028871467 FG Annotated Anodyne CC(=O)N(C(C)=O)c1nc2c(c(-c3ccc(C)cc3)c1C#N)C(=O)CCC2 ZINC000028871915 FG Annotated Mild Cn1ccnc1Sc1cc(C(=O)Nc2cccc(C#N)c2)c(N)cc1F ZINC000028871937 FG Annotated Mild N#Cc1c(N)nc(N2CCOCC2)c(C#N)c1-c1ccc(Cl)cc1Cl ZINC000028875528 FG Annotated Mild N#Cc1c(N)nc(N2CCOCC2)c(C#N)c1-c1c(Cl)cccc1Cl ZINC000028875532 FG Annotated Mild CN(C)CCN1C(=O)c2cccc3cc4nc(Cl)sc4c(c23)C1=O ZINC000028876748 FG Annotated Anodyne COc1ccc2c(c1OC)[C@@H]1[C@H]3Cc4ccccc4CN3C[C@H](C2)N1C ZINC000028880523 FG Annotated Anodyne O=C1C(Cl)=C(Nc2ccc(Br)cc2)C(=O)c2cnncc21 ZINC000028881061 FG Annotated Mild CCN(CC)CCCOc1cc2c(cn1)[C@H](c1ccc(OC)cc1)CNC2 ZINC000028883552 FG Annotated Anodyne CCN(CC)CCCOc1cc2c(cn1)[C@@H](c1ccc(OC)cc1)CNC2 ZINC000028883559 FG Annotated Anodyne CS(=O)(=O)c1ccc(-n2nc(C(F)F)c(C#N)c2-c2ccccc2)nc1 ZINC000028883695 FG Annotated Mild O=S1(=O)N=C(O)CN1c1csc(-c2ccccc2)c1Br ZINC000028886828 FG Annotated Anodyne CC1(C)OC(=O)C2(C(=O)O1)[C@H](c1ccccc1)CC(=O)C[C@@H]2c1ccco1 ZINC000028893282 FG Annotated Anodyne C[C@@H](OC(=O)CCC(=O)O)c1cc2c(s1)C(=O)c1sccc1C2=O ZINC000028893928 FG Annotated Clean C[C@H](OC(=O)CCC(=O)O)c1cc2c(s1)C(=O)c1sccc1C2=O ZINC000028893933 FG Annotated Clean CCNCc1cncc(/C=C/c2c[nH]nc2-c2nc(C(F)(F)F)c[nH]2)c1 ZINC000028896822 FG Annotated Anodyne CN1C(=O)N=C(/N=c2\[nH]c(-c3ccccc3)c(-c3ccccc3)s2)C1=O ZINC000028902264 FG Annotated Anodyne O=C(CN1CCCC1)Nc1ccc2c(c1)C(=O)c1cccc3ccnc-2c13 ZINC000028902591 FG Annotated Anodyne C[N+](C)(C)CCC(=O)Nc1ccc2c(c1)C(=O)c1cccc3ccnc-2c13 ZINC000028902719 FG Annotated Bother Nc1c(C(=O)c2ccc3ccccc3c2)sc2[nH]c(=O)c(C(=O)O)cc12 ZINC000028902865 FG Annotated Anodyne Cc1sc2nc(SCC#N)n(-c3ccc4c(c3)OCO4)c(=O)c2c1C ZINC000028949224 FG Annotated Mild COc1ccc(N2C(=O)c3c(C)c(OC)cc(O)c3[C@@H]2CC(C)=O)cc1 ZINC000028950932 FG Annotated Clean COc1ccc(N2C(=O)c3c(C)c(OC)cc(O)c3[C@H]2CC(C)=O)cc1 ZINC000028950934 FG Annotated Clean COc1cc(O)c2c(c1Br)C(=O)N1c3ccccc3CO[C@@H]21 ZINC000028951031 FG Annotated Clean COc1cc(O)c2c(c1Br)C(=O)N1c3ccccc3CO[C@H]21 ZINC000028951033 FG Annotated Clean CC(=O)C1=NN2c3cc(F)ccc3OC[C@H]2[C@@]1(CCCN)c1ccccc1 ZINC000028951413 FG Annotated Anodyne C=CCNC(=O)[C@H](N(C(=O)c1cccnc1)C1CCCCC1)C(F)(F)F ZINC000028953072 FG Annotated Mild C=CCNC(=O)[C@@H](N(C(=O)c1cccnc1)C1CCCCC1)C(F)(F)F ZINC000028953073 FG Annotated Mild C=CCNC(=O)[C@@](C=C)(CC)N(C(=O)c1cccnc1)C1CCCCC1 ZINC000028953391 FG Annotated Mild C=CCNC(=O)[C@](C=C)(CC)N(C(=O)c1cccnc1)C1CCCCC1 ZINC000028953392 FG Annotated Mild CS/C(=N\C(=O)c1ccc(Cl)nc1)NC(=O)c1ccc(Cl)nc1 ZINC000028954439 FG Annotated Mild O=c1[nH]c(N2CC[C@@H](N3CC=C(c4ccccc4)CC3)C2)nc2ccccc12 ZINC000028954677 FG Annotated Anodyne O=c1[nH]c(N2CC[C@H](N3CC=C(c4ccccc4)CC3)C2)nc2ccccc12 ZINC000028954680 FG Annotated Anodyne CCOC(=O)C1=C(c2ccccc2)c2ccc(OC)cc2/C1=[N+](\[O-])CC ZINC000028955854 FG Annotated Mild CC(C)CCN([C@@H]1CCCCNC1=O)S(=O)(=O)c1ccc(Cl)cc1 ZINC000028957763 FG Annotated Anodyne CSc1cc(NCc2cccnc2)n2ncc(Br)c2n1 ZINC000028958932 FG Annotated Anodyne CC[C@]12C=C(C(=O)OCCO)n3c4c(c5ccccc53)CCN(CCC1)[C@H]42 ZINC000028965209 FG Annotated Anodyne CC[C@@]12C=C(C(=O)OCCO)n3c4c(c5ccccc53)CCN(CCC1)[C@@H]42 ZINC000028965241 FG Annotated Anodyne CC[C@@]12C=C(C(=O)OCCO)n3c4c(c5ccccc53)CCN(CCC1)[C@H]42 ZINC000028965275 FG Annotated Anodyne N#C[C@@H](c1ccnc(NCCc2c[nH]cn2)n1)c1nc2ccccc2s1 ZINC000028966726 FG Annotated Mild N#C[C@H](c1ccnc(NCCc2c[nH]cn2)n1)c1nc2ccccc2s1 ZINC000028966731 FG Annotated Mild CC1(C)CC(=O)c2cc(C#N)c(N3CCN(c4ccccc4)CC3)nc2C1 ZINC000028967487 FG Annotated Mild C[C@@H]1CN2C(=O)CC[C@@]34C5=CCC[C@@H]5CC[C@H]5[C@H](O)OC[C@]53CC[C@H]1[C@H]24 ZINC000028969639 FG Annotated Anodyne C[C@@H]1CN2C(=O)CC[C@@]34C5=CCC[C@@H]5CC[C@@H]5[C@H](O)OC[C@]53CC[C@H]1[C@H]24 ZINC000028969645 FG Annotated Anodyne COC(=O)CC[C@@]12C3=CCC[C@@H]3CC[C@@H]3CN4C[C@@H](C)[C@@H](CC[C@@]31CO)[C@H]42 ZINC000028969661 FG Annotated Anodyne COC(=O)CC[C@@]12C3=CCC[C@@H]3CC[C@@H]3CN4C[C@@H](C)[C@H](CC[C@@]31CO)[C@H]42 ZINC000028969666 FG Annotated Anodyne C#CCO/N=C(\CC)c1cc(Cl)ccc1NS(=O)(=O)C(F)(F)F ZINC000028977077 FG Annotated Mild Cc1cccc(/C=N/N=C2\S[C@@H](CC(=O)O)C(=O)N2c2ccccc2)c1 ZINC000029038233 FG Annotated Mild Cc1cccc(/C=N/N=C2\S[C@H](CC(=O)O)C(=O)N2c2ccccc2)c1 ZINC000029038235 FG Annotated Mild O=C(O)C[C@@H]1S/C(=N\N=C\c2ccccc2F)N(c2ccccc2)C1=O ZINC000029038236 FG Annotated Mild O=C(O)C[C@H]1S/C(=N\N=C\c2ccccc2F)N(c2ccccc2)C1=O ZINC000029038238 FG Annotated Mild O=C(O)C[C@@H]1S/C(=N\N=C\c2ccc(F)cc2)N(c2ccccc2)C1=O ZINC000029038240 FG Annotated Mild O=C(O)C[C@H]1S/C(=N\N=C\c2ccc(F)cc2)N(c2ccccc2)C1=O ZINC000029038242 FG Annotated Mild Cc1ccc(/C=N/N=C2\S[C@@H](CC(=O)O)C(=O)N2c2ccccc2)cc1 ZINC000029038253 FG Annotated Mild Cc1ccc(/C=N/N=C2\S[C@H](CC(=O)O)C(=O)N2c2ccccc2)cc1 ZINC000029038255 FG Annotated Mild C[C@@H]1Oc2nc([N+](=O)[O-])cn2C[C@@H]1OCc1ccc(OC(F)(F)F)cc1 ZINC000029040446 FG Annotated Bother C[C@H]1Oc2nc([N+](=O)[O-])cn2C[C@@H]1OCc1ccc(OC(F)(F)F)cc1 ZINC000029040488 FG Annotated Bother CC[C@@H](c1ccccn1)c1c(Cl)c(Cl)cc2[nH]c(=O)c(=O)[nH]c12 ZINC000029040500 FG Annotated Anodyne CC[C@H](c1ccccn1)c1c(Cl)c(Cl)cc2[nH]c(=O)c(=O)[nH]c12 ZINC000029040502 FG Annotated Anodyne CNC(=O)c1ccc(C)c(N2Cc3nc(NC4CCCC4)sc3C2=O)c1 ZINC000029041457 FG Annotated Anodyne CCCNc1nc2c(s1)C(=O)N(c1cc(C(=O)NCC)ccc1C)C2 ZINC000029041461 FG Annotated Anodyne CCNC(=O)c1ccc(C)c(N2Cc3nc(NC(C)C)sc3C2=O)c1 ZINC000029041463 FG Annotated Anodyne N[C@@](C(=O)O)(C1CC(C(=O)O)C1)C1c2ccccc2Sc2ccccc21 ZINC000029041552 FG Annotated Anodyne N[C@](C(=O)O)(C1CC(C(=O)O)C1)C1c2ccccc2Sc2ccccc21 ZINC000029041554 FG Annotated Anodyne Cc1c(C2=CC[C@H](C(=O)N(C)C(C)C)CC2)nnn1-c1cccnc1F ZINC000029041556 FG Annotated Anodyne Cc1c(C2=CC[C@@H](C(=O)N(C)C(C)C)CC2)nnn1-c1cccnc1F ZINC000029041558 FG Annotated Anodyne COc1cc([C@@H]2C[C@H](O)C[C@H](CCc3ccc(O)cc3)O2)cc(O)c1O ZINC000029042018 FG Annotated Clean in-vitro biogenic CC1(C)C(=O)[C@@H](O)C[C@@H]2C1=CC[C@H]1[C@]3(C)CC(=O)C[C@@]3(C)CC(=O)[C@]12C ZINC000029042767 FG Annotated Anodyne CCS(=O)(=O)c1ccc2c(c1)nc(CC(C)C)n2CC1CCOCC1 ZINC000029042802 FG Annotated Anodyne CC(C)(C)CNc1nc(C#N)ncc1C#CCn1cnc(Cl)c1Cl ZINC000029051156 FG Annotated Mild O=c1c2ccccc2oc2c([N+](=O)[O-])cc3[nH]c(CN4CCCC4)nc3c12 ZINC000029056823 FG Annotated Bother C[N+](C)=c1ccc2nc3c(cc(NCCC(=O)O)c4ccccc43)oc-2c1 ZINC000029058211 FG Annotated Bother O=C(c1ccco1)c1cnn2c1n[n+]([O-])c1ccc(Oc3ccccc3)cc12 ZINC000029058233 FG Annotated Anodyne COc1cc(-c2nnc([S@@](=O)Cc3ccccc3)o2)cc(OC)c1OC ZINC000029123293 FG Annotated Anodyne COc1cc(-c2nnc([S@](=O)Cc3ccccc3)o2)cc(OC)c1OC ZINC000029123294 FG Annotated Anodyne CCN(CC)CCN1C(=O)c2c(c3c(ccn3C)c3ccsc23)C1=O ZINC000029124423 FG Annotated Anodyne CCN(CC)CCN1C(=O)C(c2cccs2)=C(c2cccs2)C1=O ZINC000029124500 FG Annotated Anodyne CN(C(=O)Cc1cs/c(=N\c2ccc(C#N)cc2)n1C)c1ccccc1 ZINC000029124750 FG Annotated Mild O=C(Nc1cc(Cl)cc(Cl)c1)[C@@H]1C(=O)O[C@@H](c2ccccc2)C1=O ZINC000029126907 FG Annotated Anodyne C[C@@]12CC[C@@](C)(O1)[C@H]1C(=O)N(c3ccc(C#N)c(C(F)(F)F)c3)C(=O)[C@H]12 ZINC000029126925 FG Annotated Mild C[C@@]12CC[C@@](C)(O1)[C@@H]1C(=O)N(c3ccc(C#N)c(C(F)(F)F)c3)C(=O)[C@@H]12 ZINC000029126926 FG Annotated Mild O=C1[C@@H]2[C@@H]3CC[C@@H](O3)[C@@H]2C(=O)N1c1ccc(Br)c2ccccc12 ZINC000029127399 FG Annotated Anodyne O=C1c2nc3cc(-c4cccs4)nn3c(O)c2CN1Cc1ccccc1 ZINC000029127658 FG Annotated Anodyne COc1ccc(O)c(-c2nc(SC)ncc2Sc2nccn2C)c1 ZINC000029128079 FG Annotated Anodyne Cc1cccc(C)c1CNc1cc(C(=O)N(C)C)nc2c(CO)c(C)[nH]c12 ZINC000029128222 FG Annotated Anodyne O=C1c2nc3cc(-c4ccco4)nn3c(O)c2CN1CCCc1ccccc1 ZINC000029128306 FG Annotated Anodyne COc1cc(N[C@@H](C)CCCN2C(=O)[C@H](C)NC2(C)C)c2ncccc2c1 ZINC000029128501 FG Annotated Anodyne COc1cc(N[C@H](C)CCCN2C(=O)[C@H](C)NC2(C)C)c2ncccc2c1 ZINC000029128502 FG Annotated Anodyne COC(=O)c1cc(NC(=O)/C=C/c2cccs2)ccc1N1CCOCC1 ZINC000029128588 FG Annotated Anodyne Cc1cc(=O)c(O)c(C(=O)NCc2ccc(-c3ccc(C#N)cc3)cc2)o1 ZINC000029129003 FG Annotated Mild O=C1CCCCc2cnn3c(NC4CC4)nc(nc23)Nc2cccc(c2)N1 ZINC000029129113 FG Annotated Anodyne in-vivo O=C1O[C@@H](Cn2ccnn2)CN1c1ccc2c(c1)Oc1ccccc1O2 ZINC000029130819 FG Annotated Anodyne Oc1cc2c(cc1O)CN(C(=S)NCCCc1ccccc1)CCC2 ZINC000029131691 FG Annotated Clean Oc1cc2c(cc1O)CN(C(=S)NCCc1ccc(F)cc1)CCC2 ZINC000029131837 FG Annotated Clean Cc1cn2c(/C=N/N=C(N)N)c(-c3cc(Cl)sc3Cl)nc2s1 ZINC000029133459 FG Annotated Mild NC(N)=N/N=C/c1c(-c2cc(Cl)sc2Cl)nc2sccn12 ZINC000029133534 FG Annotated Mild CC1(C)OC2=C(C(=O)c3ccccc3C2=O)[C@@H](OCc2ccccc2)[C@@H]1O ZINC000029135526 FG Annotated Mild CC1(C)OC2=C(C(=O)c3ccccc3C2=O)[C@H](OCc2ccccc2)[C@@H]1O ZINC000029135528 FG Annotated Mild CC1(C)OC2=C(C(=O)c3ccccc3C2=O)[C@@H](OCc2ccccc2)[C@H]1O ZINC000029135530 FG Annotated Mild CC1(C)OC2=C(C(=O)c3ccccc3C2=O)[C@H](OCc2ccccc2)[C@H]1O ZINC000029135531 FG Annotated Mild Nc1nc(N)c2c3c(oc2n1)CN(Cc1c(Cl)cccc1Cl)CC3 ZINC000029207837 FG Annotated Anodyne CCc1nc(C)c(Br)n1-c1ccc(-c2ccc(=O)[nH]n2)cc1 ZINC000029207940 FG Annotated Anodyne CCN([C@@H]1CCN2CCc3ccccc3[C@@H]2C1)S(=O)(=O)CC(C)C ZINC000029213305 FG Annotated Anodyne Cc1ccccc1S(=O)(=O)N(C)[C@@H]1CCN2CCc3ccccc3[C@@H]2C1 ZINC000029214187 FG Annotated Anodyne Cc1ccc(S(=O)(=O)N(C)[C@@H]2CCN3CCc4ccccc4[C@@H]3C2)cc1 ZINC000029214197 FG Annotated Anodyne CCCCCS(=O)(=O)N(C)[C@@H]1CCN2CCc3ccccc3[C@@H]2C1 ZINC000029214656 FG Annotated Anodyne CN([C@@H]1CCN2CCc3ccccc3[C@@H]2C1)S(=O)(=O)c1ccccc1 ZINC000029215412 FG Annotated Anodyne CN([C@@H]1CCN2CCc3ccccc3[C@@H]2C1)S(=O)(=O)CC(C)(C)C ZINC000029216590 FG Annotated Anodyne CN([C@@H]1CCN2CCc3ccccc3[C@@H]2C1)S(=O)(=O)c1ccsc1 ZINC000029219687 FG Annotated Anodyne CC(=O)NCCOC(=O)[C@H](C)c1ccc2c(c1)Oc1ccccc1CO2 ZINC000029221615 FG Annotated Anodyne CC(=O)NCCOC(=O)[C@@H](C)c1ccc2c(c1)Oc1ccccc1CO2 ZINC000029221620 FG Annotated Anodyne O=C(Cn1c2c(c3ccccc31)C(=O)CN1CCCC[C@@H]21)NC1CCCC1 ZINC000029222920 FG Annotated Anodyne O=C(Cn1c2c(c3ccccc31)C(=O)CN1CCCC[C@H]21)NC1CCCC1 ZINC000029222925 FG Annotated Anodyne CC(=O)O[C@H]1C[C@H]2/C=C\CCC[C@H](C)OC(=O)/C=C/[C@@H](OC(C)=O)[C@@H]2C1 ZINC000029226871 FG Annotated Anodyne COc1ccccc1CNC(=O)c1ccc2c(Br)nccc2n1 ZINC000029242809 FG Annotated Anodyne CC(=O)N1N=C2/C(=C/c3cccnc3)CSC[C@H]2[C@@H]1c1cccnc1 ZINC000029245211 FG Annotated Anodyne CC(=O)N1N=C2/C(=C/c3cccnc3)CSC[C@@H]2[C@@H]1c1cccnc1 ZINC000029245218 FG Annotated Anodyne CC(=O)N1N=C2/C(=C/c3cccnc3)CSC[C@H]2[C@H]1c1cccnc1 ZINC000029245224 FG Annotated Anodyne CC(=O)N1N=C2/C(=C/c3cccnc3)CSC[C@@H]2[C@H]1c1cccnc1 ZINC000029245231 FG Annotated Anodyne CCSC1=NC(=O)[C@@]2(CC(C)(C)Oc3ccc(Br)cc32)N1 ZINC000029250998 FG Annotated Anodyne CCSC1=NC(=O)[C@]2(CC(C)(C)Oc3ccc(Br)cc32)N1 ZINC000029251004 FG Annotated Anodyne COc1ccc([C@@H]2CC[C@@H](OCCCc3ccc[n+](C)c3)O2)cc1OC ZINC000029306239 FG Annotated Anodyne CSC1=NC(=O)[C@@]2(CC(C)(C)Oc3ccc(Br)cc32)N1 ZINC000029307087 FG Annotated Anodyne CSC1=NC(=O)[C@]2(CC(C)(C)Oc3ccc(Br)cc32)N1 ZINC000029307092 FG Annotated Anodyne COC(=O)[C@@H](C)Oc1ccc(N(C)c2nnc3cc(Cl)ccc3n2)cc1 ZINC000029307856 FG Annotated Anodyne COC(=O)[C@H](C)Oc1ccc(N(C)c2nnc3cc(Cl)ccc3n2)cc1 ZINC000029307862 FG Annotated Anodyne COc1cc([S@@](C)=O)ccc1-c1nc2cc3c(cc2[nH]1)C(C)(C)C(=O)N3 ZINC000029307977 FG Annotated Anodyne COc1cc([S@](C)=O)ccc1-c1nc2cc3c(cc2[nH]1)C(C)(C)C(=O)N3 ZINC000029307983 FG Annotated Anodyne COc1ccc([C@H]2CC[C@@H](OCCCc3ccc[n+](C)c3)O2)cc1OC ZINC000029308568 FG Annotated Anodyne COC(=O)[C@@H](C)Oc1ccc(Oc2nnc3cc(Cl)ccc3n2)cc1 ZINC000029309948 FG Annotated Anodyne COC(=O)[C@H](C)Oc1ccc(Oc2nnc3cc(Cl)ccc3n2)cc1 ZINC000029309954 FG Annotated Anodyne COc1ccc([C@@H]2CC[C@@H](OCCCn3c(C)nnc3C)O2)cc1OC ZINC000029316794 FG Annotated Anodyne COc1ccc([C@H]2CC[C@@H](OCCCn3c(C)nnc3C)O2)cc1OC ZINC000029316799 FG Annotated Anodyne COc1ccc([C@@H]2CC[C@H](OCCCn3c(C)nnc3C)O2)cc1OC ZINC000029316804 FG Annotated Anodyne COc1ccc([C@H]2CC[C@H](OCCCn3c(C)nnc3C)O2)cc1OC ZINC000029316809 FG Annotated Anodyne Cc1csc(Sc2cc3c(cc2NS(C)(=O)=O)CCC3=O)n1 ZINC000029321678 FG Annotated Anodyne CSCOC(=O)Cc1cccc2cc([C@@H](O)CNC(C)(C)C)oc12 ZINC000029324820 FG Annotated Anodyne CSCOC(=O)Cc1cccc2cc([C@H](O)CNC(C)(C)C)oc12 ZINC000029324822 FG Annotated Anodyne CCN(CC)CCN1C(=O)c2cc(Cl)c(NC=O)cc2OC(C)=C1C ZINC000029326066 FG Annotated Anodyne C[C@@H]1NC(=S)N(Nc2cccc(Cl)c2)[C@@H]1c1cccc(C(N)=O)c1 ZINC000029328431 FG Annotated Anodyne C[C@H]1NC(=S)N(Nc2cccc(Cl)c2)[C@@H]1c1cccc(C(N)=O)c1 ZINC000029328435 FG Annotated Anodyne C[C@@H]1NC(=S)N(Nc2cccc(Cl)c2)[C@H]1c1cccc(C(N)=O)c1 ZINC000029328439 FG Annotated Anodyne C[C@H]1NC(=S)N(Nc2cccc(Cl)c2)[C@H]1c1cccc(C(N)=O)c1 ZINC000029328444 FG Annotated Anodyne CN(C)CCn1nc2c3ccccc3sc3c(NCCN)ccc1c32 ZINC000029329576 FG Annotated Bother N#CCOc1ccc(C(=O)c2ccc(O)c(CN)c2)c(Cl)c1Cl ZINC000029331836 FG Annotated Mild Cc1nc(Sc2cc3c(cc2NS(C)(=O)=O)CCC3=O)sc1C ZINC000029332207 FG Annotated Anodyne Nc1ncc2c(n1)-c1ccc(Cl)cc1C(c1ccccc1F)=[N+]([O-])C2 ZINC000029333040 FG Annotated Anodyne CS(=O)(=O)Nc1cc2c(cc1Sc1ncccc1Cl)C(=O)CC2 ZINC000029339138 FG Annotated Anodyne CCN(CC)Cc1cc(OC)c2c(c1)C(=O)c1cc(OC)cc(O)c1C2=O ZINC000029340303 FG Annotated Clean C=CCC1=C[C@]2(OC)[C@H](C)[C@@H](c3ccc4c(c3)OCO4)O[C@]2(OC)C[C@@H]1O ZINC000029341564 FG Annotated Mild CN(C)CCN1C(=O)c2ccc(N(C)C)c3cc4ccccc4c(c23)C1=O ZINC000029341653 FG Annotated Bother Cc1cnc(Sc2cc3c(cc2NS(C)(=O)=O)CCC3=O)s1 ZINC000029341788 FG Annotated Clean CNc1nc2c(N(C)C)nc(C(F)(F)F)nc2n1Cc1ccc(C)cc1 ZINC000029347149 FG Annotated Anodyne CC(=O)COc1ccc(C(=O)c2ccc(O)c(CN)c2)c(Cl)c1Cl ZINC000029348134 FG Annotated Clean CCOC(=S)SCc1c2c(n3c1CCC3)C(=O)C(C)=C(OC)C2=O ZINC000029392373 FG Annotated Mild COc1nc2c(N(C)C)nc(C(F)(F)F)nc2n1Cc1ccc(C)cc1 ZINC000029392435 FG Annotated Anodyne O=C(Oc1cccc2c1C(=O)C=C(N1CC1)C2=O)c1ccc(Cl)cc1 ZINC000029392507 FG Annotated Mild CC(C)(C)NC(=O)N[C@@H]1[C@@H](O)c2cc(C(F)(F)F)ccc2OC1(C)C ZINC000029392892 FG Annotated Anodyne CC(C)(C)NC(=O)N[C@@H]1[C@H](O)c2cc(C(F)(F)F)ccc2OC1(C)C ZINC000029392895 FG Annotated Anodyne CN(C(=O)Cc1cccc2occc12)[C@@H]1CCCC[C@H]1N1CC[C@@H](CO)C1 ZINC000029394159 FG Annotated Anodyne CN(C(=O)Cc1cccc2occc12)[C@@H]1CCCC[C@H]1N1CC[C@H](CO)C1 ZINC000029394162 FG Annotated Anodyne COc1c(C(=O)Nc2nn[nH]n2)oc2c3ccccc3n(-c3ccccc3)c12 ZINC000029395377 FG Annotated Anodyne O=c1[nH]c2ccc(Br)cc2n1Cc1cc(Cl)ccc1O ZINC000029396264 FG Annotated Clean Cc1cn([C@@H]2O[C@H](COCc3ccccc3)[C@@H](F)[C@@H]2F)c(O)nc1=S ZINC000029397256 FG Annotated Anodyne Cc1cn([C@H]2O[C@H](COCc3ccccc3)[C@@H](F)[C@@H]2F)c(O)nc1=S ZINC000029397259 FG Annotated Anodyne COc1cccc2c1CCCN1C(=O)[C@@H](Oc3ccccc3)[C@]21SC ZINC000029402848 FG Annotated Anodyne c1ccc(C(c2ccccc2)N2CCN(c3nncc4cncn34)CC2)cc1 ZINC000029404711 FG Annotated Anodyne Cc1cc(Cn2cc(C(=O)C(=O)Nc3cc(C)no3)c3ccccc32)on1 ZINC000029412025 FG Annotated Anodyne CC1(C)N=C(N)N=CN1c1ccc(CCc2ccc3c(c2)OCO3)cc1 ZINC000029414798 FG Annotated Anodyne CN1CCN(c2cc3nc(/C=C/c4ccccc4)nc(O)c3cc2F)CC1 ZINC000029415484 FG Annotated Anodyne CN(C)c1nc(C(F)(F)F)nc2c1ncn2Cc1ccc(Cl)cc1N ZINC000029416835 FG Annotated Anodyne Cc1cc(NC(=O)C(=O)c2cn(Cc3ccno3)c3ccccc23)sn1 ZINC000029461932 FG Annotated Anodyne Cc1cc(-c2ccc3c(=O)c(C(=O)O)cn4c3c2OC[C@@H]4C)cc(C)n1 ZINC000029461970 FG Annotated Anodyne COc1cc(Cn2cnc3c(N(C)C)nc(C(F)(F)F)nc32)ccc1C ZINC000029471729 FG Annotated Anodyne CN(C)c1ccc(Cn2cnc3c(N(C)C)nc(C(F)(F)F)nc32)cc1 ZINC000029472822 FG Annotated Clean COc1ccc(Cn2cnc3c(N(C)C)nc(C(F)(F)F)nc32)cc1C ZINC000029476142 FG Annotated Anodyne CCCN1C(=O)c2cc(OCCCC(=O)O)c(Cl)c(Cl)c2C1=O ZINC000029476913 FG Annotated Anodyne COc1cc(C)ccc1Cn1cnc2c(N(C)C)nc(C(F)(F)F)nc21 ZINC000029478263 FG Annotated Anodyne Nc1cc(S(=O)(=O)c2ccccc2Cl)c([N+](=O)[O-])c2cccnc12 ZINC000029479098 FG Annotated Bother CN(C)c1nc(C(F)(F)F)nc2c1ncn2Cc1ccc(Cl)c(N)c1 ZINC000029479226 FG Annotated Anodyne Nc1cc(S(=O)(=O)c2cccc(Cl)c2)c([N+](=O)[O-])c2cccnc12 ZINC000029479772 FG Annotated Bother O=C(O)CCCOc1cc2c(cc1Cl)C(=O)N(C1CCCC1)C2=O ZINC000029480858 FG Annotated Anodyne CCc1ccccc1S(=O)(=O)c1cc(N)c2ncccc2c1[N+](=O)[O-] ZINC000029481412 FG Annotated Bother O=C(O)CCCOc1ccc2c(c1Cl)C(=O)N(C1CCCC1)C2=O ZINC000029483665 FG Annotated Anodyne CC1=NC(C)=C([N+](=O)[O-])[C@H](c2ncccc2[N+](=O)[O-])/C1=C(/O)OC(C)C ZINC000029484884 FG Annotated Bother CC1=NC(C)=C([N+](=O)[O-])[C@@H](c2ncccc2[N+](=O)[O-])/C1=C(/O)OC(C)C ZINC000029484887 FG Annotated Bother CN(CCCl)CCCNc1cccc2c1C(=O)c1ccccc1C2=O ZINC000029545146 FG Annotated Reactive O=C1Nc2ccc(S(=O)(=O)O)cc2C1(c1ccccc1)c1ccccc1 ZINC000029547945 FG Annotated Anodyne CS(=O)(=O)Nc1cc2c(cc1Cc1cccc(C(F)(F)F)c1)OCO2 ZINC000029550944 FG Annotated Anodyne CC(C)COC(=O)c1cc(CN2CCCC2)c(O)c(CN2CCCC2)c1 ZINC000029551539 FG Annotated Clean CC(C)COC(=O)Cc1cc(CN2CCCC2)c(O)c(CN2CCCC2)c1 ZINC000029552012 FG Annotated Clean CCCOC(=O)Cc1cc(CN2CCCC2)c(O)c(CN2CCCC2)c1 ZINC000029553826 FG Annotated Clean CCCOC(=O)CCc1cc(CN2CCCC2)c(O)c(CN2CCCC2)c1 ZINC000029554591 FG Annotated Clean CC(C)OC(=O)CCc1cc(CN2CCCC2)c(O)c(CN2CCCC2)c1 ZINC000029556643 FG Annotated Clean CC(C)OC(=O)Cc1cc(CN2CCCC2)c(O)c(CN2CCCC2)c1 ZINC000029557861 FG Annotated Clean COC(=O)CCc1ccc2c(c1)C(n1ccc3ccccc31)=CC(=O)C2=O ZINC000029563042 FG Annotated Mild CC[C@@H](C)OC(=O)c1cc(O)cc(OC)c1C(=O)c1c(O)cc(C)cc1O ZINC000029564031 FG Annotated Anodyne CC[C@H](C)OC(=O)c1cc(O)cc(OC)c1C(=O)c1c(O)cc(C)cc1O ZINC000029564035 FG Annotated Anodyne CCCCOC(=O)c1cc(O)cc(OC)c1C(=O)c1c(O)cc(C)cc1O ZINC000029567092 FG Annotated Anodyne N[C@@]12CC(C(F)(F)F)=C[C@@H](Cc3[nH]c(=O)ccc31)/C2=C\C(F)(F)F ZINC000029569172 FG Annotated Anodyne N[C@]12CC(C(F)(F)F)=C[C@H](Cc3[nH]c(=O)ccc31)/C2=C\C(F)(F)F ZINC000029569175 FG Annotated Anodyne CCCCS(=O)(=O)/C=C\[C@@H]1[C@@H](S(=O)(=O)CCCC)[C@@H]2C=C[C@H]1C2 ZINC000029749189 FG Annotated Anodyne CC(=O)O[C@@H]1[C@H](C)C[C@@H]2[C@H]3[C@@H]1[C@@H]1CC(=O)CCC[C@](C)(OC[C@@H]2C)[C@@H]3O1 ZINC000299806589 FG Annotated Anodyne O=[N+]([O-])c1ccc(O[C@@H]2[C@@H](n3ccnc3)CCC[C@H]2n2ccnc2)cc1 ZINC000299806629 FG Annotated Bother Cc1cc(C)c(NN=C2CC[C@@H](C)n3c2ncc(C(=O)O)c3=O)cc1C ZINC000299809180 FG Annotated Mild Cc1cc(C)c(NN=C2CC[C@H](C)n3c2ncc(C(=O)O)c3=O)cc1C ZINC000299809181 FG Annotated Mild COc1cc(OC)c(OC)cc1C=NN=c1cc(C)[nH]c2ccccc12 ZINC000299809256 FG Annotated Mild CC(=O)O[C@@]1(C)CC[C@H]2C[C@H]1OO[C@]2(C)C[S@@](=O)c1ccccc1 ZINC000299810612 FG Annotated Reactive CC(=O)O[C@]1(C)CC[C@H]2C[C@H]1OO[C@]2(C)C[S@@](=O)c1ccccc1 ZINC000299810613 FG Annotated Reactive CC(=O)O[C@]1(C)CC[C@H]2C[C@H]1OO[C@]2(C)C[S@](=O)c1ccccc1 ZINC000299810614 FG Annotated Reactive CC(=O)O[C@@]1(C)CC[C@H]2C[C@H]1OO[C@]2(C)C[S@](=O)c1ccccc1 ZINC000299810615 FG Annotated Reactive CC(=NNC(=N)O)C1=C(O)[C@H](c2ccccc2)N(C2CCCCC2)C1=O ZINC000299810718 FG Annotated Mild CC(=NNC(=N)O)C1=C(O)[C@@H](c2ccccc2)N(C2CCCCC2)C1=O ZINC000299810719 FG Annotated Mild COc1ccc(C#C[C@@H]2C=C[C@@H](Oc3cc(C)cc(C)c3)[C@H](CO)O2)cc1 ZINC000299813094 FG Annotated Mild Cn1c(O)c(N=NC(=O)CNC(=O)/C=C/c2ccccc2)c2ccccc21 ZINC000299813109 FG Annotated Clean Cn1c(O)c(N=NC(=O)Cn2ccc(C(F)(F)F)n2)c2ccccc21 ZINC000299813286 FG Annotated Clean CCOC(=O)OC[C@@H]1O[C@H](C#Cc2ccccc2)C=C[C@H]1OC(=O)OCC ZINC000299813302 FG Annotated Mild NC(=S)N=Nc1c(O)n(CC(=O)Nc2ccccc2)c2ccccc12 ZINC000299813332 FG Annotated Clean COC(=O)[C@@]12C[C@@H](C)[C@H]3[C@H](C)[C@@H](c4ccccc4[C@H]31)N2C(=O)C(F)(F)F ZINC000299813609 FG Annotated Anodyne COC(=O)[C@@]12C[C@@H](C)[C@@H]3[C@H]1c1ccccc1[C@H]([C@@H]3C)N2C(=O)C(F)(F)F ZINC000299813610 FG Annotated Anodyne COC(=O)[C@@]12C[C@H](C)[C@@H]3[C@H]1c1ccccc1[C@H]([C@@H]3C)N2C(=O)C(F)(F)F ZINC000299813611 FG Annotated Anodyne COC(=O)[C@@]12C[C@H](C)[C@H]3[C@H](C)[C@@H](c4ccccc4[C@H]31)N2C(=O)C(F)(F)F ZINC000299813612 FG Annotated Anodyne Cc1oc(-c2ccccc2)cc1C[N@@+]1(C)C(=O)[C@@H]2[C@H]3CC[C@H](O3)[C@@H]2C1=O ZINC000299813789 FG Annotated Bother Cc1oc(-c2ccccc2)cc1C[N@+]1(C)C(=O)[C@@H]2[C@H]3CC[C@H](O3)[C@@H]2C1=O ZINC000299813790 FG Annotated Bother C[C@@H]1C=CCC(=O)NCc2cccc(c2)CNC(=O)N[C@@H]1c1ccccc1 ZINC000299813914 FG Annotated Anodyne C[C@@H]1C=CCC(=O)NCc2cccc(c2)CNC(=O)N[C@H]1c1ccccc1 ZINC000299813915 FG Annotated Anodyne C[C@H]1C=CCC(=O)NCc2cccc(c2)CNC(=O)N[C@@H]1c1ccccc1 ZINC000299813916 FG Annotated Anodyne CC(C)N(C(=O)[C@@]12[C@H]3[C@@H]4[C@H]5[C@@H]([C@@H]41)[C@@]2(C(=O)N(C(C)C)C(C)C)[C@H]53)C(C)C ZINC000299814410 FG Annotated Anodyne CC(C)N(C(=O)[C@@]12[C@H]3[C@@H]4[C@@H]5[C@H]3[C@@]1(C(=O)N(C(C)C)C(C)C)[C@H]5[C@@H]42)C(C)C ZINC000299814411 FG Annotated Anodyne CC(C)N(C(=O)[C@@]12[C@@H]3[C@@H]4[C@@H]5[C@H]3[C@H]1[C@@H]5[C@@]42C(=O)N(C(C)C)C(C)C)C(C)C ZINC000299814412 FG Annotated Anodyne CC(C)=CCC/C(C)=C/CNCCN[C@]12O[C@H]3[C@@H]4[C@H]5C[C@@H]([C@@H]6[C@@H]5[C@@H]3[C@@H]61)[C@H]42 ZINC000299815019 FG Annotated Anodyne CC(C)=CCC/C(C)=C/CNCCN[C@@]12O[C@H]3[C@@H]4[C@H]5C[C@H]([C@@H]41)[C@@H]1[C@@H]5[C@@H]3[C@@H]12 ZINC000299815022 FG Annotated Anodyne CC(C)=CCC/C(C)=C/CNCCN[C@]12O[C@@H]3[C@H]4[C@@H]1[C@@H]1[C@@H]5C[C@H]([C@@H]3[C@@H]52)[C@@H]41 ZINC000299815023 FG Annotated Anodyne CC(C)=CCC/C(C)=C/CNCCN[C@@]12O[C@H]3[C@@H]4[C@H]5C[C@H]([C@@H]41)[C@H]1[C@H]2[C@H]3[C@H]51 ZINC000299815026 FG Annotated Anodyne C[C@@H](CC(=O)N1[C@@H]2C[C@H]3CC[C@@]2(CS1(=O)=O)C3(C)C)[Si](C)(C)C ZINC000299816049 FG Annotated Anodyne C[C@@H](CC(=O)N1[C@H]2C[C@H]3CC[C@@]2(CS1(=O)=O)C3(C)C)[Si](C)(C)C ZINC000299816050 FG Annotated Anodyne C[C@H](CC(=O)N1[C@@H]2C[C@H]3CC[C@@]2(CS1(=O)=O)C3(C)C)[Si](C)(C)C ZINC000299816051 FG Annotated Anodyne C[C@H](CC(=O)N1[C@H]2C[C@H]3CC[C@@]2(CS1(=O)=O)C3(C)C)[Si](C)(C)C ZINC000299816052 FG Annotated Anodyne C[C@H]1C[C@@H](C)C[C@@H]([C@@H]2C[C@@H](CC(=O)NC3CCCCC3)CC(=O)O2)[C@H]1O ZINC000299816580 FG Annotated Anodyne C[C@H]1C[C@@H](C)C[C@@H]([C@H]2C[C@H](CC(=O)NC3CCCCC3)CC(=O)O2)[C@H]1O ZINC000299816581 FG Annotated Anodyne C[C@H]1C[C@@H](C)C[C@@H]([C@H]2C[C@@H](CC(=O)NC3CCCCC3)CC(=O)O2)[C@H]1O ZINC000299816582 FG Annotated Anodyne CCn1nccc1Oc1cc(Sc2ccccn2)cnc1NC(=O)NC ZINC000299819183 FG Annotated Anodyne COc1cc(C(=O)c2cc(C(=O)O)c3cccc(C)n23)cc(OC)c1OC ZINC000299819329 FG Annotated Anodyne CCCN1CC[C@@]2(OC)OC(N)=C(C#N)[C@@H](c3ccc(Cl)cc3)[C@@H]2C1 ZINC000299819612 FG Annotated Reactive COc1ccccc1-c1ccc2nc(C(=O)NCc3ccncc3)cn2c1 ZINC000299819722 FG Annotated Anodyne O=C(Nc1ccccc1F)C1CCN(c2ccnc3nsnc23)CC1 ZINC000299820540 FG Annotated Anodyne CNC(=O)Nc1ncc(SCCCOC)cc1Oc1cccnc1C ZINC000299820603 FG Annotated Anodyne COC1CCN(c2nccc(Nc3cc4c(cn3)CCN4C(C)C)n2)CC1 ZINC000299821258 FG Annotated Anodyne Cn1cc(-c2ccc(Cn3cc4c(=O)[nH]nc-4c4ccccc43)c(F)c2)cn1 ZINC000299821464 FG Annotated Anodyne O=C1C=CC2(C=C1)OC(=O)C(c1ccc([N+](=O)[O-])cc1)=C2c1ccccc1 ZINC000299821598 FG Annotated Mild CN(C)[C@@H]1CC[C@@H](Nc2ncnc3sc4ccc(C(N)=O)cc4c23)CC1 ZINC000299821629 FG Annotated Anodyne CN1[C@H]2C[C@H]3[C@@H]4CC(=O)O[C@]4(C)OC[C@H]3[C@@H]1Cc1c2n(C)c2ccccc12 ZINC000299822155 FG Annotated Anodyne COC[C@@H]1CN(c2noc3cc(OCCCCCF)ccc23)C(=O)O1 ZINC000299822506 FG Annotated Anodyne COC(=O)[C@]1(C)CCC[C@]2(C)[C@H]3C[C@@]4(O)OC(=O)C=C4[C@H](C)[C@@H]3CC[C@@H]12 ZINC000299822544 FG Annotated Anodyne CC1CCC(NC(=O)c2cc3cccnc3n(CCCCF)c2=O)CC1 ZINC000299822786 FG Annotated Anodyne O=C1C=CC2(C=C1)OC(=O)C(c1ccc(C(=O)O)cc1)=C2c1ccccc1 ZINC000299823631 FG Annotated Mild O=S(=O)(Nc1nccnc1Nc1ccnc(Cl)c1)c1ccccc1 ZINC000299823718 FG Annotated Anodyne CCOC(=O)c1cc2c(n1CC)C(=O)C(Oc1ccccc1C)=CC2=O ZINC000299823960 FG Annotated Mild COc1ccc(OC)c(Sc2ccc3nnc(-c4cncs4)n3n2)c1 ZINC000299823974 FG Annotated Anodyne O=C1CCC(=O)N1Nc1ncnc2scc(-c3ccc(Cl)cc3)c12 ZINC000299824244 FG Annotated Anodyne COC(=O)Nc1nc2cc(S(=O)(=O)c3c[nH]c4ccccc34)ccc2[nH]1 ZINC000299824737 FG Annotated Anodyne CC(C)NC(=O)c1c(NC(C)C)c2cccnc2n2c(C(C)C)nnc12 ZINC000299824884 FG Annotated Anodyne CCc1cc(O)nc(Nc2ccc(Cl)c(S(=O)(=O)C(C)C)c2O)n1 ZINC000299825004 FG Annotated Anodyne CCOC(=O)c1cc2c(n1CC)C(=O)C(Oc1ccc(OC)cc1)=CC2=O ZINC000299825270 FG Annotated Mild COC(=O)Nc1nc2cc([S@@](=O)c3c[nH]c4ccccc34)ccc2[nH]1 ZINC000299825450 FG Annotated Anodyne COC(=O)Nc1nc2cc([S@](=O)c3c[nH]c4ccccc34)ccc2[nH]1 ZINC000299825452 FG Annotated Anodyne CCCNC(=O)c1c(NC(C)C)c2cccnc2n2c(C(C)C)nnc12 ZINC000299825750 FG Annotated Anodyne CC(=O)O[C@@H]1[C@H]2[C@H](C)OC[C@H]3[C@@H]4Cc5c(n(C)c6ccccc56)[C@H](C[C@H]32)N41 ZINC000299825786 FG Annotated Anodyne Nc1ncc(-c2ccc(-c3noc(Cc4c[nH]c5ccccc45)n3)o2)cn1 ZINC000299826327 FG Annotated Anodyne COc1ccc(OC)c(Sc2ccn3ncc(-c4cnn(C)c4)c3n2)c1 ZINC000299826437 FG Annotated Anodyne COc1ccc(OC)c(Sc2ccc3nnc(-c4ccsn4)n3n2)c1 ZINC000299826595 FG Annotated Anodyne CCC1=CN(C)[C@H]2Cc3c([nH]c4ccccc34)C(=O)C[C@H]1[C@@H]2C(=O)OC ZINC000299827350 FG Annotated Anodyne COC1CCN(c2nccc(Nc3cc4c(C(C)C)n[nH]c4cn3)n2)CC1 ZINC000299827396 FG Annotated Anodyne COc1ccc(OC)c(Sc2ccc3nnc(-c4cccnc4)n3n2)c1 ZINC000299827454 FG Annotated Anodyne COc1ccc(C(=O)c2c(O)cc3c(c2O)CCC(C)(C)O3)cc1OC ZINC000299827710 FG Annotated Anodyne C#CCNC(=O)c1cc(C(=O)c2ccc(Cl)cc2)n2c(C)cccc12 ZINC000299828683 FG Annotated Mild CO[C@@]12CCN(C)C[C@H]1[C@H](c1ccc(Cl)cc1Cl)C(C#N)=C(N)O2 ZINC000299828744 FG Annotated Reactive COc1cc(C(=O)c2c(O)cc3c(c2O)CCC(C)(C)O3)cc(OC)c1O ZINC000299828880 FG Annotated Anodyne S=C(Nc1ccc(Cl)cc1)Nn1c(S)nnc1-c1ccncc1 ZINC000299830130 FG Annotated Anodyne CCCCc1cn([C@H]2C3=C(OC2(C)C)c2ccccc2C(=O)C3=O)nn1 ZINC000299831073 FG Annotated Mild CCCCc1cn([C@@H]2C3=C(OC2(C)C)c2ccccc2C(=O)C3=O)nn1 ZINC000299831080 FG Annotated Mild COc1cc(/C=C/C(=O)NC23CC4CC(CC(C4)C2)C3)cc([N+](=O)[O-])c1O ZINC000299831237 FG Annotated Bother Cc1ccc([C@@H](C2=C(O)CC(C)(C)CC2=O)c2c(O)nc(O)nc2O)cc1 ZINC000299831537 FG Annotated Mild Cc1ccc([C@H](C2=C(O)CC(C)(C)CC2=O)c2c(O)nc(O)nc2O)cc1 ZINC000299831543 FG Annotated Mild COc1nc2ccc(Cl)cc2c2c1/C(=N/NC(=N)N)c1ccccc1-2 ZINC000299832285 FG Annotated Mild CC(=O)O[C@H]1C2=C(C[C@H]3OC(=O)C(C)=C13)[C@]1(C)[C@@H](O)CCC(C)(C)[C@H]1CC2 ZINC000299832363 FG Annotated Anodyne O=C(O)CNC(=O)Cn1ccc2cc(-c3cnc4ccccc4c3)ccc21 ZINC000299832528 FG Annotated Anodyne N#CCc1ccc(-n2cc(COc3ccc4oc(=O)ccc4c3)nn2)cc1 ZINC000299832830 FG Annotated Mild O=C1/C(=C/c2cccc(F)c2)CS(=O)(=O)C/C1=C\c1cccc(F)c1 ZINC000299833163 FG Annotated Mild COc1ccc(C(=O)c2cc3c(s2)C(=O)c2c(O)cccc2C3=O)cc1 ZINC000299833206 FG Annotated Clean COC(=O)[C@@]1(Cc2ccccc2OC)CC(=O)O[C@@]1(C)c1ccccc1 ZINC000299833284 FG Annotated Anodyne COC(=O)[C@@]1(Cc2ccccc2OC)CC(=O)O[C@]1(C)c1ccccc1 ZINC000299833286 FG Annotated Anodyne COC(=O)[C@]1(Cc2ccccc2OC)CC(=O)O[C@]1(C)c1ccccc1 ZINC000299833287 FG Annotated Anodyne COC(=O)[C@]1(Cc2ccccc2OC)CC(=O)O[C@@]1(C)c1ccccc1 ZINC000299833289 FG Annotated Anodyne COc1c(O)ccc(/C=C/C(=O)NC23CC4CC(CC(C4)C2)C3)c1[N+](=O)[O-] ZINC000299833303 FG Annotated Bother COc1ccc(Cl)cc1Sc1ccc2nnc(-c3cnn(C)c3)n2n1 ZINC000299833436 FG Annotated Anodyne CCOC(=O)c1cc2c(n1CC)C(=O)C(Oc1ccc(C)cc1)=CC2=O ZINC000299833492 FG Annotated Mild CCN(CC)CC[C@]1(C(=O)/C=C/c2ccc(N(C)C)cc2)CCOC1=O ZINC000299833575 FG Annotated Mild CCN(CC)CC[C@@]1(C(=O)/C=C/c2ccc(N(C)C)cc2)CCOC1=O ZINC000299833577 FG Annotated Mild CCN(CC)c1nc2cc(O)c3c(c2s1)C(=O)c1cccc(O)c1C3=O ZINC000299834333 FG Annotated Clean C#CCOC(=O)Nc1ccc(C)cc1-n1cnc(-c2ccc(OC)cc2)n1 ZINC000299834479 FG Annotated Mild N#Cc1ccc2[nH]cc([C@H](c3ccccc3)c3oc(CO)cc(=O)c3O)c2c1 ZINC000299834621 FG Annotated Mild N#Cc1ccc2[nH]cc([C@@H](c3ccccc3)c3oc(CO)cc(=O)c3O)c2c1 ZINC000299834624 FG Annotated Mild C[C@H](NC(=O)Cn1ccc2cc(-c3cnc4ccccc4c3)ccc21)C(=O)O ZINC000299835243 FG Annotated Anodyne O=C1c2c(O)cccc2C(=O)c2c1c(O)cc1nc(N3CCCC3)sc21 ZINC000299835409 FG Annotated Clean CN1N=C[C@@H]2C(NC(=O)N[C@@H]3CC(C)(C)Oc4cc(F)ccc43)=CC=C[C@H]21 ZINC000299835444 FG Annotated Anodyne CN1N=C[C@@H]2C(NC(=O)N[C@@H]3CC(C)(C)Oc4cc(F)ccc43)=CC=C[C@@H]21 ZINC000299835446 FG Annotated Anodyne CN1N=C[C@H]2C(NC(=O)N[C@@H]3CC(C)(C)Oc4cc(F)ccc43)=CC=C[C@@H]21 ZINC000299835448 FG Annotated Anodyne CN1N=C[C@H]2C(NC(=O)N[C@@H]3CC(C)(C)Oc4cc(F)ccc43)=CC=C[C@H]21 ZINC000299835450 FG Annotated Anodyne CNc1nc(NCc2ccc(N(C)C(C)=O)cc2)cc(-c2ccccn2)n1 ZINC000299835800 FG Annotated Anodyne COc1ccc(OC)c(Sc2ccc3ncn(-c4cnn(C)c4)c3n2)c1 ZINC000299836005 FG Annotated Anodyne COC(=O)c1c(O)cc(O)c(Cl)c1CCC(=O)N(C)c1ccccc1 ZINC000299836125 FG Annotated Anodyne CCN1CC[C@@]2(OC)OC(N)=C(C#N)[C@@H](c3ccc4ccccc4c3)[C@@H]2C1 ZINC000299836613 FG Annotated Reactive CNC(=O)CCC[C@@H]1CC(=O)c2cc(Cl)cc(Br)c2O1 ZINC000299837301 FG Annotated Anodyne CNC(=O)CCC[C@H]1CC(=O)c2cc(Cl)cc(Br)c2O1 ZINC000299837305 FG Annotated Anodyne COC(=O)c1c(O)cc(O)c(Cl)c1CCC(=O)Nc1ccccc1F ZINC000299837715 FG Annotated Anodyne COC(=O)c1c(O)cc(O)c(Cl)c1CCC(=O)Nc1ccc(C)cc1 ZINC000299837797 FG Annotated Anodyne O=C1C=CC[C@@H](/C=C/c2ccccc2)N1C(=O)CCc1ccc(O)c(O)c1 ZINC000299837884 FG Annotated Clean O=C1C=CC[C@H](/C=C/c2ccccc2)N1C(=O)CCc1ccc(O)c(O)c1 ZINC000299837885 FG Annotated Clean COC(=O)c1c(O)cc(O)c(Cl)c1CCC(=O)Nc1ccc(F)cc1 ZINC000299838778 FG Annotated Anodyne COC(=O)c1c(O)cc(O)c(Cl)c1CCC(=O)Nc1ccccc1C ZINC000299839152 FG Annotated Anodyne COC(=O)c1c(O)cc(O)c(Cl)c1CCC(=O)Nc1cccc(F)c1 ZINC000299839384 FG Annotated Anodyne COc1ncccc1C(=O)Nc1cc(-c2ccc(Br)cc2)[nH]n1 ZINC000299839591 FG Annotated Anodyne CCNC(=O)Nc1nc2cc(-c3cncnc3)cc([C@@H]3CCCO3)c2[nH]1 ZINC000299839651 FG Annotated Anodyne CCNC(=O)Nc1nc2cc(-c3cncnc3)cc([C@H]3CCCO3)c2[nH]1 ZINC000299839652 FG Annotated Anodyne C#Cc1ccc(NC(=O)CCc2c(Cl)c(O)cc(O)c2C(=O)OC)cc1 ZINC000299840850 FG Annotated Mild C[C@@H](NC(=O)N1C[C@H]2C[C@@H](c3ccccc3C(F)(F)F)C[C@H]2C1)C(=O)O ZINC000299841091 FG Annotated Anodyne C[C@H](NC(=O)N1C[C@H]2C[C@@H](c3ccccc3C(F)(F)F)C[C@H]2C1)C(=O)O ZINC000299841092 FG Annotated Anodyne C[C@@]12CCC[C@@](C)(C(=O)O)[C@H]1CC[C@@]13CC(=O)O[C@@](CO)(CC[C@@H]21)C3 ZINC000299841093 FG Annotated Anodyne C#CCOC(=O)N1Cc2nc(-c3ccc(OC)cc3)nn2-c2cc(C)ccc21 ZINC000299841165 FG Annotated Mild COC(=O)[C@@]1(Cc2cccc(OC)c2)CC(=O)O[C@@]1(C)c1ccccc1 ZINC000299841360 FG Annotated Anodyne COC(=O)[C@@]1(Cc2cccc(OC)c2)CC(=O)O[C@]1(C)c1ccccc1 ZINC000299841361 FG Annotated Anodyne COC(=O)[C@]1(Cc2cccc(OC)c2)CC(=O)O[C@]1(C)c1ccccc1 ZINC000299841362 FG Annotated Anodyne COC(=O)[C@]1(Cc2cccc(OC)c2)CC(=O)O[C@@]1(C)c1ccccc1 ZINC000299841363 FG Annotated Anodyne c1ccc(COC[C@H]2CCC[C@]23CN(Cc2nccs2)CCO3)nc1 ZINC000299841735 FG Annotated Anodyne CCc1ncc(CN[C@H]2CCCN(C(C)=O)[C@@H]2c2ccc(C)s2)cn1 ZINC000299841801 FG Annotated Anodyne CC1=N[C@]2(CC[C@H]3CN(Cc4ccccc4C)C[C@H]32)C(=O)N1CC1CC1 ZINC000299841927 FG Annotated Anodyne Cc1cc(C[C@H]2COC[C@@H]2NCc2ccc(Br)s2)on1 ZINC000299842152 FG Annotated Anodyne Cc1ccc(C(=O)N2C[C@H]3CCC[C@H](OCc4cccnc4)[C@@H]3C2)cn1 ZINC000299842171 FG Annotated Anodyne Cc1ccc(C(=O)N2C[C@H]3CCC[C@@H](OCc4cccnc4)[C@@H]3C2)cn1 ZINC000299842172 FG Annotated Anodyne COc1ccc(CN2C[C@H]3CC[C@@](O)(c4ccc(C)cn4)[C@@H]3C2)c(F)c1 ZINC000299842384 FG Annotated Anodyne Cc1ncccc1NC(=O)[C@H]1C[C@H]2CCN(Cc3cccs3)C[C@@H]2O1 ZINC000299842398 FG Annotated Anodyne O=C(c1ccccc1)N1CCC[C@@]2(C[C@@H](Oc3ncccc3F)CO2)C1 ZINC000299842420 FG Annotated Anodyne O=C(NC1CC1)[C@H]1C[C@H]2OCC[C@@H]2N(Cc2cccc3ccccc23)C1 ZINC000299842432 FG Annotated Anodyne Cc1ncccc1NC(=O)[C@H]1C[C@H]2CCN(Cc3ccsc3)C[C@@H]2O1 ZINC000299842614 FG Annotated Anodyne Cc1oncc1C(=O)N1C[C@@H]2[C@@H](CCC[C@H]2N(C)Cc2cccs2)C1 ZINC000299842755 FG Annotated Anodyne Cc1oncc1C(=O)N1C[C@H]2[C@@H](N(C)Cc3cccs3)CCC[C@H]2C1 ZINC000299842756 FG Annotated Anodyne COc1ccc(CN2CCO[C@H]3[C@H](OCc4ccncc4)CC[C@H]32)cc1 ZINC000299843048 FG Annotated Anodyne C[C@H]1CN(Cc2cccc(F)c2)C[C@]12CCN(Cc1cccnc1)C2=O ZINC000299843181 FG Annotated Anodyne Cc1ncccc1NC(=O)[C@H]1CCO[C@H]2CCN(c3ccccc3)C[C@H]21 ZINC000299843324 FG Annotated Anodyne CC[C@H]1N(Cc2ccc(OC)cc2)CCC[C@]12CCC(=O)N2CCOC ZINC000299843377 FG Annotated Anodyne Cc1ccc(CN2CC[C@H]3OCCN(Cc4ccncc4)[C@@H]3CC2)s1 ZINC000299843505 FG Annotated Anodyne Cc1cccc(CN2C(=O)CC[C@@H]3[C@@H]2CCN3Cc2ccc(F)cc2)n1 ZINC000299843656 FG Annotated Anodyne COc1ccc(CN2C[C@H](N(C)Cc3ccco3)[C@H]3OCCC[C@H]32)cc1 ZINC000299843719 FG Annotated Anodyne CC1=N[C@]2(CC[C@H]3CN(Cc4ccccc4F)C[C@H]32)C(=O)N1CC1CC1 ZINC000299843760 FG Annotated Anodyne CN1CCN(c2cc(/C=C/c3ccc(O)cc3)[n+](C)c3ccccc23)CC1 ZINC000299844703 FG Annotated Anodyne S=C1NN[C@@]2(N1)[C@H]1CCC[C@H]2[C@H](c2ccccc2)N[C@@H]1c1ccccc1 ZINC000299846552 FG Annotated Anodyne S=C1NNC2(N1)[C@H]1CCC[C@H]2[C@H](c2ccccc2)N[C@H]1c1ccccc1 ZINC000299846554 FG Annotated Anodyne CCN1C(NCc2ccc(Cl)nc2)=C([N+](=O)[O-])[C@H](C)C[C@H]1OC(C)C ZINC000299846610 FG Annotated Anodyne Cc1cc(N2CC[C@H](N3CCC[C@H]3C)C2)ccc1NC(=O)C1CCOCC1 ZINC000299848124 FG Annotated Anodyne Cc1ccc([C@@H]2[C@H]([N+](=O)[O-])[C@H]3CCCN3[C@@]23C(=O)Nc2ccccc23)cc1 ZINC000299849302 FG Annotated Bother Cc1ccc([C@@H]2[C@@H]([N+](=O)[O-])[C@H]3CCCN3[C@@]23C(=O)Nc2ccccc23)cc1 ZINC000299849303 FG Annotated Bother Cc1cn2c(=O)c(-c3ccnc(N(C)C4CCCCC4)n3)cnc2s1 ZINC000299849399 FG Annotated Anodyne CC(C)(C)Nc1nc(-c2cccnc2)c(-c2ccnc(NCCO)n2)s1 ZINC000299849418 FG Annotated Anodyne CC(C)CC(=O)N1CC(=O)c2sc(NCCc3ccccc3)nc2C1 ZINC000299849438 FG Annotated Anodyne COc1ccccc1Nc1nc2c(s1)C(=O)CN(C(=O)CC(C)C)C2 ZINC000299849448 FG Annotated Anodyne COc1cc([N+](=O)[O-])ccc1N=Nc1c(N)[nH]n(-c2ccccc2)c1=O ZINC000299849773 FG Annotated Clean O=C(C1CCCC1)N1C[C@]2(CCCN(C3COC3)C2)Cc2ccccc21 ZINC000299849832 FG Annotated Anodyne O=C(C1CCCC1)N1C[C@@]2(CCCN(C3COC3)C2)Cc2ccccc21 ZINC000299849833 FG Annotated Anodyne CN1CCCN(c2nccc(-c3cncnc3C3CCCCC3)n2)CC1 ZINC000299849900 FG Annotated Anodyne COc1ccccc1CN1CCC[C@@]2(Cc3ccccc3CNC2=O)C1 ZINC000299849903 FG Annotated Anodyne COc1ccccc1CN1CCC[C@]2(Cc3ccccc3CNC2=O)C1 ZINC000299849904 FG Annotated Anodyne CC(C)CC(=O)N1CC(=O)c2sc(Nc3ccc(C#N)cc3)nc2C1 ZINC000299850230 FG Annotated Mild O=C(C1CCCC1)N1CC2(CCN(C3COC3)CC2)Cc2ccccc21 ZINC000299850247 FG Annotated Anodyne CSc1nc(N)c2c(n1)N=C1COC(O)=C1[C@@H]2c1cccc(Cl)c1 ZINC000299850710 FG Annotated Anodyne CSc1nc(N)c2c(n1)N=C1COC(O)=C1[C@H]2c1cccc(Cl)c1 ZINC000299850711 FG Annotated Anodyne CN(C)c1cc([C@H]2CCCN(C(=O)c3noc4c3CCCC4)C2)ccn1 ZINC000299850978 FG Annotated Anodyne CN(C)c1cc([C@@H]2CCCN(C(=O)c3noc4c3CCCC4)C2)ccn1 ZINC000299850980 FG Annotated Anodyne Cc1cc(Nc2ccc(F)cn2)cc([C@H]2CCN(Cc3ncc[nH]3)C2)n1 ZINC000299851512 FG Annotated Anodyne Cc1cc(Nc2ccc(F)cn2)cc([C@@H]2CCN(Cc3ncc[nH]3)C2)n1 ZINC000299851513 FG Annotated Anodyne CCOc1ccc([C@@H]2C3=C(O)OCC3=Nc3nc(SC)nc(N)c32)cc1 ZINC000299851514 FG Annotated Anodyne CCOc1ccc([C@H]2C3=C(O)OCC3=Nc3nc(SC)nc(N)c32)cc1 ZINC000299851515 FG Annotated Anodyne CC(=O)N1N=C(c2cccs2)O[C@@H]1C(=O)Nc1ccc(C(C)C)cc1 ZINC000299852013 FG Annotated Anodyne CC(=O)N1N=C(c2cccs2)O[C@H]1C(=O)Nc1ccc(C(C)C)cc1 ZINC000299852014 FG Annotated Anodyne CO[C@@H]1CN(C(=O)Nc2ccccc2)CCC(=O)N(C)c2ccccc21 ZINC000299852360 FG Annotated Anodyne CO[C@H]1CN(C(=O)Nc2ccccc2)CCC(=O)N(C)c2ccccc21 ZINC000299852361 FG Annotated Anodyne O=C(O)/C=C1/CN([C@@H](C(=O)C2CC2)c2ccccc2F)CC[C@@H]1SO ZINC000299853171 FG Annotated Anodyne O=C(O)/C=C1/CN([C@@H](C(=O)C2CC2)c2ccccc2F)CC[C@H]1SO ZINC000299853172 FG Annotated Anodyne O=C(O)/C=C1/CN([C@H](C(=O)C2CC2)c2ccccc2F)CC[C@H]1SO ZINC000299853173 FG Annotated Anodyne O=C(O)/C=C1/CN([C@H](C(=O)C2CC2)c2ccccc2F)CC[C@@H]1SO ZINC000299853174 FG Annotated Anodyne C[C@@]12Nc3ccccc3[C@]1(O)CCN2Cc1ccc(/C=C/C(=O)O)cc1 ZINC000299853773 FG Annotated Anodyne CCN(CC)C(=O)c1cnn(-c2cccc3nc(O)ccc23)c1C1CC1 ZINC000299854252 FG Annotated Anodyne Cc1cn(CCn2cnc(-c3cccnc3)c2-c2ccc(C#N)cc2)nn1 ZINC000299855077 FG Annotated Mild CSc1nccc(N2CCC(N(C)Cc3ccc(C#N)cc3)CC2)n1 ZINC000299855589 FG Annotated Mild COCCn1c2c(n3ccnc3c1=O)Cc1c(-c3ccccc3)cccc1-2 ZINC000299856185 FG Annotated Clean N/C(=C\C(=O)c1cn(Cc2ccc(F)cc2)cc1-c1ccccc1)C(=O)O ZINC000299856914 FG Annotated Mild Cc1cc(C(=O)NCc2ccc3cc(C(=O)NO)sc3c2F)oc1C ZINC000299858517 FG Annotated Anodyne Cc1cn(CCn2cnc(-c3cncs3)c2-c2ccc(C#N)cc2)nn1 ZINC000299859454 FG Annotated Mild CCCc1cc(=O)oc2c1c1c(c3oc(C(=O)NN)cc32)C=CC(C)(C)O1 ZINC000299859939 FG Annotated Reactive O=C1C[C@H](Sc2ccc([N+](=O)[O-])cc2)N1C(=O)NCc1ccccc1 ZINC000299860561 FG Annotated Bother O=C1C[C@@H](Sc2ccc([N+](=O)[O-])cc2)N1C(=O)NCc1ccccc1 ZINC000299860563 FG Annotated Bother COc1ccc(C=C2C(=O)N(CC(C)C)C(=O)N(CC(C)C)C2=O)cc1 ZINC000299861144 FG Annotated Clean COc1ccc2ccc(=O)oc2c1C1=NN(C(N)=O)[C@@H](c2cccs2)C1 ZINC000299861240 FG Annotated Anodyne COc1ccc2ccc(=O)oc2c1C1=NN(C(N)=O)[C@H](c2cccs2)C1 ZINC000299861241 FG Annotated Anodyne CCCCCCCN1C(=N)NC[C@@H]1CCCCN1C[C@@H](CCC)NC1=N ZINC000299861392 FG Annotated Mild O=[N+]([O-])c1ccc2c(c1)/C(=N\O)C(c1c[nH]c3ccc([N+](=O)[O-])cc13)=N2 ZINC000299862253 FG Annotated Mild O=C(O)[C@H](O)[C@H]1CCCN1CCC=C(c1ccccc1)c1ccccc1 ZINC000299862511 FG Annotated Anodyne O=C(O)[C@@H](O)[C@H]1CCCN1CCC=C(c1ccccc1)c1ccccc1 ZINC000299862513 FG Annotated Anodyne O=C(O)Cn1c2ccccc2c2nnc(Sc3ccccc3F)nc21 ZINC000299862544 FG Annotated Anodyne Cc1cn(CCn2cnc(-c3ccncc3)c2-c2ccc(C#N)cc2)nn1 ZINC000299862760 FG Annotated Mild O=c1cc(CO)oc([C@H]2C=C(c3cccc(O)c3)Oc3ccccc32)c1O ZINC000299862844 FG Annotated Anodyne O=c1cc(CO)oc([C@@H]2C=C(c3cccc(O)c3)Oc3ccccc32)c1O ZINC000299862845 FG Annotated Anodyne CCOC(=O)Nc1ccc2c(CSC(=S)N(C)C)cc(=O)oc2c1 ZINC000299863076 FG Annotated Anodyne C=C1C(=O)OC[C@@H]1CCOC(=O)Nc1ccc(C(=O)OCCCC)cc1 ZINC000299863118 FG Annotated Mild C=C1C(=O)OC[C@H]1CCOC(=O)Nc1ccc(C(=O)OCCCC)cc1 ZINC000299863119 FG Annotated Mild Oc1nc2cc3nc4ccccc4nc3cc2[nH]c1=NNc1ccccc1 ZINC000299863187 FG Annotated Bother CC(C)(O)c1cc(Nc2cc(C#N)ccn2)nc(N2CCC(F)(F)C2)c1 ZINC000299863282 FG Annotated Mild COC(=O)Nc1ccc2c(CSC(=S)N(C)C)cc(=O)oc2c1 ZINC000299863807 FG Annotated Anodyne COc1ccc2c(c1)CC(=O)N2[C@H](C(=O)NC(C)(C)C)c1ccccc1 ZINC000299864397 FG Annotated Anodyne COc1ccc2c(c1)CC(=O)N2[C@@H](C(=O)NC(C)(C)C)c1ccccc1 ZINC000299864398 FG Annotated Anodyne CO[C@@H]1CCN(C(=O)Nc2ccccc2)CC(=O)N(C)c2ccccc21 ZINC000299865118 FG Annotated Anodyne CO[C@H]1CCN(C(=O)Nc2ccccc2)CC(=O)N(C)c2ccccc21 ZINC000299865119 FG Annotated Anodyne CCCCSC(=S)N1CCN(C(=S)NCc2ccccc2)CC1 ZINC000299865365 FG Annotated Anodyne COc1nccc(N2CCC(N(C)Cc3c(F)cccc3Cl)CC2)n1 ZINC000299865521 FG Annotated Anodyne C=CCc1ccc(OCc2cn(-c3cccc([N+](=O)[O-])c3)nn2)c(O)c1 ZINC000299865577 FG Annotated Mild CCCSC(=S)N1CCN(C(=S)NCc2ccccc2)CC1 ZINC000299865617 FG Annotated Anodyne Cn1cc(-c2ccnc(-c3ccc(S(C)(=O)=O)cc3)n2)c2ccncc21 ZINC000299865848 FG Annotated Anodyne COC(=O)Nc1cccc(Cn2nc(-c3cc(F)cc(F)c3)ccc2=O)c1 ZINC000299865906 FG Annotated Anodyne Cc1ccc(C(=O)NCc2ccc3cc(C(=O)NO)sc3c2F)s1 ZINC000299865919 FG Annotated Anodyne O=S(=O)(CCC(F)=C(F)F)c1nc2ccc(OC(F)F)cc2[nH]1 ZINC000299866703 FG Annotated Anodyne CCCCn1c(=O)c(C(=O)NC2CCC(C)CC2)c(O)c2cccnc21 ZINC000299866716 FG Annotated Anodyne CCOC(=O)/C=C/c1cc(O)c2oc(-c3cc(O)c(O)c(O)c3)cc2c1 ZINC000299867073 FG Annotated Clean CCCCSC(=S)N1CCN(C(=S)Nc2cccnc2)CC1 ZINC000299867273 FG Annotated Anodyne Cc1cc(O)c(C(=O)C2=NNC[C@@H]2c2ccccc2[N+](=O)[O-])c(C)c1Cl ZINC000299867561 FG Annotated Bother Cc1cc(O)c(C(=O)C2=NNC[C@H]2c2ccccc2[N+](=O)[O-])c(C)c1Cl ZINC000299867563 FG Annotated Bother CO/N=C1C(=C2/C(=O)Nc3ccc([N+](=O)[O-])cc32)/Nc2cc(F)c(F)cc2/1 ZINC000299867979 FG Annotated Mild O=C1Nc2ccccc2/C1=N/n1c(-c2cccs2)nc2ccccc2c1=O ZINC000299868165 FG Annotated Mild O=c1cc(CO)oc([C@@H]2C=C(c3cccs3)Oc3ccccc32)c1O ZINC000299868539 FG Annotated Anodyne O=c1cc(CO)oc([C@H]2C=C(c3cccs3)Oc3ccccc32)c1O ZINC000299868540 FG Annotated Anodyne C=CCc1cc(O)c(O)c(CN2CCN(c3ccc(C(C)=O)cc3)CC2)c1 ZINC000299868939 FG Annotated Mild CCCSC(=S)N1CCN(C(=S)NCCc2ccccc2)CC1 ZINC000299869207 FG Annotated Anodyne CCn1c(NC(C)C)nc2c([C@@H]3CCCN(C(C)=O)C3)csc2c1=O ZINC000299869866 FG Annotated Anodyne CCn1c(NC(C)C)nc2c([C@H]3CCCN(C(C)=O)C3)csc2c1=O ZINC000299869867 FG Annotated Anodyne Cc1ccc2nc3c(O)n(CC(=O)N[C@@H]4CCC[C@@H](C)[C@H]4C)ncc-3c2c1 ZINC000299872717 FG Annotated Anodyne Cc1ccc2nc3c(O)n(CC(=O)N[C@@H]4CCC[C@H](C)[C@H]4C)ncc-3c2c1 ZINC000299872718 FG Annotated Anodyne O=C1[C@@H]2CCCN2[C@H](c2cccc(Br)c2)N1c1nccs1 ZINC000299872719 FG Annotated Anodyne CC[C@H](C)[C@H](CO)NC(=O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccsc1 ZINC000299874512 FG Annotated Anodyne CC[C@H](C)[C@H](CO)NC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000299874513 FG Annotated Anodyne CC[C@H](C)[C@H](CO)NC(=O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccsc1 ZINC000299874514 FG Annotated Anodyne CC(C)Cc1nc2nc(N(C)[C@H](C)[C@@H](O)c3ccccc3)ccc2nc1O ZINC000299876349 FG Annotated Anodyne CC(C)Cc1nc2nc(N(C)[C@@H](C)[C@@H](O)c3ccccc3)ccc2nc1O ZINC000299876350 FG Annotated Anodyne CC(C)c1nc2nc(N(C)[C@H](C)[C@@H](O)c3ccccc3)ccc2nc1O ZINC000299877317 FG Annotated Anodyne CC(=O)N[C@@H]1CCN(c2ncc(C)c(N[C@@H]3C[C@H](C)CC(C)(C)C3)n2)C1 ZINC000299878177 FG Annotated Anodyne CC(=O)N[C@@H]1CCN(c2ncc(C)c(N[C@@H]3C[C@@H](C)CC(C)(C)C3)n2)C1 ZINC000299878178 FG Annotated Anodyne CC(=O)N[C@@H]1CCN(c2ncc(C)c(N[C@H]3C[C@H](C)CC(C)(C)C3)n2)C1 ZINC000299878179 FG Annotated Anodyne CC(=O)N[C@@H]1CCN(c2ncc(C)c(N[C@H]3C[C@@H](C)CC(C)(C)C3)n2)C1 ZINC000299878180 FG Annotated Anodyne Cc1cnc(N2C[C@H](C)O[C@@H](C)C2)nc1NCCCN(C)c1ccccc1 ZINC000299878902 FG Annotated Anodyne CC[C@H](O)CNC(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1ccccc1 ZINC000299881646 FG Annotated Anodyne CC[C@H](O)CNC(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1ccccc1 ZINC000299881647 FG Annotated Anodyne CO[C@@H]1CCC[C@H]([C@H](C)Nc2nc(N3C[C@@H](C)O[C@H](C)C3)ncc2C)C1 ZINC000299887548 FG Annotated Anodyne CO[C@@H]1CCC[C@H]([C@H](C)Nc2nc(N3C[C@H](C)O[C@@H](C)C3)ncc2C)C1 ZINC000299887549 FG Annotated Anodyne CC[C@H](C)[C@H](CO)NC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000299887631 FG Annotated Anodyne CC[C@H](C)[C@H](CO)NC(=O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccccc1 ZINC000299887632 FG Annotated Anodyne CC(C)CCNC(=O)c1ccc2c(c1)NC(=O)[C@@H](N1CCCCC1)S2 ZINC000003006219 FG Annotated Anodyne CC(C)CCNC(=O)c1ccc2c(c1)NC(=O)[C@H](N1CCCCC1)S2 ZINC000003006220 FG Annotated Anodyne O=C1c2ccc(/C(O)=N/Cc3ccccc3)cc2C(=O)N1c1ccccn1 ZINC000003015047 FG Annotated Mild CCN(CC)S(=O)(=O)c1ccc(F)c(/C(O)=N/Cc2cccs2)c1 ZINC000003020592 FG Annotated Mild O=S(=O)(c1ccc(F)c(/C(O)=N/Cc2cccs2)c1)N1CCCC1 ZINC000003020712 FG Annotated Mild CCOC(=O)c1oc2ccc(S(=O)(=O)N3CCC(C)CC3)cc2c1C ZINC000003028823 FG Annotated Anodyne O=C(O)CN1C(=O)/C(=C/c2ccccc2Br)Oc2ccccc21 ZINC000003029678 FG Annotated Anodyne COC(CNC(=O)c1ccc2c(c1)nc(C)n2-c1cc(C)cc(C)c1)OC ZINC000003032186 FG Annotated Anodyne Cc1c2c(nc3c(/C(O)=N/Cc4ccc5c(c4)OCO5)cnn13)CCCC2 ZINC000003035478 FG Annotated Mild C=CCNC(=O)c1ccc2c(c1)N(Cc1ccc(F)cc1)C(=O)CS2 ZINC000003042095 FG Annotated Anodyne O=C(CCn1c(=S)[nH]c2ccccc2c1=O)N1CCc2ccccc21 ZINC000003043451 FG Annotated Anodyne Cc1c(C(=O)O)oc2ccc(S(=O)(=O)N[C@H]3CCCC[C@H]3C)cc12 ZINC000003045439 FG Annotated Anodyne Cc1c(C(=O)O)oc2ccc(S(=O)(=O)N[C@@H]3CCCC[C@H]3C)cc12 ZINC000003045440 FG Annotated Anodyne Cc1c(C(=O)O)oc2ccc(S(=O)(=O)N[C@H]3CCCC[C@@H]3C)cc12 ZINC000003045442 FG Annotated Anodyne Cc1c(C(=O)O)oc2ccc(S(=O)(=O)N[C@@H]3CCCC[C@@H]3C)cc12 ZINC000003045444 FG Annotated Anodyne Cc1nccc2[nH]c(=O)c(C(=O)NCCCSC3CCCCC3)cc12 ZINC000003061780 FG Annotated Anodyne O=C(NC1CC1)c1ccc(CS(=O)(=O)c2c(Cl)cccc2Cl)o1 ZINC000003061883 FG Annotated Anodyne Cc1ccc(-c2nn(CC(=O)NCc3ccco3)c(=O)c3ccccc23)cc1 ZINC000003063774 FG Annotated Anodyne O=C(N/N=C/c1cn(-c2ccccc2)nc1-c1cccnc1)c1cccnc1 ZINC000003166701 FG Annotated Reactive CCN(CC)S(=O)(=O)c1cccc(-c2nc3n(n2)Cc2ccccc2-3)c1 ZINC000003191862 FG Annotated Anodyne Oc1ccc(/C=N/n2cnn(Cc3ccccc3Cl)c2=S)c(O)c1 ZINC000003197389 FG Annotated Mild COc1ccc2c(c1OC)OC[C@@H](c1ccc(OC)c(OC)c1OC)C2 ZINC000003197566 FG Annotated Anodyne in-vitro CC(C)(CNCc1ccccc1)NS(=O)(=O)c1ccc(Cl)cc1 ZINC000003201709 FG Annotated Anodyne NC1=C(c2ccc(Br)cc2)C(=O)[C@H]2CCc3ccccc3N12 ZINC000003213607 FG Annotated Mild S=C(NCCc1ccccc1)N/N=C/c1cccc(Br)c1 ZINC000003238085 FG Annotated Mild S=C(NCCc1ccccc1)N/N=C/c1ccccc1Br ZINC000003239551 FG Annotated Mild Cc1cc(C(=O)OCC(=O)NCc2ccco2)c(C)n1-c1ccc(F)cc1 ZINC000003245963 FG Annotated Clean CNC(=S)N/N=C/c1c(C)c(C(=O)c2ccc(F)cc2)n2ccccc12 ZINC000003248066 FG Annotated Mild Cc1nn(CCC(=O)O)c2nc(-c3cccnc3)cc(C(F)(F)F)c12 ZINC000003250237 FG Annotated Anodyne Cc1nn(-c2cccc(C(F)(F)F)c2)c(Cl)c1/C=N/n1cnnc1 ZINC000003255240 FG Annotated Mild COc1ccc(-c2nn(-c3ccccc3)cc2/C=N\n2cnnc2)cc1OC ZINC000003255267 FG Annotated Mild COc1ccc(-c2nn(-c3ccccc3)cc2/C=N/n2cnnc2)cc1OC ZINC000003255270 FG Annotated Mild Cc1cc(C)n2cc(CSc3nnnn3-c3ccc(Cl)cc3)nc2n1 ZINC000003265017 FG Annotated Anodyne COC(=O)N/N=C/c1c(C)c(C(=O)c2ccc(F)cc2)n2ccccc12 ZINC000003280302 FG Annotated Reactive COc1ccc(Br)cc1/C=N/n1c(C)nc2ccccc2c1=O ZINC000003283533 FG Annotated Mild N#Cc1ccc(-c2ccc(OCC(=O)N/N=C/c3ccncc3)cc2)cc1 ZINC000003289216 FG Annotated Reactive Cc1ccc(-n2nc(-c3cccnc3)cc2C(=O)N2CCOCC2)c(C)c1 ZINC000003292846 FG Annotated Anodyne Cc1ncc(CC(=O)n2cc(C(=O)c3cc(Cl)ccc3O)cn2)s1 ZINC000003299654 FG Annotated Anodyne COc1ccc(C(C)=O)cc1CSc1nnc(-c2ccncc2)n1C ZINC000003307981 FG Annotated Anodyne Cc1nn(CCC(N)=O)c2nc(-c3cccs3)cc(C(F)(F)F)c12 ZINC000003308433 FG Annotated Anodyne O=C(CSc1nn(-c2ccccc2)c(=S)s1)Nc1ncccn1 ZINC000003322482 FG Annotated Anodyne O=C(CO/N=C/c1ccc(OC(F)F)cc1)NCc1ccc(F)cc1 ZINC000003328877 FG Annotated Mild Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=N/NC(=O)c1cccnc1 ZINC000003335033 FG Annotated Reactive CCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1c(C)nn(-c2ccccc2)c1C ZINC000003339757 FG Annotated Anodyne CCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1c(C)nn(-c2ccccc2)c1C ZINC000003339759 FG Annotated Anodyne Nc1nnc(SCC(=O)OCc2ccc(Cl)c(Cl)c2)s1 ZINC000003356898 FG Annotated Anodyne CC(=O)c1c(OCC(=O)N(C)C2CCCCC2)ccc2c(C)cc(=O)oc12 ZINC000003373011 FG Annotated Anodyne Cc1ccccc1Nc1nc(N)nc(COC(=O)C[C@H]2C[C@@H]3CC[C@H]2C3)n1 ZINC000003411137 FG Annotated Anodyne O=C1NC2(CCCCC2)C(=O)N1/N=C/c1ccccc1Br ZINC000003438121 FG Annotated Mild C=CCn1c(SCC(=O)[C@@H](C#N)C(C)=N)nc2sc(C)c(C)c2c1=O ZINC000003470457 FG Annotated Mild COc1cc(-c2nc(-c3ccc(NS(C)(=O)=O)cc3)cs2)ccn1 ZINC000030447635 FG Annotated Anodyne C/C=C\[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@@H]2[C@]1(C)/C(O)=C1\C(=O)[C@H](CO)N(C)C1=O ZINC000306146963 FG Annotated Mild C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@@H]2[C@]1(C)/C(O)=C1/C(=O)[C@H](CO)N(C)C1=O ZINC000306146964 FG Annotated Mild C/C=C\[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@@H]2[C@]1(C)/C(O)=C1/C(=O)[C@H](CO)N(C)C1=O ZINC000306146965 FG Annotated Mild CC(C)=C1C[C@@]2(C)C(=CC1=O)CC[C@@H](OC(=O)/C=C/[S@](C)=O)[C@@H]2C ZINC000031164348 FG Annotated Mild CS/C(C)=N\OC(=O)N(C)SN(C)C(=O)O/N=C(\C)SC ZINC000031290752 FG Annotated Mild C=C1c2ccc3c(c2C[C@]12c1cc(OC)c(O)cc1CCN2C)OCO3 ZINC000031476727 FG Annotated Mild CCC(=O)C1=C(OC(C)=O)[C@H]2Cc3c(n(C)c4ccccc34)[C@@H](C1)N2C ZINC000031829785 FG Annotated Mild CCC(=O)C1=C(OC(C)=O)[C@@H]2Cc3c(n(C)c4ccccc34)[C@H](C1)N2C ZINC000031829786 FG Annotated Mild CCN1CC[C@@](O)(c2ccc(OC)cc2)[C@@H](C(=O)c2ccc(OC)cc2)C1 ZINC000031840908 FG Annotated Anodyne COc1ccc2[nH]c3c([N+](=O)[O-])ccc(NCCCN(C)C)c3c(=N)c2c1 ZINC000031852794 FG Annotated Bother CCN(CC)CCNc1ccc([N+](=O)[O-])c2[nH]c3ccccc3c(=N)c12 ZINC000031852802 FG Annotated Bother O=[N+]([O-])c1nccn1CCCNc1c2ccccc2[n+]([O-])c2ccccc12 ZINC000031852985 FG Annotated Clean CC1(C)C=C(/C=N/Nc2ccc([N+](=O)[O-])cc2)C(C#N)=C(O)C1(C#N)C#N ZINC000031861335 FG Annotated Reactive CC(=O)OC[C@@H](Br)[C@@]1(C)CC[C@@H](C(C)(C)Br)O1 ZINC000031861582 FG Annotated Reactive CC(=O)OC[C@H](Br)[C@@]1(C)CC[C@@H](C(C)(C)Br)O1 ZINC000031861585 FG Annotated Reactive CC(=O)OC[C@@H](Br)[C@]1(C)CC[C@@H](C(C)(C)Br)O1 ZINC000031861588 FG Annotated Reactive CC(=O)OC[C@H](Br)[C@]1(C)CC[C@@H](C(C)(C)Br)O1 ZINC000031861591 FG Annotated Reactive C=C(C(=O)O)[C@@H]1C[C@@H]2O[C@H]1[C@@H](O)[C@@H](C)CCC/C(C)=C\CC[C@@]2(C)O ZINC000031894939 FG Annotated Mild C/C(=N\Nc1cc(CN2CCCC2)c(-c2ccc(Cl)cc2)nn1)C(=O)O ZINC000031905657 FG Annotated Mild COc1cccc2c1N(C(C)=O)C13CCC4(CCCN5CC[C@]21[C@@H]54)CC3 ZINC000032134789 FG Annotated Anodyne COC(=O)c1c(C)c2c(c(C)c1O)OC(=O)c1c(C)cc(O)c(C)c1O2 ZINC000032193892 FG Annotated Anodyne COc1cc(OC)c2c(c1Cl)O[C@]1(C2=O)C(Cl)=CC(=O)C[C@H]1C ZINC000032250503 FG Annotated Mild COc1cc(OC)c2c(c1Cl)O[C@@]1(C(=O)C=C(Cl)C[C@H]1C)C2=O ZINC000032265918 FG Annotated Mild C=C[C@@]1(C)CC[C@@H]2[C@](C)(C[C@@H](O)[C@H](C(C)(C)O)[C@@]2(C)CCC(=O)OC)O1 ZINC000032302191 FG Annotated Mild in-vitro biogenic O=C1C[C@@H](NC(=O)Nc2nc(-c3ccccc3)ns2)c2ccccc2N1 ZINC000032517947 FG Annotated Anodyne O=C1C[C@H](NC(=O)Nc2nc(-c3ccccc3)ns2)c2ccccc2N1 ZINC000032517949 FG Annotated Anodyne O=S1(=O)CC/C(=N/Nc2ccc(C(F)(F)F)cn2)c2cc(F)ccc21 ZINC000033045591 FG Annotated Mild O=[N+]([O-])c1cccc(/N=C2\N=CCC(c3cccc(Cn4cncn4)c3)=N2)c1 ZINC000033295981 FG Annotated Mild in-vivo C=CCN1C(=O)[C@@H](Cc2ccc(OC)cc2)S/C1=N\N=C/c1ccco1 ZINC000033323880 FG Annotated Mild CCOC(=O)c1c(/N=C\c2cccc(OC)c2O)sc2c1CCN(C)C2 ZINC000033326847 FG Annotated Mild CC(/C=N\NC(=O)c1nn(C)c(C)c1Br)=C\c1ccccc1 ZINC000033333518 FG Annotated Reactive O=C(O)CN1C(=O)C(O)=C(C(=O)c2ccc(Cl)cc2)[C@@H]1c1ccccc1 ZINC000033336196 FG Annotated Mild O=C(O)CN1C(=O)C(O)=C(C(=O)c2ccc(Cl)cc2)[C@H]1c1ccccc1 ZINC000033336197 FG Annotated Mild O=C(N/N=C\C(Br)=C/c1ccccc1)c1[nH]nc2c1CCC2 ZINC000033340907 FG Annotated Reactive NC(=S)N/N=C\c1c(Sc2ccc(Cl)cc2)nc2sccn12 ZINC000033365533 FG Annotated Mild N#Cc1ccc(-c2ccc(OCC(=O)N/N=C\c3ccncc3)cc2)cc1 ZINC000033414526 FG Annotated Reactive C=C1C(=O)C2=C[C@H]1C[C@H](OC(C)=O)C(=O)[C@]1(C)CCCC(C)(C)[C@H]1C[C@H]2O ZINC000033503984 FG Annotated Mild in-vitro biogenic COc1cc(C)nc(N2C(=O)CS[C@@H]2c2c(F)cccc2Cl)n1 ZINC000033504936 FG Annotated Anodyne COc1cc(C)nc(N2C(=O)CS[C@H]2c2c(F)cccc2Cl)n1 ZINC000033504938 FG Annotated Anodyne Cc1cc(C(=O)N/N=C\c2ccc(OC(=O)c3ccco3)cc2)c(C)o1 ZINC000033620447 FG Annotated Reactive CCc1cc(Br)ccc1S(=O)(=O)NCc1ccccc1 ZINC000033670430 FG Annotated Anodyne CC(C)(C)n1ncc(OCc2nnc(-c3ccccc3)o2)c(Cl)c1=O ZINC000033688458 FG Annotated Anodyne CCOC(=O)/C(=N/Nc1cc(Cl)ccc1Cl)N1C[C@@H](C)O[C@H](C)C1 ZINC000033704587 FG Annotated Mild CC(C)NCC(=O)Nc1ccc([C@H]2NC(=O)C(C)(C)c3ccccc32)cc1 ZINC000033823680 FG Annotated Anodyne CC(C)NCC(=O)Nc1ccc([C@@H]2NC(=O)C(C)(C)c3ccccc32)cc1 ZINC000033823681 FG Annotated Anodyne CC[C@@H](C)n1c(SCC(=O)N2CCCC2)nc2ccsc2c1=O ZINC000033825064 FG Annotated Anodyne CC[C@H](C)n1c(SCC(=O)N2CCCC2)nc2ccsc2c1=O ZINC000033825066 FG Annotated Anodyne C/N=C(/NC)SCc1nc2ccccc2c(=O)n1-c1ccccc1Cl ZINC000033829303 FG Annotated Mild COC(=O)[C@]1(C)CCC[C@]2(C)[C@H]3CC[C@]4(CO)C[C@@]3(CC[C@@H]12)C[C@H]4O ZINC000033830120 FG Annotated Anodyne in-vitro biogenic COC(=O)[C@]1(C)CCC[C@]2(C)[C@H]3CC[C@]4(CO)C[C@@]3(CC[C@@H]12)C[C@@H]4O ZINC000033830122 FG Annotated Anodyne COc1cc2cc3c(cc2c2c1c1ccc4c(c1c[n+]2C)OCO4)OCO3 ZINC000033830147 FG Annotated Bother in-vitro biogenic CN1[C@H]2O[C@H]3Cc4cc5c(cc4[C@@H]1[C@@]3(C)c1ccc3c(c12)OCO3)OCO5 ZINC000033830333 FG Annotated Anodyne in-vitro biogenic CC[C@H](C)C(=O)O[C@@H](C=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000033832574 FG Annotated Mild in-vitro biogenic COC(=O)c1cncc([C@H]2CN3CCc4c([nH]c5ccccc45)[C@]3(C)O2)c1 ZINC000033832939 FG Annotated Anodyne C/C=C/C(=O)O[C@H]1[C@@H](OC(C)=O)c2c(ccc3ccc(=O)oc23)OC1(C)C ZINC000033833380 FG Annotated Anodyne in-vitro biogenic COc1ccc(Cc2c3c(OC)c(OC)c(OC)cc3cc[n+]2C)cc1 ZINC000033833879 FG Annotated Anodyne in-vitro biogenic COc1cc2c(C(=O)N3CCCCC3)cn(CC(C)C)c(=O)c2cc1OC ZINC000033834463 FG Annotated Anodyne C=CC(C)(C)[C@@]12C[C@H]3C(=O)N[C@@H](CC(C)C)C(=O)N3[C@@H]1Nc1ccccc12 ZINC000033836373 FG Annotated Mild Cc1cc(I)c2c(c1)[C@H]1C=CC[C@@H]1[C@@H](C(=O)O)N2 ZINC000033837904 FG Annotated Clean Cc1cc(I)c2c(c1)[C@H]1C=CC[C@@H]1[C@H](C(=O)O)N2 ZINC000033837905 FG Annotated Clean Cc1cc(I)c2c(c1)[C@H]1C=CC[C@H]1[C@@H](C(=O)O)N2 ZINC000033837906 FG Annotated Clean Cc1cc(I)c2c(c1)[C@H]1C=CC[C@H]1[C@H](C(=O)O)N2 ZINC000033837907 FG Annotated Clean C/C=C(\CO)[C@@H]1C[C@H]2c3[nH]c4ccccc4c3CCN2C=C1C(=O)OC ZINC000033841038 FG Annotated Anodyne in-vitro biogenic COC(=O)/C(=C1/OC(=O)C(c2ccc(OC)cc2)=C1O)c1ccccc1 ZINC000033845423 FG Annotated Anodyne Cc1cc(C(=O)NNC=C2C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C2)n[nH]1 ZINC000033913263 FG Annotated Reactive COC(=O)[C@]1(Cc2ccccc2)C=C2C(=C(c3ccccc3)C(=O)[C@@H]2C)CN1 ZINC000033913685 FG Annotated Mild COC(=O)[C@]1(Cc2ccccc2)C=C2C(=C(c3ccccc3)C(=O)[C@H]2C)CN1 ZINC000033913686 FG Annotated Mild COC(=O)[C@@]1(Cc2ccccc2)C=C2C(=C(c3ccccc3)C(=O)[C@@H]2C)CN1 ZINC000033913687 FG Annotated Mild COC(=O)[C@@]1(Cc2ccccc2)C=C2C(=C(c3ccccc3)C(=O)[C@H]2C)CN1 ZINC000033913688 FG Annotated Mild CC1(C)N=C(/C(Cl)=[N+](/[O-])C(=O)c2ccc(Cl)cc2)C(C)(C)N1O ZINC000033917136 FG Annotated Mild COc1cc(/C=N\N=c2\cc(C)[nH]c3ccccc23)cc(OC)c1OC ZINC000033932490 FG Annotated Mild CC(=O)/C=C1/C=C2O[C@@H](CC(=O)O)Cc3cc4cccc(O)c4c(c32)O1 ZINC000034002546 FG Annotated Mild CC(C)c1n[nH]c2c(=O)[nH]c(Cc3ccccc3OC(F)(F)F)nc12 ZINC000034021820 FG Annotated Anodyne COc1cc2c(cc1OC)C(c1cc3ccccc3s1)=NNC(=O)C2 ZINC000034030032 FG Annotated Anodyne CCOC(=O)c1c(Cc2cc(Cl)cc(Cl)c2)c(C)nn1CCO ZINC000034030372 FG Annotated Anodyne CCCCn1c(CSc2ncnc3nc[nH]c23)nc2ccccc2c1=O ZINC000034030964 FG Annotated Anodyne C[C@H](Br)C1=CC(=C(Br)Br)OC1=O ZINC000034033693 FG Annotated Reactive C[C@@H](Br)C1=CC(=C(Br)Br)OC1=O ZINC000034033694 FG Annotated Reactive CCNc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cc(OC)cc(OC)c1 ZINC000034043592 FG Annotated Reactive CCNc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cc(OC)cc(OC)c1 ZINC000034043593 FG Annotated Reactive CSc1ccc(Oc2ccc(S(N)(=O)=O)cc2CN(C)C)cc1F ZINC000034044938 FG Annotated Anodyne Cn1cc(-c2cc3cccnc3[nH]2)c2cc(C(=O)NC(C)(C)CO)ccc21 ZINC000034055334 FG Annotated Anodyne in-vivo CSc1ccc(Oc2ccc(S(N)(=O)=O)cc2CN(C)C)cc1C ZINC000034055612 FG Annotated Anodyne C=CC[C@]12C[C@@]3(OCOC3=CC1=O)[C@@H](C)[C@@H]2c1cc(OC)c2c(c1)OCO2 ZINC000034065886 FG Annotated Mild CC[C@H](C)/C=C(C)/C=C/C1=CC2=CC(=O)[C@](C)(O)[C@H](OC(C)=O)[C@H]2CO1 ZINC000034073446 FG Annotated Mild COc1ccc(-c2nc3n(c2-c2ccc(OC)cc2)CCS3(=O)=O)cc1 ZINC000034079727 FG Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)CCOC)c1Cc1cccc(/C=C/C#N)c1 ZINC000034081159 FG Annotated Reactive C[C@]1(COc2ccc(N3CCCCC3)cc2)Cn2cc([N+](=O)[O-])nc2O1 ZINC000034086760 FG Annotated Clean Cc1ccc([C@@H]2CC=C(C(=O)O)CN2S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000034131026 FG Annotated Anodyne CCOC(=O)C1=CC[C@H](C(C)(C)C)N(S(=O)(=O)c2ccc(C)cc2)C1 ZINC000034131268 FG Annotated Anodyne CCOC(=O)C1=CC[C@@H](C(C)(C)C)N(S(=O)(=O)c2ccc(C)cc2)C1 ZINC000034131270 FG Annotated Anodyne CCOC(=O)C1=CCN(S(=O)(=O)c2ccc(C)cc2)[C@@H]1c1ccccc1 ZINC000034131395 FG Annotated Anodyne CCOC(=O)C1=CCN(S(=O)(=O)c2ccc(C)cc2)[C@H]1c1ccccc1 ZINC000034131397 FG Annotated Anodyne Cc1ccc([C@H]2C(C(=O)O)=CCN2S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000034131407 FG Annotated Anodyne CN1C/C(=C\c2ccccc2)C2=NN(C(N)=S)[C@H](c3ccccc3)[C@@H]2C1 ZINC000034172411 FG Annotated Anodyne CCNc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cc(OC)c2c(c1)OCO2 ZINC000034228112 FG Annotated Reactive CCNc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cc(OC)c2c(c1)OCO2 ZINC000034228113 FG Annotated Reactive C[C@H]1CC[C@@H]2[C@@H](C)[C@@H](O[C@H]3OC(=O)[C@@H]4[C@@H](C)CC[C@@H]4[C@H]3C)OC(=O)[C@H]12 ZINC000034235518 FG Annotated Anodyne CCOc1ccc(OCc2ccc(C(=O)NN/C=C3/C=CC=N3)cc2)cc1 ZINC000034240745 FG Annotated Reactive COC(=O)[C@@H]1CCC[C@@H]2[C@@](C)(CCC3=CC(=O)OC3)[C@H](C)C[C@H](O)[C@@]12C ZINC000034278020 FG Annotated Anodyne C[C@H]1Cc2c(O)c3c(c(O)c2O1)[C@@]1(C)CCC(=O)C(C)(C)C1=C(O)C3=O ZINC000034302897 FG Annotated Mild CC(=O)O[C@@H]1CC(=O)C=C2[C@@]3(C)C=C(C#N)C(=O)C(C)(C)[C@@H]3CC[C@]21C ZINC000034322679 FG Annotated Reactive CCOC(=O)c1nn(CCO)c(C)c1Cc1cc(Cl)cc(Cl)c1 ZINC000034336245 FG Annotated Anodyne CC(C)N1CCC(COc2ncc(C(=O)c3ccc(F)cc3)n2C)CC1 ZINC000034336541 FG Annotated Anodyne N/C(=N\[C@@H]1C[C@H]2CC[C@@H]1C2)Nc1ccccc1I ZINC000034362823 FG Annotated Mild COc1cc2nc3occc3c(OC)c2cc1OC[C@H](O)C(C)(C)OC ZINC000034505493 FG Annotated Anodyne in-vitro biogenic C=C(C)[C@@H]1C[C@@]2(C)C(=C[C@H]1O)CC[C@@H](OC(=O)/C=C/[S@](C)=O)[C@@H]2C ZINC000034513523 FG Annotated Mild CC(=O)O[C@H]1CC[C@@H](CCCCCCCCCC[C@H](O)CO)N[C@H]1C ZINC000034516837 FG Annotated Anodyne CC(=O)O[C@H]1CC[C@@H](CCCCCCCCCC[C@@H](O)CO)N[C@H]1C ZINC000034516838 FG Annotated Anodyne in-vitro biogenic C=C(c1cc(Cl)cc(Cl)c1OC[C@@H](O)CNC(C)C)n1ccnc1 ZINC000034593735 FG Annotated Anodyne C=C(c1cc(Cl)cc(Cl)c1OC[C@H](O)CNC(C)C)n1ccnc1 ZINC000034593737 FG Annotated Anodyne C=C(c1ccc(Cl)c(Cl)c1OC[C@@H](O)CNC(C)C)n1ccnc1 ZINC000034593739 FG Annotated Anodyne C=C(c1ccc(Cl)c(Cl)c1OC[C@H](O)CNC(C)C)n1ccnc1 ZINC000034593741 FG Annotated Anodyne O=C1c2cccc3c(NCCO)ccc(c23)C(=O)N1c1cccc(F)c1 ZINC000034600201 FG Annotated Anodyne CCc1cc(=O)oc2nc(OCc3ccccc3C(F)(F)F)[nH]c(=O)c12 ZINC000034605468 FG Annotated Anodyne CCO[C@@H](CCc1ccc(O)c(O)c1)CC(=O)CCc1ccc(O)c(O)c1 ZINC000034635275 FG Annotated Clean in-vitro biogenic COc1c2c(c(O)c3ncccc13)C(=O)N(Cc1ccc(F)cc1)[C@H]2OC ZINC000034648424 FG Annotated Anodyne COc1c2c(c(O)c3ncccc13)C(=O)N(Cc1ccc(F)cc1)[C@@H]2OC ZINC000034648425 FG Annotated Anodyne CO[C@@H]1C[C@]2(CC[C@@]3(O2)[C@H](C)C(=O)[C@@H](O)[C@H]2C(C)(C)CCC[C@@]23C)CO1 ZINC000034729535 FG Annotated Anodyne in-vitro biogenic CO[C@H]1C[C@]2(CC[C@@]3(O2)[C@H](C)C(=O)[C@@H](O)[C@H]2C(C)(C)CCC[C@@]23C)CO1 ZINC000034729538 FG Annotated Anodyne in-vitro biogenic CC(C)=CC(=O)C/C(C)=C/CC/C(C)=C/CC[C@@H]1C(=O)O[C@@H](O)[C@@H]1O ZINC000034741799 FG Annotated Mild COC(=O)[C@@]1(C)CCC[C@@]2(C)[C@H]1CC[C@@]1(C)C3=C(CC[C@@H]12)C(=O)O[C@@H]3O ZINC000034751931 FG Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@@]2(C)[C@H]1CC[C@@]1(C)C3=C(CC[C@@H]12)[C@@H](O)OC3=O ZINC000034751932 FG Annotated Anodyne COC(=O)c1c(N)nnc2c(C)c(C)c(O)c(Sc3ccccc3)c12 ZINC000034790487 FG Annotated Anodyne Cc1cc2c(s1)CC[C@H](CN[C@H]1CC[C@@H](Oc3ccccc3)[C@@H]1O)C2=O ZINC000034800964 FG Annotated Anodyne Cc1cc2c(s1)CC[C@@H](CN[C@H]1CC[C@@H](Oc3ccccc3)[C@@H]1O)C2=O ZINC000034800965 FG Annotated Anodyne Cc1cc2c(s1)CC[C@@H](CN[C@@H]1CC[C@@H](Oc3ccccc3)[C@H]1O)C2=O ZINC000034800967 FG Annotated Anodyne C[C@@H]1OC(=O)[C@H]2C[C@H]3CCCC[C@@H]3[C@@H](CCCN3C[C@@H](C)NC[C@H]3C)[C@@H]12 ZINC000034802100 FG Annotated Anodyne C[C@H]1CN(CCC[C@@H]2[C@H]3CCCC[C@@H]3C[C@@H]3C(=O)O[C@@H](C)[C@@H]32)[C@H](C)CN1 ZINC000034802101 FG Annotated Anodyne O=C(OCc1ccccc1)[C@H]1C[C@]12C(=O)Nc1ccc(Br)cc12 ZINC000034817201 FG Annotated Anodyne CCOC(=O)[C@H]1C2(CCCC2)[C@]12C(=O)Nc1ccc(Br)cc12 ZINC000034817253 FG Annotated Anodyne Cc1cc(C)cc(C(=O)c2c(C(C)C)c(=O)[nH]c(=O)n2CC2CCC2)c1 ZINC000034819354 FG Annotated Anodyne CCOC(=O)C1=C(N2CCCC2)[C@H]2c3ccccc3S[C@@]12C(=O)OCC ZINC000034819603 FG Annotated Anodyne CCOC(=O)C1=C(N2CCCC2)[C@@H]2c3ccccc3S[C@]12C(=O)OCC ZINC000034819605 FG Annotated Anodyne CNc1nc(N)nc2nc(-c3ccccc3C(F)(F)F)c(C(=O)O)cc12 ZINC000034845343 FG Annotated Anodyne COc1cnc2c(O)c3c(c(OC)c2c1)CN(Cc1ccc(F)cc1)C3=O ZINC000034849727 FG Annotated Anodyne COc1c2c(c(O)c3ncc(F)cc13)C(=O)N(Cc1ccc(F)cc1)C2 ZINC000034849728 FG Annotated Anodyne CCOc1cc2[nH]c(=O)n(Cc3ccc(Cl)cc3)c(=O)c2cc1OCC ZINC000034858164 FG Annotated Anodyne Cc1n[nH]c2c1[C@@H]1CCC[C@H](C2)N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000034891635 FG Annotated Anodyne Cc1n[nH]c2c1[C@H]1CCC[C@@H](C2)N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000034891636 FG Annotated Anodyne Nc1nc2c(s1)[C@H]1CCC[C@@H](C2)N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000034891834 FG Annotated Anodyne CC(C)(Oc1ccc(Cl)cc1)C(=O)NC12CCC(C(N)=O)(CC1)CC2 ZINC000034947170 FG Annotated Anodyne CCc1ccc(/C=C2\SC(N[C@H](C(=O)O)c3ccc(F)cc3)=NC2=O)o1 ZINC000034947225 FG Annotated Clean in-vivo CCS(=O)(=O)Nc1ccc(-c2ccc(C#N)n2C)c(C(F)(F)F)c1 ZINC000034949106 FG Annotated Mild CC(C)CNc1ccc2c(=O)n(-c3cccc(Cl)c3)c(=O)n(C)c2c1 ZINC000034950142 FG Annotated Anodyne COCCNC(=O)c1ccc(Nc2ncc(Br)s2)cc1 ZINC000034987286 FG Annotated Anodyne COC[C@H](C)NC(=O)c1ccc(Nc2ncc(Br)s2)cc1 ZINC000034987724 FG Annotated Anodyne COC[C@@H](C)NC(=O)c1ccc(Nc2ncc(Br)s2)cc1 ZINC000034987725 FG Annotated Anodyne COCCN(C)C(=O)c1ccc(Nc2ncc(Br)s2)cc1 ZINC000034987726 FG Annotated Anodyne Cc1ccc(C(=O)N2CCC[C@@H]2c2nnn(-c3cccc(Cl)c3)n2)o1 ZINC000034999332 FG Annotated Anodyne Cc1ccc(C(=O)N2CCC[C@H]2c2nnn(-c3cccc(Cl)c3)n2)o1 ZINC000034999334 FG Annotated Anodyne CCN(CC)c1ccc(/C=N/N2C(=O)NC3(CCC(C)CC3)C2=O)cc1 ZINC000003580882 FG Annotated Mild CCOc1ccc(NC2=CC(=O)c3nc(-c4ccccn4)[nH]c3C2=O)cc1 ZINC000003588200 FG Annotated Mild CCCOc1cc(CCCOc2c(C)cc(-c3nnn(C)n3)cc2C)on1 ZINC000003590184 FG Annotated Anodyne Cc1cc(-c2nnn(C)n2)cc(C)c1OCCCc1cc(C2CC2)no1 ZINC000003590218 FG Annotated Anodyne CCCc1cc(CCCOc2c(C)cc(-c3nnn(C)n3)cc2C)on1 ZINC000003590227 FG Annotated Anodyne Cc1cc(C=O)cc(C)c1Oc1nc(N)nc(Nc2ccc(C#N)cc2)n1 ZINC000003605732 FG Annotated Anodyne CO/N=C/c1ccc(OCCC2CCN(c3ccc(C)nn3)CC2)cc1 ZINC000003618047 FG Annotated Mild CN/N=C/c1ccc(OCCC2CCN(c3ccc(Cl)nn3)CC2)cc1 ZINC000003618064 FG Annotated Mild O=S(=O)(NC(c1ccccc1)c1ccccc1)c1cccc2nonc12 ZINC000003620076 FG Annotated Anodyne COc1ccc(NC(=O)[C@@H]2C(=O)N(C)[C@@]3(C)C[C@@H]2c2ccccc2O3)cc1 ZINC000003640390 FG Annotated Anodyne C=CC[C@]12C[C@@]3(OCOC3=CC1=O)[C@@H](C)[C@H]2c1cc(OC)c2c(c1)OCO2 ZINC000003644328 FG Annotated Mild in-vitro biogenic O=C(O)COCC(=O)N1CCC(C(c2ccccc2)c2ccccc2)CC1 ZINC000003645219 FG Annotated Anodyne CN(C)c1ccc(-c2nc(N3CCc4ccccc4C3)nc(O)c2C#N)cc1 ZINC000003649568 FG Annotated Mild Cc1ccc(-c2nc(N3CCN(c4ccccc4)CC3)nc(O)c2C#N)cc1 ZINC000003649636 FG Annotated Mild CCN(CC)CCC[C@@H](C)Nc1nc(-c2ccc(F)cc2)c(C#N)c(=O)[nH]1 ZINC000003649654 FG Annotated Mild CCN(CC)CCC[C@H](C)Nc1nc(-c2ccc(F)cc2)c(C#N)c(=O)[nH]1 ZINC000003649655 FG Annotated Mild Cc1c(Cl)cccc1NC(=O)CCCN1C(=O)c2cccnc2C1=O ZINC000003660509 FG Annotated Anodyne Cc1ccc(NC(=O)CCCN2C(=O)c3cccnc3C2=O)c(Cl)c1 ZINC000003660512 FG Annotated Anodyne COc1ccc(Cl)cc1/N=C(\O)CCN1C(=O)c2ccncc2C1=O ZINC000003662221 FG Annotated Mild CC1(C)Oc2cc(Br)sc2[C@@H](N2CCCCC2=O)[C@@H]1O ZINC000003775112 FG Annotated Anodyne O=C(Cc1ccc(Br)cc1)N1CCCC[C@@H]1CN1CCCC1 ZINC000003775811 FG Annotated Anodyne CC1(C)C(=O)c2ccc(C(F)(F)F)cc2[C@@H](n2ccccc2=O)[C@@H]1O ZINC000003775892 FG Annotated Anodyne CCN(CC)CCCN[C@H]1c2cc(OC)ccc2OCc2ncccc21 ZINC000003780095 FG Annotated Anodyne CC(C)CS(=O)(=O)N1CCC[C@@H]2CN3CCc4ccccc4[C@@H]3C[C@@H]21 ZINC000003784956 FG Annotated Anodyne C[C@@H]1SC(=O)NN=C1c1ccc2c(c1)C1(SCCCS1)C(=O)N2 ZINC000003787510 FG Annotated Anodyne O=C(O)c1ccc2cc(O)c3c(c2c1)C(=O)c1ccc(Cl)c(O)c1C3=O ZINC000003788509 FG Annotated Clean Cc1cc(-c2c(F)cc3c(=O)c(C(=O)O)cn4c3c2OC[C@@H]4C)cc(C)n1 ZINC000003789916 FG Annotated Anodyne O=C(O)c1cn(-c2ccc([N+](=O)[O-])cc2)c2cc(Cl)c(F)cc2c1=O ZINC000003802763 FG Annotated Bother CSC1=N[C@H](c2cccc([N+](=O)[O-])c2SC)C2=C(O)OCC2=N1 ZINC000003806659 FG Annotated Bother CSC1=N[C@H](c2cc([N+](=O)[O-])ccc2SC)C2=C(O)OCC2=N1 ZINC000003806660 FG Annotated Bother O=C1c2c(O)cccc2C(=Cc2cc(O)c(O)c(O)c2)c2cccc(O)c21 ZINC000003810342 FG Annotated Clean COc1ccc2c(c1)c(O)c(C(=S)N(C)c1ccccc1)c(=O)n2C ZINC000003813669 FG Annotated Anodyne CCc1csc(Sc2cc3c(cc2NS(C)(=O)=O)CCC3=O)n1 ZINC000003814521 FG Annotated Anodyne NS(=O)(=O)c1ccc(-n2nc(C(F)(F)F)cc2C2=CCCCC2)cc1 ZINC000003814693 FG Annotated Anodyne O=C(Nc1n[nH]c2nc(-c3ccc(O)c(Br)c3)ccc12)C1CC1 ZINC000003817136 FG Annotated Anodyne CCN1CCc2c(C)c(NS(C)(=O)=O)c(C)c(NC(=O)C(C)(C)C)c21 ZINC000003819883 FG Annotated Anodyne O=C1N[C@@H](CS)C(=O)N(CC2CCCCC2)[C@H]1CC1CCCCC1 ZINC000003821460 FG Annotated Mild Cc1cc(Br)cc(C)c1C/N=c1\c(O)c(O)\c1=N/C(C)(C)C ZINC000003822744 FG Annotated Anodyne C[C@@H]1CCc2cc(F)cc3c(=O)c(C(=O)NCCc4ccncc4)cn1c23 ZINC000003827811 FG Annotated Anodyne COc1ccc(OC)c(NC(=O)[C@H]2CCCN2C(=O)C2CCC(C)CC2)c1 ZINC000003895884 FG Annotated Anodyne COc1ccc(OC)c(NC(=O)[C@@H]2CCCN2C(=O)C2CCC(C)CC2)c1 ZINC000003895885 FG Annotated Anodyne CC[C@@H]1CCCCN1CC(=O)N1CCCc2c1c(=O)oc1ccc(O)cc21 ZINC000003903622 FG Annotated Anodyne CC[C@H]1CCCCN1CC(=O)N1CCCc2c1c(=O)oc1ccc(O)cc21 ZINC000003903623 FG Annotated Anodyne COC(=O)CNc1c(-c2ccccc2)nc2ccc(Br)cn12 ZINC000003906274 FG Annotated Anodyne O=C(NCc1ccc(Cl)cc1)c1ccc(NC(=O)[C@@H]2CCCO2)cc1 ZINC000003906333 FG Annotated Anodyne O=C(NCc1ccc(Cl)cc1)c1ccc(NC(=O)[C@H]2CCCO2)cc1 ZINC000003906334 FG Annotated Anodyne CCCCCCN/C(N)=N\c1nc(-c2ccc(CNC(C)=O)o2)cs1 ZINC000003923002 FG Annotated Mild CCc1nc(N(C)Cc2ccccc2)nc(-n2ccnc2C)c1[N+](=O)[O-] ZINC000003923348 FG Annotated Bother CN(C)CCO/N=C/[C@H]1CC[C@]2(O)C[C@@H](c3cccc(O)c3)CC[C@]12C ZINC000003946451 FG Annotated Mild CN(C)CCO/N=C/[C@H]1CC[C@]2(O)C[C@@H](c3ccc(O)cc3)CC[C@]12C ZINC000003946452 FG Annotated Mild CN(C)CCO/N=C/[C@H]1CC[C@]2(O)C[C@@H](c3ccc(CO)cc3)CC[C@]12C ZINC000003946454 FG Annotated Mild CC[C@]12CCCN3CC[C@@]4(c5ccc(OC)c(O)c5N(C(C)=O)[C@@H]4CC1)[C@@H]32 ZINC000003947538 FG Annotated Anodyne CC[C@@]12CCCN3CC[C@@]4(c5ccc(OC)c(O)c5N(C(C)=O)[C@@H]4CC1)[C@@H]32 ZINC000003947539 FG Annotated Anodyne CC(=O)NC[C@H]1CN(c2ccc(/C=C(\F)c3cccnc3)c(F)c2)C(=O)O1 ZINC000003955682 FG Annotated Anodyne O=S(=O)(c1ccccc1)N1CCC[C@@]2(CCN(c3ccccc3)C2)C1 ZINC000003955720 FG Annotated Anodyne CC(C)CN1CCC2(CC1)CCN(S(=O)(=O)c1ccccc1)CC2 ZINC000003955743 FG Annotated Anodyne O=S(=O)(c1ccccc1)N1CCC2(CCCN(c3ccccn3)C2)CC1 ZINC000003955756 FG Annotated Anodyne Cc1noc(C)c1C(=O)N1CCC[C@@]2(CCN(Cc3ccccc3)C2)C1 ZINC000003955911 FG Annotated Anodyne O=S(=O)(c1ccccc1)N1CCC2(CCCN(c3ccncc3)C2)CC1 ZINC000003956044 FG Annotated Anodyne Cn1cccc1C(=O)N1CCC[C@@]2(CCN(Cc3ccc(C#N)cc3)C2)C1 ZINC000003956169 FG Annotated Mild Cc1noc(C)c1C(=O)N1CCC2(CC1)CCN(c1ccncc1)CC2 ZINC000003956214 FG Annotated Anodyne Cc1noc(C)c1C(=O)N1CCC2(CCCN(Cc3nccs3)C2)CC1 ZINC000003956293 FG Annotated Anodyne O=C(c1cccc(F)c1)N1CCC[C@@]2(CCN(Cc3nccs3)C2)C1 ZINC000003956319 FG Annotated Anodyne Cn1cccc1C(=O)N1CCC2(CCCN(Cc3nccs3)C2)CC1 ZINC000003956405 FG Annotated Anodyne O=C1CCCN1CN(C(=O)c1ccc2c(c1)OCO2)c1cccc(Cl)c1 ZINC000003958688 FG Annotated Anodyne O=C1O[C@@H](COc2ccccn2)CN1c1ccc(C2=CCOCC2)c(F)c1 ZINC000003962739 FG Annotated Anodyne CC[C@H](c1ccc(F)c(F)c1)n1c(C(=O)OC)c(C(=O)OC)[nH]c1=S ZINC000003963136 FG Annotated Anodyne C[C@@H]1NC(c2cnccn2)=NC1(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000003964547 FG Annotated Anodyne COc1ccc2c(c1)O[C@@H](c1cc(OC)c(OC)c(OC)c1)C(C=O)=C2 ZINC000003964627 FG Annotated Reactive CN[C@@H](CCOc1ccc([N+](=O)[O-])cc1)c1ccc(OC(=O)N(C)C)cc1 ZINC000003966185 FG Annotated Bother C[C@H]1CN(c2ncc(-c3cccc(Cl)c3Cl)c(N)n2)C[C@@H](C)N1 ZINC000003966618 FG Annotated Anodyne in-vitro CCOC(=O)N1c2ccccc2NC(=O)[C@]1(C#CC1CC1)C(F)(F)F ZINC000003982756 FG Annotated Mild CO[C@H]1[C@@H](O)c2c(O)cccc2C2=C3CCC(=O)c4c(O)ccc(c43)[C@@H]21 ZINC000003982794 FG Annotated Anodyne C=Cc1cccc2c1/C(=N/O)C(=O)N2Cc1cc(F)cc2c1OCOC2 ZINC000003994188 FG Annotated Mild CCOC(=O)c1ccc(C[C@H]2CC[C@H]3CN[C@H](C(=O)OCC)C[C@H]3C2)cc1 ZINC000003995009 FG Annotated Anodyne Nc1ccc(NS(=O)(=O)c2ccccc2N)cc1-c1ccccc1O ZINC000035000912 FG Annotated Anodyne CC(C)(C)NC(=O)NC(=S)NC(=O)[C@H]1[C@H](C=C(Cl)Cl)C1(C)C ZINC000035000964 FG Annotated Anodyne O=C(NNCCO)c1[nH]c2ccc(Cl)cc2c1Sc1ccccc1 ZINC000035001629 FG Annotated Reactive CN(C)CCN1C(=O)[C@H]2[C@@H](c3ccccc3)C=C[C@H](c3ccccc3)[C@H]2C1=O ZINC000035047313 FG Annotated Anodyne CO[C@]12C(=O)/C(=C/c3ccco3)C[C@@]1(CO)[C@H]2[C@@]1(C)O[C@@H]1CC=C(C)C ZINC000035049784 FG Annotated Mild C[C@H]1CN2CCN(Cc3cccnc3)C[C@H]2C[C@@]1(C)c1cccc(O)c1 ZINC000035075228 FG Annotated Anodyne CC1(C)C[C@@]2(CN(Cc3ccc(N)cc3)C(=O)CO2)c2ccccc2O1 ZINC000035079516 FG Annotated Clean CC1(C)C[C@]2(CN(Cc3ccc(N)cc3)C(=O)CO2)c2ccccc2O1 ZINC000035079517 FG Annotated Clean CC(=O)O[C@@H]1[C@H](C)C[C@@H]2[C@@H]3[C@@H]4O[C@@H](CC(=O)CCC[C@]4(C)OC[C@@H]2C)[C@@H]31 ZINC000035086301 FG Annotated Anodyne N#Cc1c(N)nc(SCCN2CCCCC2)c(C#N)c1-c1ccco1 ZINC000035087246 FG Annotated Mild Cc1cc(NS(C)(=O)=O)cc(C)c1OC[C@@H]1CCCN2CCCC[C@H]12 ZINC000035090966 FG Annotated Anodyne Cc1cc(NS(C)(=O)=O)cc(C)c1OC[C@H]1CCCN2CCCC[C@H]12 ZINC000035090988 FG Annotated Anodyne CO[C@H]1CC[C@@H]2c3c(ccc(O)c31)[C@@]1(O)c3cccc(O)c3C(=O)C[C@@H]21 ZINC000035241623 FG Annotated Anodyne COc1ccc(-n2cnnc2-c2cc(OC)c(OC)c(OC)c2)cc1F ZINC000035259116 FG Annotated Anodyne CC[C@@H](C)C(=O)O[C@@H]1C2=C(C)C(=O)OC2=C[C@H]2CCC=C(C(=O)OC)[C@@]12C ZINC000035259364 FG Annotated Anodyne C=C1C(=O)[C@@]23CC[C@@H]4[C@H](C(=O)OC)C[C@@H](OC(C)=O)C[C@@]4(C)[C@@H]2CC[C@@H]1C3 ZINC000035269853 FG Annotated Mild Cc1cc(Cc2nc3n(n2)Cc2c(C)ncn2-c2ccc(Cl)cc2-3)on1 ZINC000035278595 FG Annotated Anodyne C/N=c1\cc[nH]c2sc3c(=O)n(-c4ccc(OC)cc4F)ccc3c12 ZINC000035279756 FG Annotated Anodyne CC(=O)O[C@@H]1c2c(ccc3ccc(=O)oc23)OC(C)(C)[C@@H]1OC(=O)C(C)C ZINC000035455857 FG Annotated Anodyne C[C@@H]1CC2=C(C[C@@H]3[C@](C)(CC[C@@]4(O)C(C)(C)C=CC(=O)[C@]34C)O2)C(=O)O1 ZINC000035465593 FG Annotated Mild O=[N+]([O-])c1cn2c(n1)CC[C@@H](OCc1ccc(OC(F)(F)F)cc1)C2 ZINC000035564972 FG Annotated Bother O=[N+]([O-])c1cn2c(n1)CC[C@H](OCc1ccc(OC(F)(F)F)cc1)C2 ZINC000035564973 FG Annotated Bother C[C@@H]1[C@H](c2ccncc2)OC(=S)N1C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000035791141 FG Annotated Bother COC(=O)C1=CCC[C@@H]2[C@@](C)(CCC3=CC(=O)OC3)[C@H](C)C[C@H](O)[C@@]12C ZINC000035791518 FG Annotated Anodyne in-vitro biogenic Cc1cc(OCCN2CCOCC2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000035846334 FG Annotated Anodyne C=C1CC[C@@H]2[C@]3(C)[C@@H](CC[C@@]2(C)[C@@H]1C(=O)OC)C(C)(C)C[C@H](O)[C@@H]3O ZINC000035858274 FG Annotated Mild C[C@@H]1CCCN1CCc1ccc2nc(-c3ccn4ncnc4n3)ccc2c1 ZINC000035858532 FG Annotated Anodyne CNC[C@@H](O)[C@H](c1ccccc1)n1c(=O)n(C2CCCC2)c2ccccc21 ZINC000035858803 FG Annotated Anodyne Nc1ccccc1C(=O)NC(=O)Nc1ccc(Sc2ncccn2)cc1 ZINC000035876860 FG Annotated Anodyne COc1ccc2oc3c(O)cc(/C=C\C(C)(C)O)c(OC)c3c(=O)c2c1 ZINC000035930710 FG Annotated Bother in-vitro biogenic COC(=O)c1cccc(CSc2nc3ccccc3n2CC(=O)O)c1 ZINC000035930716 FG Annotated Anodyne C[C@@]12CCC[C@@](C)(C(=O)O)[C@H]1CC[C@]13C[C@](C)(CC[C@@H]21)[C@H](O)[C@H]3CO ZINC000035942132 FG Annotated Anodyne CCc1cccc(CC)c1NC(=O)[C@@H](Cc1ccco1)NC(=O)CCl ZINC000035950348 FG Annotated Reactive CCc1cccc(CC)c1NC(=O)[C@H](Cc1ccco1)NC(=O)CCl ZINC000035950349 FG Annotated Reactive O=C1[C@H]2CCCN2[C@H](c2cccc(Br)c2)N1c1nccs1 ZINC000035973971 FG Annotated Anodyne C=C1C(=O)O[C@@H]2CC(C)=C([C@@H](C)CCCO)[C@H](OC(=O)[C@H](C)CC)[C@H]12 ZINC000035979434 FG Annotated Mild C=C1C(=O)O[C@@H]2CC(C)=C([C@@H](C)CCCO)[C@H](OC(=O)[C@@H](C)CC)[C@H]12 ZINC000035979436 FG Annotated Mild Cc1cc(OCCN2CCN(C)CC2)nn1-c1ccc(Cl)c(Cl)c1 ZINC000035996510 FG Annotated Anodyne CCCCCC[C@H](N1CCOCC1)C(O)(c1cccnc1)c1cccnc1 ZINC000035996517 FG Annotated Anodyne in-vivo CCCCCC[C@@H](N1CCOCC1)C(O)(c1cccnc1)c1cccnc1 ZINC000035996518 FG Annotated Anodyne in-vivo COc1cc2c(cc1OC)-c1c(OC)c(O)cc3c1[C@H](C2)[N+](C)(C)CC3 ZINC000036079950 FG Annotated Bother in-vivo COc1cccc(OC)c1OC(=O)[C@@H](CCSC)N1CCCCC1 ZINC000036080031 FG Annotated Anodyne COc1cccc(OC)c1OC(=O)[C@H](CCSC)N1CCCCC1 ZINC000036080032 FG Annotated Anodyne COc1cc(C)cc(OC)c1OC(=O)[C@@H](CCSC)N1CCCC1 ZINC000036080033 FG Annotated Anodyne COc1cc(C)cc(OC)c1OC(=O)[C@H](CCSC)N1CCCC1 ZINC000036080034 FG Annotated Anodyne C[C@]12CC[C@@](C)(O)C[C@@H]1CC[C@H]1[C@@H]2CC[C@@]2(C)[C@@H]1CCCN2C(=O)CO ZINC000036080171 FG Annotated Anodyne C[C@]12CC[C@@](C)(O)C[C@@H]1CC[C@H]1[C@H]2CC[C@@]2(C)[C@@H]1CCCN2C(=O)CO ZINC000036080172 FG Annotated Anodyne O=C1[C@H]2CCCN2[C@@H](c2cccc(Br)c2)N1c1nccs1 ZINC000036082178 FG Annotated Anodyne Oc1c2c(nn1-c1ccc(Cl)cc1)[C@@H]1CN(CC3CC3)CC[C@@H]1N=C2 ZINC000036088253 FG Annotated Anodyne CO[C@]12CCCCC[C@@H]1c1ccccc1/C2=N/OC[C@H](O)CNC(C)C ZINC000036107924 FG Annotated Mild CO[C@]12CCCCC[C@H]1c1ccccc1/C2=N/OC[C@H](O)CNC(C)C ZINC000036107925 FG Annotated Mild O=C([C@@H](O)C1CC1)N1CC(c2cc(F)ccc2F)=C[C@H]1c1cccc(O)c1 ZINC000036184648 FG Annotated Anodyne CCN(C(=O)C(C)C)c1ccc(C(O)(C(F)(F)F)C(F)(F)F)nc1 ZINC000036184810 FG Annotated Anodyne C=CCN1CC[C@H]2c3cccc(OS(=O)(=O)C(F)(F)F)c3CC[C@@H]21 ZINC000036187787 FG Annotated Unstable C=CCN1CC[C@@H]2c3cccc(OS(=O)(=O)C(F)(F)F)c3CC[C@@H]21 ZINC000036187788 FG Annotated Unstable CCCN[C@@H]1CCc2c(OS(=O)(=O)C(F)(F)F)cccc2[C@@H]1C ZINC000036216563 FG Annotated Unstable CC(=O)SC[C@H](C)C(=O)N(CC(=O)O)C[C@H]1C[C@H]2C[C@@H]([C@H]1C)C2(C)C ZINC000036222739 FG Annotated Anodyne O=[N+]([O-])c1cccc(S(=O)(=O)Nc2nc3cc(Cl)ccc3o2)c1 ZINC000036241912 FG Annotated Bother Cc1nn(Cc2ccccc2)c(=O)c2ncn3nc(-c4ccccc4)cc3c12 ZINC000036242928 FG Annotated Anodyne Cc1nn(Cc2ccccc2)c(=O)c2nc(C)n3nc(-c4ccoc4)cc3c12 ZINC000036242940 FG Annotated Anodyne c1ccc2sc(COc3ccc(OCCCc4nnn[nH]4)cc3)nc2c1 ZINC000036268553 FG Annotated Anodyne O=C1CC[C@@H]2CN([C@@H]3c4ccc(Cl)cc4CCc4cccnc43)CCN12 ZINC000036289137 FG Annotated Anodyne O=C1CC[C@@H]2CN([C@H]3c4ccc(Cl)cc4CCc4cccnc43)CCN12 ZINC000036289138 FG Annotated Anodyne C[C@H](Nc1cc(N(C)C)nc(-n2cnc3ccncc32)n1)c1ccccc1 ZINC000036348912 FG Annotated Anodyne NC(=O)Nc1snc(S[C@H]2CCc3cc(Cl)ccc32)c1C(N)=O ZINC000036348980 FG Annotated Anodyne NC(=O)Nc1snc(S[C@@H]2CCc3cc(Cl)ccc32)c1C(N)=O ZINC000036348982 FG Annotated Anodyne C[C@@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@]3(O)C(C)(C)C=CC(=O)[C@]3(C)[C@@H]1C2 ZINC000036375455 FG Annotated Mild C[C@H]1CC(=O)C2=C(O1)O[C@]1(C)CC[C@]3(O)C(C)(C)C=CC(=O)[C@]3(C)[C@@H]1C2 ZINC000036375457 FG Annotated Mild C[C@@H]1CC(=O)C2=C(O1)O[C@@]1(C)CC[C@]3(O)C(C)(C)C=CC(=O)[C@]3(C)[C@@H]1C2 ZINC000036375459 FG Annotated Mild C[C@H]1CC(=O)C2=C(O1)O[C@@]1(C)CC[C@]3(O)C(C)(C)C=CC(=O)[C@]3(C)[C@@H]1C2 ZINC000036375461 FG Annotated Mild CN1[C@H](C(=O)NCC2CC2)C[C@H]2Cn3c(nc4cc5ccccc5cc43)[C@@H]21 ZINC000036378282 FG Annotated Anodyne Cc1cc2nc3n(c2cc1C)C[C@@H]1C[C@H](C(=O)NCCC(C)C)N(C)[C@H]31 ZINC000036378296 FG Annotated Anodyne C=CCNC(=O)[C@@H]1C[C@H]2Cn3c(nc4cc(Cl)c(Cl)cc43)[C@@H]2N1C ZINC000036378297 FG Annotated Mild C=CCNC(=O)[C@H]1C[C@H]2Cn3c(nc4cc(Cl)c(Cl)cc43)[C@@H]2N1C ZINC000036378298 FG Annotated Mild Cc1cc2nc3n(c2cc1C)C[C@@H]1C[C@H](C(=O)NCc2ccccc2)N(C)[C@H]31 ZINC000036378309 FG Annotated Anodyne Cc1cc2nc3n(c2cc1C)C[C@@H]1C[C@H](C(=O)NCc2ccccc2)N(C)[C@@H]31 ZINC000036378310 FG Annotated Anodyne CCOC(=O)/C=C1\CN([C@H](C)c2ccccc2)S(=O)(=O)c2ccccc21 ZINC000036378324 FG Annotated Anodyne C=CCn1c(SCC(=O)[C@@H](C#N)C(C)=N)nc2sc(CC)cc2c1=O ZINC000036380003 FG Annotated Mild COc1ccccc1-c1csc2ncnc(Sc3nnnn3C)c12 ZINC000036380173 FG Annotated Anodyne COc1cccc(-c2csc3ncnc(Sc4nnnn4C)c23)c1 ZINC000036380174 FG Annotated Anodyne CC(=O)c1ccc(-c2csc3ncnc(Sc4nnnn4C)c23)cc1 ZINC000036380192 FG Annotated Anodyne CC(=O)c1cccc(-c2csc3ncnc(Sc4nnnn4C)c23)c1 ZINC000036380193 FG Annotated Anodyne CC(=O)c1ccccc1-c1csc2ncnc(Sc3nnnn3C)c12 ZINC000036380206 FG Annotated Anodyne CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2ccc(Cl)cc2)C1 ZINC000036380564 FG Annotated Anodyne CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2ccccc2Cl)C1 ZINC000036380652 FG Annotated Anodyne CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2cccc(Cl)c2)C1 ZINC000036380653 FG Annotated Anodyne CC(=O)c1cc2c(s1)c1cnn(Cc3ccccc3F)c(=O)c1n2C ZINC000036380678 FG Annotated Anodyne Cn1c2cc([N+](=O)[O-])sc2c2cnn(Cc3ccccc3F)c(=O)c21 ZINC000036380680 FG Annotated Bother CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2c(C)cccc2C)C1 ZINC000036380771 FG Annotated Anodyne NC(=O)C1CCN(c2nc(-c3ccccc3Br)cs2)CC1 ZINC000036380796 FG Annotated Anodyne CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2ccc(C)c(C)c2)C1 ZINC000036380826 FG Annotated Anodyne CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2cccc(C)c2C)C1 ZINC000036380828 FG Annotated Anodyne CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2ccc(C)cc2C)C1 ZINC000036380830 FG Annotated Anodyne CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2cc(C)cc(C)c2)C1 ZINC000036380852 FG Annotated Anodyne CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2cc(C)ccc2C)C1 ZINC000036380855 FG Annotated Anodyne COc1ccc(CCn2c(=S)[nH]c(=O)c3c(C)cc(C)nc32)cc1OC ZINC000036380993 FG Annotated Anodyne COC1=C[C@H](C(=O)NCc2ccccn2)[C@H](C)[C@@H](c2ccccc2)CC1=O ZINC000036381825 FG Annotated Mild COc1ccc2c(c1)CO[C@H]([C@H](O)COC(C)=O)[C@H]2/C=C/c1ccccc1 ZINC000036381852 FG Annotated Anodyne COc1cccc2c1[C@H](/C=C/c1ccccc1)[C@@H]([C@H](O)COC(C)=O)OC2 ZINC000036381853 FG Annotated Anodyne COc1cc(CO[C@H]2C=C[C@@H](c3ccccc3)O[C@@H]2CO)cc(OC)c1 ZINC000036381858 FG Annotated Anodyne CC[C@H]1Nc2ncnc(N3CCCCC3)c2N(Cc2ccccc2)C1=O ZINC000036382432 FG Annotated Anodyne CC[C@@H]1Nc2ncnc(N3CCCCC3)c2N(Cc2ccccc2)C1=O ZINC000036382433 FG Annotated Anodyne Brc1cccc[n+]1C/C=C/C[n+]1ccccc1Br ZINC000036382674 FG Annotated Anodyne CC(=O)/C=C/c1ccc2c(c1)S(=O)(=O)N(C1CCCC1)[C@H]2CC(C)=O ZINC000036382888 FG Annotated Mild COC(=O)c1ccc2nc3c(cc2c1)[C@@H]1CCN2C(=O)CCC[C@H](C3)[C@H]12 ZINC000036382930 FG Annotated Anodyne O=C1CCN(Cc2ccccc2)S(=O)(=O)c2ccc(C(F)(F)F)cc21 ZINC000036383034 FG Annotated Anodyne COc1ccc(C2=NCCn3c2c2ccc(C(F)(F)F)cc2[n+]3[O-])cc1 ZINC000036383463 FG Annotated Anodyne CCCCCOC(=O)[C@@H]1[C@@H]2C=C[C@@]3(CN(c4ccccc4C)C(=O)[C@@H]13)O2 ZINC000036383544 FG Annotated Anodyne COc1ccc([C@H]2C(C#N)=C(C)NC3=C2S(=O)(=O)c2ccccc23)cc1 ZINC000036383702 FG Annotated Reactive COc1ccc([C@@H]2C(C#N)=C(C)NC3=C2S(=O)(=O)c2ccccc23)cc1 ZINC000036383703 FG Annotated Reactive COC(=O)C1=C(c2ccc(C(C)=O)cc2)C[C@@H]2CC[C@H]1N2C(=O)NC(C)C ZINC000036384230 FG Annotated Anodyne COC(=O)C1=C(c2ccc(F)cc2F)C[C@@H]2CC[C@H]1N2C(=O)NC(C)C ZINC000036384231 FG Annotated Anodyne COC(=O)C1=C(c2c(C)noc2C)C[C@@H]2CC[C@H]1N2C(=O)N1CCCCC1 ZINC000036384237 FG Annotated Anodyne CCCNC(=O)N1[C@H]2CC[C@@H]1C(C(=O)OC)=C(c1ccc(C(C)=O)cc1)C2 ZINC000036384251 FG Annotated Anodyne CCCNC(=O)N1[C@H]2CC[C@@H]1C(C(=O)OC)=C(c1ccc(F)cc1F)C2 ZINC000036384252 FG Annotated Anodyne COC(=O)C1=C(c2ccc(F)cc2F)C[C@@H]2CC[C@H]1N2C(=O)NC1CC1 ZINC000036384362 FG Annotated Anodyne Cc1onc(-c2ccccc2)c1C(=O)N/N=C/c1ccc([N+](=O)[O-])c(O)c1 ZINC000036384365 FG Annotated Reactive Cc1onc(-c2ccccc2)c1C(=O)N/N=C/c1ccc(O)c([N+](=O)[O-])c1 ZINC000036384366 FG Annotated Reactive COc1ccc(O[C@H]2[C@H](/C=C/C#Cc3ccc(F)cc3F)OC[C@H]2O)cc1 ZINC000036384625 FG Annotated Mild CN(C)c1ccc(CNC(=O)[C@@]2(C)C=C[C@@H](Cc3ccccc3)N2C)cc1 ZINC000036384865 FG Annotated Clean Cc1ccc(CN2CCN(C/C=C/c3ccc(F)cc3)C[C@H]2CCO)o1 ZINC000036385596 FG Annotated Anodyne CN1CCN(Cc2nc(Cc3cccc(F)c3)no2)C[C@H]1c1ccccc1 ZINC000036385611 FG Annotated Anodyne CC(C)c1csc(CN2CCN(Cc3ccccc3)[C@H](CCO)C2)n1 ZINC000036385675 FG Annotated Anodyne CC(=O)c1cc(CN2CCN(C3CCCCC3)[C@H](CCO)C2)cs1 ZINC000036385743 FG Annotated Anodyne Cc1ccc(CN2CCN(Cc3c(C)nn(C(C)C)c3C)C[C@H]2CCO)o1 ZINC000036385818 FG Annotated Anodyne Cc1ccc([C@@H]2CC=C(C(=O)O)CN2S(=O)(=O)c2ccccc2C)cc1 ZINC000036387292 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H](C(=O)OC(C)(C)C)c1ccc2c(c1)OCO2 ZINC000036387560 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](C(=O)OC(C)(C)C)c1ccc2c(c1)OCO2 ZINC000036387561 FG Annotated Anodyne COc1ccc(C2=C3C(=O)OC[C@@H]3Cc3ncn(Cc4ccccc4)c32)cc1 ZINC000036387964 FG Annotated Anodyne COc1ccc(C2=C3C(=O)OC[C@H]3Cc3ncn(Cc4ccccc4)c32)cc1 ZINC000036387966 FG Annotated Anodyne COc1cc2cc(CCCOC(=O)c3ccco3)oc(=O)c2cc1OC ZINC000036388709 FG Annotated Anodyne COc1cc2cc(CCOC(=O)c3ccc(F)cc3)oc(=O)c2cc1OC ZINC000036388710 FG Annotated Anodyne O=C(OCCCc1cc2ccccc2c(=O)o1)c1ccc2c(c1)OCO2 ZINC000036388803 FG Annotated Anodyne COc1cc(C#Cc2ccc3cc(CCCO)oc(=O)c3c2)cc(OC)c1 ZINC000036388907 FG Annotated Mild COc1cc(C#Cc2ccc3cc(C(C)(C)O)oc(=O)c3c2)cc(OC)c1 ZINC000036388915 FG Annotated Mild C[C@]1(NC(=O)CCc2ccccc2)CCN(CCCc2ccccc2)C1=O ZINC000036389158 FG Annotated Anodyne C[C@@]1(NC(=O)CCc2ccccc2)CCN(CCCc2ccccc2)C1=O ZINC000036389159 FG Annotated Anodyne CC(C)C[C@H]1NC(=O)c2ccccc2-n2c1nc1cc(F)ccc1c2=O ZINC000036389162 FG Annotated Anodyne CC(C)C[C@@H]1NC(=O)c2ccccc2-n2c1nc1cc(F)ccc1c2=O ZINC000036389163 FG Annotated Anodyne CC(C)C[C@H]1NC(=O)c2ccccc2-n2c1nc1ccc(F)cc1c2=O ZINC000036389164 FG Annotated Anodyne CC(C)C[C@@H]1NC(=O)c2ccccc2-n2c1nc1ccc(F)cc1c2=O ZINC000036389165 FG Annotated Anodyne CC(=O)C[C@H](O)CC(=O)[C@H]1OC(=O)CCCCCCCc2ccccc21 ZINC000036389196 FG Annotated Anodyne Cc1ccc(Cl)c2c1[nH]c1nc3nnc(Cc4ccc(O)cc4)n3nc12 ZINC000036408008 FG Annotated Bother Cc1ccc(Nc2cc(-c3cccc(N)c3)ncn2)cc1NS(C)(=O)=O ZINC000036408167 FG Annotated Anodyne CC(=O)O[C@@]1(CO)C[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)O)[C@@H]2CC[C@@H]1C3 ZINC000036416810 FG Annotated Anodyne CO[C@H]1C2=C(C(=O)[C@@H](C)[C@@H]2c2ccoc2)[C@@]23CCC=C(C)[C@@H]2[C@@H]1OC3=O ZINC000036416893 FG Annotated Mild CCCCn1ncc(OCc2nnc(-c3ccccc3)o2)c(Cl)c1=O ZINC000036423795 FG Annotated Anodyne Cc1nn(-c2cccc([N+](=O)[O-])c2)c2nc(C(F)(F)F)sc(=O)c12 ZINC000036434218 FG Annotated Bother COc1cc2c(c(OC)c1CBr)C(=O)c1ccccc1C2=O ZINC000036441163 FG Annotated Reactive C[C@@](Cl)(/C=C/Br)[C@@H]1C[C@H](Br)[C@](C)(O)CO1 ZINC000036441261 FG Annotated Reactive CO[C@@H]1C[C@H](O)C2=C3c4cccc(O)c4C(=O)C[C@@H]3c3ccc(O)c1c32 ZINC000036453050 FG Annotated Anodyne CO[C@H]1C[C@H](O)C2=C3c4cccc(O)c4C(=O)C[C@@H]3c3ccc(O)c1c32 ZINC000036453051 FG Annotated Anodyne COc1ccc2c(c1OC)Oc1c3c(cc4ccnc(c14)[C@@H]2O)OCO3 ZINC000036463518 FG Annotated Anodyne CC(=O)O[C@@H]1C(=O)C[C@@]2(C)[C@@H](CC[C@@]3(C)c4cocc4CC[C@@H]32)[C@@]1(C)CO ZINC000036471573 FG Annotated Anodyne CO/N=C(\N)c1ccc(-c2ccc(-c3ccc(C(=N)NOC)cc3)cc2)o1 ZINC000036476232 FG Annotated Mild C[C@@H]1CNCCN1c1ccc2c(n1)[C@@H](OCc1cc(F)ccc1F)CC2 ZINC000036520297 FG Annotated Anodyne N#C[C@@H](C(N)=O)[C@@H](S)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000036901613 FG Annotated Mild in-vivo N#C[C@@H](C(N)=O)[C@H](S)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000036901615 FG Annotated Mild N#C[C@H](C(N)=O)[C@@H](S)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000036901617 FG Annotated Mild N#C[C@H](C(N)=O)[C@H](S)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000036901619 FG Annotated Mild O=c1[nH]c2ccc(N3CCCC3)nc2nc1CSCc1ccccc1 ZINC000037492461 FG Annotated Anodyne O=C1N=c2ccccc2=C1C=C1C=CN(Cc2ccc(CCl)cc2)C=C1 ZINC000377466635 FG Annotated Reactive O=C1N=c2ccccc2=C1C=C1C=CN(Cc2c(F)cccc2Cl)C=C1 ZINC000377466639 FG Annotated Anodyne C[C@@H](OC(=O)c1cnn2c1[nH][n+](=O)c1ccc(Cl)cc12)c1ccccc1 ZINC000377602839 FG Annotated Anodyne C[C@H](OC(=O)c1cnn2c1[nH][n+](=O)c1ccc(Cl)cc12)c1ccccc1 ZINC000377602842 FG Annotated Anodyne Cc1ccccc1OC(=O)C[C@H]1C=NN2c3cc(Cl)ccc3[N+](=O)N[C@@H]12 ZINC000377605755 FG Annotated Anodyne Cc1ccccc1OC(=O)C[C@@H]1C=NN2c3cc(Cl)ccc3[N+](=O)N[C@@H]12 ZINC000377605784 FG Annotated Anodyne Cc1ccccc1OC(=O)C[C@H]1C=NN2c3cc(Cl)ccc3[N+](=O)N[C@H]12 ZINC000377605786 FG Annotated Anodyne Cc1ccccc1OC(=O)C[C@@H]1C=NN2c3cc(Cl)ccc3[N+](=O)N[C@H]12 ZINC000377605789 FG Annotated Anodyne COc1ccc2c(c1)n(O)c(C(=O)c1cccs1)c(C(F)(F)F)[n+]2=O ZINC000377799885 FG Annotated Anodyne O=C(c1ccco1)c1cnn2c1[nH][n+](=O)c1ccc(Oc3ccccc3)cc12 ZINC000377803471 FG Annotated Anodyne CCOC(=O)CN1C=CC(=C(O)N=N/C=C2/C=C(Cl)C=CC2=O)C=C1 ZINC000377805989 FG Annotated Mild CCOC(=O)CN1C=CC(=C(O)N=N/C=C2\C=C(Cl)C=CC2=O)C=C1 ZINC000377805990 FG Annotated Mild C1=CN2C=CC1=NCc1cccc(c1)CN=C1C=CN(C=C1)CCOCC2 ZINC000377815081 FG Annotated Anodyne O=C(c1cccs1)c1cnn2c1[nH][n+](=O)c1ccc(C(F)(F)F)cc12 ZINC000377825221 FG Annotated Anodyne Cc1ccc2c(c1)n(O)c(C(=O)c1cccs1)c(C(F)(F)F)[n+]2=O ZINC000377825235 FG Annotated Anodyne O=C(c1ccco1)c1c(C(F)(F)F)[n+](=O)c2ccc(Cl)cc2n1O ZINC000377829936 FG Annotated Anodyne O=C(NCc1ccccc1)c1c(-c2ccccc2)n(O)c2ccccc2[n+]1=O ZINC000377829946 FG Annotated Anodyne O=C(c1cccs1)c1c(C(F)(F)F)[n+](=O)c2ccc(F)cc2n1O ZINC000377829982 FG Annotated Anodyne O=C(c1ccccc1)c1c(C(F)(F)F)[n+](=O)c2ccc(F)cc2n1O ZINC000377829983 FG Annotated Anodyne Cc1ccc2ccc3c(c2n1)=N[S@](=O)(O)=c1ccc(C(F)(F)F)cc1=3 ZINC000377833868 FG Annotated Anodyne CC(C)(C)C(=O)c1c(C(F)(F)F)[n+](=O)c2cc(F)c(F)cc2n1O ZINC000377836344 FG Annotated Anodyne O=C(c1ccccc1)c1c(C(F)(F)F)[n+](=O)c2cc(F)c(F)cc2n1O ZINC000377836364 FG Annotated Anodyne CC1(C)O[C@@H]2C(=O)c3ccccc3C(=O)[C@@H]2[C@@H](N=[N+]=[N-])[C@@H]1Br ZINC000377836376 FG Annotated Reactive CC1(C)O[C@@H]2C(=O)c3ccccc3C(=O)[C@H]2[C@@H](N=[N+]=[N-])[C@@H]1Br ZINC000377836377 FG Annotated Reactive CC1(C)O[C@H]2C(=O)c3ccccc3C(=O)[C@H]2[C@@H](N=[N+]=[N-])[C@@H]1Br ZINC000377836378 FG Annotated Reactive CC1(C)O[C@H]2C(=O)c3ccccc3C(=O)[C@@H]2[C@@H](N=[N+]=[N-])[C@@H]1Br ZINC000377836379 FG Annotated Reactive O=C1/C(=C(\O)Nc2cccc([N+](=O)[O-])c2)N=NN1c1cccc([N+](=O)[O-])c1 ZINC000377841304 FG Annotated Bother O=C1/C(=C(/O)Nc2cccc([N+](=O)[O-])c2)N=NN1c1cccc([N+](=O)[O-])c1 ZINC000377841305 FG Annotated Bother COc1ccc2c(c1)n(O)c(-c1ccc(Cl)c(Cl)c1)c(N)[n+]2=O ZINC000377841327 FG Annotated Anodyne COc1ccc2c(c1)n(O)c(-c1c(Cl)cccc1Cl)c(N)[n+]2=O ZINC000377844297 FG Annotated Anodyne CCOC(=O)c1c(C(F)(F)F)[n+](=O)c2cc(Cl)c(Cl)cc2n1O ZINC000377845646 FG Annotated Anodyne CCOC(=O)c1c(C(F)(F)F)[n+](=O)c2ccc(C(F)(F)F)cc2n1O ZINC000377845787 FG Annotated Anodyne CC1(C)Cc2ccccc2C(C(=NNc2cccc(Cl)c2)C(N)=O)=N1 ZINC000377848898 FG Annotated Mild CCN(CC)CCCNc1cc(C)nc2c3cc4ccccc4nc3[nH][n+]12 ZINC000377853419 FG Annotated Bother C1=CN2C=CC1=NCc1ccc(cc1)CN=C1C=CN(C=C1)CCOCC2 ZINC000377853795 FG Annotated Anodyne C1=CN2C=CC1=NCCOCCN=C1C=CN(C=C1)Cc1cccc(c1)C2 ZINC000377853797 FG Annotated Anodyne COC(=O)c1ccc(Cn2c(O)c(N=NC(N)=S)c3ccccc32)o1 ZINC000377871789 FG Annotated Clean O=C(c1ccc[nH]1)c1cnn2c1[nH][n+](=O)c1ccc(Oc3ccccc3)cc12 ZINC000379420238 FG Annotated Anodyne CC(C)(C)c1cc(C[C@@H](CO[N+](=O)[O-])[N+](=O)[O-])cc(C(C)(C)C)c1O ZINC000038143399 FG Annotated Bother CC(C)(C)c1cc(C[C@H](CO[N+](=O)[O-])[N+](=O)[O-])cc(C(C)(C)C)c1O ZINC000038143400 FG Annotated Bother CC(C)(O)C1=C[C@@]23CC[C@@H]4[C@](C)(CCC[C@@]4(C)C(=O)O)[C@@H]2C[C@@H]1OO3 ZINC000038143733 FG Annotated Reactive Cc1nc(C)c(/C=C\[C@@H]2C[C@@H](O)CC(=O)O2)c(-c2ccc(Cl)cc2)n1 ZINC000038148819 FG Annotated Anodyne Cc1ccc(Cl)cc1NC(=O)CN1CCC(c2cccc[n+]2[O-])CC1 ZINC000038149990 FG Annotated Anodyne CC(C)c1ccc(N/N=C2\CC[C@@H](C)n3c2ncc(C(=O)O)c3=O)cc1 ZINC000038153708 FG Annotated Mild CC(C)c1ccc(N/N=C2\CC[C@H](C)n3c2ncc(C(=O)O)c3=O)cc1 ZINC000038153709 FG Annotated Mild O=S1(=O)N=C(NC2(c3ccccc3)CC2)Nc2cc(Cl)sc21 ZINC000038157782 FG Annotated Anodyne O=C(COc1cccc(Br)c1)N/N=C\c1ccccc1F ZINC000038163462 FG Annotated Reactive O=C1N=C(O)N(c2ccccc2)C(=O)/C1=C\C=C1/C=Cc2ccccc2N1 ZINC000038179509 FG Annotated Clean CCOC(=O)CCCCCSc1nc2ccccc2n1CC(=O)O ZINC000038208575 FG Annotated Anodyne C[C@H](C(=O)[C@@H](C)C(=O)N1CC[C@H](O)C1)c1cccc(Oc2ccccc2)c1 ZINC000038208912 FG Annotated Anodyne C[C@H](C(=O)[C@H](C)c1cccc(Oc2ccccc2)c1)C(=O)N1CC[C@H](O)C1 ZINC000038208913 FG Annotated Anodyne C[C@@H](C(=O)[C@@H](C)c1cccc(Oc2ccccc2)c1)C(=O)N1CC[C@H](O)C1 ZINC000038208914 FG Annotated Anodyne C[C@@H](C(=O)[C@H](C)c1cccc(Oc2ccccc2)c1)C(=O)N1CC[C@H](O)C1 ZINC000038208915 FG Annotated Anodyne CCNC(=O)N(c1ccc(OCC)cc1)c1ccnc(N[C@@H](C)COC)n1 ZINC000038224760 FG Annotated Anodyne C=C1CC[C@@H]2[C@@](C)(C(=O)O)[C@H](C(C)(C)C=O)CC[C@@]2(C)[C@@H]1C(=O)OC ZINC000038267027 FG Annotated Mild CN(CCN1CCCCC1)C(=O)N1CCC2(CC1)CC(=O)c1ccccc12 ZINC000038267442 FG Annotated Anodyne Cc1cc(=O)c(-c2nnc(Nc3ccccc3F)o2)nn1-c1ccccc1 ZINC000038280201 FG Annotated Anodyne COC(=O)CN(C)CC(=O)N[C@@H]1[C@H](C(C)C)CC[C@H](C)[C@@]12C=C(C)CC2 ZINC000038280266 FG Annotated Anodyne CC(=O)O[C@@H]1/C=C(\C)CC/C=C(/C(=O)O)C[C@@H](OC(C)=O)[C@@H]1C(C)C ZINC000038307169 FG Annotated Anodyne C[C@H]1O[C@@H](n2c(Cl)c(C#N)c3cc(Cl)c(Cl)cc32)[C@H](O)[C@@H]1O ZINC000038318321 FG Annotated Mild CCNC(=O)Nc1nc2c(-n3cccn3)c(F)c(-c3cccnc3)cc2[nH]1 ZINC000038318406 FG Annotated Anodyne O=S(=O)(Nc1ccc2c(c1)C(C1CCNCC1)=CCO2)c1ccccc1 ZINC000038318544 FG Annotated Anodyne CN(C)CCCNc1nccc([C@@H](C#N)c2nc3ccccc3s2)n1 ZINC000038345066 FG Annotated Mild CN(C)CCCNc1nccc([C@H](C#N)c2nc3ccccc3s2)n1 ZINC000038345067 FG Annotated Mild CCCOc1ccc2nc(-c3ccc(OCCOC)c(OC)c3)cn2n1 ZINC000038345170 FG Annotated Anodyne COc1cc2c3ccc4c(c3c[n+](C)c2c2cc3c(cc12)OCO3)OCO4 ZINC000038423100 FG Annotated Bother O=C(Nc1cccnc1)C(=O)c1cc(Cc2ccc(O)cc2)n2ccccc12 ZINC000038424099 FG Annotated Anodyne COC(=O)[C@@]1(O)C=CC[C@H]2[C@]3(C)C[C@@H](c4ccoc4)OC(=O)C3=CC[C@]21C ZINC000038424223 FG Annotated Anodyne COC1=C[C@@H](C)[C@@H]2C[C@H]3OC=C[C@H]4C(C)=C(OC)C(=O)[C@H]([C@@]2(C)C1=O)[C@@]34C ZINC000038424254 FG Annotated Mild O=C(Oc1ccc(Br)c(Cl)c1)N1CCN2CCC1CC2 ZINC000038444564 FG Annotated Anodyne CCOC(=O)C(=O)/C(=N\Nc1ccccc1)C(=O)c1ccc(Cl)cc1 ZINC000038459252 FG Annotated Mild CN(C)CCCSc1ncc(/C(=N\O)c2ccc(Cl)cc2)n1C ZINC000038463321 FG Annotated Mild CC[C@@H](C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)[C@](C)(O)[C@H](O)[C@H]2CO1 ZINC000038543140 FG Annotated Mild CN(C)C[C@H](Br)c1ccc(I)cc1 ZINC000038543198 FG Annotated Reactive CN(C)C[C@@H](Br)c1ccc(I)cc1 ZINC000038543199 FG Annotated Reactive C=CC[C@]12C=C(OC)C(=O)[C@H]([C@H](c3ccc(OC)c(OC)c3)[C@H]1C)[C@H]2O ZINC000038543458 FG Annotated Mild CCNc1c(C(=O)N(CC)CC)c2nnc(C(C)C)n2c2ncccc12 ZINC000038696510 FG Annotated Anodyne CC(/C=C/C=O)=C1/C(=O)C[C@@H]2[C@]1(C)CC[C@@H]1[C@]2(C)CC[C@@H](O)[C@]1(C)C(=O)O ZINC000038699384 FG Annotated Reactive CC(=O)O[C@H]1C(=O)C2=CC3=C(C=O)[C@@H](O)CC[C@@]3(C)CC[C@]2(C)[C@H]1C(C)C ZINC000038699386 FG Annotated Reactive C=C1/C=C/[C@@H]([C@H](C)C(=C)C)OC(=O)C[C@]2(O)O[C@@H](CC(=C)[C@H]2C)[C@@H]2O[C@H]2C1 ZINC000038699387 FG Annotated Mild S=C(SSC(=S)N1CCSCC1)N1CCSCC1 ZINC000038793690 FG Annotated Reactive CC(=O)O[C@H]1C[C@]2(C)C(=O)C=CC[C@H]2[C@](C)(CCC2=CCOC2=O)[C@H]1C ZINC000038794088 FG Annotated Mild O=C1N=C(O)[C@@H](O)N1/N=C/c1ccc(-c2cccc(C(F)(F)F)c2)o1 ZINC000038796608 FG Annotated Mild O=C1N=C(O)[C@H](O)N1/N=C/c1ccc(-c2cccc(C(F)(F)F)c2)o1 ZINC000038796611 FG Annotated Mild COc1cc(OC)cc([C@H]2C(C#N)=C(N)Oc3c2ccc2c3ccn2C)c1 ZINC000038824645 FG Annotated Reactive COc1cc(OC)cc([C@@H]2C(C#N)=C(N)Oc3c2ccc2c3ccn2C)c1 ZINC000038824647 FG Annotated Reactive C[C@H](Br)C1=C(Br)/C(=C/Br)OC1=O ZINC000038842683 FG Annotated Reactive C[C@@H](Br)C1=C(Br)/C(=C/Br)OC1=O ZINC000038842685 FG Annotated Reactive C=C[C@]1(C)O[C@@]2(C)CC[C@H](C(C)(C)C(=O)O)[C@@](C)(CC(=O)O)[C@@H]2C[C@H]1O ZINC000038858015 FG Annotated Mild COc1cc(OC)c(OC)cc1/C=N/N=c1/cc(C)[nH]c2ccccc12 ZINC000038889798 FG Annotated Mild CC[C@@]12C[C@@](C)(O)[C@](O)(c3ccccn3)C[C@H]1CCc1cc(O)ccc12 ZINC000038894828 FG Annotated Anodyne COc1ccc2c3c(n(C)c2c1)[C@@H]1C[C@H]2C(C(C)=O)=COC[C@H]2[C@H](C3)N1C ZINC000038895559 FG Annotated Mild Nc1ccc(Cc2cc(C(=O)C(=O)Nc3cccnc3)c3ccccn23)cc1 ZINC000038895791 FG Annotated Clean CC(=O)O[C@@H]1C/C=C(/C)C[C@H]2O[C@H]3[C@@H]4[C@H]2C(C)=CC(=O)[C@@H]4[C@@H](C)CO[C@]31C ZINC000038896042 FG Annotated Mild CC(=O)O[C@@H]1C/C=C(/C)C[C@@H]2O[C@H]3[C@@H]4[C@H]2C(C)=CC(=O)[C@@H]4[C@@H](C)CO[C@]31C ZINC000038896043 FG Annotated Mild NC(=O)c1ccc(Oc2ccc(CNCCC3CCOCC3)cc2F)nc1 ZINC000038910715 FG Annotated Anodyne in-man CC1=CC(=O)[C@@H]2[C@](C)(CCC[C@@]2(C)CO)[C@@]12CC[C@@](C)(CC(=O)O)O2 ZINC000038962635 FG Annotated Mild CCCCNC(=O)[C@@H]1c2ccccc2OCC(=O)N1Cc1ccccc1 ZINC000038962719 FG Annotated Anodyne CCCCNC(=O)[C@H]1c2ccccc2OCC(=O)N1Cc1ccccc1 ZINC000038962720 FG Annotated Anodyne C=C(C)[C@H](CCC1=C[C@H](CC(C)=O)OC1=O)[C@H](O)c1oc(C=O)cc1C ZINC000038963103 FG Annotated Mild Cc1c(O)c(C)c2oc(=O)c(C3=CC(=O)C[C@H](C)O3)cc2c1[C@@H](C)[C@@H](C)O ZINC000038987724 FG Annotated Mild Clc1nc2nonc2nc1Nc1ccccc1I ZINC000038987805 FG Annotated Anodyne CC(C)(C(=O)O)[C@H]1CC[C@@]23C=C[C@@H](C[C@H]2[C@]1(C)CC(=O)O)[C@@](C)(O)C3 ZINC000039008276 FG Annotated Anodyne Cc1c(O)cc2oc(=O)c(C3=CC(=O)C[C@H](C)O3)cc2c1[C@@H](C)[C@@H](C)O ZINC000039030499 FG Annotated Mild CC(=O)O[C@H]1c2c(ccc3ccc(=O)oc23)OC(C)(C)[C@@H]1Br ZINC000039031010 FG Annotated Reactive CC(C)=C1C[C@@]2(C)C(=CC1=O)CC[C@@H](OC(=O)/C=C\[S@](C)=O)[C@@H]2C ZINC000039052281 FG Annotated Mild CO/C=C(C(=O)OC)\C(C)=C/C=C/c1ccc2c(c1)OC(C)(C)[C@@H](O)CO2 ZINC000039097051 FG Annotated Anodyne C=C1C(=O)C2=C[C@@H]1C[C@H](OC(C)=O)C(=O)[C@]1(C)CCCC(C)(C)[C@H]1C[C@H]2O ZINC000039161445 FG Annotated Mild in-vitro biogenic C[C@@H](S(=O)(=O)c1ccc(Cl)c(Cl)c1)S(=O)(=O)C(F)(F)F ZINC000039179199 FG Annotated Anodyne C[C@H](S(=O)(=O)c1ccc(Cl)c(Cl)c1)S(=O)(=O)C(F)(F)F ZINC000039179200 FG Annotated Anodyne CN(C)Cc1nnc2n1-c1ccc(Cl)cc1N(c1ccccc1)C(=O)C2 ZINC000039193618 FG Annotated Anodyne CNC(=O)N1C/C(=C\c2ccccc2)C2=NN(C)[C@@H](c3ccccc3)[C@H]2C1 ZINC000039235807 FG Annotated Anodyne CNC(=O)N1C/C(=C\c2ccccc2)C2=NN(C)[C@@H](c3ccccc3)[C@@H]2C1 ZINC000039235808 FG Annotated Anodyne CNC(=O)N1C/C(=C\c2ccccc2)C2=NN(C)[C@H](c3ccccc3)[C@H]2C1 ZINC000039235810 FG Annotated Anodyne CNC(=O)N1C/C(=C\c2ccccc2)C2=NN(C)[C@H](c3ccccc3)[C@@H]2C1 ZINC000039235812 FG Annotated Anodyne CCOCCNC(=O)c1cccnc1Sc1cc(OC)ccc1OC ZINC000039263177 FG Annotated Anodyne COc1ccc(OC)c(Sc2ncccc2C(=O)N(C)CCC#N)c1 ZINC000039263907 FG Annotated Mild COc1ccc(OC)c(Sc2ncccc2C(=O)NCCSC)c1 ZINC000039264028 FG Annotated Anodyne CNc1ccc(Sc2nncn2C)cc1C(=O)Nc1nc(C)cs1 ZINC000039277809 FG Annotated Anodyne in-vivo CC(C)N1C(=O)N[C@@H](c2ccc3c(c2)OCO3)c2cc3c(cc21)OCO3 ZINC000039290297 FG Annotated Anodyne CC(C)N1C(=O)N[C@H](c2ccc3c(c2)OCO3)c2cc3c(cc21)OCO3 ZINC000039290298 FG Annotated Anodyne CC(C)N1C(=O)N[C@@H](c2ccccc2[N+](=O)[O-])c2cc3c(cc21)OCO3 ZINC000039290299 FG Annotated Bother CC(C)N1C(=O)N[C@H](c2ccccc2[N+](=O)[O-])c2cc3c(cc21)OCO3 ZINC000039290300 FG Annotated Bother CC(C)n1c(=O)nc(-c2ccccc2[N+](=O)[O-])c2cc3c(cc21)OCO3 ZINC000039290317 FG Annotated Bother CC(C)n1c(=O)nc(-c2cccc([N+](=O)[O-])c2)c2cc3c(cc21)OCO3 ZINC000039290318 FG Annotated Bother C[C@H](C(=O)NCC(=O)O)c1ccc2c(c1)SC[C@@H]1CCCC[C@@H]1C2=O ZINC000039310066 FG Annotated Anodyne C[C@@H](C(=O)NCC(=O)O)c1ccc2c(c1)SC[C@@H]1CCCC[C@@H]1C2=O ZINC000039310067 FG Annotated Anodyne CSCCNCc1c(C(=O)N2CCCCCCC2)nc2sccn12 ZINC000039359808 FG Annotated Anodyne CCN(Cc1ccncc1)[C@@H]1CCCN(C(=O)CCc2scnc2C)C1 ZINC000039364208 FG Annotated Anodyne CCN(Cc1ccncc1)[C@H]1CCCN(C(=O)CCc2scnc2C)C1 ZINC000039364209 FG Annotated Anodyne CCOC(=O)c1cc2c(cn1)[nH]c1ccc(I)cc12 ZINC000039376386 FG Annotated Anodyne in-vivo c1ccc2oc(C3CCN(c4cc(C5CCNCC5)ncn4)CC3)nc2c1 ZINC000039379916 FG Annotated Anodyne Cc1cc(C)c(N/N=C2\CC[C@H](C)n3c2ncc(C(=O)O)c3=O)c(C)c1 ZINC000039425245 FG Annotated Mild Cc1cc(C)c(N/N=C2/CC[C@@H](C)n3c2ncc(C(=O)O)c3=O)c(C)c1 ZINC000039425246 FG Annotated Mild Cc1cc(C)c(N/N=C2\CC[C@H](C)n3c2ncc(C(=O)O)c3=O)cc1C ZINC000039425248 FG Annotated Mild Cc1cc(C)c(N/N=C2/CC[C@@H](C)n3c2ncc(C(=O)O)c3=O)cc1C ZINC000039425250 FG Annotated Mild Cc1nc(NCc2cnn(Cc3ccccc3)c2)cc(C2CCNCC2)n1 ZINC000039442940 FG Annotated Anodyne O=C(CC1=CCCCC1)N1CC[C@]2(CCCN(Cc3cccnc3)C2=O)C1 ZINC000039447035 FG Annotated Anodyne O=C(CC1=CCCCC1)N1CC[C@@]2(CCCN(Cc3cccnc3)C2=O)C1 ZINC000039447036 FG Annotated Anodyne Cc1nc(NCc2ccc(-n3ccnc3C)cc2)cc(C2CCNCC2)n1 ZINC000039536948 FG Annotated Anodyne Cc1nc(NCCCn2ncc3ccccc32)cc([C@@H]2CCCNC2)n1 ZINC000039551384 FG Annotated Anodyne Cc1nc(NCCCn2ncc3ccccc32)cc([C@H]2CCCNC2)n1 ZINC000039551386 FG Annotated Anodyne Cc1nc(N)nc2c1/C(=N/O)C[C@@H](c1ccc(F)cc1-c1cccnc1)C2 ZINC000039795246 FG Annotated Mild in-vivo C=CCn1c(SCC(=O)[C@H](C#N)C(C)=N)nc2sc(CC)cc2c1=O ZINC000004013719 FG Annotated Mild CCC(=O)NS(=O)(=O)c1cnccc1Sc1ccc(Cl)cc1 ZINC000004019190 FG Annotated Anodyne Cc1ccc2cc3cc(C(=O)N4CCC(C(N)=O)CC4)sc3nc2c1 ZINC000004030384 FG Annotated Anodyne Nc1ccccc1CNC(=O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccoc1 ZINC000004036906 FG Annotated Anodyne Nc1ccccc1CNC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccoc1 ZINC000004036909 FG Annotated Anodyne CCCCNC(=O)[C@H]1C(c2ccc(N(C)C)cc2)=NO[C@H]1c1ccoc1 ZINC000004043196 FG Annotated Anodyne CCCCNC(=O)[C@@H]1C(c2ccc(N(C)C)cc2)=NO[C@H]1c1ccoc1 ZINC000004043198 FG Annotated Anodyne CCCCNC(=O)[C@H]1C(c2ccc(N(C)C)cc2)=NO[C@@H]1c1ccoc1 ZINC000004043202 FG Annotated Anodyne CCCCNC(=O)[C@@H]1C(c2ccc(N(C)C)cc2)=NO[C@@H]1c1ccoc1 ZINC000004043205 FG Annotated Anodyne CCN(CC)CCNC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000004049106 FG Annotated Anodyne CCN(CC)CCNC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000004049107 FG Annotated Anodyne CCN(CC)CCNC(=O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccccc1 ZINC000004049108 FG Annotated Anodyne CCN(CC)CCNC(=O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccccc1 ZINC000004049109 FG Annotated Anodyne CC(C)c1ccc([C@H]2ON=C(c3ccccc3)[C@H]2C(=O)NCCO)cc1 ZINC000004049206 FG Annotated Anodyne CC(C)c1ccc([C@@H]2ON=C(c3ccccc3)[C@H]2C(=O)NCCO)cc1 ZINC000004049207 FG Annotated Anodyne CC(C)c1ccc([C@H]2ON=C(c3ccccc3)[C@@H]2C(=O)NCCO)cc1 ZINC000004049208 FG Annotated Anodyne CC(C)c1ccc([C@@H]2ON=C(c3ccccc3)[C@@H]2C(=O)NCCO)cc1 ZINC000004049209 FG Annotated Anodyne CCN(CC)CCNC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000004049419 FG Annotated Anodyne CCN(CC)CCNC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000004049420 FG Annotated Anodyne CCN(CC)CCNC(=O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccsc1 ZINC000004049421 FG Annotated Anodyne CCN(CC)CCNC(=O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccsc1 ZINC000004049422 FG Annotated Anodyne O=C(NCCO)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1cccc2ccccc12 ZINC000004049483 FG Annotated Anodyne O=C(NCCO)[C@@H]1C(c2ccccc2)=NO[C@H]1c1cccc2ccccc12 ZINC000004049484 FG Annotated Anodyne O=C(NCCO)[C@H]1C(c2ccccc2)=NO[C@@H]1c1cccc2ccccc12 ZINC000004049485 FG Annotated Anodyne O=C(NCCO)[C@H]1C(c2ccccc2)=NO[C@H]1c1cccc2ccccc12 ZINC000004049486 FG Annotated Anodyne CCOc1ccccc1[C@H]1ON=C(c2ccccc2)[C@H]1C(=O)NCCC#N ZINC000004049589 FG Annotated Mild CCOc1ccccc1[C@@H]1ON=C(c2ccccc2)[C@H]1C(=O)NCCC#N ZINC000004049590 FG Annotated Mild CCOc1ccccc1[C@H]1ON=C(c2ccccc2)[C@@H]1C(=O)NCCC#N ZINC000004049591 FG Annotated Mild CCOc1ccccc1[C@@H]1ON=C(c2ccccc2)[C@@H]1C(=O)NCCC#N ZINC000004049592 FG Annotated Mild CCOc1ccc([C@H]2ON=C(c3ccccc3)[C@H]2C(=O)NCCC#N)cc1 ZINC000004049609 FG Annotated Mild CCOc1ccc([C@@H]2ON=C(c3ccccc3)[C@H]2C(=O)NCCC#N)cc1 ZINC000004049610 FG Annotated Mild CCOc1ccc([C@H]2ON=C(c3ccccc3)[C@@H]2C(=O)NCCC#N)cc1 ZINC000004049611 FG Annotated Mild CCOc1ccc([C@@H]2ON=C(c3ccccc3)[C@@H]2C(=O)NCCC#N)cc1 ZINC000004049612 FG Annotated Mild O=C(N[C@@H]1CCCC[C@@H]1O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccccc1 ZINC000004049665 FG Annotated Anodyne O=C(N[C@@H]1CCCC[C@@H]1O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000004049666 FG Annotated Anodyne O=C(N[C@@H]1CCCC[C@@H]1O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccccc1 ZINC000004049667 FG Annotated Anodyne O=C(N[C@@H]1CCCC[C@@H]1O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000004049668 FG Annotated Anodyne O=C(N[C@@H]1CCCC[C@@H]1O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccsc1 ZINC000004050124 FG Annotated Anodyne O=C(N[C@@H]1CCCC[C@@H]1O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000004050125 FG Annotated Anodyne O=C(N[C@@H]1CCCC[C@@H]1O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccsc1 ZINC000004050127 FG Annotated Anodyne O=C(N[C@@H]1CCCC[C@@H]1O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000004050129 FG Annotated Anodyne CC[C@@H](C)[C@@H](CO)NC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000004050817 FG Annotated Anodyne CC[C@H](C)[C@@H](CO)NC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000004050818 FG Annotated Anodyne CC[C@@H](C)[C@H](CO)NC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000004050819 FG Annotated Anodyne CC[C@H](C)[C@H](CO)NC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000004050820 FG Annotated Anodyne CC[C@@H](C)[C@@H](CO)NC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000004051566 FG Annotated Anodyne CC[C@H](C)[C@@H](CO)NC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000004051570 FG Annotated Anodyne CC[C@@H](C)[C@H](CO)NC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000004051572 FG Annotated Anodyne CC[C@H](C)[C@H](CO)NC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000004051573 FG Annotated Anodyne CN(C)C(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000004054176 FG Annotated Bother CN(C)C(=O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000004054178 FG Annotated Bother CC[C@H](O)CNC(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccccc1 ZINC000004054587 FG Annotated Anodyne CC[C@@H](O)CNC(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccccc1 ZINC000004054590 FG Annotated Anodyne CC[C@H](O)CNC(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccccc1 ZINC000004054592 FG Annotated Anodyne CC[C@@H](O)CNC(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccccc1 ZINC000004054595 FG Annotated Anodyne N#CCCNC(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1ccccc1 ZINC000004055310 FG Annotated Mild N#CCCNC(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccccc1 ZINC000004055311 FG Annotated Mild N#CCCNC(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1ccccc1 ZINC000004055312 FG Annotated Mild N#CCCNC(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccccc1 ZINC000004055313 FG Annotated Mild COCCCNC(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccoc1 ZINC000004055624 FG Annotated Anodyne COCCCNC(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccoc1 ZINC000004055625 FG Annotated Anodyne COCCCNC(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1ccoc1 ZINC000004055626 FG Annotated Anodyne COCCCNC(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1ccoc1 ZINC000004055627 FG Annotated Anodyne Cc1ccnc(NC(=O)CCCOc2cc(=O)n(C)c3ccccc23)c1 ZINC000004057390 FG Annotated Anodyne C(\Cc1ccccc1)=C1/Nn2c(Cn3cnc4ccccc43)nnc2S1 ZINC000004058232 FG Annotated Anodyne O=C1N=C(N2CCN(c3ccccc3)CC2)S[C@@H]1Cc1ccccc1 ZINC000004063821 FG Annotated Anodyne O=C1N=C(N2CCN(c3ccccc3)CC2)S[C@H]1Cc1ccccc1 ZINC000004063822 FG Annotated Anodyne Cc1nc2ncnn2c(Nc2ccc3c(c2)OCO3)c1Cc1ccccc1 ZINC000004093106 FG Annotated Anodyne CC(C)(C)NC(=O)CN(C(=O)CCN1CCCc2ccccc21)C(C)(C)C ZINC000004093334 FG Annotated Anodyne C=CC[C@]1(C)c2c(C)c3c(c(O)c2O[C@H]1O)C(=O)C(C(C)C)=C(O)C3=O ZINC000004098658 FG Annotated Mild in-vitro C=CC[C@]1(C)c2c(C)c3c(c(O)c2O[C@@H]1O)C(=O)C(C(C)C)=C(O)C3=O ZINC000004098659 FG Annotated Mild in-vitro COC(=O)c1cc2sccc2n1CC(=O)Nc1cc(OC)cc(OC)c1 ZINC000004100395 FG Annotated Anodyne O=C(NC[C@@H]1CCCO1)[C@H]1c2ccccc2C(=O)N1C1CCCCCC1 ZINC000004100672 FG Annotated Anodyne O=C(NC[C@@H]1CCCO1)[C@@H]1c2ccccc2C(=O)N1C1CCCCCC1 ZINC000004100674 FG Annotated Anodyne O=C(NC[C@H]1CCCO1)[C@H]1c2ccccc2C(=O)N1C1CCCCCC1 ZINC000004100676 FG Annotated Anodyne O=C(NC[C@H]1CCCO1)[C@@H]1c2ccccc2C(=O)N1C1CCCCCC1 ZINC000004100679 FG Annotated Anodyne Cc1c(C(=O)NC[C@@H]2CCCO2)oc2ccc3c(c12)C(=O)CC(C)(C)O3 ZINC000004101742 FG Annotated Anodyne Cc1c(C(=O)NC[C@H]2CCCO2)oc2ccc3c(c12)C(=O)CC(C)(C)O3 ZINC000004101743 FG Annotated Anodyne C/C=C1/CN2[C@H]3C[C@@H]1[C@@H]1[C@@H]2C[C@@]2(C3=Nc3cc(OC)ccc32)[C@@H]1OC(C)=O ZINC000004102319 FG Annotated Anodyne in-vitro O=C(Nc1c2c(nn1-c1cccc(Cl)c1)C[S@@](=O)C2)C1CCCC1 ZINC000004105607 FG Annotated Anodyne Cc1ccccc1C(=O)Nc1c2c(nn1-c1ccc(F)cc1)C[S@@](=O)C2 ZINC000004106018 FG Annotated Anodyne CCOc1ccc(C(=O)Nc2c3c(nn2C(C)(C)C)C[S@@](=O)C3)cc1 ZINC000004106143 FG Annotated Anodyne CC1(C)Cc2nc3sc4c(N5CCNCC5)ncnc4c3cc2CS1 ZINC000004111977 FG Annotated Anodyne COC(=O)c1cc2oc(C)cc2n1CC(=O)N1CCCc2ccccc21 ZINC000004119082 FG Annotated Anodyne CC(=O)N(C1=C(N(C)C)C(=O)c2ccccc2C1=O)c1ccc(F)cc1 ZINC000004120405 FG Annotated Mild Cc1nc2sc([C@@H](c3cccs3)N3C[C@H](C)O[C@H](C)C3)c(O)n2n1 ZINC000004121057 FG Annotated Anodyne Cc1nc2sc([C@H](c3cccs3)N3C[C@H](C)O[C@H](C)C3)c(O)n2n1 ZINC000004121058 FG Annotated Anodyne Cc1nc2sc([C@H](c3cccs3)N3C[C@@H](C)O[C@H](C)C3)c(O)n2n1 ZINC000004121060 FG Annotated Anodyne CN(C)CCN1C(=O)[C@H]2[C@@H](c3ccccc3)C=C[C@@H](c3ccccc3)[C@@H]2C1=O ZINC000004131599 FG Annotated Anodyne CN(C)CCN1C(=O)[C@H]2[C@@H](c3ccccc3)C=C[C@H](c3ccccc3)[C@@H]2C1=O ZINC000004131603 FG Annotated Anodyne COc1cccc2s/c(=N/C(=S)NC(=O)c3ccc(C)cc3)n(C)c12 ZINC000004135112 FG Annotated Anodyne CCOc1ccccc1C1=NO[C@H](c2ccccc2)[C@@H]1C(=O)NCCC#N ZINC000004152777 FG Annotated Mild CCOc1ccccc1C1=NO[C@@H](c2ccccc2)[C@@H]1C(=O)NCCC#N ZINC000004152779 FG Annotated Mild CCOc1ccccc1C1=NO[C@H](c2ccccc2)[C@H]1C(=O)NCCC#N ZINC000004152780 FG Annotated Mild CCOc1ccccc1C1=NO[C@@H](c2ccccc2)[C@H]1C(=O)NCCC#N ZINC000004152783 FG Annotated Mild CCOc1ccccc1C1=NO[C@H](c2ccsc2)[C@@H]1C(=O)NCCC#N ZINC000004153297 FG Annotated Mild CCOc1ccccc1C1=NO[C@@H](c2ccsc2)[C@@H]1C(=O)NCCC#N ZINC000004153299 FG Annotated Mild CCOc1ccccc1C1=NO[C@H](c2ccsc2)[C@H]1C(=O)NCCC#N ZINC000004153300 FG Annotated Mild CCOc1ccccc1C1=NO[C@@H](c2ccsc2)[C@H]1C(=O)NCCC#N ZINC000004153301 FG Annotated Mild CCCCn1c(SCC(=O)Nc2cc(C)on2)nnc1-c1cccnc1 ZINC000004161415 FG Annotated Anodyne COCCCn1c(SCC(=O)NC(C)(C)C)nnc1-c1cccs1 ZINC000004161513 FG Annotated Anodyne CNP1(NC)=Nc2nn(-c3ccccc3)c(N)c2C(c2ccccc2)=N1 ZINC000004163666 FG Annotated Anodyne O=S(=O)(NCc1csc(-c2cccnc2)n1)c1ccc(Cl)s1 ZINC000004166832 FG Annotated Anodyne COc1cc2c(cc1OC)C1=C(c3ccc4c(c3C1)OCO4)N(C)CC2 ZINC000004173595 FG Annotated Anodyne O=C(c1ccccc1F)N1N=C(c2ccccc2)C[C@@]1(O)C(F)(F)F ZINC000004174034 FG Annotated Anodyne CCn1ncc2c(NCc3ccc(OC)c(Cl)c3)c(C(=O)O)cnc21 ZINC000004199947 FG Annotated Anodyne CCC1=NN(C(=O)c2cccnc2)[C@](O)(c2ccc(Br)cc2)C1 ZINC000004201231 FG Annotated Anodyne CCC1=NN(C(=O)c2cccnc2)[C@@](O)(c2ccc(Br)cc2)C1 ZINC000004201232 FG Annotated Anodyne CCOc1ccccc1C1=NO[C@H](c2ccccc2OC)[C@@H]1C(=O)N(C)C ZINC000004205025 FG Annotated Anodyne CCOc1ccccc1C1=NO[C@@H](c2ccccc2OC)[C@@H]1C(=O)N(C)C ZINC000004205026 FG Annotated Anodyne N#CCCNC(=O)[C@@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1ccccc1 ZINC000004206927 FG Annotated Mild N#CCCNC(=O)[C@@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1ccccc1 ZINC000004206930 FG Annotated Mild N#CCCNC(=O)[C@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1ccccc1 ZINC000004206932 FG Annotated Mild N#CCCNC(=O)[C@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1ccccc1 ZINC000004206934 FG Annotated Mild COCCCNC(=O)[C@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1ccoc1 ZINC000004207573 FG Annotated Anodyne COCCCNC(=O)[C@@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1ccoc1 ZINC000004207574 FG Annotated Anodyne COCCCNC(=O)[C@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1ccoc1 ZINC000004207575 FG Annotated Anodyne COCCCNC(=O)[C@@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1ccoc1 ZINC000004207576 FG Annotated Anodyne Cc1c([C@H](C)OC(=O)CCC(=O)O)oc2cc(C3=CC(=O)OC3)ccc12 ZINC000004212081 FG Annotated Anodyne in-man CCCCCCC1=NO[C@H](c2ccccc2OCC)[C@@H]1C(=O)NCCO ZINC000004212783 FG Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccccc2OCC)[C@@H]1C(=O)NCCO ZINC000004212786 FG Annotated Anodyne CCCCCCC1=NO[C@H](c2ccccc2OCC)[C@H]1C(=O)NCCO ZINC000004212789 FG Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccccc2OCC)[C@H]1C(=O)NCCO ZINC000004212792 FG Annotated Anodyne CCCOc1ccc(-c2nnn(CC(=O)c3c[nH]c4ccccc34)n2)cc1 ZINC000004213468 FG Annotated Anodyne CCCCCCC1=NO[C@H](c2cccc(OCC)c2)[C@@H]1C(=O)NCCO ZINC000004213710 FG Annotated Anodyne CCCCCCC1=NO[C@@H](c2cccc(OCC)c2)[C@@H]1C(=O)NCCO ZINC000004213713 FG Annotated Anodyne CCCCCCC1=NO[C@H](c2cccc(OCC)c2)[C@H]1C(=O)NCCO ZINC000004213716 FG Annotated Anodyne CCCCCCC1=NO[C@@H](c2cccc(OCC)c2)[C@H]1C(=O)NCCO ZINC000004213718 FG Annotated Anodyne CC(=O)[C@@]1(O)CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)OC[C@]4(C)[C@H]3CC[C@@]21C ZINC000004217209 FG Annotated Anodyne in-man CC(C)CC(=O)Nc1c2c(nn1-c1cccc(Cl)c1)C[S@@](=O)C2 ZINC000004224596 FG Annotated Anodyne Cc1noc(C)c1C(=O)N1CCC2(CCCN(c3ccncc3)C2)CC1 ZINC000004238050 FG Annotated Anodyne Cc1noc(C)c1C(=O)N1CCC2(CCCN(c3ccccn3)C2)CC1 ZINC000004238058 FG Annotated Anodyne Cc1noc(C)c1C(=O)N1CCC2(CCN(Cc3nccs3)CC2)CC1 ZINC000004238107 FG Annotated Anodyne COc1ccc(C(=O)N2CCC[C@@]3(CCN(Cc4nccs4)C3)C2)cc1 ZINC000004238110 FG Annotated Anodyne CC(C)CN1CCCC2(CCN(S(=O)(=O)c3ccccc3)CC2)C1 ZINC000004238115 FG Annotated Anodyne CS(=O)(=O)N1CCC2(CC1)CN(c1ccc(-c3ccccc3)cc1)C2 ZINC000004238157 FG Annotated Anodyne CN(C)c1ncc2nc(CCc3ccccc3)c(=O)n(-c3ccccc3)c2n1 ZINC000004238229 FG Annotated Anodyne Cc1nc2cnc(Oc3cccc(Cl)c3)nc2n(C[C@H]2CCCO2)c1=O ZINC000004238242 FG Annotated Anodyne COc1ccccc1CCn1c(=O)c(-c2ccccc2)nc2cncnc21 ZINC000004238257 FG Annotated Anodyne COCCn1c(=O)c(-c2ccccc2)nc2cnc(Oc3ccccc3)nc21 ZINC000004238280 FG Annotated Anodyne Cn1c(=O)c(CCc2ccccc2)nc2cnc(Oc3ccccc3)nc21 ZINC000004238297 FG Annotated Anodyne CCNc1ncc2nc(CCc3ccccc3)c(=O)n(-c3ccccc3)c2n1 ZINC000004238311 FG Annotated Anodyne Cn1c(=O)c(-c2cc(F)cc(F)c2)nc2cnc(Oc3ccccc3)nc21 ZINC000004238385 FG Annotated Anodyne O=c1cnc2cnc(OCc3ccccc3)nc2n1CCc1ccccc1 ZINC000004238408 FG Annotated Anodyne O=c1c(-c2ccc(F)c(F)c2)nc2cncnc2n1Cc1ccc(F)cc1 ZINC000004238414 FG Annotated Anodyne O=c1c(-c2ccc(F)c(F)c2)nc2cncnc2n1Cc1ccccc1 ZINC000004238512 FG Annotated Anodyne COc1cccc(Cn2c(=O)c(-c3cccc(F)c3)nc3cncnc32)c1 ZINC000004238520 FG Annotated Anodyne O=c1c(-c2cc(F)cc(F)c2)nc2cncnc2n1Cc1ccc(F)cc1 ZINC000004238542 FG Annotated Anodyne COc1ncc2nc(-c3cc(F)cc(F)c3)c(=O)n(-c3ccccc3)c2n1 ZINC000004238569 FG Annotated Anodyne O=c1c(CCc2ccccc2)nc2cncnc2n1Cc1ccc(F)cc1 ZINC000004238573 FG Annotated Anodyne Cn1c(=O)c(CCc2ccccc2)nc2cnc(OCc3ccccc3)nc21 ZINC000004238580 FG Annotated Anodyne O=c1c(-c2ccc(F)cc2)nc2cncnc2n1Cc1ccc(F)cc1 ZINC000004238583 FG Annotated Anodyne O=c1c(-c2cccc(F)c2)nc2cncnc2n1Cc1ccc(F)cc1 ZINC000004238605 FG Annotated Anodyne COc1ccc(-n2c(=O)c(-c3cc(F)cc(F)c3)nc3cncnc32)cc1 ZINC000004238631 FG Annotated Anodyne Cc1nc2cnc(Oc3ccccc3)nc2n(Cc2cccs2)c1=O ZINC000004238639 FG Annotated Anodyne Cn1c(=O)c(-c2ccc(F)cc2)nc2cnc(OCc3ccccc3)nc21 ZINC000004238660 FG Annotated Anodyne COc1ncc2nc(-c3ccc(F)cc3)c(=O)n(Cc3cccs3)c2n1 ZINC000004238686 FG Annotated Anodyne CCNc1ncc2nc(-c3ccc(F)cc3)c(=O)n(-c3ccccc3)c2n1 ZINC000004238720 FG Annotated Anodyne CCNc1ncc2nc(-c3ccccc3)c(=O)n(Cc3cccs3)c2n1 ZINC000004238750 FG Annotated Anodyne COc1ncc2nc(-c3cccs3)c(=O)n(CCc3ccccc3)c2n1 ZINC000004238774 FG Annotated Anodyne COc1cccc(Cn2c(=O)c(CCc3ccccc3)nc3cncnc32)c1 ZINC000004238777 FG Annotated Anodyne CN(C)c1ncc2nc(-c3ccc(F)cc3)c(=O)n(-c3ccccc3)c2n1 ZINC000004238806 FG Annotated Anodyne Cn1c(=O)c(-c2cccc(C#N)c2)nc2cnc(Oc3ccccc3)nc21 ZINC000004238826 FG Annotated Mild O=c1c(-c2cc(F)cc(F)c2)nc2cncnc2n1Cc1ccccc1 ZINC000004238855 FG Annotated Anodyne COc1ccc(-n2c(=O)c(-c3ccc(F)c(F)c3)nc3cncnc32)cc1 ZINC000004238876 FG Annotated Anodyne COc1ncc2nc(-c3cccs3)c(=O)n(Cc3ccc(F)cc3)c2n1 ZINC000004238904 FG Annotated Anodyne CN(C)c1ncc2nc(-c3ccccc3)c(=O)n(Cc3cccs3)c2n1 ZINC000004238997 FG Annotated Anodyne CCNc1ncc2nc(-c3cccs3)c(=O)n(Cc3cccs3)c2n1 ZINC000004239074 FG Annotated Anodyne COc1ccccc1CCn1c(=O)c(-c2cccs2)nc2cncnc21 ZINC000004239075 FG Annotated Anodyne CN(C)c1ncc2nc(-c3cccs3)c(=O)n(Cc3cccs3)c2n1 ZINC000004239131 FG Annotated Anodyne COc1ncc2nc(-c3cccs3)c(=O)n(Cc3cccs3)c2n1 ZINC000004239132 FG Annotated Anodyne Cn1c(=O)c(-c2cccs2)nc2cnc(OCc3ccccc3)nc21 ZINC000004239156 FG Annotated Anodyne COc1ccccc1CNc1ncncc1-c1ccc(C(=O)N(C)C)cc1 ZINC000004239347 FG Annotated Anodyne CS(=O)(=O)Nc1cccc(-c2cncnc2NCc2ccccc2)c1 ZINC000004257382 FG Annotated Anodyne CS(=O)(=O)Nc1cccc(-c2cc(NCc3cccs3)ncn2)c1 ZINC000004257415 FG Annotated Anodyne Cc1cccc(CNc2cc(-c3cccc(NS(C)(=O)=O)c3)ncn2)c1 ZINC000004257432 FG Annotated Anodyne Cc1cccc(CNc2ncncc2-c2cccc(NS(C)(=O)=O)c2)c1 ZINC000004257444 FG Annotated Anodyne COc1ccccc1CNc1ccnc(-c2ccc(C(=O)N(C)C)cc2)n1 ZINC000004266421 FG Annotated Anodyne CCCCCCC1=NO[C@H](c2ccoc2)[C@@H]1C(=O)NCC(C)(C)CO ZINC000004273884 FG Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccoc2)[C@@H]1C(=O)NCC(C)(C)CO ZINC000004273886 FG Annotated Anodyne CCCCCCC1=NO[C@H](c2ccoc2)[C@H]1C(=O)NCC(C)(C)CO ZINC000004273890 FG Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccoc2)[C@H]1C(=O)NCC(C)(C)CO ZINC000004273893 FG Annotated Anodyne CCCSc1nc2c(c(=O)[nH]1)[C@H](c1ccncc1)/C(=C(\O)OC)C(C)=N2 ZINC000004292256 FG Annotated Anodyne C=CCn1c(SCCN2CCCC2)nc2c([nH]c3ccccc32)c1=O ZINC000004341954 FG Annotated Mild O=C(Nn1c(Cc2cccs2)nc2ccccc2c1=O)c1cccs1 ZINC000004354029 FG Annotated Anodyne CCCCNC(=O)N(O)[C@H]1N(/N=C/c2ccco2)C(=S)SC1(C)C ZINC000004354066 FG Annotated Mild CCCCNC(=O)N(O)[C@@H]1N(/N=C/c2ccco2)C(=S)SC1(C)C ZINC000004354072 FG Annotated Mild O=C(CSc1nnc2ccc(-c3ccncc3)nn12)c1cccs1 ZINC000004377065 FG Annotated Anodyne Cc1cc2c(cc(C(=O)O[C@H](C(=O)NCc3ccco3)C(C)C)n2C)o1 ZINC000004388635 FG Annotated Anodyne Cc1cc2c(cc(C(=O)O[C@@H](C(=O)NCc3ccco3)C(C)C)n2C)o1 ZINC000004388636 FG Annotated Anodyne Cc1onc(-c2ccccc2)c1CNC(=O)[C@@H]1COc2ccccc2O1 ZINC000004389114 FG Annotated Anodyne Cc1onc(-c2ccccc2)c1CNC(=O)[C@H]1COc2ccccc2O1 ZINC000004389115 FG Annotated Anodyne CC(C)CCC1=NN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@](O)(C(F)(F)F)C1 ZINC000004414572 FG Annotated Bother CC(C)CCC1=NN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@](O)(C(F)(F)F)C1 ZINC000004414574 FG Annotated Bother O=C(c1cc2c(s1)-c1ccccc1OC2)N1CCC2(CC1)OCCO2 ZINC000004436309 FG Annotated Anodyne CC(C)Oc1cccc(-c2nnc(S)n2N/C=C2\C=CC(=O)C=C2O)c1 ZINC000004464171 FG Annotated Mild CCCCS(=O)(=O)/C=C\[C@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1S(=O)(=O)CCCC ZINC000004481132 FG Annotated Anodyne CCCCS(=O)(=O)/C=C\[C@@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1S(=O)(=O)CCCC ZINC000004481704 FG Annotated Anodyne CCCCS(=O)(=O)/C=C/[C@@H]1[C@@H]2C=C[C@@H](C2)[C@@H]1S(=O)(=O)CCCC ZINC000004481708 FG Annotated Anodyne CN(C)C(=O)N(Cc1ccco1)Cc1cc(Br)ccc1O ZINC000040379002 FG Annotated Clean Cc1ccc2oc(=O)cc(CC(=O)N/N=C/c3ccccc3Cl)c2c1 ZINC000040379216 FG Annotated Reactive CS/C=C(/C)n1c(C(=O)c2ccc(Br)cc2)noc1=O ZINC000040379550 FG Annotated Anodyne CC1(C)c2[nH]c3ccc(Cl)cc3c2C[C@@]23CN4CCC[C@]4(C[C@@H]12)C(=O)N3 ZINC000040379558 FG Annotated Anodyne CC(=O)c1c2c(n3cccc(Br)c13)C(=O)c1cccnc1C2=O ZINC000040379890 FG Annotated Clean CCSC(SCC)[C@@H]1O[C@H](c2ccccc2)O[C@H](CO)[C@@H]1OC ZINC000040380049 FG Annotated Anodyne O=S1(=O)Oc2ccccc2N=C2C1=CC=CN2CCc1ccc(O)cc1 ZINC000040380102 FG Annotated Anodyne COc1cc(OC)cc([C@H]2C3=C(COC3=O)Nc3cc(OC)c(C)cc32)c1 ZINC000040380441 FG Annotated Anodyne COc1cc(OC)cc([C@@H]2C3=C(COC3=O)Nc3cc(OC)c(C)cc32)c1 ZINC000040380442 FG Annotated Anodyne Cc1cc(C)c(C/C(=N/OCC(=O)NN)c2cc3ccccc3o2)c(C)c1 ZINC000040380773 FG Annotated Reactive C[C@H](NC1=NC(=O)[C@@](C)(c2ccc(C(N)=O)cc2)S1)c1ccc(F)cc1 ZINC000040392022 FG Annotated Anodyne C[C@H](NC1=NC(=O)[C@](C)(c2ccc(C(N)=O)cc2)S1)c1ccc(F)cc1 ZINC000040392025 FG Annotated Anodyne COc1ccc(/C=N/Nc2[nH]nc(C)c2C(=O)N(C)c2ccccc2)cc1 ZINC000040392635 FG Annotated Mild COc1cc2[nH]c3c(c2cc1OC)C(c1ccc(O)cc1)=CCNC3=O ZINC000040392671 FG Annotated Anodyne CC[C@@]1(Cc2ccccc2)OS(=O)(=O)C=C1OC(=O)c1ccccc1 ZINC000040392724 FG Annotated Mild CC[C@]1(Cc2ccccc2)OS(=O)(=O)C=C1OC(=O)c1ccccc1 ZINC000040392725 FG Annotated Mild Cc1cc2c(n1S(=O)(=O)c1ccccc1)CCc1ccc(=O)sc1-2 ZINC000040392779 FG Annotated Anodyne CNC(=O)c1cn2c(C)c(C)nc2c2c1CC[C@]1(CCc3ccccc31)O2 ZINC000040392852 FG Annotated Anodyne CNC(=O)c1cn2c(C)c(C)nc2c2c1CC[C@@]1(CCc3ccccc31)O2 ZINC000040392853 FG Annotated Anodyne Cc1nc2c(nc1C)C(=O)C(Nc1ccc(Br)cc1)=CC2=O ZINC000040393371 FG Annotated Mild OC1([C@H](CN2CCNCC2)c2cccc(OC(F)(F)F)c2)CCCCC1 ZINC000040394345 FG Annotated Anodyne OC1([C@@H](CN2CCNCC2)c2cccc(OC(F)(F)F)c2)CCCCC1 ZINC000040394346 FG Annotated Anodyne C[C@@H]1CN2[C@@H]3[C@H](CC(=O)[C@H]4CCC[C@H]43)[C@]3(C)OC(=O)CC[C@]34CC[C@H]1[C@H]24 ZINC000040394420 FG Annotated Anodyne COC(=O)C1=CC[C@H](O)[C@@H]2[C@@](C)(CCc3ccoc3)[C@H](CO)CC[C@@]12C ZINC000040394812 FG Annotated Anodyne N=C1S/C(=C\c2c[nH]nc2-c2ccccc2F)C(=O)N1c1nncs1 ZINC000040402800 FG Annotated Anodyne CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@H]1Nc1ccc([N+](=O)[O-])cc1 ZINC000040403204 FG Annotated Mild CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@@H]1Nc1ccc([N+](=O)[O-])cc1 ZINC000040403207 FG Annotated Mild COc1cc2c3c(n(C)c2cc1OC)C(=O)NCC=C3c1ccc(O)cc1 ZINC000040403362 FG Annotated Anodyne CC(=O)O[C@H]1C[C@@H](C)[C@@H]2COC(C)(C)OC[C@@]3(C)CC(C)(C)[C@H]1[C@]23O ZINC000040403647 FG Annotated Anodyne O=[N+]([O-])c1ccc(/C=N/NC(=S)Nc2ccccc2Br)o1 ZINC000040404133 FG Annotated Mild Cc1ccc(NC(=S)OCCN2C(=O)c3ccc(C)cc3C2=O)cc1 ZINC000040404790 FG Annotated Anodyne O=C1OCC2=C1[C@H](c1cc(F)c(F)c(F)c1)c1cc3c(cc1N2)OCO3 ZINC000040405530 FG Annotated Anodyne O=C1OCC2=C1[C@@H](c1cc(F)c(F)c(F)c1)c1cc3c(cc1N2)OCO3 ZINC000040405533 FG Annotated Anodyne N=C1S/C(=C\c2c[nH]nc2-c2cccc(F)c2)C(=O)N1c1nncs1 ZINC000040407116 FG Annotated Anodyne COc1cc(OC)cc([C@H]2C3=C(COC3=O)Nc3c(OC)cc(C)cc32)c1 ZINC000040407363 FG Annotated Anodyne COc1cc(OC)cc([C@@H]2C3=C(COC3=O)Nc3c(OC)cc(C)cc32)c1 ZINC000040407366 FG Annotated Anodyne Cc1ccc2c(c1)/C(=N/NC(=S)Nc1ccc(Cl)cc1)C(=O)N2C ZINC000040407580 FG Annotated Mild O=c1cnnc2n1-c1ccc(Oc3ccccc3Br)cc1CC2 ZINC000040408998 FG Annotated Anodyne C[C@H](Cc1cc2c(cc1O)OCO2)[C@@H](C)[C@H](O)c1ccc2c(c1)OCO2 ZINC000040409523 FG Annotated Anodyne CC(C)CC#Cc1cn([C@H](C)C[C@@H]2CC[C@H]([C@@H](C)C(=O)NC(C)C)O2)nn1 ZINC000040409598 FG Annotated Mild Cc1ccc(-c2ccc(/C=C(\C#N)c3n[nH]c(N)c3C#N)o2)c([N+](=O)[O-])c1 ZINC000040411919 FG Annotated Reactive CN/N=C(/c1cc(OC)c(OC)c(OC)c1)c1ccc2c(ccn2C)c1 ZINC000040412606 FG Annotated Mild CCOc1ccc2c(c1)NC1=C(C(=O)OC1)[C@@H]2c1cc(OC)cc(OC)c1 ZINC000040413056 FG Annotated Anodyne CCOc1ccc2c(c1)NC1=C(C(=O)OC1)[C@H]2c1cc(OC)cc(OC)c1 ZINC000040413059 FG Annotated Anodyne CO[C@@H]1OC[C@H](Cc2ccc3c(c2)OCO3)[C@H]1Cc1ccc2c(c1)OCO2 ZINC000040413296 FG Annotated Anodyne biogenic in-vivo C[C@H]([C@H](O)c1ccc2c(c1)OCO2)[C@H](C)[C@H](O)c1ccc2c(c1)OCO2 ZINC000040413597 FG Annotated Anodyne CN(CC#Cc1ccc(C[C@@H](C(=O)O)n2cccc2)cc1)c1ccccn1 ZINC000040413689 FG Annotated Mild CN(CC#Cc1ccc(C[C@H](C(=O)O)n2cccc2)cc1)c1ccccn1 ZINC000040413692 FG Annotated Mild Cn1cc(N(Cc2ccccc2)c2ccc([N+](=O)[O-])cc2)cc1C(N)=O ZINC000040414183 FG Annotated Bother CN(C)c1cc(O)cc(OCCCCOc2cc(O)cc(N(C)C)c2)c1 ZINC000040420707 FG Annotated Anodyne COC(=O)Cc1ccccc1OC(=O)Cc1ccc(Br)cc1 ZINC000040420825 FG Annotated Anodyne CC(C)N(C(=S)/N=C1\SCS(=O)(=O)N1c1ccccc1)C(C)C ZINC000040421100 FG Annotated Mild CCC(=O)Oc1cccc2c1C(=O)c1c(OC(=O)CC)cc(C)cc1C2=O ZINC000040421240 FG Annotated Clean O=c1c(/C=N/CC/N=C/c2coc3ccccc3c2=O)coc2ccccc12 ZINC000040422539 FG Annotated Mild O=[N+]([O-])c1cn2c(n1)C=C[C@@H](OCc1ccc(OC(F)(F)F)cc1)C2 ZINC000040423462 FG Annotated Bother COc1cc(OC)cc([C@@H]2C3=C(COC3=O)Nc3ccc(OC)cc32)c1 ZINC000040424062 FG Annotated Anodyne COc1cc(OC)cc([C@H]2C3=C(COC3=O)Nc3ccc(OC)cc32)c1 ZINC000040424063 FG Annotated Anodyne N#Cc1ccc([C@@H](c2ccc(O)c(Br)c2)n2cncn2)cc1 ZINC000040428701 FG Annotated Mild CCOC(=O)C[C@@H]1CC2=C(C(=O)c3ccccc3C2=O)C2(CCCC2)O1 ZINC000040430107 FG Annotated Mild O=C1N[C@H](Cn2cc(-c3nc(Cc4ccccc4)no3)c3ccccc32)CO1 ZINC000040430965 FG Annotated Anodyne O=C1N[C@@H](Cn2cc(-c3nc(Cc4ccccc4)no3)c3ccccc32)CO1 ZINC000040430968 FG Annotated Anodyne CNC(=S)Nc1ccc(OCc2nnc(S)n2-c2ccccc2)cc1 ZINC000040431195 FG Annotated Anodyne CCc1ccc/c(=N/S(=O)(=O)c2ccc(-c3ccc(C#N)cc3)cc2)[nH]1 ZINC000040431263 FG Annotated Mild CSc1ccc(Br)c2ccc(CC3=NO[S@@](=O)N3)cc12 ZINC000040454290 FG Annotated Mild CSc1ccc(Br)c2ccc(CC3=NO[S@](=O)N3)cc12 ZINC000040454293 FG Annotated Mild CN(C(=O)N(CC/C=N/C(=O)N(CCCl)N=O)N=O)C1CCCCC1 ZINC000040465100 FG Annotated Reactive CC(C)N1C(=O)N[C@@H](c2ccc(C(=O)O)cc2)c2cc3c(cc21)OCO3 ZINC000040465491 FG Annotated Anodyne CC(C)N1C(=O)N[C@H](c2ccc(C(=O)O)cc2)c2cc3c(cc21)OCO3 ZINC000040465493 FG Annotated Anodyne C[C@@H]1CC/C(=N/Nc2ccc3ccccc3c2)c2ncc(C(=O)O)c(=O)n21 ZINC000040465665 FG Annotated Mild C[C@H]1CC/C(=N\Nc2ccc3ccccc3c2)c2ncc(C(=O)O)c(=O)n21 ZINC000040465668 FG Annotated Mild C[C@@H]1CC/C(=N/Nc2cccc3ccccc23)c2ncc(C(=O)O)c(=O)n21 ZINC000040465789 FG Annotated Mild C[C@H]1CC/C(=N\Nc2cccc3ccccc23)c2ncc(C(=O)O)c(=O)n21 ZINC000040465792 FG Annotated Mild C=C(c1cc(Cl)cc(C)c1OC[C@H](O)CNC(C)(C)C)n1ccnc1 ZINC000040466137 FG Annotated Anodyne C=C(c1cc(Cl)cc(C)c1OC[C@@H](O)CNC(C)(C)C)n1ccnc1 ZINC000040466139 FG Annotated Anodyne C=C(c1c(C)ccc(Cl)c1OC[C@H](O)CNC(C)(C)C)n1ccnc1 ZINC000040466753 FG Annotated Anodyne C=C(c1c(C)ccc(Cl)c1OC[C@@H](O)CNC(C)(C)C)n1ccnc1 ZINC000040466754 FG Annotated Anodyne C[C@H]1C[C@H](C)[C@H](O)[C@@H]([C@@H]2C[C@H](CC(=O)NCc3ccccc3)CC(=O)O2)C1 ZINC000040499297 FG Annotated Anodyne C[C@H]1C[C@H](C)[C@H](O)[C@@H]([C@H]2C[C@H](CC(=O)NCc3ccccc3)CC(=O)O2)C1 ZINC000040499299 FG Annotated Anodyne CCCS(=O)(=O)Nc1cccc(OCc2nc3ccccc3n2C)c1 ZINC000040504269 FG Annotated Anodyne COc1ccc(-c2nc3n(c2-c2ccc(OC)cc2)CC[S@]3=O)cc1 ZINC000040504962 FG Annotated Anodyne COc1ccc(-c2nc3n(c2-c2ccc(OC)cc2)CC[S@@]3=O)cc1 ZINC000040504965 FG Annotated Anodyne CCCCS(=O)(=O)c1c(O)n(Cc2ccccc2)c(=O)c2ccccc12 ZINC000040505483 FG Annotated Anodyne CC(=O)N1Cc2c(ccc(Cl)c2-c2ccccc2)N2CCN(C)C[C@@H]2C1 ZINC000040526200 FG Annotated Anodyne COC(=O)N1CC[C@@H]2Nc3c(Br)c(C)c(OC)c(C)c3[C@@H]2C1 ZINC000040563833 FG Annotated Anodyne CN1CC[C@@H](CN(Cc2ccccc2)Cc2ccc([N+](=O)[O-])cc2)OC1=O ZINC000040563959 FG Annotated Bother CN1CC[C@@H](CN(Cc2ccccc2)Cc2cccc([N+](=O)[O-])c2)OC1=O ZINC000040564018 FG Annotated Bother O/N=C/c1cc[n+](CCCCCCCCC[n+]2ccc(/C=N/O)cc2)cc1 ZINC000040565086 FG Annotated Mild N#Cc1ccc(C2=NN(S(=O)(=O)c3ccccc3F)CCCC2)cc1 ZINC000040567070 FG Annotated Mild C[C@H](Nc1ncc2nc(NCc3ccccc3Cl)n(C)c2n1)C(C)(C)O ZINC000040567750 FG Annotated Anodyne Cc1nccn1-c1nc(N(C)Cc2ccccc2)nc(Cl)c1[N+](=O)[O-] ZINC000040567768 FG Annotated Bother C[S@](=O)C[C@H]1[C@H]2CC[C@@]3(CC[C@@H]4[C@](C)(CO)CCC[C@@]4(C)[C@@H]3C2)[C@@H]1O ZINC000040567964 FG Annotated Anodyne C[S@@](=O)C[C@H]1[C@H]2CC[C@@]3(CC[C@@H]4[C@](C)(CO)CCC[C@@]4(C)[C@@H]3C2)[C@@H]1O ZINC000040567966 FG Annotated Anodyne CCc1nccn1-c1nc(N(C)Cc2ccccc2)nc(C)c1[N+](=O)[O-] ZINC000040568310 FG Annotated Bother CCc1cc(S(=O)(=O)NCCCCO)ccc1-c1ccc(F)cc1F ZINC000040575576 FG Annotated Anodyne O=C1c2ccccc2[C@](NCCO)(c2ccccc2)N1Cc1ccccc1 ZINC000040575658 FG Annotated Anodyne O=C1c2ccccc2[C@@](NCCO)(c2ccccc2)N1Cc1ccccc1 ZINC000040575660 FG Annotated Anodyne CCOC(=O)[C@@H](C)SC1=C(NC(C)(C)C)C(=O)c2ccccc2C1=O ZINC000040584207 FG Annotated Mild CCOC(=O)[C@H](C)SC1=C(NC(C)(C)C)C(=O)c2ccccc2C1=O ZINC000040584209 FG Annotated Mild COc1ccc([C@H]2[C@H]3CCc4ccc(OC)cc4C3=NN2C(N)=O)cc1 ZINC000040584683 FG Annotated Anodyne C=C1C(=O)[C@@]23CC[C@H]4[C@H](C(=O)OC)C[C@@H](OC(C)=O)C[C@@]4(C)[C@@H]2CC[C@@H]1C3 ZINC000040587710 FG Annotated Mild CCOC(=O)C(=O)Nc1nc(-c2ccc3oc(C)c(C)c(=O)c3c2)cs1 ZINC000040631446 FG Annotated Anodyne Cc1cccc(Cl)c1N/N=C1\CC[C@H](C)n2c1ncc(C(=O)O)c2=O ZINC000040631662 FG Annotated Mild Cc1cccc(Cl)c1N/N=C1\CC[C@@H](C)n2c1ncc(C(=O)O)c2=O ZINC000040631664 FG Annotated Mild CC(C)N(CC[C@](CCCN(C)C)(C(N)=O)c1ccccc1F)C(C)C ZINC000040632282 FG Annotated Anodyne CC(C)N(CC[C@@](CCCN(C)C)(C(N)=O)c1ccccc1F)C(C)C ZINC000040632284 FG Annotated Anodyne O=C1CCC/C=C\C[C@H]2[C@@H](O)C[C@@H](O)[C@@H]2/C=C\[C@@H](COc2ccccc2)O1 ZINC000040639374 FG Annotated Anodyne COc1cccc(-c2nc3n(c2-c2cccc(OC)c2)CC[S@]3=O)c1 ZINC000040641203 FG Annotated Anodyne COc1cccc(-c2nc3n(c2-c2cccc(OC)c2)CC[S@@]3=O)c1 ZINC000040641206 FG Annotated Anodyne COc1ccccc1C(=O)N1N=C(c2ccccc2)NN=C1c1ccccc1 ZINC000040641408 FG Annotated Anodyne C=C[C@]1(CO)CC[C@@H]2[C@](C)(CC[C@@H]3[C@@](C)(C(=O)OC)C(=O)CC[C@@]23C)O1 ZINC000040676650 FG Annotated Mild O=C(CCN1CCN2Cc3ccccc3C[C@H]2C1)Nc1ccccc1Cl ZINC000040690567 FG Annotated Anodyne COc1ccc([C@H]2[C@H]3CCc4ccc(OC)cc4C3=NN2C(N)=S)cc1 ZINC000040753573 FG Annotated Anodyne CO[C@H]1C[C@H]2[C@@H]3CCC(=O)c4c(O)ccc(c43)[C@]2(O)c2cccc(O)c21 ZINC000040753966 FG Annotated Anodyne CO[C@]12C(=O)/C(=C/c3ccco3)C[C@@]1(CO)[C@@H]2[C@@]1(C)O[C@@H]1CC=C(C)C ZINC000040762371 FG Annotated Mild COc1cc(C2=NN(C(C)=O)[C@H](c3ccccc3F)O2)cc(OC)c1OC ZINC000040762938 FG Annotated Anodyne COc1cc(C2=NN(C(C)=O)[C@@H](c3ccccc3F)O2)cc(OC)c1OC ZINC000040762940 FG Annotated Anodyne CC(=O)O/N=C1/C(c2c(O)n(C)c3c(F)cccc23)=Nc2ccccc21 ZINC000040763059 FG Annotated Mild CCCCC1=C(C)C(=O)[C@@](C)(CN2c3ccccc3[C@@]3(O)CCO[C@@H]23)C1=O ZINC000040763307 FG Annotated Mild CCOC(=O)C1=C(N2CCCC2)[C@H]2c3ccccc3S[C@]12C(=O)OCC ZINC000040764064 FG Annotated Anodyne CCOC(=O)C1=C(N2CCCC2)[C@@H]2c3ccccc3S[C@@]12C(=O)OCC ZINC000040764065 FG Annotated Anodyne COc1cc(C2=NN(C(C)=O)[C@H](c3ccc(F)cc3)O2)cc(OC)c1OC ZINC000040764240 FG Annotated Anodyne COc1cc(C2=NN(C(C)=O)[C@@H](c3ccc(F)cc3)O2)cc(OC)c1OC ZINC000040764241 FG Annotated Anodyne Cc1coc2c1C(=O)C(=O)c1c-2ccc2c1CC[C@H](OCCO)C2(C)C ZINC000040766939 FG Annotated Clean OCCCN1CCN(C2=Nc3ccccc3Cn3c2cc2ccccc23)CC1 ZINC000040812385 FG Annotated Anodyne C[C@H](Nc1ncc2nc(Nc3ccccc3Cl)n(C)c2n1)C(C)(C)O ZINC000040812541 FG Annotated Anodyne O=C1C(Nc2ccc(OC(F)(F)F)cc2)=C(Cl)C(=O)c2[nH]cnc21 ZINC000040829241 FG Annotated Mild CCS(=O)(=O)Nc1cc2c(cc1C)[C@@H](S(=O)(=O)CC)C1=C2CCC1 ZINC000040834153 FG Annotated Anodyne CCS(=O)(=O)Nc1cc2c(cc1C)[C@H](S(=O)(=O)CC)C1=C2CCC1 ZINC000040834155 FG Annotated Anodyne Cc1cc2c(cc1Cl)S[C@H](C(=O)c1ccccc1)NS2(=O)=O ZINC000040834876 FG Annotated Anodyne Cc1cc2c(cc1Cl)S[C@@H](C(=O)c1ccccc1)NS2(=O)=O ZINC000040834878 FG Annotated Anodyne FCCOCCOCCOc1ccc(C#Cc2ccc3c(c2)CCN3)cc1 ZINC000040835373 FG Annotated Mild COC1=C(C(C)C)C(=O)c2c(O)cc3c(c2C1=O)C=C/C(=N\O)C3(C)C ZINC000040835851 FG Annotated Mild COC(=O)[C@]1(C)CCC[C@]2(C)[C@H]3CC[C@](O)(C(C)C)C=C3[C@H](O)C[C@@H]12 ZINC000040845180 FG Annotated Anodyne Cc1ccccc1-n1c(=O)c2ccccc2n2c(N3CCCCC3)nnc12 ZINC000040847411 FG Annotated Anodyne CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@H]1n1cc(-c2ccccc2)nn1 ZINC000040847956 FG Annotated Mild CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@@H]1n1cc(-c2ccccc2)nn1 ZINC000040847957 FG Annotated Mild Cc1c(C2=CCN(C(=O)OC(C)(C)C)CC2)nnn1-c1ncccc1F ZINC000040848420 FG Annotated Anodyne Nn1c(S)nnc1-c1cc2c([nH]c3ccccc32)c(-c2ccc(O)cc2)n1 ZINC000040848453 FG Annotated Anodyne COc1ccc(CN2C=CC=C3C2=Nc2ccccc2OS3(=O)=O)cc1 ZINC000040848695 FG Annotated Anodyne CNc1nc(-c2nnc(Cc3ccc(F)cc3)o2)c(O)c2ncccc12 ZINC000040849110 FG Annotated Anodyne C[C@@](Cl)(/C=C/Br)[C@H]1CO[C@@](C)(O)[C@@H](Br)C1 ZINC000040860336 FG Annotated Reactive CC(=O)c1c2c(n3cccc(Br)c13)C(=O)c1ncccc1C2=O ZINC000040860683 FG Annotated Clean CC1(C)c2[nH]c3cc(Cl)ccc3c2C[C@@]23CN4CCC[C@]4(C[C@@H]12)C(=O)N3 ZINC000040860697 FG Annotated Anodyne O=[N+]([O-])c1ccc(OC2[C@@H](n3ccnc3)CCC[C@@H]2n2ccnc2)cc1 ZINC000040860921 FG Annotated Bother O=[N+]([O-])c1ccc(OC2[C@H](n3ccnc3)CCC[C@H]2n2ccnc2)cc1 ZINC000040860923 FG Annotated Bother COC(OC)[C@@H]1O[C@H](c2ccccc2)O[C@@H]2CO[C@H](c3ccccc3)O[C@@H]21 ZINC000040861537 FG Annotated Anodyne C[C@@H](Cc1ccc(OCC(=O)O)cc1)N1CCO[C@H](c2ccccc2)C1 ZINC000040861704 FG Annotated Anodyne C[C@H](Cc1ccc(OCC(=O)O)cc1)N1CCO[C@H](c2ccccc2)C1 ZINC000040861706 FG Annotated Anodyne Cc1nccc2c1[nH]c1cc([C@]34CC[C@](C(=O)O)(OC3=O)C4(C)C)ccc12 ZINC000040862124 FG Annotated Anodyne Cc1nccc2c1[nH]c1cc([C@@]34CC[C@@](C(=O)O)(OC3=O)C4(C)C)ccc12 ZINC000040862126 FG Annotated Anodyne COc1cc2c(cc1O)C(=O)[C@H]1c3cc(OC)c(OC)c(OC)c3CC[C@H]21 ZINC000040862359 FG Annotated Anodyne COc1cc2c(cc1O)C(=O)[C@@H]1c3cc(OC)c(OC)c(OC)c3CC[C@H]21 ZINC000040862361 FG Annotated Anodyne COc1cc2c(cc1O)C(=O)[C@H]1c3cc(OC)c(OC)c(OC)c3CC[C@@H]21 ZINC000040862363 FG Annotated Anodyne COc1cc2c(cc1O)C(=O)[C@@H]1c3cc(OC)c(OC)c(OC)c3CC[C@@H]21 ZINC000040862365 FG Annotated Anodyne COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CC[C@]13C[C@H](CC[C@@H]21)[C@@](O)(CO)C3 ZINC000040862568 FG Annotated Anodyne CCCCC[C@H]1C(=O)C(I)=C[C@@H]1CC(=O)OC ZINC000040862900 FG Annotated Mild CCCCC[C@@H]1C(=O)C(I)=C[C@H]1CC(=O)OC ZINC000040862902 FG Annotated Mild O=C(C[C@]1(O)c2ccccc2-n2c1nc1ccccc1c2=O)c1ccccc1 ZINC000040863335 FG Annotated Anodyne O=C(C[C@@]1(O)c2ccccc2-n2c1nc1ccccc1c2=O)c1ccccc1 ZINC000040863337 FG Annotated Anodyne CCN(CC)C(=O)c1c(N(C)CC)c2cccnc2n2c(C(C)C)nnc12 ZINC000040864097 FG Annotated Anodyne COC1=C[C@@H]2C=Cc3c(CCN(C)C)cc4c(c3[C@H]2C=C1OC)OCO4 ZINC000040864470 FG Annotated Anodyne COC1=C[C@H]2C=Cc3c(CCN(C)C)cc4c(c3[C@H]2C=C1OC)OCO4 ZINC000040864473 FG Annotated Anodyne COC1=C[C@H]2c3c(c(CCN(C)C)cc4c3OCO4)C=C[C@H]2C=C1OC ZINC000040864476 FG Annotated Anodyne COC1=C[C@H]2C=Cc3c(CCN(C)C)cc4c(c3[C@@H]2C=C1OC)OCO4 ZINC000040864479 FG Annotated Anodyne CCOc1c(C(=O)N(CC)CC)c2nnc(C(C)C)n2c2ncccc12 ZINC000040864908 FG Annotated Anodyne O=C1C(Nc2ccc(Br)cc2)=C(Cl)C(=O)c2[nH]cnc21 ZINC000040865359 FG Annotated Mild Cc1cc(C#N)ccc1N1CCc2c(-n3ccc(-n4cccn4)n3)ccnc21 ZINC000040865872 FG Annotated Mild O=C1Nc2ccccc2O/C1=C\c1ccc(/C=C/C(=O)N2CCCC2)o1 ZINC000040866283 FG Annotated Anodyne COC(=O)c1c(OC)cc(C)cc1Oc1c(CO)cc(OC)cc1OC ZINC000040872550 FG Annotated Anodyne COc1ccc(Nc2cc(-c3ccccc3)ncn2)cc1NS(C)(=O)=O ZINC000040873438 FG Annotated Anodyne CC1(C)c2[nH]c3cc(Cl)ccc3c2C[C@@]23CN4CCC[C@]4(C[C@H]12)C(=O)N3 ZINC000040873926 FG Annotated Anodyne Cc1ccc(Cc2n[nH]c(=O)n2C)c(F)c1Oc1cc(Cl)cc(C#N)c1 ZINC000040875963 FG Annotated Mild COc1ccccc1OS(=O)(=O)c1ccc2[nH]c3ccncc3c2c1 ZINC000040878915 FG Annotated Anodyne CC(=O)O[C@@H]1[C@H](C)C[C@H]2[C@@H]3[C@@H]4O[C@H](CC(=O)CCC[C@]4(C)OC[C@@H]2C)[C@@H]31 ZINC000040879059 FG Annotated Anodyne CC(=O)O[C@@H]1[C@H](C)C[C@@H]2[C@@H]3[C@@H]4O[C@H](CC(=O)CCC[C@]4(C)OC[C@@H]2C)[C@@H]31 ZINC000040879063 FG Annotated Anodyne CC(=O)O[C@@H]1[C@H](C)C[C@H]2[C@@H]3[C@@H]4O[C@@H](CC(=O)CCC[C@]4(C)OC[C@@H]2C)[C@@H]31 ZINC000040879067 FG Annotated Anodyne O=C(O)CCCNC(=S)NN=C(Cc1ccccc1)Cc1ccccc1 ZINC000040881193 FG Annotated Mild CC(=O)N1CCn2c1c(C(=S)Nc1ccccc1)c1ccccc1c2=O ZINC000040891670 FG Annotated Anodyne CCCNc1nc(NCCc2ccncc2)ncc1-c1nnc(C2CC2)o1 ZINC000040892287 FG Annotated Anodyne C[C@@]12CCC[C@]3(C)c4cc5c(O)ccc(O)c5cc4C(=O)[C@](O)(OC1)[C@H]23 ZINC000040893475 FG Annotated Anodyne in-vitro Cc1ccccc1[C@@H]1CCN(C[C@@H]2CCc3cccnc3[C@@H](O)C2)C[C@H]1O ZINC000040895148 FG Annotated Anodyne OC1([C@H](CN2CCNCC2)c2cccc(C(F)(F)F)c2)CCCCC1 ZINC000040895306 FG Annotated Anodyne OC1([C@@H](CN2CCNCC2)c2cccc(C(F)(F)F)c2)CCCCC1 ZINC000040895308 FG Annotated Anodyne O=[N+]([O-])c1ccc(OS(=O)(=O)c2ccc3[nH]c4ccncc4c3c2)cc1 ZINC000040896526 FG Annotated Bother COc1ccc(NC(=S)OCCN2C(=O)c3ccc(C)cc3C2=O)cc1 ZINC000040897364 FG Annotated Anodyne COc1cc([C@H]2C3=C(COC3=O)Nc3cc4c(cc32)OCO4)ccc1Cl ZINC000040897985 FG Annotated Anodyne COc1cc([C@@H]2C3=C(COC3=O)Nc3cc4c(cc32)OCO4)ccc1Cl ZINC000040897989 FG Annotated Anodyne O=c1cnnc2n1-c1ccc(Oc3ccc(Br)cc3)cc1CC2 ZINC000040899837 FG Annotated Anodyne Cc1ccc2c(c1)C(=O)N(CCOC(=S)Nc1ccc(F)cc1)C2=O ZINC000040900723 FG Annotated Anodyne C=CCN(C)c1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 ZINC000040901158 FG Annotated Mild O=c1n(-c2ccccc2)nc2c(NC3CCCCC3)nc3ncccc3n12 ZINC000040901507 FG Annotated Anodyne Cc1ccc(NC(=S)OC[C@@H](C)N2C(=O)c3ccccc3C2=O)cc1 ZINC000040913677 FG Annotated Anodyne O=C(N/N=C/c1ccncc1)c1nc2ccccc2nc1-c1ccccc1 ZINC000040914377 FG Annotated Reactive O=C1[C@H]2C=C(I)[C@H](C[C@H]2c2ccccc2)[C@]12CO2 ZINC000040914563 FG Annotated Anodyne O=C1[C@H]2C=C(I)[C@H](C[C@@H]2c2ccccc2)[C@]12CO2 ZINC000040914565 FG Annotated Anodyne O=C(N/N=C/c1ccccn1)c1nc2ccccc2nc1-c1ccccc1 ZINC000040914815 FG Annotated Reactive CCOC(=O)c1cc(Cn2ccc(=O)c3ccc(C(F)(F)F)cc32)on1 ZINC000040915922 FG Annotated Anodyne N=C1S/C(=C\c2c[nH]nc2-c2ccc(O)cc2)C(=O)N1c1nccs1 ZINC000040916196 FG Annotated Anodyne O=S(=O)(c1ccccc1)n1cc(Cl)c2cc3c(cc21)CCNCC3 ZINC000040916318 FG Annotated Anodyne C=C(C)[C@H]1c2cc(C(=O)OC)c(o2)C[C@H](C(C)C)[C@H]2O[C@H]2C2=C[C@H]1OC2=O ZINC000040916685 FG Annotated Mild O=S(=O)(c1ccccc1Cl)n1ccc2cc3c(cc21)CCNCC3 ZINC000040916799 FG Annotated Anodyne CCO[P@]1(=O)C(SC)=NN(CC)C12C(=O)c1ccccc1C2=O ZINC000040917087 FG Annotated Clean CCO[P@@]1(=O)C(SC)=NN(CC)C12C(=O)c1ccccc1C2=O ZINC000040917089 FG Annotated Clean COc1ccc2c(c1)[C@H]1N=CN(CCc3c[nH]c4ccccc34)C(=O)[C@@H]1N2 ZINC000040917140 FG Annotated Anodyne COc1ccc2c(c1)[C@@H]1N=CN(CCc3c[nH]c4ccccc34)C(=O)[C@@H]1N2 ZINC000040917141 FG Annotated Anodyne COc1ccc2c(c1)[C@H]1N=CN(CCc3c[nH]c4ccccc34)C(=O)[C@H]1N2 ZINC000040917143 FG Annotated Anodyne COc1ccc2c(c1)[C@@H]1N=CN(CCc3c[nH]c4ccccc34)C(=O)[C@H]1N2 ZINC000040917145 FG Annotated Anodyne Cc1ccc2oc(=O)cc(CC(=O)N/N=C/c3ccc(Cl)cc3)c2c1 ZINC000040917294 FG Annotated Reactive CCS(=O)(=O)N(Cc1ccccc1-c1ccccc1)[C@H]1CCN(C)C1 ZINC000040917335 FG Annotated Anodyne CCCN(CC1CC1)c1nc(NCc2ccc3c(c2)OCO3)ncc1C#N ZINC000040917398 FG Annotated Mild COc1cc(O)c(C(=O)/C=C/c2cccs2)cc1CN1CCOCC1 ZINC000040917508 FG Annotated Mild COc1cc2oc(=O)cc(-c3ccc4c(c3)CCO4)c2c(OC)c1OC ZINC000040917874 FG Annotated Anodyne Cn1c(CN2C[C@@H]3C(COc4ccc(Cl)cn4)[C@@H]3C2)nc2ccccc21 ZINC000040918020 FG Annotated Anodyne CCOP(=O)(OCC)C1=NN(CC)C2(C1)C(=O)c1ccccc1C2=O ZINC000040918233 FG Annotated Clean CCOc1cc(O)c(C(=O)/C=C/c2ccco2)cc1CN1CCOCC1 ZINC000040918431 FG Annotated Mild CCOc1cc(O)c(C(=O)/C=C/c2ccc(C)o2)cc1CN1CCOCC1 ZINC000040918432 FG Annotated Mild N=C1S/C(=C\c2c[nH]nc2-c2ccc(F)cc2)C(=O)N1c1nncs1 ZINC000040918762 FG Annotated Anodyne C=C1C[C@@]23C[C@@H]1CC[C@H]2[C@]1(C)CC[C@@H](O)[C@](C)(COC(C)=O)[C@@H]1C[C@@H]3O ZINC000040918800 FG Annotated Mild CC1(C)C[C@H](OC(=O)NCCCl)c2c(ccc3ccc(=O)oc23)O1 ZINC000040919021 FG Annotated Reactive CC1(C)C[C@@H](OC(=O)NCCCl)c2c(ccc3ccc(=O)oc23)O1 ZINC000040919022 FG Annotated Reactive C/C1=C/CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)[C@@H](CNCc3ccc(N)cc3)[C@@H]2CC1 ZINC000040933068 FG Annotated Clean C/C1=C/CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)[C@@H](CNCc3cccnc3)[C@@H]2CC1 ZINC000040933070 FG Annotated Anodyne COc1cc2c(cc1OC)[C@H](c1cc(OC)c(OC)c(OC)c1)CC2=O ZINC000040933359 FG Annotated Anodyne COc1cc2c(cc1OC)[C@@H](c1cc(OC)c(OC)c(OC)c1)CC2=O ZINC000040933361 FG Annotated Anodyne Cc1oc(-c2ccccc2)cc1C(=O)N(CC(=O)O)Cc1ccccn1 ZINC000040933533 FG Annotated Anodyne N#Cc1ccc([C@H](c2ccc(O)c(Br)c2)n2cncn2)cc1 ZINC000040934002 FG Annotated Mild C/C1=C/CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)[C@@H](CNCCc3ccccn3)[C@@H]2CC1 ZINC000040934157 FG Annotated Anodyne C[C@@H](CO)NC(=O)c1ccc(OCc2cc(Cl)ccn2)c(Cl)c1 ZINC000040934406 FG Annotated Anodyne C[C@H](CO)NC(=O)c1ccc(OCc2cc(Cl)ccn2)c(Cl)c1 ZINC000040934408 FG Annotated Anodyne COc1ccc2nc(Nc3nc(=O)c4ccc(F)cc4[nH]3)nc(C)c2c1 ZINC000040934816 FG Annotated Anodyne C=C(C(=O)OC)[C@@H]1CC[C@@](C)(O)[C@@H](O)CC/C(C)=C/C/C=C(\C)[C@@H](O)C1 ZINC000040936238 FG Annotated Mild CCCCCc1nc2c3c(cc(F)c2n1C)c(=O)c(C(=O)NC)cn3CC ZINC000040937187 FG Annotated Anodyne CCCCN(C)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 ZINC000040938007 FG Annotated Anodyne COC(=O)[C@@H]1C[C@@]2(CC=C(C)C)c3ccccc3N3C(=N)C(C)(C)N1[C@H]32 ZINC000040938219 FG Annotated Anodyne COC(=O)[C@]1(C)CCC[C@@]2(C)[C@H]1[C@H](O)C[C@H]1C[C@H](O)[C@@]3(C)CC[C@]12C3 ZINC000040938481 FG Annotated Anodyne Cc1ccc2sn(/N=C/c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])c(=O)c2c1 ZINC000040938585 FG Annotated Mild CCn1ccc2cc(/C(=N\N)c3cc(OC)c(OC)c(OC)c3)ccc21 ZINC000040938947 FG Annotated Mild Cc1ccc(NC(=S)OCCNC(=O)c2ccccc2C(=O)O)c(C)c1 ZINC000040943249 FG Annotated Anodyne CC1=C2CC[C@@](C)(O)CCC[C@](C)(O)[C@@H]3CC[C@@](C)(C[C@@H]2OC1=O)O3 ZINC000040943694 FG Annotated Anodyne CCOC(=O)CCN(Cc1ccco1)C(=S)Nc1cccc(OC)c1 ZINC000040949421 FG Annotated Anodyne CCOC1=CC(=O)C[C@@H](C)[C@]12Oc1c(Cl)c(OC)cc(OC)c1C2=O ZINC000040949770 FG Annotated Mild N=C1S/C(=C\c2n[nH]nc2-c2ccc(F)cc2)C(=O)N1c1nccs1 ZINC000040950389 FG Annotated Anodyne CN(CCN1CCCCC1)C(=O)N1CCC2(CC1)Cc1ccccc1C2 ZINC000040950806 FG Annotated Anodyne CCN(C1=CC(=O)c2c(C(=O)OC)c(C)nc(C)c2C1=O)c1ccccc1 ZINC000040951708 FG Annotated Mild FC(F)(F)c1cc(OCc2nnn[nH]2)c2cccc(C(F)(F)F)c2n1 ZINC000040952659 FG Annotated Anodyne COc1ccc([C@@H](Cc2cc([N+](=O)[O-])ccc2OC)c2c[nH]c(N)n2)cc1 ZINC000040953846 FG Annotated Bother COc1ccc([C@H](Cc2cc([N+](=O)[O-])ccc2OC)c2c[nH]c(N)n2)cc1 ZINC000040953848 FG Annotated Bother CCOCCOC(=O)c1c(SC)nn(-c2ccc(Cl)cc2)c1N ZINC000040955394 FG Annotated Anodyne CCOCCOC(=O)c1c(C(C)C)nn(-c2ccc(Cl)cc2)c1N ZINC000040955397 FG Annotated Anodyne C=CCNC(=S)Nc1ccc(OCc2n[nH]c(=S)n2CC=C)cc1 ZINC000040955481 FG Annotated Mild C[C@@H](COC(=O)[C@@H](C)c1ccc(C(=O)c2cccs2)cc1)O[N+](=O)[O-] ZINC000040974368 FG Annotated Anodyne C[C@H](C(=O)OC[C@@H](C)O[N+](=O)[O-])c1ccc(C(=O)c2cccs2)cc1 ZINC000040974370 FG Annotated Anodyne C[C@@H](COC(=O)[C@H](C)c1ccc(C(=O)c2cccs2)cc1)O[N+](=O)[O-] ZINC000040974372 FG Annotated Anodyne C[C@H](COC(=O)[C@H](C)c1ccc(C(=O)c2cccs2)cc1)O[N+](=O)[O-] ZINC000040974374 FG Annotated Anodyne O=C1CN(S(=O)(=O)c2cccc3cccnc23)c2cc(Cl)ccc2N1 ZINC000040974498 FG Annotated Anodyne CCCCCN1C(=O)/C(=N\NC(=O)OC(C)(C)C)c2ccc(OC)cc21 ZINC000040975566 FG Annotated Reactive O=C1OC2(CCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)c2ccccc21 ZINC000040976202 FG Annotated Bother O=S(=O)(c1ccc(O)cc1)N(c1ccc(O)cc1)c1ccc(O)cc1 ZINC000040976496 FG Annotated Anodyne O=C1[C@H]2Nc3ccc(Br)cc3[C@H]2N=CN1CCc1ccccc1 ZINC000040979803 FG Annotated Anodyne O=C1[C@H]2Nc3ccc(Br)cc3[C@@H]2N=CN1CCc1ccccc1 ZINC000040979805 FG Annotated Anodyne O=C1[C@@H]2Nc3ccc(Br)cc3[C@H]2N=CN1CCc1ccccc1 ZINC000040979807 FG Annotated Anodyne O=C1[C@@H]2Nc3ccc(Br)cc3[C@@H]2N=CN1CCc1ccccc1 ZINC000040979809 FG Annotated Anodyne COC(=O)C(=O)[C@@H]1c2ccccc2-c2ccccc2N1C(=O)c1ccco1 ZINC000040980303 FG Annotated Anodyne COC(=O)C(=O)[C@H]1c2ccccc2-c2ccccc2N1C(=O)c1ccco1 ZINC000040980304 FG Annotated Anodyne Cc1nc2cc(C(=O)N/N=C\c3c[nH]c4ccccc34)c([N+](=O)[O-])cc2[nH]1 ZINC000040980944 FG Annotated Reactive C=C1C(=O)O[C@H]2/C=C(\C)C[C@@H]3C=C(C/C=C/[C@@](C)(OO)CC[C@H]12)C(=O)O3 ZINC000042835773 FG Annotated Reactive O=C1OCC2=C1[C@H](c1cccc(OC(F)F)c1)c1cc3c(cc1O2)OCO3 ZINC000042878943 FG Annotated Anodyne O=C1OCC2=C1[C@@H](c1cccc(OC(F)F)c1)c1cc3c(cc1O2)OCO3 ZINC000042878947 FG Annotated Anodyne CCS/C=C(/C)n1c(C(=O)c2ccc(Br)cc2)noc1=O ZINC000042890359 FG Annotated Anodyne O=C1c2c(ccc(O)c2O)CN1Cc1ccc(F)c(Br)c1 ZINC000042892429 FG Annotated Clean CCC[C@@H](C(=O)c1ccc(N)c(I)c1)N1CCCC1 ZINC000042919843 FG Annotated Anodyne CCC[C@H](C(=O)c1ccc(N)c(I)c1)N1CCCC1 ZINC000042919844 FG Annotated Anodyne O[C@@H](CO/N=C(\Cl)c1nc2cc(Cl)ccc2o1)CN1CCCCC1 ZINC000042921028 FG Annotated Mild O[C@H](CO/N=C(\Cl)c1nc2cc(Cl)ccc2o1)CN1CCCCC1 ZINC000042921030 FG Annotated Mild CCCN(CCC)C[C@H](O)CO/N=C(\Cl)c1nc2ccccc2o1 ZINC000042921040 FG Annotated Mild CCCN(CCC)C[C@@H](O)CO/N=C(\Cl)c1nc2ccccc2o1 ZINC000042921042 FG Annotated Mild COc1cc(O)c(CC=C(C)C)cc1C(=O)[C@@H](O)Cc1ccc(O)cc1 ZINC000042923114 FG Annotated Anodyne in-vitro CC(=O)c1ccc(/N=N/N(C)C(=O)NCCc2ccc(O)c(O)c2)cc1 ZINC000042923128 FG Annotated Reactive O=c1c(Cl)c(CSC(=S)N2CCOCC2)oc2ccccc12 ZINC000042963671 FG Annotated Anodyne CCc1c(C(=O)c2cc(C)cc(C)c2)n(CC2=CCCC2)c(=O)[nH]c1=O ZINC000042964691 FG Annotated Anodyne O=c1c(CSC(=S)N2CCOCC2)coc2cc(Cl)ccc12 ZINC000042989282 FG Annotated Anodyne COCc1c(CN[C@H]2CC[C@@H](F)C2)nn(C)c1-c1cc(F)cc(F)c1 ZINC000043009158 FG Annotated Anodyne O=C(NC(=O)c1c(O)cccc1O)NC(c1ccccc1)c1ccccc1 ZINC000043009654 FG Annotated Anodyne COC(=O)c1cccc2c1C(=O)C=C1N(C(=O)OC(C)(C)C)C[C@H]3C[C@]123 ZINC000043009988 FG Annotated Mild Nc1c(C(=O)c2ccc(F)cc2F)cc[n+]([O-])c1-c1ccc(F)cc1F ZINC000043010492 FG Annotated Anodyne COc1cccc(OC)c1-c1c(CO)c(CO)c2n1-c1ccccc1C2 ZINC000043011168 FG Annotated Anodyne COc1ccc(-c2c(CO)c(CO)c3n2-c2ccccc2C3)cc1OC ZINC000043011500 FG Annotated Anodyne C[N+](C)(C)CCCNC(=O)c1cnc2c3c(cccc13)-c1ccccc1C2=O ZINC000043012234 FG Annotated Bother Cc1ccc(-c2cc(NC(=O)c3nnc(-c4ccccc4N)o3)n[nH]2)cc1 ZINC000043013415 FG Annotated Anodyne aggregator CCCN(C[C@H](O)CO/N=C(\Cl)c1nc2ccccc2o1)C(C)C ZINC000043013725 FG Annotated Mild CCCN(C[C@@H](O)CO/N=C(\Cl)c1nc2ccccc2o1)C(C)C ZINC000043013727 FG Annotated Mild CN(Cc1ccc(Cl)cc1Cl)Cn1nc(-c2ccncc2)oc1=O ZINC000043014403 FG Annotated Anodyne COC(C)(C)c1ccc(S(=O)(=O)N2CCC[C@](C)(OC)CC2)cc1 ZINC000043015046 FG Annotated Anodyne COC(C)(C)c1ccc(S(=O)(=O)N2CCC[C@@](C)(OC)CC2)cc1 ZINC000043015048 FG Annotated Anodyne O=C(/C=C/C=C/c1ccccc1[N+](=O)[O-])N1CCN(C2CCCC2)CC1 ZINC000043017097 FG Annotated Bother Cc1nc2c(-c3ccc(N(C)C)cc3)[nH]c(-c3ccc(O)cc3)cn-2c1=O ZINC000043018202 FG Annotated Anodyne Nc1ncnc2c1cnn2-c1ncnc2sc3c(c12)-c1ccccc1CC3 ZINC000043019075 FG Annotated Anodyne Nc1c(C(=O)c2ccc(F)cc2F)cc[n+]([O-])c1-c1c(F)cccc1F ZINC000043019707 FG Annotated Anodyne COC[C@H](C)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O ZINC000043020268 FG Annotated Anodyne COC[C@@H](C)n1cc(Cl)nc(Nc2cc(C)c(OC)cc2C)c1=O ZINC000043020270 FG Annotated Anodyne C[C@H]1CCC[C@@H](C)N1C[C@H](O)CO/N=C(\Cl)c1nc2ccccc2o1 ZINC000043020881 FG Annotated Mild C[C@H]1CCC[C@H](C)N1C[C@H](O)CO/N=C(\Cl)c1nc2ccccc2o1 ZINC000043020883 FG Annotated Mild C[C@@H]1CCC[C@@H](C)N1C[C@H](O)CO/N=C(\Cl)c1nc2ccccc2o1 ZINC000043020886 FG Annotated Mild CC(C)=CCc1cc(C(=O)[C@@H](O)Cc2ccc(O)cc2)c(O)c(C)c1O ZINC000043021229 FG Annotated Anodyne COc1ccc(-c2c(CO)c(CO)c3n2-c2ccc(OC)cc2C3)cc1 ZINC000043022237 FG Annotated Anodyne COc1ccccc1C(=O)c1cc[n+]([O-])c(-c2ccccc2Cl)c1N ZINC000043058914 FG Annotated Anodyne CC(C)(C)c1ccc(S(=O)(=O)N2CCC[C@](O)(C3CC3)CC2)cc1 ZINC000043058916 FG Annotated Anodyne CC(C)(C)c1ccc(S(=O)(=O)N2CCC[C@@](O)(C3CC3)CC2)cc1 ZINC000043058918 FG Annotated Anodyne Cc1cc(O)ccc1-c1c(N)c(C(=O)c2ccc(F)cc2F)cc[n+]1[O-] ZINC000043059354 FG Annotated Anodyne N#Cc1cnn(-c2ncnc3sc4c(c23)-c2ccccc2CC4)c1NC=O ZINC000043062525 FG Annotated Mild CC(C)N(C[C@H](O)CO/N=C(\Cl)c1nc2ccccc2o1)C(C)C ZINC000043062629 FG Annotated Mild CC(C)N(C[C@@H](O)CO/N=C(\Cl)c1nc2ccccc2o1)C(C)C ZINC000043062632 FG Annotated Mild COc1c2c(c(C(C)(C)[C@@H]3CO3)c3oc(=O)ccc13)OC(C)(C)CC2=O ZINC000043062773 FG Annotated Anodyne COc1c2c(c(C(C)(C)[C@H]3CO3)c3oc(=O)ccc13)OC(C)(C)CC2=O ZINC000043062776 FG Annotated Anodyne COc1ccc2sc3c(c2c1)NC[C@@H](CNCc1ccccc1)NC3=O ZINC000043062907 FG Annotated Anodyne O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCN(CC2CCCCC2)CC1 ZINC000043065710 FG Annotated Bother CC(C)N(CCCF)C[C@H](O)CO/N=C(\Cl)c1nc2ccccc2o1 ZINC000043067587 FG Annotated Mild CC(C)N(CCCF)C[C@@H](O)CO/N=C(\Cl)c1nc2ccccc2o1 ZINC000043067590 FG Annotated Mild CC(C)N(CC1CC1)C[C@H](O)CO/N=C(\Cl)c1nc2ccccc2o1 ZINC000043072491 FG Annotated Mild CC(C)N(CC1CC1)C[C@@H](O)CO/N=C(\Cl)c1nc2ccccc2o1 ZINC000043072494 FG Annotated Mild C[C@H]1C[C@@H](C)CN(C[C@H](O)CO/N=C(\Cl)c2nc3ccccc3o2)C1 ZINC000043073535 FG Annotated Mild C[C@H]1C[C@H](C)CN(C[C@H](O)CO/N=C(\Cl)c2nc3ccccc3o2)C1 ZINC000043073538 FG Annotated Mild C[C@@H]1C[C@@H](C)CN(C[C@H](O)CO/N=C(\Cl)c2nc3ccccc3o2)C1 ZINC000043073541 FG Annotated Mild CCOC(=O)c1ccc(/N=N/N(C)C(=O)NCCc2ccc(O)cc2)cc1 ZINC000043074406 FG Annotated Reactive COc1ccc(C[C@H](O)C(=O)c2cc(CC=C(C)C)c(O)cc2O)cc1 ZINC000043075059 FG Annotated Anodyne N#Cc1ccc(-c2n[nH]c3c2Cc2cc(OC4CCOCC4)ccc2-3)cn1 ZINC000043077388 FG Annotated Mild CC(=O)Oc1ccc(-c2ccc(F)cc2F)cc1C(=O)N1CCOCC1 ZINC000043077437 FG Annotated Anodyne CCCCCSc1nc(N)cc(OS(=O)(=O)c2ccc(C)cc2)n1 ZINC000043079004 FG Annotated Anodyne COc1cc(-c2cc3nc(O)c4ccccc4n3n2)cc(OC)c1OC ZINC000043079890 FG Annotated Anodyne O[C@@H](CO/N=C(\Cl)c1nc2ccc(Cl)cc2o1)CN1CCCCC1 ZINC000043118257 FG Annotated Mild O[C@H](CO/N=C(\Cl)c1nc2ccc(Cl)cc2o1)CN1CCCCC1 ZINC000043118262 FG Annotated Mild COc1c2c(c(C(C)(C)[C@@H]3CO3)c3oc(=O)ccc13)OC(C)(C)[C@H]1O[C@@H]21 ZINC000043119249 FG Annotated Anodyne COc1c2c(c(C(C)(C)[C@@H]3CO3)c3oc(=O)ccc13)OC(C)(C)[C@@H]1O[C@H]21 ZINC000043119253 FG Annotated Anodyne COc1ccccc1-c1c(N)c(C(=O)c2ccc(F)cc2F)cc[n+]1[O-] ZINC000043119900 FG Annotated Anodyne Nc1cc2c(cc1Cl)NC(=O)Nc1cncc(n1)OCC/C=C/CO2 ZINC000043120008 FG Annotated Anodyne CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C\N1CCN(c2ccco2)CC1 ZINC000043121356 FG Annotated Clean Nc1ccccc1-c1nnc(C(=O)Nc2cc(-c3cccs3)[nH]n2)o1 ZINC000043123179 FG Annotated Anodyne aggregator O=c1c(-c2cccnc2)c[nH]n1-c1nnc(-c2ccc(Cl)cc2)s1 ZINC000043195337 FG Annotated Anodyne Clc1ncnc2c1nc(I)n2[C@@H]1C[C@H]2CC[C@@H]1C2 ZINC000043200917 FG Annotated Anodyne Cc1cc(Oc2c(C3CC3)nn(CS(C)(=O)=O)c2C)cc(C)c1C#N ZINC000043203372 FG Annotated Mild investigational Cc1ccc(CNCC2(F)CCN(C(=O)c3sccc3C)CC2)nc1 ZINC000043204880 FG Annotated Anodyne Cc1ccc(CNCC2(F)CCN(C(=O)c3ccc(C)s3)CC2)nc1 ZINC000043204881 FG Annotated Anodyne O=C(O)c1cc(CN2CCc3cc(Cl)ccc3C2)c2ccccn2c1=O ZINC000043207349 FG Annotated Anodyne CO[C@H]1O[C@]2(C)OO[C@]13[C@H](CCO)CCC[C@@H]3C[C@H]2Cc1ccccc1 ZINC000043261057 FG Annotated Reactive CO[C@H]1O[C@]2(C)OO[C@]13[C@H](CCO)CCC[C@@H]3C[C@@H]2Cc1ccccc1 ZINC000043261091 FG Annotated Reactive O=[P@]1(N(CCCl)CCCl)N[C@H](OO)C[C@@H](c2ccccc2)O1 ZINC000043328054 FG Annotated Reactive CCOC(=O)[C@H](I)[C@@]12CCC[C@@H](C1)C(C)(C)OO2 ZINC000043393595 FG Annotated Reactive CCOC(=O)[C@@H](I)[C@@]12CCC[C@@H](C1)C(C)(C)OO2 ZINC000043393597 FG Annotated Reactive C[C@@H]1CC[C@@H]2[C@@H](C)C(=O)N(Cc3ccco3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000043397145 FG Annotated Reactive C[C@@H]1CC[C@H]2[C@@H](C)C(=O)N(Cc3ccco3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000043397146 FG Annotated Reactive CO[C@H]1O[C@@]2(C)OO[C@@]13[C@H](CCO)CCC[C@@H]3C[C@H]2Cc1ccccc1 ZINC000043443406 FG Annotated Reactive CO[C@H]1O[C@@]2(C)OO[C@@]13[C@H](CCO)CCC[C@@H]3C[C@@H]2Cc1ccccc1 ZINC000043443408 FG Annotated Reactive CCCCCCCCCCC/C=C(\C)C(=O)[C@]12O[C@H]1[C@@](C)(O)NC2=O ZINC000043469821 FG Annotated Mild CCCCCCCCCCC/C=C(\C)C(=O)[C@]12O[C@H]1[C@](C)(O)NC2=O ZINC000043469824 FG Annotated Mild CCCCCCCCCC#Cc1cc2cn(COCCO)c(=O)nc2o1 ZINC000043481801 FG Annotated Mild C=C(c1ccccc1)[C@H]1COC2(CCC(O)(CC(=O)OCC)CC2)OO1 ZINC000043482075 FG Annotated Reactive C=C(c1ccccc1)[C@@H]1COC2(CCC(O)(CC(=O)OCC)CC2)OO1 ZINC000043482077 FG Annotated Reactive C=C(C)[C@@H]1C[C@]2(C)C(=CC1=O)CC[C@@H](OC(=O)/C=C/[S@](C)=O)[C@@H]2C ZINC000043510711 FG Annotated Mild in-man endogenous COC(=O)[C@H](C#N)C1=C(Sc2ccc(C)cc2)C(=O)C(C)=C(C)C1=O ZINC000043511504 FG Annotated Mild COC(=O)[C@@H](C#N)C1=C(Sc2ccc(C)cc2)C(=O)C(C)=C(C)C1=O ZINC000043511506 FG Annotated Mild COC(=O)[C@H](C#N)C1=C(Sc2ccc(C)c(C)c2)C(=O)C(C)=C(C)C1=O ZINC000043523809 FG Annotated Mild COC(=O)[C@@H](C#N)C1=C(Sc2ccc(C)c(C)c2)C(=O)C(C)=C(C)C1=O ZINC000043523812 FG Annotated Mild COC(=O)[C@H](C#N)C1=C(Sc2cccc(C)c2)C(=O)C(C)=C(C)C1=O ZINC000043524029 FG Annotated Mild COC(=O)[C@@H](C#N)C1=C(Sc2cccc(C)c2)C(=O)C(C)=C(C)C1=O ZINC000043524032 FG Annotated Mild CC(C)(N)CNCC1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3 ZINC000043569765 FG Annotated Reactive C[C@@H](C(=O)Nc1ccccn1)c1ccc(OS(=O)(=O)C(F)(F)F)cc1 ZINC000043587470 FG Annotated Unstable CCCCCCCO[C@@H](c1ccc([N+](=O)[O-])cc1)c1c[nH]c(=O)[nH]c1=O ZINC000043589927 FG Annotated Mild CCCCCCCO[C@H](c1ccc([N+](=O)[O-])cc1)c1c[nH]c(=O)[nH]c1=O ZINC000043589928 FG Annotated Mild C[C@@H]1CC[C@H]2[C@@H](C)[C@](O)(C(F)(F)F)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@]23OO4 ZINC000043641136 FG Annotated Reactive O=C(c1ccncc1)N1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3 ZINC000043649788 FG Annotated Reactive O=C(O)CC[C@@H]1CCCCC12OOC1(CCCC[C@@H]1CCC(=O)O)OO2 ZINC000043706339 FG Annotated Reactive CCCCCOC(=O)[C@H]1[C@@H]2C=C[C@@]3(CN(c4ccccc4C)C(=O)[C@@H]13)O2 ZINC000043740438 FG Annotated Anodyne C=CCC1=C[C@@]2(OC)[C@H](C)[C@@H](c3ccc4c(c3)OCO4)O[C@@]2(OC)CC1=O ZINC000043781640 FG Annotated Mild O=[P@@]1(N(CCCl)CCCl)N[C@H](OO)C[C@@H](c2ccccc2)O1 ZINC000043833763 FG Annotated Reactive CCN(CC)C(=O)OCC[C@@H]1CCC[C@@H]2CC[C@@]3(C)OO[C@@]12[C@H](OC)O3 ZINC000043845623 FG Annotated Reactive CCN(CC)C(=O)OCC[C@@H]1CCC[C@@H]2CC[C@]3(C)OO[C@]12[C@H](OC)O3 ZINC000043845624 FG Annotated Reactive COC(=O)C1=C[C@]2(C)CC[C@H]3C(C)(C)C(=O)C(C#N)=C[C@]3(C)C2=CC1=O ZINC000043911328 FG Annotated Reactive C[C@@H]1CC[C@@H]2[C@@H](C)C(=O)N(Cc3ccccn3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000043919910 FG Annotated Reactive C[C@@H]1CC[C@H]2[C@@H](C)C(=O)N(Cc3ccccn3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000043919912 FG Annotated Reactive CC(C)(C)NC(=O)N1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3 ZINC000044069370 FG Annotated Reactive O=C(N1CCCC1)N1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3 ZINC000044069925 FG Annotated Reactive C[C@@H](C(=O)Nc1cccnc1)c1ccc(OS(=O)(=O)C(F)(F)F)cc1 ZINC000044093665 FG Annotated Unstable CCCCCCC/C=C/C[C@@H]1OC[C@H](C)[C@H](OC)[C@H]1COC(=O)CN ZINC000044182452 FG Annotated Mild C=C1C(=O)O[C@@H](CCCCCCCC)[C@@H]1C(=O)NC/C=C/CC(=O)OC ZINC000044247164 FG Annotated Mild C[C@@H](CCC[C@]1(C)OC/C(=C/CO)CC[C@H]1O)C(=O)/C=C/C(C)(C)OO ZINC000044265009 FG Annotated Reactive C[C@H](CCC[C@]1(C)OC/C(=C/CO)CC[C@H]1O)C(=O)/C=C/C(C)(C)OO ZINC000044265014 FG Annotated Reactive COC1=C(C(C)C)C(=O)C2=C(C[C@@]34CCCC(C)(C)[C@@H]3C[C@]2(O)O4)C1=O ZINC000044387394 FG Annotated Mild in-vitro CC1=CC(=O)c2c(ccc(C3=C(C)C(=O)c4cccc(O)c4C3=O)c2O)C1=O ZINC000044417732 FG Annotated Mild in-vitro biogenic C=C1CC[C@@H]2C(=C)C(=O)O[C@H]2/C=C(\C)C[C@@H]2C=C(CC[C@H]1OO)C(=O)O2 ZINC000044417824 FG Annotated Reactive CCC[C@@H]1C=C[C@H](CCC[C@]2(OC)C=C[C@@H](CC(=O)OC)OO2)OO1 ZINC000044418090 FG Annotated Reactive CCC[C@H]1C=C[C@H](CCC[C@]2(OC)C=C[C@@H](CC(=O)OC)OO2)OO1 ZINC000044418094 FG Annotated Reactive CCC[C@@H]1C=C[C@@H](CCC[C@]2(OC)C=C[C@@H](CC(=O)OC)OO2)OO1 ZINC000044418098 FG Annotated Reactive CCC[C@H]1C=C[C@@H](CCC[C@]2(OC)C=C[C@@H](CC(=O)OC)OO2)OO1 ZINC000044418102 FG Annotated Reactive C=C1C(=O)O[C@H]2C[C@](C)(O)CCC[C@](C)(OO)C/C=C/[C@@]3(C)O[C@H]3C[C@@H]12 ZINC000044431776 FG Annotated Reactive COCc1cccc(-c2c(-c3ccc4nccnc4c3)n(C)n(C)c2=O)c1 ZINC000044460338 FG Annotated Anodyne CCCN1C(=O)CN(C2CCCCC2)C(=O)[C@H]1c1ccc(N(C)C)cc1 ZINC000004669070 FG Annotated Anodyne CCCN1C(=O)CN(C2CCCCC2)C(=O)[C@@H]1c1ccc(N(C)C)cc1 ZINC000004669071 FG Annotated Anodyne CC[C@H]1Oc2ccc(Cl)cc2N([C@@H](C)/C(O)=N/CCCOC)C1=O ZINC000004686874 FG Annotated Anodyne CC[C@@H]1Oc2ccc(Cl)cc2N([C@@H](C)/C(O)=N/CCCOC)C1=O ZINC000004686876 FG Annotated Anodyne CC[C@H]1Oc2ccc(Cl)cc2N([C@H](C)/C(O)=N/CCCOC)C1=O ZINC000004686878 FG Annotated Anodyne CC[C@@H]1Oc2ccc(Cl)cc2N([C@H](C)/C(O)=N/CCCOC)C1=O ZINC000004686881 FG Annotated Anodyne Cc1ccc(CS(=O)(=O)CCC(=O)N[C@@H]2CCC[C@H](C)[C@@H]2C)cc1 ZINC000004708529 FG Annotated Anodyne Cc1ccc(CS(=O)(=O)CCC(=O)N[C@@H]2CCC[C@@H](C)[C@@H]2C)cc1 ZINC000004708536 FG Annotated Anodyne COc1ccc(C2=NN(CCC(=O)N[C@H]3CCCC[C@H]3C)C(=O)CC2)cc1 ZINC000004712724 FG Annotated Anodyne COc1ccc(C2=NN(CCC(=O)N[C@H]3CCCC[C@@H]3C)C(=O)CC2)cc1 ZINC000004712725 FG Annotated Anodyne COc1ccc(C2=NN(CCC(=O)N[C@@H]3CCCC[C@H]3C)C(=O)CC2)cc1 ZINC000004712726 FG Annotated Anodyne COc1ccc(C2=NN(CCC(=O)N[C@@H]3CCCC[C@@H]3C)C(=O)CC2)cc1 ZINC000004712727 FG Annotated Anodyne Cc1ccc(OCCn2ccc(=O)n(Cc3cc(C)ccc3C)c2=O)cc1 ZINC000004769816 FG Annotated Anodyne CCc1ccc2nc(SCC(=O)NC[C@@H]3CCCO3)c(C#N)cc2c1 ZINC000004848957 FG Annotated Mild CCc1ccc2nc(SCC(=O)NC[C@H]3CCCO3)c(C#N)cc2c1 ZINC000004848958 FG Annotated Mild COc1ccccc1-n1c(SCC(=O)OC(C)C)nc2cccnc21 ZINC000004853479 FG Annotated Anodyne CC[C@]1(C)OC(c2ccccc2)=C/C(=C/C=C2/C(=O)NC(=O)N=C2O)O1 ZINC000004853681 FG Annotated Clean CC[C@@]1(C)OC(c2ccccc2)=C/C(=C/C=C2/C(=O)NC(=O)N=C2O)O1 ZINC000004853682 FG Annotated Clean CC/C(NNC(=O)c1ccc2c(c1)nc(C)n2CC)=C1/C=C(F)C=CC1=O ZINC000004865338 FG Annotated Reactive CCn1c(=O)cc(SCC(=O)Nc2cc(C)ccn2)c2ccccc21 ZINC000004884858 FG Annotated Anodyne COc1ccc2cc3c(N)nn(C(=O)CSc4ccncc4)c3nc2c1 ZINC000004885203 FG Annotated Anodyne Cc1ccc(N2CCN(C(=O)CCc3nc4ccccc4[nH]3)CC2)c(C)c1 ZINC000004885699 FG Annotated Anodyne COc1ccccc1CN1C(=O)CC[C@@]1(C)C(=O)NC1CCC(C)CC1 ZINC000004892637 FG Annotated Anodyne COc1ccccc1CN1C(=O)CC[C@]1(C)C(=O)NC1CCC(C)CC1 ZINC000004892649 FG Annotated Anodyne CC[C@@H](C)NC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccc(OC)cc1 ZINC000004894520 FG Annotated Anodyne CC[C@H](C)NC(=O)[C@@H]1c2ccccc2C(=O)N1Cc1ccc(OC)cc1 ZINC000004894523 FG Annotated Anodyne CC[C@@H](C)NC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccc(OC)cc1 ZINC000004894527 FG Annotated Anodyne CC[C@H](C)NC(=O)[C@H]1c2ccccc2C(=O)N1Cc1ccc(OC)cc1 ZINC000004894535 FG Annotated Anodyne COc1ccc([C@@H](OC(=O)c2ccco2)C(=O)NC(C)(C)C)cc1OC ZINC000004901563 FG Annotated Anodyne COc1ccc([C@H](OC(=O)c2ccco2)C(=O)NC(C)(C)C)cc1OC ZINC000004901567 FG Annotated Anodyne Cc1cccc(-n2c(=O)c3ccccc3n(CC(=O)C(C)(C)C)c2=O)c1 ZINC000004905101 FG Annotated Anodyne O=c1c2ccccc2n(Cc2ccccc2F)c(=O)n1-c1cccc(F)c1 ZINC000004906082 FG Annotated Anodyne CCC(=O)Oc1c(S(=O)(=O)c2ccccc2)c(C)nn1C(C)(C)C ZINC000004907431 FG Annotated Anodyne Cc1nn(C(C)(C)C)c(OC(=O)C(C)C)c1S(=O)(=O)c1ccccc1 ZINC000004907439 FG Annotated Anodyne CN(C)CCNC(=O)c1ccc2c(c1)N(Cc1ccc(F)cc1)CCS2 ZINC000004908449 FG Annotated Anodyne CC(C)n1cc(C(=O)N(CC(=O)NC(C)(C)C)Cc2ccccc2)cn1 ZINC000004910516 FG Annotated Anodyne COC(=O)c1cc2oc(C)cc2n1CC(=O)Nc1ccc(N(C)C)cc1 ZINC000004911549 FG Annotated Anodyne O=C(NCc1ccccn1)c1cc2c(s1)-c1ccccc1S(=O)(=O)C2 ZINC000004918822 FG Annotated Anodyne CCCN1Cc2cccc(C(=O)N3CCN(c4ccccc4)CC3)c2C1=O ZINC000004920183 FG Annotated Anodyne O=C(O)c1cc(N/N=C/c2ccc(N3CCOCC3)s2)ccc1Cl ZINC000004926239 FG Annotated Mild Cc1ccccc1CN1CCN(CC(=O)NCCC2=CCCCC2)C1=O ZINC000004930586 FG Annotated Anodyne Cc1ccc(C)c(Cn2nnc(C(=O)Nc3ccc(Cl)cc3)c2N)c1 ZINC000004934344 FG Annotated Anodyne CCn1c(=O)cc(SCC(=O)NCc2ccc(C)o2)c2ccccc21 ZINC000004936661 FG Annotated Anodyne O=C(Cn1c(=O)c(C(F)(F)F)nc2ccccc21)N1CCc2ccccc21 ZINC000004959005 FG Annotated Anodyne CCC(C)(C)NC(=O)[C@@H](c1ccccc1)N(C(=O)c1csnn1)C1CC1 ZINC000004964963 FG Annotated Anodyne CCC(C)(C)NC(=O)[C@H](c1ccccc1)N(C(=O)c1csnn1)C1CC1 ZINC000004964964 FG Annotated Anodyne C/C(=N\NC(=O)c1ccc(CSc2nncn2C)cc1)c1cccs1 ZINC000004965099 FG Annotated Reactive CCC(=O)N1CCc2cc(S(=O)(=O)N(C)c3cc(C)ccc3C)ccc21 ZINC000004969230 FG Annotated Anodyne Cc1cc(N2CCCC2)nc(/N=C(/N)Nc2cccc(C(F)(F)F)c2)n1 ZINC000045167373 FG Annotated Mild CC(C)Sc1ccc(Cl)cc1CON1C(=N)N=C(N)NC1(C)C ZINC000045168677 FG Annotated Anodyne COc1ccc(CS[C@@H]2CCCC[C@]23NC(=S)NC3=S)cc1 ZINC000045189373 FG Annotated Anodyne COc1ccc(CS[C@H]2CCCC[C@]23NC(=S)NC3=S)cc1 ZINC000045189376 FG Annotated Anodyne COc1ccc(CS[C@@H]2CCCC[C@@]23NC(=S)NC3=S)cc1 ZINC000045189379 FG Annotated Anodyne COc1ccc(CS[C@H]2CCCC[C@@]23NC(=S)NC3=S)cc1 ZINC000045189383 FG Annotated Anodyne COc1ccc(OC)c([C@@H](O)[C@H](C)NCc2cc(Cl)ccc2O)c1 ZINC000045191167 FG Annotated Clean COc1ccc(OC)c([C@@H](O)[C@@H](C)NCc2cc(Cl)ccc2O)c1 ZINC000045191170 FG Annotated Clean COc1ccc(OC)c([C@H](O)[C@H](C)NCc2cc(Cl)ccc2O)c1 ZINC000045191173 FG Annotated Clean COc1ccc(OC)c([C@H](O)[C@@H](C)NCc2cc(Cl)ccc2O)c1 ZINC000045191176 FG Annotated Clean Cn1c(Cc2ccccc2)nnc1Sc1ccc(C#N)c([N+](=O)[O-])c1 ZINC000045228059 FG Annotated Mild CCc1nc2c(o1)C(=O)C(Nc1ccc(F)cc1)=C(Br)C2=O ZINC000045245080 FG Annotated Mild CCNC(=O)c1c(NCC(C)C)c2cccnc2n2c(C(C)C)nnc12 ZINC000045245161 FG Annotated Anodyne CCN(C)C(=O)c1c(NC(C)C)c2cccnc2n2c(C(C)C)nnc12 ZINC000045245506 FG Annotated Anodyne C=CCNc1c(C(=O)N(CC)CC)c2nnc(C(C)C)n2c2ncccc12 ZINC000045245736 FG Annotated Mild CCOc1ccc(Nc2c(C)c(NCCN)c(C#N)c3ccnn23)cc1 ZINC000045253179 FG Annotated Mild CCc1nc2c(o1)C(=O)C(Nc1ccc(O)cc1)=C(Br)C2=O ZINC000045253261 FG Annotated Mild CCc1nc2c(o1)C(=O)C(Nc1cccc(C#N)c1)=C(Br)C2=O ZINC000045253263 FG Annotated Mild NC1=NCC[C@@H](c2c[nH]c3cc(Br)c(Br)cc23)N1 ZINC000045256677 FG Annotated Anodyne NC1=NCC[C@H](c2c[nH]c3cc(Br)c(Br)cc23)N1 ZINC000045256681 FG Annotated Anodyne CCNC(=O)Nc1cn2c(-c3ncccn3)cc(-c3ccc(C)nc3)cc2n1 ZINC000045257062 FG Annotated Anodyne Nc1ccc(-c2ccc(CO[C@@H]3COc4nc([N+](=O)[O-])cn4C3)cc2)cc1 ZINC000045257508 FG Annotated Bother CCOc1ccc(-n2cc(C(=O)c3ccc(OC)cc3O)ccc2=O)cc1 ZINC000045257692 FG Annotated Anodyne Nc1cccc(-c2ccc(CO[C@@H]3COc4nc([N+](=O)[O-])cn4C3)cc2)c1 ZINC000045258148 FG Annotated Bother O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3cccc(O)c3)cc1)C2 ZINC000045259786 FG Annotated Bother CCc1nc2c(o1)C(=O)C(Nc1ccc(C#N)cc1)=C(Br)C2=O ZINC000045259948 FG Annotated Mild O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(O)cc3)cc1)C2 ZINC000045283313 FG Annotated Bother O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1cccc(-c3cccc(O)c3)c1)C2 ZINC000045283617 FG Annotated Bother CCCc1cc(=O)oc2c3c(c4c(c12)OC(C)(C)C=C4)O[C@@H](CN)CC3=O ZINC000045283667 FG Annotated Anodyne CCCc1cc(=O)oc2c3c(c4c(c12)OC(C)(C)C=C4)O[C@H](CN)CC3=O ZINC000045283669 FG Annotated Anodyne CN1CCC=C([C@H]2SCC(=O)N2c2ccc(Br)cc2)C1 ZINC000045283797 FG Annotated Anodyne CN1CCC=C([C@@H]2SCC(=O)N2c2ccc(Br)cc2)C1 ZINC000045283800 FG Annotated Anodyne CCC[C@H](CN[C@H](CNC)Cc1ccc(O)cc1)NCCC1CCCC1 ZINC000045284751 FG Annotated Anodyne CCC[C@H](CNC)NC[C@H](Cc1ccc(O)cc1)NCCC1CCCC1 ZINC000045284778 FG Annotated Anodyne CNC[C@H](Cc1ccc(O)cc1)N1CCN(CC2CCCCCC2)CC1 ZINC000045284780 FG Annotated Anodyne CC(C)N1CCN(Cc2ccc(C#CCCN3CCCCC3)cc2)CC1 ZINC000045285131 FG Annotated Mild CCOC(=O)C1=C(Nc2ccccc2C)N=C(c2ccccc2)N2CCN=C12 ZINC000045285935 FG Annotated Anodyne CCOC(=O)C1=C(Nc2ccc(C)cc2)N=C(c2ccccc2)N2CCN=C12 ZINC000045285937 FG Annotated Anodyne CC(=O)O[C@H]1CC[C@@]2(C)[C@@H](CC[C@H]3[C@@H]4CC[C@H](O)[C@@]4(C)C[C@H](O)[C@@]32F)C1 ZINC000045286274 FG Annotated Anodyne N#CC1=C(N)N2C(=O)CSC2=C(C#N)[C@@H]1c1ccc(Cl)cc1Cl ZINC000045286351 FG Annotated Reactive N#CC1=C(N)N2C(=O)CSC2=C(C#N)[C@H]1c1ccc(Cl)cc1Cl ZINC000045286353 FG Annotated Reactive C[C@@H]1c2c[nH]nc2-c2ccncc2N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000045287180 FG Annotated Anodyne C[C@H]1c2c[nH]nc2-c2ccncc2N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000045287181 FG Annotated Anodyne CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@H]1Nc1ccccc1[N+](=O)[O-] ZINC000045287602 FG Annotated Mild CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@@H]1Nc1ccccc1[N+](=O)[O-] ZINC000045287604 FG Annotated Mild O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1cccc(-c3ccccc3)c1)C2 ZINC000045287614 FG Annotated Bother O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1cccc(-c3ccc(O)cc3)c1)C2 ZINC000045288464 FG Annotated Bother O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccccc1-c1ccccc1)C2 ZINC000045289327 FG Annotated Bother COc1cc(N[C@H](C)CCCN2C(=O)[C@@H](C)NC2(C)C)c2ncccc2c1 ZINC000045289560 FG Annotated Anodyne COc1cc(N[C@@H](C)CCCN2C(=O)[C@@H](C)NC2(C)C)c2ncccc2c1 ZINC000045289562 FG Annotated Anodyne CC(=O)N1N=C(c2nc(C(C)C)cs2)O[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000045289665 FG Annotated Bother CC(=O)N1N=C(c2nc(C(C)C)cs2)O[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000045289668 FG Annotated Bother CN/N=C(/c1ccc2c(ccn2C)c1)c1ccc(OC)c(OC)c1OC ZINC000045290054 FG Annotated Mild CCn1ccc2cc(/C(=N/N)c3ccc(OC)c(OC)c3OC)ccc21 ZINC000045298561 FG Annotated Mild O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccccc3)cc1)C2 ZINC000045298581 FG Annotated Bother CCc1nc2c(o1)C(=O)C(Nc1cccc(O)c1)=C(Br)C2=O ZINC000045299349 FG Annotated Mild CNC[C@@H](Cc1ccc(O)cc1)N1CCN(CC2CCCCCC2)CC1 ZINC000045299559 FG Annotated Anodyne Cc1c(Br)[nH]c(-c2nccc3[nH]c(N)nc23)c1Br ZINC000045299755 FG Annotated Anodyne Nc1nnc2n(-c3ccc(Cl)cc3)c(=O)c3c4c(sc3n12)CCCC4 ZINC000045300893 FG Annotated Anodyne CCc1nn(CCO)c(NCCOC)c1Cc1cc(Cl)cc(Cl)c1 ZINC000045300938 FG Annotated Anodyne Cc1cc(N(C)CCN(C)C)nc(Nc2ccc(Br)cc2)n1 ZINC000045302083 FG Annotated Anodyne CCOCc1cnc(C)nc1CNC(=O)c1c(C)[nH]c2ccc(C)cc12 ZINC000045302286 FG Annotated Anodyne CCc1nn(CCO)c(NC(C)=O)c1Cc1cc(Cl)cc(Cl)c1 ZINC000045302442 FG Annotated Anodyne COCCN(C)C(=O)CO[C@H](c1cccs1)c1cccnc1Cl ZINC000045302551 FG Annotated Anodyne COCCN(C)C(=O)CO[C@@H](c1cccs1)c1cccnc1Cl ZINC000045302552 FG Annotated Anodyne O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccccc3O)cc1)C2 ZINC000045302974 FG Annotated Bother COc1cc(OC)c2c(OS(=O)(=O)c3ccc(C)cc3)ccnc2c1 ZINC000045314766 FG Annotated Anodyne CCOc1ccc(Nc2c(C)c(NCCCN)c(C#N)c3ccnn23)cc1 ZINC000045314862 FG Annotated Mild CC1(C)C[C@@]2(CN(C(=O)c3ccccc3)C(=O)CO2)c2ccccc2O1 ZINC000045315763 FG Annotated Anodyne CC1(C)C[C@]2(CN(C(=O)c3ccccc3)C(=O)CO2)c2ccccc2O1 ZINC000045315767 FG Annotated Anodyne CC1(C)C[C@@]2(CN(S(=O)(=O)c3ccccc3)CCO2)c2ccccc2O1 ZINC000045316026 FG Annotated Anodyne CC1(C)C[C@]2(CN(S(=O)(=O)c3ccccc3)CCO2)c2ccccc2O1 ZINC000045316030 FG Annotated Anodyne CC(C)C(=O)c1ncn2c1Cn1cnnc1-c1cc(Br)ccc1-2 ZINC000045317507 FG Annotated Anodyne NCCn1cc(S(=O)(=O)c2cc(Cl)cc(Cl)c2)c2cccnc21 ZINC000045320070 FG Annotated Anodyne Cc1ccc(C(=O)C[C@H](C(=O)c2ccc(C)cc2)[C@H]2C(=N)ON=C2N)cc1 ZINC000045320098 FG Annotated Anodyne Cc1ccc(C(=O)C[C@@H](C(=O)c2ccc(C)cc2)[C@H]2C(=N)ON=C2N)cc1 ZINC000045320101 FG Annotated Anodyne CN(C)CCn1cc(S(=O)(=O)c2ccc(Cl)s2)c2cccnc21 ZINC000045320748 FG Annotated Anodyne COc1cc(/C=N/NC2=C3C4=C(CCCC4)S[C@@H]3N=CN2)ccc1O ZINC000045322854 FG Annotated Mild COc1cc(/C=N/NC2=C3C4=C(CCCC4)S[C@H]3N=CN2)ccc1O ZINC000045322857 FG Annotated Mild CCc1nc2c(o1)C(=O)C(Nc1cccc(F)c1)=C(Br)C2=O ZINC000045335707 FG Annotated Mild c1ccc(-c2ccc(N3C[C@@H]4CN(Cc5ccncc5)C[C@@H]4C3)nn2)cc1 ZINC000045337405 FG Annotated Anodyne O=C(O)c1cn(Cc2ccc(-n3ccnc3)cc2)c2cccc(F)c2c1=O ZINC000045337411 FG Annotated Anodyne COc1cc(OC)cc(-c2nc3ccc(OCCN(C)C)c(C#N)c3[nH]2)c1 ZINC000045339311 FG Annotated Mild CCCCN(CCO)c1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000045339453 FG Annotated Bother CCCN1CCc2cc3oc(=O)n(C)c3cc2[C@@H]1c1cccc(OC)c1 ZINC000045347399 FG Annotated Anodyne CCCN1CCc2cc3oc(=O)n(C)c3cc2[C@H]1c1cccc(OC)c1 ZINC000045347402 FG Annotated Anodyne O=C(O)c1cn(Cc2ccc(-c3cn[nH]c3)cc2F)c2ccccc2c1=O ZINC000045348353 FG Annotated Anodyne O=C(NCC/N=C/c1cc(Cl)cc(Cl)c1O)c1ccccc1O ZINC000045349755 FG Annotated Mild O=C1CCCC2=C1[C@H](c1ccc(F)cc1Cl)N=C(c1cnccn1)N2 ZINC000045350949 FG Annotated Mild Cn1c(-c2ccc3nccnc3c2)c(-c2cccc(CC#N)c2)c(=O)n1C ZINC000045351555 FG Annotated Mild c1cc2c(c(OC3CCN(c4ccc(-n5ccnc5)nn4)CC3)c1)CCC2 ZINC000045351878 FG Annotated Anodyne Clc1cccc(COc2nc(N3CCNCC3)nc3sccc23)c1 ZINC000045351882 FG Annotated Anodyne O=C(/C=C/c1ccc([N+](=O)[O-])o1)N1CCN(C/C=C/c2ccccc2)CC1 ZINC000045353095 FG Annotated Bother Fc1ccc2nc(NCCN3CCNCC3)c3c4ccccc4[nH]c3c2c1 ZINC000045357211 FG Annotated Bother NCCCCCNc1nc(Nc2ccc(F)cc2)nc(-c2cccnc2)n1 ZINC000045357570 FG Annotated Anodyne Cc1cc2nc(NCCCO)n(CC(=O)c3ccc(O)cc3)c2cc1C ZINC000045358383 FG Annotated Anodyne Cc1ccc(S(=O)(=O)/N=C(/CCCCO)N(C(C)C)C(C)C)cc1 ZINC000045364252 FG Annotated Mild COc1ccc(-c2ccccc2)c2cc(C(=O)NN3CCOCC3)oc12 ZINC000045364922 FG Annotated Anodyne O=P(O)(O)COc1ccc(-c2cccnc2)c2c1-c1ncsc1C2 ZINC000045365597 FG Annotated Anodyne CCC(C)(C)C(=O)Nc1cc(C)c(C)c(S(=O)(=O)N2CCSC2)c1 ZINC000045368035 FG Annotated Anodyne Cc1cc(C)c(C)c(S(=O)(=O)n2c(=O)[nH]c3ccc(Cl)cc32)c1C ZINC000045368662 FG Annotated Anodyne COc1cccc2c1c(OC)c([N+](=O)[O-])c1c(C(=O)O)cc3c(c12)OCO3 ZINC000045372149 FG Annotated Bother O=C(O)c1cn(Cc2ccc(-n3cccn3)cc2)c2cccc(F)c2c1=O ZINC000045374316 FG Annotated Anodyne O=P(O)(O)COc1ccc(-c2ccncc2)c2c1-c1ncsc1C2 ZINC000045374916 FG Annotated Anodyne Nc1ccc(-n2cc(C(=O)C(=O)Nc3ccncc3)c3ccccc32)cc1 ZINC000045385325 FG Annotated Clean C=CCOC1=CC2=C3c4ccc(OCC=C)cc4OC[C@@]3(O)CC2=CC1=O ZINC000045390953 FG Annotated Mild C=CCOC1=CC2=C3c4ccc(OCC=C)cc4OC[C@]3(O)CC2=CC1=O ZINC000045390957 FG Annotated Mild CC(=O)c1cccc(-c2c(-c3ccc4nccnc4c3)n(C)n(C)c2=O)c1 ZINC000045391924 FG Annotated Anodyne COc1cccc(/C=N/N=C2\C(=O)Nc3c(Cl)ccc(Cl)c32)c1O ZINC000045392842 FG Annotated Mild Nc1cccc(NC(=O)c2cc(Sc3nncs3)c(F)cc2N)c1 ZINC000045393855 FG Annotated Anodyne CN1CCN(C(=O)c2ccc3c(c2)Oc2ccc(Cl)cc2[C@@]3(C)O)CC1 ZINC000045394318 FG Annotated Anodyne CN1CCN(C(=O)c2ccc3c(c2)Oc2ccc(Cl)cc2[C@]3(C)O)CC1 ZINC000045394322 FG Annotated Anodyne CCOC(=O)c1cc(COc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)on1 ZINC000045394499 FG Annotated Bother CNS(=O)(=O)c1ccc(Oc2ccc(SC)cc2)c(CN(C)C)c1 ZINC000045495419 FG Annotated Anodyne CCOc1cccc([C@H]2C3=C(COC3=O)Nc3cc4c(cc32)OCO4)c1 ZINC000045495939 FG Annotated Anodyne CCOc1cccc([C@@H]2C3=C(COC3=O)Nc3cc4c(cc32)OCO4)c1 ZINC000045495941 FG Annotated Anodyne Nc1ccccc1S(=O)(=O)Nc1ccc(O)c(-c2ccccc2O)c1 ZINC000045497725 FG Annotated Clean Cc1ccccc1N1CCN(C[C@@H]2CCc3cccnc3[C@@H](O)C2)CC1 ZINC000045497822 FG Annotated Anodyne CCOc1cc(OC)c(Cl)c2c1C(=O)[C@@]1(O2)C(OC)=CC(=O)C[C@H]1C ZINC000045497901 FG Annotated Mild C[C@@H]1NC(c2nccs2)=N[C@@]1(c1ccc(F)cc1)c1ccc(F)nc1 ZINC000045498491 FG Annotated Anodyne COC1=C/C(=N\O)C[C@@H](C)[C@]12Oc1c(Cl)c(OC)cc(OC)c1C2=O ZINC000045498757 FG Annotated Mild Fc1ccc(-c2n[nH]cc2CNc2cc(C3CCNCC3)ncn2)cc1 ZINC000046173763 FG Annotated Anodyne O=S(=O)(/N=C(\O)Cc1ccc(Br)cc1)c1ccccc1 ZINC000046708633 FG Annotated Mild O=S(=O)(/N=C(\O)Cc1ccc(F)cc1)c1ccc(Br)cc1 ZINC000046709038 FG Annotated Mild CN[S@@+](=O)(NC(=O)N(C)c1ccc(Cl)cc1)c1ccc(C)cc1 ZINC000472490942 FG Annotated Mild CN[S@+](=O)(NC(=O)N(C)c1ccc(Cl)cc1)c1ccc(C)cc1 ZINC000472490971 FG Annotated Mild CCCNCc1ccc(-c2[nH]c3cc(F)cc4c(O)n[nH]c(=O)c2c34)cc1 ZINC000473081291 FG Annotated Anodyne C[C@@H]1CN(c2cccnc2)C(=O)c2cc(COc3ccc(Cl)cn3)nn21 ZINC000473082680 FG Annotated Anodyne Cc1cc2c(c3oc(=O)c(CCCC#N)cc13)C(=O)c1c(O)cccc1C2=O ZINC000473084097 FG Annotated Mild O=C(C[C@]1(O)c2ccccc2-n2c1nc1ccccc1c2=O)c1cccs1 ZINC000473084763 FG Annotated Anodyne O=C(C[C@@]1(O)c2ccccc2-n2c1nc1ccccc1c2=O)c1cccs1 ZINC000473084765 FG Annotated Anodyne CC(C)=CCN1C(=O)N(Cc2cccc(F)c2)S(=O)(=O)n2cccc21 ZINC000473084949 FG Annotated Anodyne C[C@@H]1CN(c2ccccn2)C(=O)c2cc(COc3ccc(Cl)cn3)nn21 ZINC000473085534 FG Annotated Anodyne C=CC(=O)Nc1ccccc1-c1nc(N=c2cc[nH][nH]2)c2ccccc2n1 ZINC000473086090 FG Annotated Anodyne N#Cc1cccc(-c2cncc(C(=O)N3CC(=O)Nc4ccccc43)c2)c1 ZINC000473086670 FG Annotated Mild Oc1ccc([C@@H]2c3c(O)cc(O)cc3[C@@H](O)[C@H]2c2cc(O)cc(O)c2)cc1 ZINC000473087025 FG Annotated Anodyne Oc1ccc([C@@H]2c3c(O)cc(O)cc3[C@H](O)[C@H]2c2cc(O)cc(O)c2)cc1 ZINC000473087029 FG Annotated Anodyne Cc1cc2ccnc(N[C@H]3CCNC[C@@H]3OCC3CCCCC3)c2nc1O ZINC000473087238 FG Annotated Anodyne O=[N+]([O-])c1cn2c(n1)O[C@@H](CCOc1ccc(C(F)(F)F)cc1)CC2 ZINC000473087518 FG Annotated Bother C=CC(=O)Nc1cccc(-c2nc(N=c3cc[nH][nH]3)c3ccccc3n2)c1 ZINC000473088703 FG Annotated Anodyne O=C(Cc1ccccc1)NCC1=Cc2ccccc2O[C@@]1(O)C(F)(F)F ZINC000473088979 FG Annotated Anodyne O=C(Cc1ccccc1)NCC1=Cc2ccccc2O[C@]1(O)C(F)(F)F ZINC000473088980 FG Annotated Anodyne CC(C)[C@@]12C=C3[C@@H](O)C[C@@H]4[C@@](C)(C(=O)O)CCC[C@@]4(C)[C@]3(CC1)OO2 ZINC000473090273 FG Annotated Reactive CCSC[C@H](C(=O)c1ccc(Cl)cc1)n1cnc2ncnc(N)c21 ZINC000473090715 FG Annotated Anodyne CCSC[C@@H](C(=O)c1ccc(Cl)cc1)n1cnc2ncnc(N)c21 ZINC000473090717 FG Annotated Anodyne COc1cc(CCNCc2ccncc2)c(OC)cc1Br ZINC000473090865 FG Annotated Anodyne O=[N+]([O-])c1cn2c(n1)O[C@@H](CCOc1ccc(OC(F)(F)F)cc1)CC2 ZINC000473091486 FG Annotated Bother C=CC(=O)Nc1ccc(-c2nc(N=c3cc[nH][nH]3)c3ccccc3n2)cc1 ZINC000473096114 FG Annotated Anodyne C[C@@H]1CN(c2ccc(F)cc2)C(=O)c2cc(COc3ncccc3F)nn21 ZINC000473096844 FG Annotated Anodyne COc1cc(CCNCc2ccccn2)c(OC)cc1Br ZINC000473098385 FG Annotated Anodyne C[C@@H]1CN(c2ccc(F)cc2)C(=O)c2cc(COc3ccc(F)cn3)nn21 ZINC000473099547 FG Annotated Anodyne C=CC(=O)Nc1cccc(CN=c2[nH]c(Nc3cnoc3)ncc2Cl)c1 ZINC000473101594 FG Annotated Anodyne C[C@@H]1CN(c2cccc(F)c2)C(=O)c2cc(COc3ccc(F)cn3)nn21 ZINC000473101694 FG Annotated Anodyne C[C@@H]1CN(c2ccccc2F)C(=O)c2cc(COc3ccc(F)cn3)nn21 ZINC000473101877 FG Annotated Anodyne CCN(CC)c1cc2c(cc1NC(C)=O)NC(=O)/C2=C\c1ccccn1 ZINC000473102901 FG Annotated Anodyne O=C(Nc1ccc(Cl)cc1)OCC[C@H]1CCn2cc([N+](=O)[O-])nc2O1 ZINC000473104895 FG Annotated Bother COc1cccc2c1[C@H](C(C)C)N(C(=O)CNCC1(O)CCCCC1)CC2 ZINC000473107114 FG Annotated Anodyne COc1cccc2c1[C@@H](C(C)C)N(C(=O)CNCC1(O)CCCCC1)CC2 ZINC000473107119 FG Annotated Anodyne CN1CCN(Cc2cc(CNC(C)(C)c3ccccc3F)ccc2O)CC1 ZINC000473107734 FG Annotated Clean CC(C)(C)[C@@H]1c2ccccc2CCN1C(=O)CNCC1(O)CCCCC1 ZINC000473108004 FG Annotated Anodyne CC(C)(C)[C@H]1c2ccccc2CCN1C(=O)CNCC1(O)CCCCC1 ZINC000473108005 FG Annotated Anodyne Cc1cccc2c1CCN(C(=O)CNCC1(O)CCCCC1)[C@H]2C(C)C ZINC000473110123 FG Annotated Anodyne Cc1cccc2c1CCN(C(=O)CNCC1(O)CCCCC1)[C@@H]2C(C)C ZINC000473110124 FG Annotated Anodyne CC(C)[C@H]1c2cc(F)ccc2CCN1C(=O)CNCC1(O)CCCCC1 ZINC000473110327 FG Annotated Anodyne CC(C)[C@@H]1c2cc(F)ccc2CCN1C(=O)CNCC1(O)CCCCC1 ZINC000473110330 FG Annotated Anodyne CCCCN1C(=O)/C(=C/N[C@@H]2CC[C@@H](O)CC2)C(=O)c2cccc(C)c21 ZINC000473110346 FG Annotated Mild Cc1ccc2c(c1)[C@H](C(C)C)N(C(=O)CNCC1(O)CCCCC1)CC2 ZINC000473110349 FG Annotated Anodyne Cc1ccc2c(c1)[C@@H](C(C)C)N(C(=O)CNCC1(O)CCCCC1)CC2 ZINC000473110350 FG Annotated Anodyne CC(C)[C@H]1c2c(F)cccc2CCN1C(=O)CNCC1(O)CCCCC1 ZINC000473110914 FG Annotated Anodyne CC(C)[C@@H]1c2c(F)cccc2CCN1C(=O)CNCC1(O)CCCCC1 ZINC000473110915 FG Annotated Anodyne COc1nc(OC)nc(-c2cc(C(=O)c3ccc(C)cc3)n3ccccc23)n1 ZINC000473112683 FG Annotated Anodyne COc1cc(C)ccc1Oc1cccc(Cl)c1CN=c1[nH][nH]c(=N)[nH]1 ZINC000473112957 FG Annotated Anodyne CCOC(=O)c1csc2nc(-c3cccc(NC(=O)CCl)c3)cn12 ZINC000473113223 FG Annotated Reactive Cc1ccc(NC(=O)COc2cccc(Cl)c2Cl)c(C(N)=O)c1 ZINC000473114419 FG Annotated Anodyne CCOC(=O)c1csc2nc(-c3ccc(NC(=O)CCl)cc3)cn12 ZINC000473114596 FG Annotated Reactive CC(C)(C)OC(=O)n1cc(-c2ccc(NCc3cnc[nH]3)cc2)[nH]c1=N ZINC000473114677 FG Annotated Anodyne COc1nc(N2CCC(F)(F)CC2)nc(OC)c1NC(=O)CC(C)(C)C ZINC000473115526 FG Annotated Anodyne N#Cc1ccc(Nc2nccc(=Nc3ccn4cc(C#N)cc4c3)[nH]2)cc1 ZINC000473115547 FG Annotated Mild CSc1ccc(Oc2cccc(Cl)c2CN=c2[nH][nH]c(=N)[nH]2)cc1 ZINC000473117379 FG Annotated Anodyne Cc1cc2c(-c3cncc(C)c3C)cnc(NC3CCNCC3)c2nc1O ZINC000473120154 FG Annotated Anodyne O=C(COc1ccc2ccncc2c1)Nc1ccc(-c2cnccn2)cn1 ZINC000473122310 FG Annotated Anodyne Cc1cc(C)cc(Nc2nccc(-n3cc(C)c(CN4CC(O)C4)c3)n2)c1 ZINC000473122506 FG Annotated Anodyne N=C(NN)N1Nc2onc(-c3ccccc3)c2[C@@H]1c1ccc(Cl)cc1 ZINC000473124771 FG Annotated Anodyne N=C(NN)N1Nc2onc(-c3ccccc3)c2[C@H]1c1ccc(Cl)cc1 ZINC000473124774 FG Annotated Anodyne O=c1c2ccc(Cl)cc2ncn1CCCCCn1cnc([N+](=O)[O-])c1 ZINC000473124846 FG Annotated Bother COc1cccc(NCc2nn[nH]n2)c1OCc1ccc(F)cc1Cl ZINC000473124863 FG Annotated Anodyne CN1C(=O)C(c2ccc(C=O)cc2)=C(c2ccccc2)C12C=CC(=O)C=C2 ZINC000473127159 FG Annotated Mild CN1C(=O)C(c2ccc(C=O)s2)=C(c2ccccc2)C12C=CC(=O)C=C2 ZINC000473127316 FG Annotated Mild CC(C)Nc1nccc(-c2cc3n(c2)CCN(Cc2ccccc2)C3=O)n1 ZINC000473129033 FG Annotated Anodyne COc1ccccc1CN=c1ccc2ncc(-c3ccc(C#N)cc3)n2[nH]1 ZINC000473130026 FG Annotated Mild CN1C(=O)C(c2ccc(C#N)cc2)=C(c2ccccc2)C12C=CC(=O)C=C2 ZINC000473130599 FG Annotated Mild O=C(O)c1c(-c2ccc(O)cc2)ccc(CO)c1C#Cc1ccc(O)cc1 ZINC000473132718 FG Annotated Mild CCOC(=O)/C=C/c1cc(OC)ccc1OC(=O)c1nc(C)c(C)nc1C ZINC000473133727 FG Annotated Anodyne CCOC(=O)/C=C/c1ccc(OC(=O)c2nc(C)c(C)nc2C)c(OC)c1 ZINC000473133735 FG Annotated Anodyne C#CCN(C)[C@H](C)Cc1ccc(NCc2cc([N+](=O)[O-])ccc2O)cc1 ZINC000473134133 FG Annotated Mild COc1cccc(OC)c1C(=O)c1c(O)cc(C)c(OC)c1COC(C)=O ZINC000473134796 FG Annotated Anodyne C#CCCCCCOC(=O)/C=C/c1ccc(OC(C)=O)c(OC(C)=O)c1 ZINC000473135596 FG Annotated Mild CCOC(=O)/C=C/c1ccc(OC)c(OC(=O)c2nc(C)c(C)nc2C)c1 ZINC000473135653 FG Annotated Anodyne Cc1cc2c(-c3cccc4[nH]ncc34)cnc(NC3CCNCC3)c2nc1O ZINC000473136156 FG Annotated Anodyne Cc1cc2c(-c3cccc(O)c3)cnc(NC3CCNCC3)c2nc1O ZINC000473136211 FG Annotated Anodyne O=C1C2=C(C(=O)c3ccccc31)[C@H](c1ccc(Cl)cc1)[C@@H]([N+](=O)[O-])CO2 ZINC000473136235 FG Annotated Mild CNC(=O)[C@H]1N(C(=O)COc2ccc(Cl)cc2)c2ccccc2C1(C)C ZINC000473136275 FG Annotated Anodyne CNC(=O)[C@@H]1N(C(=O)COc2ccc(Cl)cc2)c2ccccc2C1(C)C ZINC000473136276 FG Annotated Anodyne C=CC[C@@]12C[C@]3(OCOC3=CC1=O)[C@@H](C)[C@@H]2c1cc(O)c2c(c1)OCO2 ZINC000473136923 FG Annotated Mild O=C1C2=C(C(=O)c3ccccc31)[C@H](c1ccccc1Cl)[C@@H]([N+](=O)[O-])CO2 ZINC000473136930 FG Annotated Mild O=C(Cn1cc(-c2ccccc2C(F)(F)F)nn1)NCc1ccccc1 ZINC000473144234 FG Annotated Anodyne Cc1cc(Nc2nccc(-c3cn(C)cn3)n2)cc2cc(-c3nnco3)[nH]c12 ZINC000473145164 FG Annotated Anodyne CCOC(=O)[C@H]1[C@H](C(=O)c2ccc(Cl)cc2)[C@@]12C(=O)Nc1ccccc12 ZINC000473148495 FG Annotated Anodyne CCOC(=O)[C@H]1[C@H](C(=O)c2ccc(Cl)cc2)[C@]12C(=O)Nc1ccccc12 ZINC000473148521 FG Annotated Anodyne Oc1ccc(-c2nc(N3CCN(c4cccc(Cl)c4)CC3)no2)cc1 ZINC000473151891 FG Annotated Anodyne Clc1cccc(N2CCN(c3noc(-c4n[nH]cc4Cl)n3)CC2)c1 ZINC000473152326 FG Annotated Anodyne O=C(NC1CCCCC1)C1=Cc2cc(Br)ccc2S1(=O)=O ZINC000473153340 FG Annotated Anodyne COn1c(-c2ccc(Cc3ccc(C)cc3)c(C#N)c2)nc(C)c1C(=O)O ZINC000473154255 FG Annotated Mild C=CCOc1cccc2c1C(=O)c1c(OCC=C)cc(CO)cc1C2=O ZINC000473154287 FG Annotated Mild CC(C)N1C(=O)C=C(Br)C1=C(Br)Br ZINC000473154739 FG Annotated Anodyne COc1cc(CN=c2nn[nH][nH]2)cc(Cl)c1O[C@H](C)c1ccccc1 ZINC000473154900 FG Annotated Anodyne COc1cc(CN=c2nn[nH][nH]2)cc(Cl)c1O[C@@H](C)c1ccccc1 ZINC000473154901 FG Annotated Anodyne O=C1c2cccc(O)c2C(=O)c2c(O)cc(/C=N/OCc3ccccc3)cc21 ZINC000473155130 FG Annotated Mild C[C@H](Oc1cc2oc(=O)n(CCC(=O)O)c2cc1Cl)c1ccccn1 ZINC000473155181 FG Annotated Anodyne C[C@@H](Oc1cc2oc(=O)n(CCC(=O)O)c2cc1Cl)c1ccccn1 ZINC000473155182 FG Annotated Anodyne Cc1c(C(N)=O)sc2[nH]cnc(=Nc3ccc(F)cc3OC(C)C)c12 ZINC000473156094 FG Annotated Anodyne C=CCOc1cccc2c1C(=O)c1c(OCC=C)cc(/C=N/O)cc1C2=O ZINC000473159803 FG Annotated Mild COc1ccc(NC(=O)c2c(NO)cc(-c3cccs3)oc2=O)cc1 ZINC000473159859 FG Annotated Anodyne CNC(=O)c1sc2[nH]cnc(=Nc3ccc(F)cc3OC(C)C)c2c1C ZINC000473160743 FG Annotated Anodyne COc1nc(-c2ccc(SC)cc2)[nH]c(=NCCc2ccc(F)cc2)n1 ZINC000473162739 FG Annotated Anodyne COc1c(F)cccc1C(=O)N1[C@H]2CC[C@H]1[C@@H](COc1ccc(F)cn1)C2 ZINC000473162749 FG Annotated Anodyne COc1nc(-c2ccc3cc[nH]c3c2)nc(=NCCc2ccc(F)cc2)[nH]1 ZINC000473162786 FG Annotated Anodyne COc1nc(-c2ccc3[nH]ccc3c2)[nH]c(=NCCc2ccc(F)cc2)n1 ZINC000473162843 FG Annotated Anodyne Cc1ccn2ccnc2c1C(=O)N1[C@H]2CC[C@H]1[C@@H](COc1ccccn1)C2 ZINC000473162850 FG Annotated Anodyne Cc1ccc2nccn2c1C(=O)N1[C@H]2CC[C@H]1[C@@H](COc1ccccn1)C2 ZINC000473162946 FG Annotated Anodyne COc1nc(-c2cccc3[nH]ccc23)nc(=NCCc2ccc(F)cc2)[nH]1 ZINC000473162983 FG Annotated Anodyne NC(=O)c1[nH]c(=Nc2ccc3ccc(F)cc3c2)sc1NC(=O)C1CC1 ZINC000473164822 FG Annotated Anodyne CC(C)=CC(=O)Nc1sc(=Nc2ccc3ccccc3c2)[nH]c1C(N)=O ZINC000473164986 FG Annotated Anodyne CN(C)CCNc1nccn2c(-c3ccncc3)c(-c3ccccc3)nc12 ZINC000473165287 FG Annotated Anodyne CN(C)c1nccn2c(I)c(-c3ccccc3)nc12 ZINC000473165471 FG Annotated Anodyne O=S(=O)(Nc1ccc(-c2ccncc2)c2cccnc12)c1cccnc1 ZINC000473169967 FG Annotated Anodyne Cc1nc2sccn2c1C(=O)N1[C@H]2CC[C@H]1[C@@H](COc1ccccn1)C2 ZINC000473170652 FG Annotated Anodyne CCOc1nccc(C)c1C(=O)N1[C@H]2CC[C@H]1[C@@H](COc1ccccn1)C2 ZINC000473170654 FG Annotated Anodyne N=C(N)NC(=O)N1CCc2c(Cl)ccc(-c3ccc(F)cc3F)c2C1 ZINC000473170741 FG Annotated Anodyne N=C(N)NC(=O)N1Cc2c(-c3ccccc3F)ccc(F)c2C2(CC2)C1 ZINC000473170759 FG Annotated Anodyne CCOc1nc(C)ccc1C(=O)N1[C@H]2CC[C@H]1[C@@H](COc1ccccn1)C2 ZINC000473171366 FG Annotated Anodyne COc1c(F)cccc1C(=O)N1[C@H]2CC[C@H]1[C@@H](Nc1ccc(F)cn1)C2 ZINC000473179601 FG Annotated Anodyne COC(C)(C)[C@@H]1CCCCN1C(=O)[C@@H]1CNC[C@]12CCCc1ccccc12 ZINC000473182568 FG Annotated Anodyne COC(C)(C)[C@H]1CCCCN1C(=O)[C@@H]1CNC[C@]12CCCc1ccccc12 ZINC000473182569 FG Annotated Anodyne CC(C)C[C@@H]1C(=O)N([C@H](CC(C)C)C(=O)O)C(=O)[C@H]1c1ccc(O)cc1 ZINC000473197808 FG Annotated Anodyne CC(C)C[C@@H]1C(=O)N([C@H](CC(C)C)C(=O)O)C(=O)[C@@H]1c1ccc(O)cc1 ZINC000473197816 FG Annotated Anodyne CC(C)C[C@@H]1C(=O)N([C@@H](CC(C)C)C(=O)O)C(=O)[C@H]1c1ccc(O)cc1 ZINC000473197818 FG Annotated Anodyne CC(C)C[C@@H]1C(=O)N([C@@H](CC(C)C)C(=O)O)C(=O)[C@@H]1c1ccc(O)cc1 ZINC000473197821 FG Annotated Anodyne N#Cc1cc(S(=O)(=O)Nc2ccc(F)cn2)ccc1Oc1cccnc1 ZINC000473201077 FG Annotated Mild N#Cc1cc(S(=O)(=O)Nc2ccc(F)cn2)ccc1Oc1ccccn1 ZINC000473201202 FG Annotated Mild CC1(C)[C@H]2Cc3c(O)cccc3[C@]1(C)CCN2C(=O)[C@@H]1CC[C@@H](O)CC1 ZINC000473233359 FG Annotated Anodyne CC1(C)[C@H]2Cc3c(O)cccc3[C@]1(C)CCN2C(=O)[C@@H]1CC[C@H](O)CC1 ZINC000473233361 FG Annotated Anodyne C[C@H]1COc2c(CNc3ccccc3)c(F)cc3c(=O)c(C(=O)O)cn1c23 ZINC000473244581 FG Annotated Anodyne CCn1cc(COCc2c(-c3ccc(C)cc3)nc3sc(C)nn23)nn1 ZINC000473247765 FG Annotated Anodyne CCCCc1cc(=O)n2[nH]c(=NCc3ccc(Cl)cc3F)c(C#N)c2[nH]1 ZINC000473248267 FG Annotated Mild O=S(=O)(Cc1ccc(Cl)cc1Cl)NCc1ccc(O)c(O)c1 ZINC000473248924 FG Annotated Clean Cc1ccc([N+](=O)[O-])c(N2CCC(=CC#Cc3ccc(C#N)cn3)CC2)n1 ZINC000473249659 FG Annotated Mild CC(C)CCc1cc(=O)n2[nH]c(=NCc3ccc(Cl)cc3)c(C#N)c2[nH]1 ZINC000473249696 FG Annotated Mild CNCCN(C)Cc1cnn(C)c1-c1ccc(OC(C)C)c(Cl)c1 ZINC000474609360 FG Annotated Anodyne Cn1ncc2c(Cl)cc(-c3ccc([C@@]4(C)CCCNC4=O)c(O)n3)cc21 ZINC000474609505 FG Annotated Anodyne CCOc1nn(-c2ccc(C(=O)OC)cn2)c(C)c1Cc1ccccc1 ZINC000474609529 FG Annotated Anodyne N#Cc1ccc2[nH]c(=Nc3ccc(O)cc3)c(=Nc3ccc(O)cc3)[nH]c2c1 ZINC000474609712 FG Annotated Mild Cn1cnc2cc(-c3ccc([C@@]4(C)CCCNC4=O)c(O)n3)cc(Cl)c21 ZINC000474610011 FG Annotated Anodyne COc1cc(OC)c(OC)cc1/C=N\N=c1\cc(C)[nH]c2ccccc12 ZINC000048308904 FG Annotated Mild O=S(=O)(/N=C(\O)Cc1ccc(Br)cc1)c1ccc(F)cc1 ZINC000048453264 FG Annotated Mild Cc1cc(C)n2cc(CSc3nc(-c4ccccc4)cn3N)nc2n1 ZINC000048656722 FG Annotated Anodyne COc1cc(-c2c3c(cc4cc(OC)c(O)cc24)CNC3=O)ccc1O ZINC000049017822 FG Annotated Anodyne O=C(c1cncs1)c1nc(NCc2cccnc2)nc2ccsc12 ZINC000049018622 FG Annotated Anodyne C/C=C1/C[N+]2([O-])[C@H]3C[C@@H]1[C@H]1[C@@H]2C[C@@]2(C3=Nc3ccccc32)[C@@H]1OC(C)=O ZINC000049019074 FG Annotated Bother Cc1cccc2c1C(=O)N1C[C@H](OCc3ccccc3)C[C@H]1c1cnnn1-2 ZINC000049019786 FG Annotated Anodyne C[C@H]1O[C@H](n2c(Cl)c(C=O)c3cc(Cl)c(Cl)cc32)[C@H](O)[C@@H]1O ZINC000049021510 FG Annotated Anodyne C[C@@H](Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1 ZINC000049031402 FG Annotated Anodyne C[C@H]1O[C@H](n2c(Cl)c(C#N)c3cc(Cl)c(Cl)cc32)[C@H](O)[C@@H]1O ZINC000049031918 FG Annotated Mild COC(=O)c1cc2c(s1)C(=O)C=C1N(C(=O)OC(C)(C)C)C[C@@H]3C[C@@]123 ZINC000049032213 FG Annotated Mild CCOC[C@@]1(CN(CC)CC)COc2ccc3c(C)cc(=O)oc3c2C1=O ZINC000049032721 FG Annotated Anodyne CCOC[C@]1(CN(CC)CC)COc2ccc3c(C)cc(=O)oc3c2C1=O ZINC000049032723 FG Annotated Anodyne COc1[nH]c(=O)c(C(=O)[C@@H](C)Cc2ccc(C(C)(C)C)cc2)c(O)c1OC ZINC000049033027 FG Annotated Anodyne COc1[nH]c(=O)c(C(=O)[C@H](C)Cc2ccc(C(C)(C)C)cc2)c(O)c1OC ZINC000049033029 FG Annotated Anodyne COc1[nH]c(O)c(C(=O)C(c2ccccc2)c2ccccc2)c(=O)c1OC ZINC000049033032 FG Annotated Anodyne Cc1cc(C)c(O)c(C2=NN[C@H](c3ccc(N4CCOCC4)cc3)C2)c1 ZINC000049034434 FG Annotated Clean Cc1cc(C)c(O)c(C2=NN[C@@H](c3ccc(N4CCOCC4)cc3)C2)c1 ZINC000049034436 FG Annotated Clean CNCCC[C@@H]1Cc2ccccc2N(c2c(F)cccc2F)S1(=O)=O ZINC000049034489 FG Annotated Anodyne CNCCC[C@H]1Cc2ccccc2N(c2c(F)cccc2F)S1(=O)=O ZINC000049034491 FG Annotated Anodyne COc1ccc(/C=C2\CO[C@H](c3cc(OC)cc(OC)c3)[C@@H]2CO)cc1 ZINC000049035045 FG Annotated Anodyne COc1ccc(/C=C2\CO[C@@H](c3cc(OC)cc(OC)c3)[C@@H]2CO)cc1 ZINC000049035048 FG Annotated Anodyne COc1ccc(/C=C2\CO[C@H](c3cc(OC)cc(OC)c3)[C@H]2CO)cc1 ZINC000049035050 FG Annotated Anodyne COc1ccc(/C=C2\CO[C@@H](c3cc(OC)cc(OC)c3)[C@H]2CO)cc1 ZINC000049035052 FG Annotated Anodyne CC[C@H]1c2cn[nH]c2C(=O)[C@@H](CC)N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000049036279 FG Annotated Anodyne CC[C@H]1C(=O)c2[nH]ncc2[C@@H](CC)N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000049036281 FG Annotated Anodyne Nc1nc2c(c(N3C[C@H]4CCCN[C@H]4C3)n1)CCCC[C@H]2c1ccccc1 ZINC000049045940 FG Annotated Anodyne Nc1nc2c(c(N3C[C@H]4CCCN[C@H]4C3)n1)CCCC[C@@H]2c1ccccc1 ZINC000049045943 FG Annotated Anodyne O=C(c1cccs1)N1CCC[C@@H](c2nnn(-c3cccc(Cl)c3)n2)C1 ZINC000049045947 FG Annotated Anodyne O=C(c1cccs1)N1CCC[C@H](c2nnn(-c3cccc(Cl)c3)n2)C1 ZINC000049045951 FG Annotated Anodyne C[C@H](Nc1nc(C(=O)N2CCCC2)c2sccc2n1)c1cccnc1 ZINC000049046456 FG Annotated Anodyne O=c1c2cccnc2oc2cc(OC[C@@H]3CS3)cc(OC[C@@H]3CS3)c12 ZINC000049047710 FG Annotated Bother O=c1c2cccnc2oc2cc(OC[C@@H]3CS3)cc(OC[C@H]3CS3)c12 ZINC000049047714 FG Annotated Bother O=c1c2cccnc2oc2cc(OC[C@H]3CS3)cc(OC[C@@H]3CS3)c12 ZINC000049047719 FG Annotated Bother O=c1c2cccnc2oc2cc(OC[C@H]3CS3)cc(OC[C@H]3CS3)c12 ZINC000049047724 FG Annotated Bother Nc1nc(-c2ccccc2)c2c(n1)-c1cc(CNN3CCCC3)ccc1C2=O ZINC000049048118 FG Annotated Anodyne Cn1cc(-c2cc(F)c(CN3C(=O)C(=O)c4cccc(F)c43)c(F)c2)cn1 ZINC000049048180 FG Annotated Anodyne CCOC(=O)[C@@](O)(c1c[nH]c2ccc(Br)cc12)C(F)(F)F ZINC000049048426 FG Annotated Anodyne CCC1=CN2CC[C@]34c5ccccc5-n5c3c(cc(C(=O)OC)c5=O)[C@H]1C[C@H]24 ZINC000049049905 FG Annotated Anodyne Cn1cc(-c2cnc(N)c(OCc3c(Cl)cccc3Cl)n2)cn1 ZINC000049050351 FG Annotated Anodyne CCSc1n[nH]c(/C=C\C(=O)Nc2ccc(Br)cc2)n1 ZINC000049053056 FG Annotated Anodyne Nc1ccc2cc3ccc(I)cc3nc2c1CO ZINC000049053390 FG Annotated Bother Nc1nc2c(c(N3C[C@@H]4CCCN[C@@H]4C3)n1)CCCC[C@H]2c1ccccc1 ZINC000049054911 FG Annotated Anodyne Nc1nc2c(c(N3C[C@@H]4CCCN[C@@H]4C3)n1)CCCC[C@@H]2c1ccccc1 ZINC000049054914 FG Annotated Anodyne CN1CC[C@H](n2cc(S(=O)(=O)c3cccc(F)c3)c3ccccc32)C1 ZINC000049055387 FG Annotated Anodyne CN1CC[C@@H](n2cc(S(=O)(=O)c3cccc(F)c3)c3ccccc32)C1 ZINC000049055390 FG Annotated Anodyne CON=C1C[C@@H]2CC[C@H](C1)N2S(=O)(=O)c1ccc(C(C)(C)C)cc1 ZINC000049055655 FG Annotated Mild O=C(O)c1cn(Cc2ccc(-c3ccccc3)cc2)c2nsnc2c1=O ZINC000049067289 FG Annotated Anodyne CN1CC[C@]2(CCCCC2=O)[C@]12C(=O)Nc1ccc(Br)cc12 ZINC000049067989 FG Annotated Anodyne CN1CC[C@@]2(CCCCC2=O)[C@]12C(=O)Nc1ccc(Br)cc12 ZINC000049067991 FG Annotated Anodyne CCN(C(=O)c1cnn(-c2ccc(OC)cc2)c1C)c1ccc(OC)nc1 ZINC000049068316 FG Annotated Anodyne CCc1nn(C)c2ncc(C(=O)NCC3Cc4ccccc4C3)c(Cl)c12 ZINC000049068541 FG Annotated Anodyne CC(=O)N1CCC[C@@]1(Cc1cccc(C#N)c1)C(=O)OCc1ccccc1 ZINC000049069242 FG Annotated Mild CC(=O)N1CCC[C@]1(Cc1cccc(C#N)c1)C(=O)OCc1ccccc1 ZINC000049069244 FG Annotated Mild O=C(O)c1cn(Cc2ccc(-c3ccccc3)cc2)c2ncncc2c1=O ZINC000049069652 FG Annotated Anodyne Cc1nc(N)sc1CCCNC(=N)NC(=O)C[C@@H](C)C1CCCCC1 ZINC000049070700 FG Annotated Anodyne Cc1nc(N)sc1CCCNC(=N)NC(=O)C[C@H](C)C1CCCCC1 ZINC000049070701 FG Annotated Anodyne COc1ccc(N(C)C(=O)N2CC(Oc3ccc(F)cc3Cl)C2)cn1 ZINC000049070746 FG Annotated Anodyne O=C(O)c1cn(Cc2ccc(-c3ccccc3)cc2)c2nccnc2c1=O ZINC000049070785 FG Annotated Anodyne O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1cc(/C=C\c2ccco2)on1 ZINC000049070928 FG Annotated Reactive CCOc1ccccc1-c1ncnn1-c1cc(OC)c(OC)c(OC)c1 ZINC000049071909 FG Annotated Anodyne CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@H](N=[N+]=[N-])[C@H]1Br ZINC000049071928 FG Annotated Reactive Cn1cc(-c2ccc(Cn3cc(C(=O)O)c(=O)c4sccc43)cc2)cn1 ZINC000049072482 FG Annotated Anodyne CN1CCC=C([C@@H]2CN(C(=O)c3cc(Cl)ccc3Cl)CCO2)C1 ZINC000049072578 FG Annotated Anodyne CN1CCC=C([C@H]2CN(C(=O)c3cc(Cl)ccc3Cl)CCO2)C1 ZINC000049072580 FG Annotated Anodyne CSc1nn2c(C)c3c(nc2c1S(=O)(=O)c1ccccc1)CCCC3 ZINC000049072715 FG Annotated Anodyne CSc1nn2c3c(cnc2c1S(=O)(=O)c1ccccc1)CCCC3 ZINC000049073336 FG Annotated Anodyne CC(=O)N1CCC[C@@]1(Cc1ccc(C#N)cc1)C(=O)OCc1ccccc1 ZINC000049073398 FG Annotated Mild CC(=O)N1CCC[C@]1(Cc1ccc(C#N)cc1)C(=O)OCc1ccccc1 ZINC000049073400 FG Annotated Mild COc1ccc(C[C@@]2(C(=O)OCc3ccccc3)CCCN2C(C)=O)cc1 ZINC000049087660 FG Annotated Anodyne COc1ccc(C[C@]2(C(=O)OCc3ccccc3)CCCN2C(C)=O)cc1 ZINC000049087663 FG Annotated Anodyne NC(=O)c1sc2nc3c(c(-c4ccc(CO)o4)c2c1N)CCCCCC3 ZINC000049087681 FG Annotated Anodyne CC(=O)N1CCC[C@@]1(Cc1ccc(F)cc1)C(=O)OCc1ccccc1 ZINC000049087745 FG Annotated Anodyne CC(=O)N1CCC[C@]1(Cc1ccc(F)cc1)C(=O)OCc1ccccc1 ZINC000049087748 FG Annotated Anodyne CCOc1cccc(-c2ncnn2-c2cc(OC)c(OC)c(OC)c2)c1 ZINC000049088262 FG Annotated Anodyne COc1cccc2sc(COc3ccc(F)c(C(N)=O)c3F)nc12 ZINC000049088397 FG Annotated Anodyne CC(C)OC(=O)c1nn(-c2ccc(Cl)cc2)c(=O)c2c(N)scc12 ZINC000049088456 FG Annotated Anodyne Cc1ccc(-c2nn(Cc3nnc(S)o3)c(=O)c3ccccc23)cc1C ZINC000049088975 FG Annotated Anodyne CCOC(=O)[C@](O)(c1c[nH]c2ccc(Br)cc12)C(F)(F)F ZINC000049089171 FG Annotated Anodyne CCC1=CN2CC[C@]34c5ccccc5-n5c3c(cc(C(=O)O)c5=O)[C@H]1C[C@H]24 ZINC000049111528 FG Annotated Anodyne CCOP(=O)(OCC)[C@H](O)c1cc2cccc(CC)c2n2nnnc12 ZINC000049112056 FG Annotated Anodyne CCOP(=O)(OCC)[C@@H](O)c1cc2cccc(CC)c2n2nnnc12 ZINC000049112057 FG Annotated Anodyne C[C@@H]1OC(c2ccc(F)cc2[N+](=O)[O-])=N[C@@H]1C(=O)OCc1ccccc1 ZINC000049112248 FG Annotated Bother COc1cc(OCC2CCCCC2)c(F)cc1CNC(=O)[C@@H]1CCCN1 ZINC000049112710 FG Annotated Anodyne Cc1ccn(-c2ccc(Cn3cc(C(=O)O)c(=O)c4sccc43)cc2)n1 ZINC000049112842 FG Annotated Anodyne CSc1nn2c3c(c(C)nc2c1S(=O)(=O)c1ccccc1)CCCC3 ZINC000049113924 FG Annotated Anodyne O=c1c2cc3c(nc2nc2sc4nc5ccccc5nc4n12)CCCC3 ZINC000049114186 FG Annotated Bother CN1CCN(Cn2nc(Cc3cccc4ccccc34)oc2=S)CC1 ZINC000049114687 FG Annotated Anodyne O=C(O)c1cn(Cc2ccc(-c3cccnc3)cn2)c2ccsc2c1=O ZINC000049115274 FG Annotated Anodyne CC(=O)c1cn(S(=O)(=O)c2cccc([N+](=O)[O-])c2)c2cc(C)ccc12 ZINC000049116014 FG Annotated Bother O=C(c1nccs1)c1nc(NCc2cccnc2)nc2ccsc12 ZINC000049124713 FG Annotated Anodyne O=C(NC1C2CC3CC(C2)CC1C3)[C@H]1CCCN1CC1(O)CCCCC1 ZINC000049124877 FG Annotated Anodyne COc1ccc(N2CCN(c3cc(=O)oc4ccc(C)cc34)CC2)cc1 ZINC000049563704 FG Annotated Clean CC(=O)O[C@@H]1[C@@H](OC(=O)C(C)C)c2c(ccc3ccc(=O)oc23)OC1(C)C ZINC000049601308 FG Annotated Anodyne CC(=O)O[C@H]1[C@H](OC(=O)C(C)C)c2c(ccc3ccc(=O)oc23)OC1(C)C ZINC000049601309 FG Annotated Anodyne COC(=O)c1ccc(CNC(=O)C[C@@]2(C)CC3(CCCCC3)OO2)cc1 ZINC000049710958 FG Annotated Reactive COC(=O)c1ccc(CNC(=O)C[C@]2(C)CC3(CCCCC3)OO2)cc1 ZINC000049710960 FG Annotated Reactive Cc1c(N2C[C@@H](C)C[C@@H](C)C2)c(N)cc2c(=O)c(C(=O)O)cn(C3CC3)c12 ZINC000049756163 FG Annotated Anodyne Cc1c(N2C[C@@H](C)C[C@H](C)C2)c(N)cc2c(=O)c(C(=O)O)cn(C3CC3)c12 ZINC000049756165 FG Annotated Anodyne Cc1c(N2C[C@H](C)C[C@@H](C)C2)c(N)cc2c(=O)c(C(=O)O)cn(C3CC3)c12 ZINC000049756166 FG Annotated Anodyne CSc1ccc(C2=C(c3ccc(OC(C)=O)cc3)C(=O)OC2=O)cc1 ZINC000049756654 FG Annotated Reactive CCNC(=O)NCC1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3 ZINC000049757000 FG Annotated Reactive CSc1ccc(C2=C(c3ccc(NC(C)=O)cc3)C(=O)OC2=O)cc1 ZINC000049762333 FG Annotated Reactive CN(C)C(=O)NCC1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3 ZINC000049766972 FG Annotated Reactive N#Cc1ccc(CN2CCC[C@@H]2C(=O)NC2C3CC4CC(C3)CC2C4)cc1 ZINC000049783989 FG Annotated Mild C=C1CC[C@H](C(C)C)[C@@H]2[C@H]1[C@H]1C[C@](C)(O)[C@@H](OC)CC[C@@](C)(O)[C@@H]2O1 ZINC000049784033 FG Annotated Mild O=C(NCCO)NC(=O)[C@H](CC1CCCC1)c1ccc(Cl)c(Cl)c1 ZINC000049784506 FG Annotated Anodyne O=C(NCCO)NC(=O)[C@@H](CC1CCCC1)c1ccc(Cl)c(Cl)c1 ZINC000049784507 FG Annotated Anodyne CN(C)c1ccc2sc(COc3ccc(F)c(C(N)=O)c3F)nc2c1 ZINC000049784843 FG Annotated Anodyne Cn1cc(-c2ccc(CN3C(=O)C(=O)c4cccc(F)c43)c(F)c2)cn1 ZINC000049785208 FG Annotated Anodyne COC(=O)c1cc2c(s1)C(=O)C=C1N(C(=O)OC(C)(C)C)C[C@H]3C[C@]123 ZINC000049792942 FG Annotated Mild Cn1cc(-c2ccc(CN3C(=O)C(=O)c4c(F)ccc(F)c43)c(F)c2)cn1 ZINC000049793581 FG Annotated Anodyne C[C@]12CC[C@H]3[C@@H](C[C@@]4(CO4)[C@H]4C/C(=N/OCCN)CC[C@]34C)[C@@H]1CCC2=O ZINC000049799624 FG Annotated Mild COc1cc2c(cc1OC)C(=O)N1C=C(c3ccc(O)cc3)C[C@H]1C=N2 ZINC000049802397 FG Annotated Anodyne c1cc(-c2cc3ccc(C4=NCCCN4)cc3[nH]2)ccc1C1=NCCCN1 ZINC000049802642 FG Annotated Anodyne CCN(CC)C(=O)C1=C(C)[C@@H]2CC[C@@H](C)[C@@H]3CC[C@@]4(C)OO[C@@]23[C@H](O1)O4 ZINC000049802729 FG Annotated Reactive CCOC(=O)/C=C/c1cn(-c2ccc(O)cc2)nc1-c1cc(O)ccc1O ZINC000049803374 FG Annotated Anodyne NNC(=O)c1ccc(N2C(=O)c3ccccc3NC23CCCCC3)cc1 ZINC000049803724 FG Annotated Reactive COc1ccc([C@H]2C[C@H]3C=Nc4cc(OC)c(OC)cc4C(=O)N3C2)cc1 ZINC000049803804 FG Annotated Anodyne CCc1nc(NCc2ccc(OC)cc2)c(NC=O)c(-c2ccco2)n1 ZINC000049807405 FG Annotated Anodyne O=C(NCC[S@](=O)Cc1cccc(O)c1)c1c(Cl)cccc1Cl ZINC000049807764 FG Annotated Anodyne O=C(NCC[S@@](=O)Cc1cccc(O)c1)c1c(Cl)cccc1Cl ZINC000049807765 FG Annotated Anodyne COc1cc2c(cc1OC)C(=O)N1C=C(c3ccc(C=O)cc3)C[C@H]1C=N2 ZINC000049808077 FG Annotated Anodyne N#Cc1c(NN)nc(SCc2nc3ccccc3[nH]2)nc1-c1ccccc1 ZINC000049808591 FG Annotated Mild C[C@]12CC[C@H]3[C@@H](C[C@]4(CO4)[C@H]4C/C(=N/OCCN)CC[C@]34C)[C@@H]1CCC2=O ZINC000049863752 FG Annotated Mild O=C1OC(=O)[C@H]2[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(c2ccccc2)[C@@H]1c1ccccc1 ZINC000049872154 FG Annotated Reactive C=C1C(=O)O[C@H]2C(=O)[C@H](C)CCC[C@](C)(OO)/C=C/C[C@@]3(C)O[C@@H]3C[C@@H]12 ZINC000049878133 FG Annotated Reactive CCCCCCC/C=C/C(=O)N1[C@@H](O)[C@@H]([C@@H](C)O)C(=O)[C@H]1CC(C)C ZINC000049888717 FG Annotated Mild CCCCCCC/C=C/C(=O)N1[C@@H](O)[C@H]([C@@H](C)O)C(=O)[C@H]1CC(C)C ZINC000049888718 FG Annotated Mild CCCCCCC/C=C/C(=O)N1[C@H](CC(C)C)C(=O)[C@H]([C@@H](C)O)[C@H]1O ZINC000049888719 FG Annotated Mild CCCCCCC/C=C/C(=O)N1[C@H](CC(C)C)C(=O)[C@@H]([C@@H](C)O)[C@H]1O ZINC000049888720 FG Annotated Mild Cc1c(OCc2cccnc2)ccc2c(N3CCC(N)CC3)cc(=O)oc12 ZINC000049942639 FG Annotated Anodyne Cc1cc(-c2nnc3c4c(c(OCc5ccccn5)nn23)[C@H]2CC[C@@H]4C2)no1 ZINC000000579873 FG Annotated Anodyne COC(=O)Cn1cc(-c2cccc(Cl)c2)c(=O)c2c(O)cc(OC)cc21 ZINC000000581498 FG Annotated Anodyne Nc1cc(O)c(-c2nn(-c3ccc(C(F)(F)F)cc3)c(=O)o2)cc1Cl ZINC000000581976 FG Annotated Anodyne CC[n+]1cc2cc(OC)c(OC)cc2c2c1-c1cc3c(cc1C2)OCO3 ZINC000000588521 FG Annotated Anodyne CN(C)Cc1c(F)c(N)c2c(=O)cc(-c3ccc(N)c(F)c3)oc2c1F ZINC000000592242 FG Annotated Anodyne CC(C)(O)c1cnn2c(-c3ccc(F)c(-c4ncccc4C#N)c3)cnc2n1 ZINC000000594838 FG Annotated Mild COc1ccc2c(C(=S)N(C)CC(N)=O)c(F)ccc2c1C(F)(F)F ZINC000000596244 FG Annotated Anodyne Cc1cc(-c2c(F)cc3c(=O)c(C(=O)O)cn4c3c2OC[C@H]4C)cc(C)n1 ZINC000000597027 FG Annotated Anodyne CSC1=N[C@@H](c2cccc([N+](=O)[O-])c2SC)C2=C(O)OCC2=N1 ZINC000000598116 FG Annotated Bother COC(=O)c1[nH]cc(-c2ccc(Br)cc2)c1N1CCOCC1 ZINC000000600433 FG Annotated Anodyne Cc1[nH]c2ccccc2c1CN(C)C(=O)/C=C/c1cnc2c(c1)CCC(=O)N2 ZINC000000603070 FG Annotated Anodyne CSc1ccc2c(c1)c(O)c(C(=O)N(C)c1ccccc1)c(=O)n2C ZINC000000603125 FG Annotated Anodyne CSC1=N[C@@H](c2cc([N+](=O)[O-])ccc2SC)C2=C(O)OCC2=N1 ZINC000000604644 FG Annotated Bother CCN1CCC[C@@H]1CN[C@@H]1c2cc(OC)ccc2OCc2ncccc21 ZINC000000607331 FG Annotated Anodyne CCSc1cc(N2CCN(CC)CC2)nc(-c2ccc(OC)cc2)n1 ZINC000000631245 FG Annotated Anodyne O=C1C[C@H](c2ccc(Cl)cc2)N2CCNC2=C1C(=O)Nc1ccccc1 ZINC000000642872 FG Annotated Mild aggregator O=C1C[C@@H](c2ccc(Cl)cc2)N2CCNC2=C1C(=O)Nc1ccccc1 ZINC000000642873 FG Annotated Mild aggregator CO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@@H]1c1ccc(O)c([N+](=O)[O-])c1 ZINC000000676053 FG Annotated Mild CO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@H]1c1ccc(O)c([N+](=O)[O-])c1 ZINC000000676058 FG Annotated Mild O=C(N/N=C/c1ccc(O)c(O)c1)C1c2ccccc2Oc2ccccc21 ZINC000000695361 FG Annotated Reactive O=C(c1ccccc1F)N1N=C(c2ccccc2)C[C@]1(O)C(F)(F)F ZINC000000724124 FG Annotated Anodyne COc1c(OC)c2c3c(ncc(OC)c3c1OC)C(=O)c1ccccc1-2 ZINC000000730611 FG Annotated Anodyne C[C@H]1S[C@@H](c2ccccc2)N(C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1=O ZINC000000752039 FG Annotated Bother Cc1nc(N2CCOCC2)c2c(C)c(C(=O)N3CCC(C)CC3)sc2n1 ZINC000000752885 FG Annotated Anodyne COc1ccccc1/C=C1\C(=O)NC(=O)N(c2c(C)cc(C)cc2C)C1=O ZINC000000753077 FG Annotated Clean CCOC(=O)c1c(C)n(C)c2cc(Br)c(C(=O)OC)cc12 ZINC000000753731 FG Annotated Anodyne COc1cc2oc(C(=O)OCCN(C)C)c(C)c2cc1Br ZINC000000753767 FG Annotated Anodyne Cc1nc(N2CCOCC2)c2c(C)c(C(=O)NC3CCCCC3)sc2n1 ZINC000000753829 FG Annotated Anodyne CCC[C@@H](C)NC(=O)c1sc2nc(C)nc(N3CCOCC3)c2c1C ZINC000000753833 FG Annotated Anodyne CCC[C@H](C)NC(=O)c1sc2nc(C)nc(N3CCOCC3)c2c1C ZINC000000753834 FG Annotated Anodyne CCOC(=O)c1sc2nc(CC(=O)OC)nc(N[C@H](C)CC)c2c1C ZINC000000753841 FG Annotated Anodyne CCOC(=O)c1sc2nc(CC(=O)OC)nc(N[C@@H](C)CC)c2c1C ZINC000000753842 FG Annotated Anodyne COc1ccc([C@H]2CC(c3c(O)cc(C)oc3=O)=NCCS2)cc1O ZINC000000754268 FG Annotated Anodyne COc1ccc([C@@H]2CC(c3c(O)cc(C)oc3=O)=NCCS2)cc1O ZINC000000754269 FG Annotated Anodyne Cc1cc(O)c(C2=NCCS[C@@H](c3ccc4c(c3)OCO4)C2)c(=O)o1 ZINC000000754496 FG Annotated Anodyne Cc1cc(O)c(C2=NCCS[C@H](c3ccc4c(c3)OCO4)C2)c(=O)o1 ZINC000000754497 FG Annotated Anodyne Cc1cc(O)c(C2=NCCS[C@@H](c3ccccc3[N+](=O)[O-])C2)c(=O)o1 ZINC000000754498 FG Annotated Bother Cc1cc(O)c(C2=NCCS[C@H](c3ccccc3[N+](=O)[O-])C2)c(=O)o1 ZINC000000754499 FG Annotated Bother COc1cc(-c2ncnn2-c2sc3c(c2C#N)CCCC3)ccc1O ZINC000000757981 FG Annotated Mild CN(C)S(=O)(=O)N1C=Cc2ccccc2[C@H]1c1c[nH]c2ccccc12 ZINC000000758194 FG Annotated Anodyne CN(C)S(=O)(=O)N1C=Cc2ccccc2[C@@H]1c1c[nH]c2ccccc12 ZINC000000758196 FG Annotated Anodyne CNC(=O)N(Cc1ccccc1)[C@@H]1CC(C)(C)Oc2ccc(C(N)=O)cc21 ZINC000000758420 FG Annotated Anodyne CNC(=O)N(Cc1ccccc1)[C@H]1CC(C)(C)Oc2ccc(C(N)=O)cc21 ZINC000000758421 FG Annotated Anodyne CC(=O)N(Cc1ccccc1)[C@H]1CC(C)(C)Oc2ccc(C(N)=O)cc21 ZINC000000758424 FG Annotated Anodyne CC(=O)N(Cc1ccccc1)[C@@H]1CC(C)(C)Oc2ccc(C(N)=O)cc21 ZINC000000758425 FG Annotated Anodyne CCOC(=O)C1=C(N)Oc2[nH]nc(C)c2[C@H]1c1ccc(Cl)cc1Cl ZINC000000758711 FG Annotated Anodyne CCOC(=O)C1=C(N)Oc2[nH]nc(C)c2[C@@H]1c1ccc(Cl)cc1Cl ZINC000000758712 FG Annotated Anodyne CC(=O)N(C[C@H]1CCCO1)[C@H]1CC(C)(C)Oc2ccc(C(=O)N(C)C)cc21 ZINC000000760319 FG Annotated Anodyne CC(=O)N(C[C@@H]1CCCO1)[C@H]1CC(C)(C)Oc2ccc(C(=O)N(C)C)cc21 ZINC000000760320 FG Annotated Anodyne CC(=O)N(C[C@H]1CCCO1)[C@@H]1CC(C)(C)Oc2ccc(C(=O)N(C)C)cc21 ZINC000000760321 FG Annotated Anodyne CC(=O)N(C[C@@H]1CCCO1)[C@@H]1CC(C)(C)Oc2ccc(C(=O)N(C)C)cc21 ZINC000000760322 FG Annotated Anodyne C[C@H]1CN(c2ccc3nc(O)c(Cc4ccc(F)cc4)nc3n2)C[C@@H](C)O1 ZINC000000766838 FG Annotated Anodyne C[C@@H]1CN(c2ccc3nc(O)c(Cc4ccc(F)cc4)nc3n2)C[C@@H](C)O1 ZINC000000766839 FG Annotated Anodyne C[C@H]1CN(c2ccc3nc(O)c(Cc4ccc(F)cc4)nc3n2)C[C@H](C)O1 ZINC000000766840 FG Annotated Anodyne CC[C@H](C)[C@H](CO)NC(=O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccccc1 ZINC000000767077 FG Annotated Anodyne CCOc1ccc(CCNC(=O)[C@@]2(C)CON=C2c2ccccc2)cc1 ZINC000000767460 FG Annotated Anodyne CCOc1ccc(CCNC(=O)[C@]2(C)CON=C2c2ccccc2)cc1 ZINC000000767461 FG Annotated Anodyne Nc1ccccc1CNC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccoc1 ZINC000000767868 FG Annotated Anodyne Nc1ccccc1CNC(=O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccoc1 ZINC000000767870 FG Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000000767963 FG Annotated Bother CN(C)C(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000000767965 FG Annotated Bother CCOc1ccccc1C1=NOC[C@]1(C)C(=O)NCCc1ccc(F)cc1 ZINC000000770552 FG Annotated Anodyne CCOc1ccccc1C1=NOC[C@@]1(C)C(=O)NCCc1ccc(F)cc1 ZINC000000770553 FG Annotated Anodyne CCOc1ccccc1C1=NOC[C@]1(C)C(=O)NCCc1ccccc1F ZINC000000771733 FG Annotated Anodyne CCOc1ccccc1C1=NOC[C@@]1(C)C(=O)NCCc1ccccc1F ZINC000000771734 FG Annotated Anodyne CCOc1ccccc1C1=NOC[C@]1(C)C(=O)NCc1ccccc1OC ZINC000000771737 FG Annotated Anodyne CCOc1ccccc1C1=NOC[C@@]1(C)C(=O)NCc1ccccc1OC ZINC000000771738 FG Annotated Anodyne CCOc1ccccc1C1=NO[C@@H](c2ccccc2OC)[C@H]1C(=O)N(C)C ZINC000000771929 FG Annotated Anodyne CCOc1ccccc1C1=NO[C@H](c2ccccc2OC)[C@H]1C(=O)N(C)C ZINC000000771931 FG Annotated Anodyne COc1ccccc1CNC(=O)[C@]1(C)CON=C1c1cccc(Cl)c1 ZINC000000772714 FG Annotated Anodyne COc1ccccc1CNC(=O)[C@@]1(C)CON=C1c1cccc(Cl)c1 ZINC000000772715 FG Annotated Anodyne CC(C)(CO)CNC(=O)c1c(-c2ccc(F)cc2)noc1-c1ccoc1 ZINC000000773686 FG Annotated Anodyne CC[C@H](O)CNC(=O)c1c(-c2ccc(OC)cc2)noc1-c1ccoc1 ZINC000000774161 FG Annotated Anodyne CC[C@@H](O)CNC(=O)c1c(-c2ccc(OC)cc2)noc1-c1ccoc1 ZINC000000774162 FG Annotated Anodyne COc1ccc(-c2noc(-c3ccoc3)c2C(=O)NCC(C)(C)CO)cc1 ZINC000000774260 FG Annotated Anodyne Cc1onc(-c2ccccc2F)c1C(=O)N[C@H](CO)Cc1ccccc1 ZINC000000775164 FG Annotated Anodyne Cc1onc(-c2ccccc2F)c1C(=O)N[C@@H](CO)Cc1ccccc1 ZINC000000775165 FG Annotated Anodyne CC(C)(CO)CNC(=O)c1c(-c2ccccc2F)noc1-c1ccoc1 ZINC000000775272 FG Annotated Anodyne COc1ccccc1-c1onc(C(C)(C)C)c1C(=O)NCC(C)(C)CO ZINC000000775904 FG Annotated Anodyne CC1=C2C(N)=C(C(=O)Nc3ccccc3)S[C@@H]2NC(C(F)(F)F)=C1 ZINC000000803782 FG Annotated Anodyne C[C@H](Sc1nc(NC(C)(C)C)nc(N(C)C)n1)C(=O)Nc1ccccc1 ZINC000000804845 FG Annotated Anodyne C[C@@H](Sc1nc(NC(C)(C)C)nc(N(C)C)n1)C(=O)Nc1ccccc1 ZINC000000804846 FG Annotated Anodyne CCS(=O)(=O)c1ccc(OC)c(-c2ccc(CN3CCCCC3)[nH]2)c1 ZINC000000835055 FG Annotated Anodyne Cc1cc2cc3c(cc2n2c(SCC(=O)OC(C)C)nnc12)OCCO3 ZINC000000877380 FG Annotated Anodyne O=C(CCn1nnc2ccccc21)Nc1nnc(-c2ccccc2F)s1 ZINC000000897628 FG Annotated Anodyne Fc1cccc(Cl)c1Cn1nnc(-c2ccc(N3CCOCC3)cc2)n1 ZINC000000919981 FG Annotated Anodyne COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@H]3C[C@@H]12 ZINC000000967907 FG Annotated Anodyne COc1ccc([C@](O)(C(=O)NNc2ccc(C)cc2)c2cccs2)cc1 ZINC000000969115 FG Annotated Reactive COc1ccc([C@@](O)(C(=O)NNc2ccc(C)cc2)c2cccs2)cc1 ZINC000000969116 FG Annotated Reactive CC(C)(C)NC(=O)c1nc2nc(-c3ccccc3)cc(C(F)(F)F)n2n1 ZINC000000978162 FG Annotated Anodyne Cc1ccc(C(=O)N/N=C2\SCC(=O)N2c2cc(C)ccc2C)cc1 ZINC000005006809 FG Annotated Reactive Cn1c(=O)cc(SCC(=O)N2CCCCC2)c2ccc(Cl)cc21 ZINC000005008496 FG Annotated Anodyne C/C(=C1/C(=O)N(c2ccc([N+](=O)[O-])cc2)N=C1c1ccccc1)N(C)C ZINC000005044415 FG Annotated Clean O=C(CN1C(=O)CCSc2ccccc21)NCc1ccccc1Cl ZINC000005051974 FG Annotated Anodyne O=C(NC(c1ccccc1)c1ccccc1)c1cnc2ccccn2c1=O ZINC000005053652 FG Annotated Anodyne CCC(C)(C)n1nnnc1CN1CCC(c2nc3cc(C)ccc3[nH]2)CC1 ZINC000005054735 FG Annotated Anodyne Cc1ccccc1-c1nc(C[S@@](=O)CC(=O)N2CCCCC2)c(C)o1 ZINC000005058125 FG Annotated Anodyne Cc1ccccc1-c1nc(C[S@](=O)CC(=O)N2CCCCC2)c(C)o1 ZINC000005058126 FG Annotated Anodyne COC(OC)[C@@H]1O[C@@H](c2ccccc2)O[C@@H]2CO[C@H](c3ccccc3)O[C@@H]21 ZINC000005063271 FG Annotated Anodyne Cc1ccc(C)c(N(C)C(=O)COc2cc(=O)n(C)c3ccccc23)c1 ZINC000005066543 FG Annotated Anodyne COC(=O)c1cc2oc(C)cc2n1CC(=O)Cc1ccc(OC)cc1OC ZINC000005084538 FG Annotated Anodyne CCOC(=O)Nc1cc2c(c(/N=C/N(C)C)n1)N=C(c1ccccc1)CO2 ZINC000005114816 FG Annotated Mild COc1ccc(N2C(=O)/C(=C/c3ccc([N+](=O)[O-])cc3)N=C2C)c(OC)c1 ZINC000005125901 FG Annotated Bother O=C1C[C@H](NCCc2ccccc2)C(=O)N1c1ccccc1C(F)(F)F ZINC000005127021 FG Annotated Anodyne COC(=O)c1cc2oc3ccccc3c2n1CC(=O)NCc1ccco1 ZINC000005135083 FG Annotated Anodyne COC(=O)c1cc2oc3ccccc3c2n1Cc1cc(=O)n2ccccc2n1 ZINC000005135104 FG Annotated Anodyne COc1ccc(C2=NN(CC(=O)Nc3cc(C)ccc3C)C(=O)CC2)cc1 ZINC000005135832 FG Annotated Anodyne COCCC/N=C/c1c(C)nn(-c2ccc(Br)c(C)c2)c1O ZINC000005155554 FG Annotated Mild CC#C[C@]1(O)CC[C@H]2[C@@H]3C=C(C)C4=CC(=O)C=C[C@]4(C)[C@H]3[C@@H](O)C[C@@]21C ZINC000005158108 FG Annotated Mild in-vitro CC(=O)OC[C@@]1(C)[C@H](O)C(=O)C[C@@]2(C)[C@H]1CC[C@@]1(C)c3cocc3CC[C@@H]12 ZINC000005166173 FG Annotated Anodyne CCCOc1ccc2c(c1)C(=NNC(=N)N)c1cc(OCCC)ccc1-2 ZINC000005171868 FG Annotated Mild COc1cc2c(cc1O)C(CCc1cc(OC)c(OC)c(OC)c1)=NCC2 ZINC000005203252 FG Annotated Anodyne COc1ccc2c(c1OC)OC[C@H](c1ccc(OC)c(OC)c1OC)C2 ZINC000005257411 FG Annotated Anodyne Cc1cc(O)c(C2=NCCS[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(=O)o1 ZINC000005276971 FG Annotated Bother Cc1cc(O)c(C2=NCCS[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(=O)o1 ZINC000005276972 FG Annotated Bother COc1c2ccoc2nc2c(OC)c(OC[C@H](O)C(C)(C)OC)ccc12 ZINC000005380176 FG Annotated Anodyne N#CCC[P+](CCC#N)(CCC#N)CCN1C(=O)c2ccccc2C1=O ZINC000005411971 FG Annotated Mild Cc1ccc(N2NC(=O)/C(=C/c3cc4c(cc3Cl)OCO4)C2=O)cc1C ZINC000005417247 FG Annotated Clean CCn1c(O)c(/C=N/N=C2CCCC2)c2ccc(C3=NNC(=O)CC3)cc21 ZINC000005432330 FG Annotated Mild COc1ccc(/C=C2/N=C(c3ccc(Br)cc3)NC2=O)cc1 ZINC000005432879 FG Annotated Anodyne COC(=O)c1c(NC(=O)[C@@H]2[C@@H]3C=C[C@@H](CC3)[C@H]2C(=O)O)sc(C)c1C ZINC000005440993 FG Annotated Anodyne COc1cccc([C@@H]2CC(c3c(O)cc(C)oc3=O)=NCCS2)c1O ZINC000005441506 FG Annotated Anodyne COc1cccc([C@H]2CC(c3c(O)cc(C)oc3=O)=NCCS2)c1O ZINC000005441596 FG Annotated Anodyne CCOc1ncn(-c2ccc(NC(=S)Nc3cccc(O)c3)cc2)n1 ZINC000005499923 FG Annotated Anodyne C=C[C@]1(C)C[C@@H](OC(=O)/C=C(\C)CC)[C@H]2C(=C)C(=O)O[C@@H]2[C@H]1C(=C)C(=O)O ZINC000523041428 FG Annotated Mild CC(=O)N[C@@H](C)c1nc2ccccc2n1CC(=O)N1[C@@H](C)CCC[C@@H]1C ZINC000052715817 FG Annotated Anodyne Cc1ccc(C2=CCc3ccccc3N=C2N2CCN(CCO)CC2)cc1 ZINC000053046093 FG Annotated Anodyne OCCN1CCN(C2=Nc3ccc(F)cc3CC=C2c2ccccc2)CC1 ZINC000053064449 FG Annotated Anodyne Cn1/c(=N/NC(=O)OC(C)(C)C)sc2cc(OC(F)(F)F)ccc21 ZINC000053184547 FG Annotated Reactive Cn1/c(=N/NC(=O)c2ccccc2)sc2cc(OC(F)(F)F)ccc21 ZINC000053184706 FG Annotated Reactive O=C1N(c2ccccc2)C[C@@H]2C[C@@H](c3ccc4nonc4c3)N3CCC[C@@]123 ZINC000053193451 FG Annotated Anodyne C=C1C[C@@]2(C(=O)Nc3ccc(Br)cc3F)C=C[C@@H](O)[C@@H]1C2 ZINC000053229237 FG Annotated Mild COC(=O)c1c(C(=O)OC)c2c3ccccc3ccn2c1C(=O)C1CC1 ZINC000053242780 FG Annotated Anodyne Cc1c(O)ccc2cc(-n3cc(-c4ccc(F)cc4F)nn3)c(=O)oc12 ZINC000053243074 FG Annotated Anodyne Cc1c(O)ccc2cc(-n3cc(-c4ccc(N(C)C)cc4)nn3)c(=O)oc12 ZINC000053243076 FG Annotated Anodyne Nc1nc(N)c2c(n1)N[C@H](c1ccccc1)[C@@H]1CCc3ccccc3C1=N2 ZINC000053246995 FG Annotated Anodyne Nc1nc(N)c2c(n1)N[C@@H](c1ccccc1)[C@@H]1CCc3ccccc3C1=N2 ZINC000053246998 FG Annotated Anodyne Nc1nc(N)c2c(n1)N[C@H](c1ccccc1)[C@H]1CCc3ccccc3C1=N2 ZINC000053246999 FG Annotated Anodyne Nc1nc(N)c2c(n1)N[C@@H](c1ccccc1)[C@H]1CCc3ccccc3C1=N2 ZINC000053247002 FG Annotated Anodyne CO[C@H]1Cc2c(cnn2-c2ccccc2)C2(CCN(CC(C)C)CC2)O1 ZINC000053293627 FG Annotated Anodyne O=C(NCc1ccccc1O)c1cc(C(=O)c2ccc(F)cc2F)c[nH]1 ZINC000053294850 FG Annotated Clean CC(=O)Oc1ccc2cc(-n3cc(-c4ccccc4)nn3)c(=O)oc2c1C ZINC000053296241 FG Annotated Anodyne CC(=O)N[C@@H](C)c1nc2ccccc2n1CC(=O)N1[C@@H](C)CCC[C@H]1C ZINC000053391288 FG Annotated Anodyne CCOC(=O)/C(=N\Nc1cc(Cl)ccc1Cl)N1C[C@H](C)O[C@H](C)C1 ZINC000005525027 FG Annotated Mild CCOC(=O)/C(=N\Nc1cc(Cl)ccc1Cl)N1C[C@@H](C)O[C@H](C)C1 ZINC000005525030 FG Annotated Mild CCOC(=O)/C(=N\Nc1cc(Cl)ccc1Cl)N1C[C@H](C)O[C@@H](C)C1 ZINC000005525033 FG Annotated Mild C[C@H]1C[C@@H](C)C[C@@H]([C@@H]2C[C@H](CC(=O)NC3CCCCC3)CC(=O)O2)[C@H]1O ZINC000005539500 FG Annotated Anodyne O=C(COC(=O)c1cccc2c(=O)c3ccccc3[nH]c12)Nc1ccccc1 ZINC000005546114 FG Annotated Bother COC(=O)Cc1ccc2c(c1)Sc1ccc(CC(=O)OC)cc1N2C ZINC000005549798 FG Annotated Anodyne Cc1c(C(=O)/C=C/c2ccc(N(C)C)cc2)c(=O)n(-c2ccccc2)n1C ZINC000005551985 FG Annotated Mild CN(C)c1ccc([C@@H]2[C@@H]3C=C[C@@H](C3)[C@@]2(C#N)C(=O)O)c(Br)c1 ZINC000005569580 FG Annotated Mild CN(C)c1ccc([C@H]2[C@@H]3C=C[C@@H](C3)[C@@]2(C#N)C(=O)O)c(Br)c1 ZINC000005569583 FG Annotated Mild C=CCN1C(=O)[C@@H](Cc2ccc(OC)cc2)S/C1=N\N=C\c1ccco1 ZINC000005578476 FG Annotated Mild O=C(O)c1ccc(/N=N/c2cc(S(=O)(=O)O)c3cccnc3c2O)cc1 ZINC000005581333 FG Annotated Clean COc1ccc2nc3c([N+](=O)[O-])ccc4c3c(ncn4CCN(C)C)c2c1 ZINC000005581637 FG Annotated Bother Cc1c2c(OC[C@@H]3CCCCO3)nn(C)c(=O)c2c(C)n1-c1ccccc1 ZINC000005596678 FG Annotated Anodyne CN(C)c1ccc(/C=c2/c3ccccc3n3c2c2c([n+]3C)CCCC2)cc1 ZINC000005597202 FG Annotated Clean CC[C@H]1OC(=O)[C@H](C)C(=O)/C(C)=C/[C@@H](C)C[C@@H](C)C(=O)/C=C/[C@]1(C)O ZINC000005599141 FG Annotated Mild CN[C@@H]1c2cc(C(C)C)c(O)c(O)c2[C@@]23CCCC(C)(C)[C@@H]2[C@@H]1OC3=O ZINC000005649043 FG Annotated Clean C/C(=N\N=c1/sc2ccccc2n1C)c1ccc(N2CCOCC2)cc1 ZINC000005658166 FG Annotated Mild CC(=O)OC[C@H](Br)[C@]1(C)CC[C@H](C(C)(C)Br)O1 ZINC000005664082 FG Annotated Unstable CC(=O)OC[C@H](Br)[C@@]1(C)CC[C@H](C(C)(C)Br)O1 ZINC000005664088 FG Annotated Unstable CC(C)(C)OC(=O)[C@@H]1CCC/C1=N/Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000005714481 FG Annotated Mild CC(C)(C)OC(=O)[C@H]1CCC/C1=N/Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000005714487 FG Annotated Mild CC(C)(C)c1cc([C@@H](CO)OCCOCCO)cc(C(C)(C)C)c1O ZINC000005714780 FG Annotated Anodyne O=C(Cc1nccc2c1[nH]c1ccccc12)O[C@@H]1C#CCSCC#C/C=C\1 ZINC000005742115 FG Annotated Mild Cc1cccc(C)c1N/C(O)=C1\C(=O)c2sccc2N(C)S1(=O)=O ZINC000005752410 FG Annotated Mild C/C(=N\NC(=O)COc1ccc(C#N)cc1)c1ccccc1OC(F)F ZINC000005752812 FG Annotated Reactive COC1(OC)C[C@H]2CCCCC2=C(C)N1S(=O)(=O)c1ccccc1 ZINC000005757558 FG Annotated Anodyne C=C1CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1C[C@@]12O[C@@H]1[C@H](O)C(CO)=CC2=O ZINC000005762285 FG Annotated Mild Cc1cc2c(s1)CC[C@@H](CN[C@@H]1CC[C@@H](Oc3ccccc3)[C@@H]1O)C2=O ZINC000005765273 FG Annotated Anodyne in-man CCCCNC(=S)Nn1c(-c2ccccc2)nc2ccccc2c1=O ZINC000005782091 FG Annotated Anodyne CCCO/[S@](=N\S(=O)(=O)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000005785154 FG Annotated Bother CSc1nc(NC(C)C)c2c(n1)Sc1nc3ccccc3n1[C@@H]2O ZINC000005800897 FG Annotated Anodyne O=C(O)/C=C/C(=O)N1C/C(=C\c2ccccc2)C(=O)/C(=C/c2ccccc2)C1 ZINC000005808420 FG Annotated Mild N=C(N)N/N=C(/C[C@@H]1OC(=O)c2ccccc21)c1ccc2ccccc2c1 ZINC000005810481 FG Annotated Mild N#CCc1ccccc1/C(C#N)=C1/OC(=N)[C@H](c2ccccc2CC#N)C1=O ZINC000005810605 FG Annotated Reactive N#CCc1ccccc1/C(C#N)=C1/OC(=N)[C@@H](c2ccccc2CC#N)C1=O ZINC000005810607 FG Annotated Reactive N#CCc1ccc(/C(C#N)=C2/OC(=N)[C@@H](c3ccc(CC#N)cc3)C2=O)cc1 ZINC000005810639 FG Annotated Reactive Cc1ccc(N/C(S)=C2\C(=O)c3sccc3N(C)S2(=O)=O)cc1 ZINC000005812469 FG Annotated Mild C[C@@]1(C(=O)Nc2ccc3ccccc3c2)C[C@]2(C)C[C@](C)(C1)[C@@H](O)NC2=O ZINC000005813164 FG Annotated Anodyne C[C@@]1(C(=O)Nc2ccc3ccccc3c2)C[C@@]2(C)C[C@@](C)(C1)[C@@H](O)NC2=O ZINC000005813166 FG Annotated Anodyne Cc1ccccc1N/C(S)=C1\C(=O)c2sccc2N(C)S1(=O)=O ZINC000005813330 FG Annotated Mild C/C=C/[C@@H]1C=C[C@@H]2C[C@H](C)CC[C@H]2[C@]1(C)C(=O)C1=C(O)[C@H](CO)N(C)C1=O ZINC000005833428 FG Annotated Mild CCC(=O)c1ccc(F)c([C@@H]2C[C@H]2NC(=O)Nc2ccc(C#N)cn2)c1O ZINC000005836983 FG Annotated Mild CCC(=O)c1ccc(F)c([C@H]2C[C@@H]2NC(=O)Nc2ccc(C#N)cn2)c1O ZINC000005837000 FG Annotated Mild Cc1ccc(C(=O)C2=CN=C3C(=O)N(c4ccccc4)N(C)[C@]3(C)C2=N)cc1 ZINC000005837767 FG Annotated Mild CCN1c2ncc(CCc3ccccn3)cc2C(=O)N(C)c2cccnc21 ZINC000005842319 FG Annotated Anodyne CCN1c2ncc(CCc3cccnc3)cc2C(=O)N(C)c2cccnc21 ZINC000005842320 FG Annotated Anodyne CCN1c2ncc(CCc3ccncc3)cc2C(=O)N(C)c2cccnc21 ZINC000005842332 FG Annotated Anodyne CCN1c2ncc(CCc3nccs3)cc2C(=O)N(C)c2cccnc21 ZINC000005842352 FG Annotated Anodyne CCN1c2ncc(COc3ccncc3)cc2C(=O)N(C)c2cccnc21 ZINC000005842374 FG Annotated Anodyne C=C(C(=O)O)[C@@H]1C[C@@H]2O[C@H]1[C@@H](O)[C@@H](C)CCC/C(C)=C/CC[C@@]2(C)O ZINC000005845237 FG Annotated Mild COC(=O)[C@@H]1CC=C(SC(=O)c2ccccc2)N1C(=O)c1ccccc1 ZINC000005850974 FG Annotated Anodyne CC(=O)Nc1sc([N+](=O)[O-])cc1S(=O)(=O)c1ccc(Cl)cc1 ZINC000005856497 FG Annotated Bother CC(C)(C)C(=O)OC[C@@H]1C=C(c2ccc(Br)cc2)C(=O)O1 ZINC000005884980 FG Annotated Anodyne CC(C)(C)C(=O)OC[C@H]1C=C(c2ccc(Br)cc2)C(=O)O1 ZINC000005885017 FG Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cc(Br)cs1 ZINC000005885977 FG Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(Br)c1 ZINC000005886022 FG Annotated Anodyne C[C@]12CCC3(OCCO3)C(OC(=O)c3ccccc3)=C1CCC21OCCO1 ZINC000005886824 FG Annotated Anodyne Cc1c(C#N)c2nc3ccccc3n2c(=O)/c1=C/Nc1ccc(Cl)cc1 ZINC000005890849 FG Annotated Mild Cc1nc(N[C@@H]2CCc3ccccc32)nc(-n2ccnc2C)c1[N+](=O)[O-] ZINC000005891217 FG Annotated Bother Cc1nc(N[C@H]2CCc3ccccc32)nc(-n2ccnc2C)c1[N+](=O)[O-] ZINC000005891246 FG Annotated Bother Cc1[nH]c(=O)nc2s/c(=N/C3CCCCC3)n(C3CCCCC3)c(=O)c12 ZINC000005891680 FG Annotated Anodyne CCOc1ccc2c(c1)=C(c1ccccc1)NN=C(c1ccc(C)cc1)N=2 ZINC000005905861 FG Annotated Anodyne CC[C@H](C)C(=O)O[C@H]1C[C@@]2(C)O[C@]23C[C@@H]2[C@H](C)C(=O)O[C@@H]2C[C@@H](C)[C@H]13 ZINC000005924528 FG Annotated Anodyne Cc1c(Sc2ccccc2)n(C/C=C/c2cccnc2)c(=O)[nH]c1=O ZINC000005930278 FG Annotated Anodyne O=c1nc(-c2cccs2)[nH]c2ccc(I)cc12 ZINC000005933604 FG Annotated Anodyne O=C1Nc2ccc(Cl)cc2[C@@](C#Cc2cc([N+](=O)[O-])ccn2)(C2CC2)N1 ZINC000005933638 FG Annotated Mild O=C1Nc2ccc(Cl)cc2[C@](C#Cc2cc([N+](=O)[O-])ccn2)(C2CC2)N1 ZINC000005933642 FG Annotated Mild O=S1(=O)c2cnccc2N=C(NCc2ccccc2)N1c1ccccc1 ZINC000005934201 FG Annotated Anodyne O=S(=O)(c1ccccc1)n1c([C@H](O)c2ccncc2)cc2ccccc21 ZINC000005939150 FG Annotated Anodyne O=S(=O)(c1ccccc1)n1c([C@@H](O)c2ccncc2)cc2ccccc21 ZINC000005939151 FG Annotated Anodyne COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H](CCC(=O)C(C)C)[C@]3(C=O)O[C@@H]3C[C@H]21 ZINC000005962465 FG Annotated Mild CC(C)C[C@@H]1[C@H](O)[C@@H](O)[C@@H](CC(C)C)N(CC2CC2)C(=O)N1CC1CC1 ZINC000005962804 FG Annotated Anodyne Cn1cc(CN2CCOc3ccc([C@H](O)C4CCCCC4)cc3C2)cn1 ZINC000055036544 FG Annotated Anodyne Cn1cc(CN2CCOc3ccc([C@@H](O)C4CCCCC4)cc3C2)cn1 ZINC000055036546 FG Annotated Anodyne COc1cccc(N2CCN(Cc3nc(-c4ccco4)oc3C)CC2=O)c1 ZINC000055074794 FG Annotated Anodyne COc1ccc(-c2n[nH]cc2CN(C)[C@@H](C)c2ccncn2)c(OC)c1 ZINC000055168030 FG Annotated Anodyne COc1ccc(-c2n[nH]cc2CN(C)[C@H](C)c2ccncn2)c(OC)c1 ZINC000055168031 FG Annotated Anodyne Cc1oc(-c2cc(F)ccc2F)nc1CN1CCN(c2cnccn2)CC1 ZINC000055328018 FG Annotated Anodyne CC(C)CN1CCN(Cc2ccc(Cl)cc2Cl)[C@H](C2=NCCN2)C1 ZINC000055884264 FG Annotated Anodyne CN1CC[C@]2([C@]34CCN(C)[C@H]3Nc3ccccc34)c3ccccc3N(C)[C@H]12 ZINC000056871294 FG Annotated Anodyne in-man endogenous CC1=Nc2nc(-c3cccc(C)c3)nn2[C@H](c2cccs2)[C@@H]1C(N)=O ZINC000056913737 FG Annotated Anodyne CC1=Nc2nc(-c3cccc(C)c3)nn2[C@@H](c2cccs2)[C@@H]1C(N)=O ZINC000056913739 FG Annotated Anodyne COc1ccc(N2C(=O)[C@H]3CCCN3[C@H]2c2cccc(OC)c2OC)cc1 ZINC000057011026 FG Annotated Anodyne COc1ccc(N2C(=O)[C@H]3CCCN3[C@@H]2c2cccc(OC)c2OC)cc1 ZINC000057011027 FG Annotated Anodyne Cc1cccn2cc(CN(Cc3nc4ccccc4c(=O)[nH]3)C(C)C)nc12 ZINC000057570800 FG Annotated Anodyne CCN1CCN(C(=O)c2nc(-c3cccc(F)c3)n3c2CCCCC3)CC1 ZINC000057994720 FG Annotated Anodyne CCN1CCN(C(=O)c2cc3cc4ccc(OC)cc4nc3s2)CC1 ZINC000058024230 FG Annotated Anodyne COc1cccc(N2C(=O)[C@H]3CCCN3[C@H]2c2ccc(N(C)C)cc2)c1 ZINC000058046055 FG Annotated Clean COc1cccc(N2C(=O)[C@H]3CCCN3[C@@H]2c2ccc(N(C)C)cc2)c1 ZINC000058046062 FG Annotated Clean Cc1cc(N2C(=O)[C@H]3CCCN3[C@H]2c2cccc(Br)c2)no1 ZINC000058047687 FG Annotated Anodyne Cc1cc(N2C(=O)[C@H]3CCCN3[C@@H]2c2cccc(Br)c2)no1 ZINC000058047690 FG Annotated Anodyne O[C@@H]1CCCC[C@@H]1N1CCC(C2CCN([C@@H]3CCCC[C@H]3O)CC2)CC1 ZINC000058485803 FG Annotated Anodyne O=C(O)CCC1=C(c2ccccc2)NC(=S)N[C@H]1c1ccccc1O ZINC000058487818 FG Annotated Clean CC(C)CN1CCN(Cc2ccc(Cl)cc2Cl)[C@@H](C2=NCCN2)C1 ZINC000058496095 FG Annotated Anodyne C[C@H]1C(=O)S[C@@](C)(Cc2ccc(I)cc2)C1=O ZINC000058498090 FG Annotated Anodyne C=C[C@@H]1CN2CC[C@H]1C[C@H]2[C@H](c1ccnc2ccccc12)S(=O)(=O)O ZINC000058499052 FG Annotated Anodyne COC(=O)/C(C#N)=C1\SCC(=O)N1c1ccc(-c2ccccc2)cc1F ZINC000584904662 FG Annotated Reactive Nc1ncc(-c2cnc(C3CCNCC3)s2)cc1OCc1ccncc1 ZINC000584904715 FG Annotated Clean O=C(/C=C/N1[C@H]2CC[C@@H]1c1ncnc(NC3CC3)c1C2)c1ccccc1O ZINC000584904883 FG Annotated Mild Clc1cc(Cl)cc(CNCCCN=c2[nH]c3cccnc3[nH]2)c1 ZINC000584904923 FG Annotated Anodyne Fc1ccc2[nH]c(=NCCCNCc3cc(Cl)cc(Cl)c3)[nH]c2n1 ZINC000584905008 FG Annotated Anodyne Oc1ccc(-c2nc3ccc(O)cn3c2I)cc1 ZINC000584905036 FG Annotated Anodyne C[C@H](NC(=O)n1[nH]c(=N)nc1Nc1ccc(Cl)cc1)c1ccccc1 ZINC000584905070 FG Annotated Anodyne COC(=O)CC(=O)NCCCNCc1ccc(-c2ccccc2)c(Cl)c1 ZINC000584905140 FG Annotated Anodyne CN(O)C(=O)C[C@@H](CCCc1cccc2ccccc12)CP(=O)(O)O ZINC000584905590 FG Annotated Anodyne CCc1ccccc1NC(=O)CCN1CCN2Cc3ccccc3C[C@H]2C1 ZINC000058500213 FG Annotated Anodyne COc1ccc(-n2nc(C)n(CCSc3ccc(F)cc3)c2=O)cc1 ZINC000058506244 FG Annotated Anodyne C[C@@H](CO)CCc1cc2c(cc1O)OC[C@@H]1c3cc4c(cc3O[C@@H]21)OCO4 ZINC000058509452 FG Annotated Anodyne C/C=C1/C[N+]2([O-])[C@H]3C[C@@H]1[C@@H]1[C@H](OC(C)=O)[C@@]4(C[C@@H]12)C3=Nc1ccccc14 ZINC000058511738 FG Annotated Bother COc1ccc(-n2nc(C)n(CCSc3cccc(OC)c3)c2=O)cc1 ZINC000058512073 FG Annotated Anodyne CN1CC[C@@]2(CCCCC2=O)[C@@]12C(=O)Nc1ccc(Br)cc12 ZINC000058534230 FG Annotated Anodyne Nc1nc2c(s1)[C@@H]1CCC[C@H](C2)N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000058538171 FG Annotated Anodyne COc1ccc(Nc2c(C#N)c(F)c3c(N)nc(N)nc3c2Cl)cc1 ZINC000058538273 FG Annotated Mild COc1cc(NS(C)(=O)=O)ccc1Nc1nc2ccc(N)cc2s1 ZINC000058538280 FG Annotated Anodyne O=C1NC(CCCN2CC=C(c3ccccc3)CC2)=N[C@@H]2CCSC[C@@H]12 ZINC000058550492 FG Annotated Anodyne CC(=O)O[C@@H]1[C@H](C)C[C@H]2[C@H]3[C@@H]1[C@H]1CC(=O)CCC[C@](C)(OC[C@@H]2C)[C@@H]3O1 ZINC000058566834 FG Annotated Anodyne CC(C)CN(NC(=O)OC(C)(C)C)c1nc(C#N)ncc1Br ZINC000058568559 FG Annotated Reactive O=C(/C=C/c1cccnc1)N1CCc2c(Cl)c(O)c(O)c(Cl)c2C1 ZINC000058580950 FG Annotated Clean CC(C)CN(NC(=O)OC(C)(C)C)c1nc(C#N)ncc1C(F)(F)F ZINC000058581794 FG Annotated Reactive CC[C@@H](CC(=O)NCC1CCOCC1)n1c(N)nc2cc(Cl)ccc21 ZINC000058583441 FG Annotated Anodyne CC[C@@H](CC(=O)NCc1ccccn1)n1c(N)nc2cc(Cl)ccc21 ZINC000058583443 FG Annotated Anodyne CCC(=O)N1[C@@H]2CC[C@@H]3[C@H]1CC[C@H]2N3C/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000058584144 FG Annotated Bother CCc1nc2c(C#N)c(C)c(-c3ccccc3)c(N3CC[C@H](N(C)C)C3)n2n1 ZINC000058590567 FG Annotated Mild COc1ccc(-n2nc(C)n(CCSc3ccccc3F)c2=O)cc1 ZINC000058591334 FG Annotated Anodyne O=C(c1cn2c3c(cccc13)OC[C@H]2C1CCCCC1)N1CCNCC1 ZINC000058599979 FG Annotated Anodyne COc1ccc(-n2nc(C)n(CCSc3cccc(F)c3)c2=O)cc1 ZINC000058603502 FG Annotated Anodyne CCCC#CC#CC#CCCCCC[C@@H]1O[C@](C)(OC)[C@@](C)(OC)OC1=O ZINC000058603515 FG Annotated Mild CCOc1ccc(Nc2c(C)c(N[C@H]3CCCNC3)nc3ccnn23)cc1 ZINC000058633578 FG Annotated Anodyne O=C/C1=C\CCOC(=O)c2c(O)cc(O)c(Cl)c2CC(=O)CCCC1 ZINC000058639168 FG Annotated Reactive Cc1n[nH]c(-c2ccco2)c1CCCCN(C)c1ncnc2[nH]cnc12 ZINC000058650871 FG Annotated Anodyne Cc1nc2c(C#N)c(C)c(-c3ccccc3)c(N3CC[C@H](N(C)C)C3)n2n1 ZINC000058662318 FG Annotated Mild C=CCN1CC[C@@H]2c3cccc(OS(=O)(=O)C(F)(F)F)c3CC[C@H]21 ZINC000058677889 FG Annotated Unstable O=C1CCC(c2ccccc2)(c2nc3cc4c(cc3[nH]2)OCC(=O)N4)CC1 ZINC000586877856 FG Annotated Anodyne O=C1CCC(c2ccccc2)(c2nc3c(S)nc(S)nc3[nH]2)CC1 ZINC000586877978 FG Annotated Anodyne O=C1CCC(c2ccccc2)(c2nc3ccc(S(=O)(=O)O)cc3[nH]2)CC1 ZINC000586877984 FG Annotated Anodyne COC(=O)c1cc2[nH]c(-c3ccccc3/C=C/C(=O)O)nc2cc1OC ZINC000586878174 FG Annotated Anodyne COC(=O)c1cc2[nH]c(-c3ccccc3/C=C\C(=O)O)nc2cc1OC ZINC000586878175 FG Annotated Anodyne COC(=O)c1ccc2nc(/C=C/c3ccccc3C(=O)O)[nH]c2c1OC ZINC000586878717 FG Annotated Anodyne COC(=O)c1ccc2nc(/C=C\c3ccccc3C(=O)O)[nH]c2c1OC ZINC000586878724 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3ccccc3/C=C/C(=O)O)[nH]c2c1 ZINC000586879707 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3ccccc3/C=C\C(=O)O)[nH]c2c1 ZINC000586879714 FG Annotated Anodyne CC1=C(c2ccc3nc(/C=C\c4ccccc4C(=O)O)[nH]c3c2)NNC(=O)C1 ZINC000586879783 FG Annotated Anodyne CC1=C(c2ccc3nc(/C=C/c4ccccc4C(=O)O)[nH]c3c2)NNC(=O)C1 ZINC000586879788 FG Annotated Anodyne O=C(O)c1ccccc1/C=C/c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000586879855 FG Annotated Anodyne O=C(O)c1ccccc1/C=C\c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000586879862 FG Annotated Anodyne Cc1cc(-c2nc3c(O)nc(O)nc3[nH]2)ccc1-c1ccc(C(=O)O)cc1 ZINC000586880066 FG Annotated Anodyne CC(=O)C(C(C)=O)c1ccccc1-c1nc2cc(F)cc(C(=O)O)c2[nH]1 ZINC000586880741 FG Annotated Anodyne CC(=O)C(C(C)=O)c1ccccc1-c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000586880767 FG Annotated Anodyne CC(=O)C(C(C)=O)c1ccccc1-c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000586880782 FG Annotated Anodyne COC(=O)c1cccc2nc(-c3ccccc3C(C(C)=O)C(C)=O)[nH]c12 ZINC000586880910 FG Annotated Anodyne O=C(O)/C=C/c1ccccc1-c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000586881145 FG Annotated Anodyne O=C(O)/C=C\c1ccccc1-c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000586881158 FG Annotated Anodyne O=C(O)c1ccccc1/C=C/c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000586881299 FG Annotated Bother O=C(O)c1ccccc1/C=C\c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000586881301 FG Annotated Bother O=C(O)/C=C/c1ccccc1-c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000586881348 FG Annotated Bother O=C(O)/C=C\c1ccccc1-c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000586881349 FG Annotated Bother COC(=O)c1ccc2nc(-c3ccccc3/C=C/C(=O)O)[nH]c2c1OC ZINC000586881355 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3ccccc3/C=C\C(=O)O)[nH]c2c1OC ZINC000586881356 FG Annotated Anodyne CC1=C(c2ccc3nc(-c4ccccc4/C=C\C(=O)O)[nH]c3c2)NNC(=O)C1 ZINC000586881361 FG Annotated Anodyne CC1=C(c2ccc3nc(-c4ccccc4/C=C/C(=O)O)[nH]c3c2)NNC(=O)C1 ZINC000586881522 FG Annotated Anodyne COC(=O)c1cc2[nH]c(/C=C/c3ccccc3C(=O)O)nc2cc1OC ZINC000586881542 FG Annotated Anodyne COC(=O)c1cc2[nH]c(/C=C\c3ccccc3C(=O)O)nc2cc1OC ZINC000586881543 FG Annotated Anodyne CC(=O)C(C(C)=O)c1ccccc1-c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000586882184 FG Annotated Anodyne CC(=O)C(C(C)=O)c1ccccc1-c1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000586882354 FG Annotated Anodyne CC(=O)C(C(C)=O)c1ccccc1-c1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000586882355 FG Annotated Anodyne CC(=O)C(C(C)=O)c1ccccc1-c1nc2cc(Cl)nc(C#N)c2[nH]1 ZINC000586882386 FG Annotated Mild COC(=O)c1ccc2nc(-c3ccccc3C(C(C)=O)C(C)=O)[nH]c2c1 ZINC000586882458 FG Annotated Anodyne Cc1ccc(C)c(C(=O)c2ccccc2-c2nc3c(O)nc(O)nc3[nH]2)c1 ZINC000586882541 FG Annotated Anodyne O=C1[C@H]2CC=C[C@H]1C[C@H](c1nc3ccc(CN4CCOCC4)cc3[nH]1)C2 ZINC000586883552 FG Annotated Anodyne O=C1[C@H]2CC=C[C@H]1C[C@@H](c1nc3ccc(CN4CCOCC4)cc3[nH]1)C2 ZINC000586883553 FG Annotated Anodyne O=C1CCC[C@@H](c2nc3cc(I)cnc3[nH]2)CC1 ZINC000586884298 FG Annotated Anodyne O=C1CCC[C@H](c2nc3cc(I)cnc3[nH]2)CC1 ZINC000586884300 FG Annotated Anodyne O=C1CCC[C@@H](c2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)CC1 ZINC000586884466 FG Annotated Anodyne O=C1CCC[C@H](c2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)CC1 ZINC000586884490 FG Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@@H]3CCCC(=O)CC3)[nH]c2c1 ZINC000586884861 FG Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@H]3CCCC(=O)CC3)[nH]c2c1 ZINC000586884868 FG Annotated Anodyne O=C1CCC[C@@H](c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)CC1 ZINC000586885355 FG Annotated Anodyne O=C1CCC[C@H](c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)CC1 ZINC000586885356 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc([C@H]3C[C@@]34CCc3ccccc34)[nH]c12 ZINC000586885514 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc([C@@H]3C[C@@]34CCc3ccccc34)[nH]c12 ZINC000586885515 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc([C@H]3C[C@]34CCc3ccccc34)[nH]c12 ZINC000586885564 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc([C@@H]3C[C@]34CCc3ccccc34)[nH]c12 ZINC000586885565 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc([C@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)[nH]c2c1 ZINC000586886446 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc([C@@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)[nH]c2c1 ZINC000586886453 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc([C@]34CCC[C@H]3[C@H]3CC[C@H]4C3)[nH]c2c1 ZINC000586886454 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc([C@@]34CCC[C@H]3[C@H]3CC[C@H]4C3)[nH]c2c1 ZINC000586886459 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc([C@@H]3C[C@]34CCc3ccccc34)[nH]c2c1 ZINC000586888524 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc([C@@H]3C[C@@]34CCc3ccccc34)[nH]c2c1 ZINC000586888528 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc([C@H]3C[C@@]34CCc3ccccc34)[nH]c2c1 ZINC000586888532 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc([C@H]3C[C@]34CCc3ccccc34)[nH]c2c1 ZINC000586888533 FG Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c([C@@](C)(O)C(C)C)nc2c1 ZINC000586888718 FG Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c([C@](C)(O)C(C)C)nc2c1 ZINC000586888722 FG Annotated Anodyne O=C1[C@H]2CC=C[C@H]1C[C@H](c1nc3c(F)cnc(Br)c3[nH]1)C2 ZINC000586888788 FG Annotated Anodyne O=C1[C@H]2CC=C[C@H]1C[C@@H](c1nc3c(F)cnc(Br)c3[nH]1)C2 ZINC000586888790 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc([C@@H]3CCCC(=O)CC3)[nH]c2c1 ZINC000586888997 FG Annotated Anodyne O=C1c2ccccc2C(=O)c2c1ccc1nc([C@@H](O)c3cccc(O)c3)[nH]c21 ZINC000586889001 FG Annotated Clean CCN(CC)S(=O)(=O)c1ccc2nc([C@H]3CCCC(=O)CC3)[nH]c2c1 ZINC000586889003 FG Annotated Anodyne O=C1c2ccccc2C(=O)c2c1ccc1nc([C@H](O)c3cccc(O)c3)[nH]c21 ZINC000586889024 FG Annotated Clean Oc1cccc([C@@H](O)c2nc3c(Cl)c(Br)cnc3[nH]2)c1 ZINC000586889185 FG Annotated Anodyne Oc1cccc([C@H](O)c2nc3c(Cl)c(Br)cnc3[nH]2)c1 ZINC000586889208 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc([C@]34CCC[C@H]3[C@H]3CC[C@H]4C3)[nH]c12 ZINC000586890908 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc([C@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)[nH]c12 ZINC000586890909 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc([C@@]34CCC[C@H]3[C@H]3CC[C@H]4C3)[nH]c12 ZINC000586890910 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc([C@@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)[nH]c12 ZINC000586890911 FG Annotated Anodyne CC(C)[C@@](C)(O)c1nc2c(I)cnc(Cl)c2[nH]1 ZINC000586891165 FG Annotated Anodyne CC(C)[C@](C)(O)c1nc2c(I)cnc(Cl)c2[nH]1 ZINC000586891170 FG Annotated Anodyne O=[N+]([O-])c1c(Br)ccc2nc([C@H](O)c3cccc(O)c3)[nH]c12 ZINC000586892464 FG Annotated Bother O=[N+]([O-])c1c(Br)ccc2nc([C@@H](O)c3cccc(O)c3)[nH]c12 ZINC000586892481 FG Annotated Bother Oc1cccc([C@@H](O)c2nc3c(Br)cnc(Cl)c3[nH]2)c1 ZINC000586893391 FG Annotated Anodyne Oc1cccc([C@H](O)c2nc3c(Br)cnc(Cl)c3[nH]2)c1 ZINC000586893393 FG Annotated Anodyne Oc1cccc([C@@H](O)c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c1 ZINC000586893415 FG Annotated Anodyne Oc1cccc([C@H](O)c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c1 ZINC000586893426 FG Annotated Anodyne CC(C)[C@@](C)(O)c1nc2c(Br)cnc(Br)c2[nH]1 ZINC000586893484 FG Annotated Anodyne CC(C)[C@](C)(O)c1nc2c(Br)cnc(Br)c2[nH]1 ZINC000586893486 FG Annotated Anodyne Oc1cccc([C@@H](O)c2nc3cc(Br)c(F)c(F)c3[nH]2)c1 ZINC000586893916 FG Annotated Anodyne Oc1cccc([C@H](O)c2nc3cc(Br)c(F)c(F)c3[nH]2)c1 ZINC000586893922 FG Annotated Anodyne O=[N+]([O-])c1cc(Br)cc2nc([C@H](O)c3cccc(O)c3)[nH]c12 ZINC000586894090 FG Annotated Bother O=[N+]([O-])c1cc(Br)cc2nc([C@@H](O)c3cccc(O)c3)[nH]c12 ZINC000586894091 FG Annotated Bother O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3cccc(CO)c3)[nH]c21 ZINC000586894670 FG Annotated Clean OCc1cccc(-c2nc3ccc(I)cc3[nH]2)c1 ZINC000586894934 FG Annotated Anodyne NS(=O)(=O)c1cccc2nc(CCCCCCCCCCCO)[nH]c12 ZINC000586894948 FG Annotated Anodyne N=c1[nH]c2nc(-c3cccc(-c4ccccc4CO)c3)nc-2c(Cl)[nH]1 ZINC000586894980 FG Annotated Anodyne OCc1cccc(-c2nc3cccc(I)c3[nH]2)c1 ZINC000586895010 FG Annotated Anodyne OCc1ccccc1-c1cccc(-c2nc3c(O)nc(S)nc3[nH]2)c1 ZINC000586895040 FG Annotated Anodyne OCC12CCC(c3nc4c(F)cnc(Br)c4[nH]3)(CC1)CC2 ZINC000586895236 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(-c3cccc(CO)c3)nc2c1 ZINC000586895261 FG Annotated Anodyne Oc1cccc(CCc2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)c1 ZINC000586895923 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(CCCCc3cccc(O)c3)[nH]c12 ZINC000586896263 FG Annotated Anodyne Oc1cccc(CCc2nc3cc(I)cnc3[nH]2)c1 ZINC000586896383 FG Annotated Anodyne CC1=C(c2ccc3nc(C4(c5ccccc5O)CC4)[nH]c3c2)NNC(=O)C1 ZINC000586896405 FG Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc(C3(c4ccccc4O)CC3)nc-2[nH]1 ZINC000586896658 FG Annotated Anodyne Oc1ccc(C2(c3nc4[nH]c(O)nc(NCc5ccccc5)c-4n3)CC2)cc1 ZINC000586898318 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(-c3ccc4c(c3O)CCCC4)[nH]c12 ZINC000586899034 FG Annotated Anodyne CC1=C(c2ccc3nc(C4(c5ccc(O)cc5)CC4)[nH]c3c2)NNC(=O)C1 ZINC000586899408 FG Annotated Anodyne NS(=O)(=O)c1cccc2nc(-c3ccccc3-c3ccc(O)cc3)[nH]c12 ZINC000586899494 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c([C@@H]3CC[C@H](O)CC3)nc2c1 ZINC000586899813 FG Annotated Anodyne CC(C)C[C@H](O)c1nc2c(I)cnc(Cl)c2[nH]1 ZINC000586900248 FG Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc([C@H](O)C(C)(C)CO)[nH]c3c2)cc1 ZINC000586900259 FG Annotated Anodyne NC(=O)c1cccc2nc(-c3ccoc3COc3ccc(C=O)cc3)[nH]c12 ZINC000586900409 FG Annotated Anodyne CC(C)(CO)[C@@H](O)c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000586900684 FG Annotated Anodyne CC(C)(CO)[C@@H](O)c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000586900686 FG Annotated Anodyne CC(C)(CO)[C@@H](O)c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000586901510 FG Annotated Anodyne N=c1[nH]c2nc(-c3ccoc3COc3ccc(C=O)cc3)nc-2c(Cl)[nH]1 ZINC000586901683 FG Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@@H]3C[C@H](O)c4ccccc43)nc-2[nH]1 ZINC000586901748 FG Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@H]3C[C@H](O)c4ccccc43)nc-2[nH]1 ZINC000586901750 FG Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@@H]3C[C@@H](O)c4ccccc43)nc-2[nH]1 ZINC000586901751 FG Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@H]3C[C@@H](O)c4ccccc43)nc-2[nH]1 ZINC000586901752 FG Annotated Anodyne CC(C)COc1cc2nc([C@H](O)C(C)(C)CO)[nH]c2cc1Br ZINC000586901796 FG Annotated Anodyne CC(C)(CO)[C@@H](O)c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000586902114 FG Annotated Anodyne CCOCc1ccc(-c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)o1 ZINC000586902529 FG Annotated Anodyne CCCOc1cc2nc([C@H](O)C(C)(C)CO)[nH]c2cc1Br ZINC000586902821 FG Annotated Anodyne CC(C)Oc1cc2nc([C@H](O)C(C)(C)CO)[nH]c2cc1Br ZINC000586903102 FG Annotated Anodyne CCOCc1ccc(-c2nc3cc(C4=C(C)CC(=O)NN4)ccc3[nH]2)o1 ZINC000586903340 FG Annotated Anodyne COC(=O)c1cc2[nH]c(-c3c(C)oc4c3C(=O)CCC4)nc2cc1OC ZINC000586903484 FG Annotated Anodyne Cc1c(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)oc2c1[C@H](O)CCC2 ZINC000586903581 FG Annotated Bother Cc1c(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)oc2c1[C@@H](O)CCC2 ZINC000586903588 FG Annotated Bother C(#Cc1cc(-c2nc3ccc(-n4cnnn4)cc3[nH]2)co1)c1ccccc1 ZINC000586903739 FG Annotated Mild COc1ccc(C=O)c2cc(-c3nc4cc5c(cc4[nH]3)NC(=O)CO5)oc12 ZINC000586903773 FG Annotated Anodyne CCOCc1ccc(-c2nc3ncc(I)cc3[nH]2)o1 ZINC000586904028 FG Annotated Anodyne COc1ccc(C=O)c2cc(-c3nc4cc(S(C)(=O)=O)ccc4[nH]3)oc12 ZINC000586904181 FG Annotated Anodyne Cc1oc2c(c1-c1nc3ccc(CN4CCOCC4)cc3[nH]1)C(=O)CCC2 ZINC000586904197 FG Annotated Anodyne Cc1oc2c(c1-c1nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]1)C(=O)CCC2 ZINC000586904224 FG Annotated Bother COc1ccc(C=O)c2cc(-c3nc4nc(Br)c[nH]c-4n3)oc12 ZINC000586904234 FG Annotated Anodyne COc1ccc(C=O)c2cc(-c3nc4c(S)nc(S)nc4[nH]3)oc12 ZINC000586904538 FG Annotated Anodyne COc1ccc(C=O)c2cc(-c3nc4cc(S(=O)(=O)O)ccc4[nH]3)oc12 ZINC000586904614 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3c(C)oc4c3C(=O)CCC4)[nH]c2c1OC ZINC000586904701 FG Annotated Anodyne COC(=O)c1cc2nc(-c3oc4c(c3C)[C@H](O)CCC4)[nH]c2cc1OC ZINC000586905012 FG Annotated Anodyne COC(=O)c1cc2nc(-c3oc4c(c3C)[C@@H](O)CCC4)[nH]c2cc1OC ZINC000586905014 FG Annotated Anodyne COC(=O)c1ccc2[nH]c(-c3oc4c(c3C)[C@H](O)CCC4)nc2c1OC ZINC000586905428 FG Annotated Anodyne COC(=O)c1ccc2[nH]c(-c3oc4c(c3C)[C@@H](O)CCC4)nc2c1OC ZINC000586905429 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc(-c3occ4c3CCC4)[nH]c2c1 ZINC000586905569 FG Annotated Anodyne Ic1cnc2[nH]c(-c3occ4c3CCC4)nc2c1 ZINC000586905573 FG Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc(-c3occ4c3CCC4)[nH]c2c1 ZINC000586905689 FG Annotated Anodyne O=C1OC(=O)c2cc(-c3nc4cc(F)cc(Br)c4[nH]3)ccc21 ZINC000586905968 FG Annotated Reactive CN(C)S(=O)(=O)c1cccc2nc(CCc3cc4ccccc4o3)[nH]c12 ZINC000586906292 FG Annotated Anodyne O=C1OC(=O)c2cc(-c3nc4ccc(Br)c(F)c4[nH]3)ccc21 ZINC000586906377 FG Annotated Reactive Nc1ccc(-c2ccc3nc(-c4ccc5c(c4)C(=O)OC5=O)[nH]c3c2)cc1N ZINC000586906378 FG Annotated Reactive CC1(C)OC(=O)C[C@H]1c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000586906531 FG Annotated Bother CC1(C)OC(=O)C[C@@H]1c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000586906533 FG Annotated Bother CC1(C)OC(=O)C[C@@H]1c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000586906816 FG Annotated Bother CC1(C)OC(=O)C[C@H]1c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000586906817 FG Annotated Bother O=C1OC(=O)c2cc(-c3nc4cc(Br)cc(F)c4[nH]3)ccc21 ZINC000586906935 FG Annotated Reactive N#Cc1cc(Br)c2[nH]c(-c3ccc4c(c3)C(=O)OC4=O)nc2c1 ZINC000586907030 FG Annotated Reactive CCOC(=O)Cc1ccc2nc(C[C@H]3CCc4occc4C3=O)[nH]c2c1 ZINC000586907082 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(C[C@@H]3CCc4occc4C3=O)[nH]c2c1 ZINC000586907088 FG Annotated Anodyne CC(C)COc1cc2nc(CC3OCCO3)[nH]c2cc1Br ZINC000586907114 FG Annotated Anodyne O=C1O/C(=C\c2nc3ccc(CN4CCOCC4)cc3[nH]2)c2ccccc21 ZINC000586907116 FG Annotated Anodyne O=C1O/C(=C/c2nc3ccc(CN4CCOCC4)cc3[nH]2)c2ccccc21 ZINC000586907117 FG Annotated Anodyne FC(F)(F)Oc1cc2nc(CC3OCCO3)[nH]c2cc1Br ZINC000586907143 FG Annotated Anodyne FC(F)(F)c1c(Br)ccc2nc(CC3OCCO3)[nH]c12 ZINC000586907146 FG Annotated Anodyne Cc1nc2[nH]c(-c3ccc4c(c3)C(=O)OC4=O)nc2cc1Br ZINC000586907300 FG Annotated Reactive FC(F)(F)c1cc(Br)c2[nH]c(CC3OCCO3)nc2c1 ZINC000586907363 FG Annotated Anodyne FC(F)(F)Oc1cc(Br)cc2nc(CC3OCCO3)[nH]c12 ZINC000586907468 FG Annotated Anodyne CC[C@@H]1OCCC[C@@H]1c1nc2[nH]c(O)nc(NCc3ccccc3)c-2n1 ZINC000586907509 FG Annotated Anodyne CC[C@@H]1OCCC[C@H]1c1nc2[nH]c(O)nc(NCc3ccccc3)c-2n1 ZINC000586907511 FG Annotated Anodyne CC[C@H]1OCCC[C@@H]1c1nc2[nH]c(O)nc(NCc3ccccc3)c-2n1 ZINC000586907513 FG Annotated Anodyne CC[C@H]1OCCC[C@H]1c1nc2[nH]c(O)nc(NCc3ccccc3)c-2n1 ZINC000586907515 FG Annotated Anodyne O=C1OC(=O)c2cc(-c3nc4ccc(F)c(Br)c4[nH]3)ccc21 ZINC000586907648 FG Annotated Reactive COC(=O)c1ccc(Oc2ccc3nc(CC4OCCO4)[nH]c3c2)cc1 ZINC000586908335 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(C3=Cc4cccc(O)c4OC3)[nH]c2cc1[N+](=O)[O-] ZINC000586908354 FG Annotated Bother COC(=O)c1ccc(Oc2ccc3nc(C[C@H]4COCCO4)[nH]c3c2)cc1 ZINC000586908380 FG Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc(C[C@@H]4COCCO4)[nH]c3c2)cc1 ZINC000586908381 FG Annotated Anodyne FC(F)(F)c1c(Br)ccc2nc(C[C@@H]3COCCO3)[nH]c12 ZINC000586908462 FG Annotated Anodyne FC(F)(F)c1c(Br)ccc2nc(C[C@H]3COCCO3)[nH]c12 ZINC000586908469 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc(CCc3cc4ccccc4o3)[nH]c2c1 ZINC000586908582 FG Annotated Anodyne Nc1cc2nc(CCCCCC#CCO[C@@H]3CCCCO3)[nH]c2cc1N ZINC000586908611 FG Annotated Mild Nc1cc2nc(CCCCCC#CCO[C@H]3CCCCO3)[nH]c2cc1N ZINC000586908615 FG Annotated Mild FC(F)(F)c1cc(Br)cc2nc(CC3OCCO3)[nH]c12 ZINC000586908626 FG Annotated Anodyne FC(F)(F)c1cc2nc(CC3OCCO3)[nH]c2cc1Br ZINC000586908681 FG Annotated Anodyne FC(F)(F)Oc1cc(Br)c2[nH]c(CC3OCCO3)nc2c1 ZINC000586908860 FG Annotated Anodyne O=C1OC(=O)c2cc(-c3nc4ccc(Br)c(O)c4[nH]3)ccc21 ZINC000586909099 FG Annotated Reactive FC(F)(F)c1cc(Br)cc2nc(C[C@@H]3COCCO3)[nH]c12 ZINC000586909118 FG Annotated Anodyne FC(F)(F)c1cc(Br)cc2nc(C[C@H]3COCCO3)[nH]c12 ZINC000586909119 FG Annotated Anodyne COC(=O)c1cc2nc(CC3OCCO3)[nH]c2c(F)c1Nc1ccccc1 ZINC000586909219 FG Annotated Anodyne O=C1c2ccoc2CC[C@@H]1Cc1nc2c(F)cnc(Br)c2[nH]1 ZINC000586909222 FG Annotated Anodyne O=C1c2ccoc2CC[C@H]1Cc1nc2c(F)cnc(Br)c2[nH]1 ZINC000586909223 FG Annotated Anodyne Brc1cc2nc(CC3OCCO3)[nH]c2cc1Br ZINC000586909292 FG Annotated Anodyne CCCCOc1cc2nc(CC3OCCO3)[nH]c2cc1Br ZINC000586909369 FG Annotated Anodyne Oc1cccc2c1OCC(c1nc3c(Br)ncc(F)c3[nH]1)=C2 ZINC000586909414 FG Annotated Anodyne O=C1c2ccoc2CC[C@@H]1Cc1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000586909673 FG Annotated Anodyne O=C1c2ccoc2CC[C@H]1Cc1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000586909674 FG Annotated Anodyne CC(C)COc1cc2nc(C[C@@H]3COCCO3)[nH]c2cc1Br ZINC000586909683 FG Annotated Anodyne CC(C)COc1cc2nc(C[C@H]3COCCO3)[nH]c2cc1Br ZINC000586909685 FG Annotated Anodyne CC(C)Oc1cc2nc(C[C@H]3COCCO3)[nH]c2cc1Br ZINC000586910094 FG Annotated Anodyne CC(C)Oc1cc2nc(C[C@@H]3COCCO3)[nH]c2cc1Br ZINC000586910095 FG Annotated Anodyne Brc1ccc(Br)c2[nH]c(CC3OCCO3)nc12 ZINC000586910238 FG Annotated Anodyne CC1(C)OC(=O)C[C@@H]1c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000586910322 FG Annotated Clean CC1(C)OC(=O)C[C@H]1c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000586910325 FG Annotated Clean FC(F)(F)c1cc2nc(C[C@@H]3COCCO3)[nH]c2cc1Br ZINC000586910513 FG Annotated Anodyne FC(F)(F)c1cc2nc(C[C@H]3COCCO3)[nH]c2cc1Br ZINC000586910514 FG Annotated Anodyne CCCOc1cc2nc(C[C@H]3COCCO3)[nH]c2cc1Br ZINC000586911047 FG Annotated Anodyne CCCOc1cc2nc(C[C@@H]3COCCO3)[nH]c2cc1Br ZINC000586911048 FG Annotated Anodyne CCCCOc1cc2nc(C[C@@H]3COCCO3)[nH]c2cc1Br ZINC000586911246 FG Annotated Anodyne CCCCOc1cc2nc(C[C@H]3COCCO3)[nH]c2cc1Br ZINC000586911250 FG Annotated Anodyne FC(F)(F)c1cc(Br)c2[nH]c(C[C@@H]3COCCO3)nc2c1 ZINC000586911278 FG Annotated Anodyne FC(F)(F)c1cc(Br)c2[nH]c(C[C@H]3COCCO3)nc2c1 ZINC000586911396 FG Annotated Anodyne CC[C@@H]1OCCC[C@H]1c1nc2ccc(S(=O)(=O)N(CC)CC)cc2[nH]1 ZINC000586911823 FG Annotated Anodyne CC[C@H]1OCCC[C@H]1c1nc2ccc(S(=O)(=O)N(CC)CC)cc2[nH]1 ZINC000586911824 FG Annotated Anodyne CC[C@H]1OCCC[C@@H]1c1nc2ccc(S(=O)(=O)N(CC)CC)cc2[nH]1 ZINC000586911825 FG Annotated Anodyne CC[C@@H]1OCCC[C@@H]1c1nc2ccc(S(=O)(=O)N(CC)CC)cc2[nH]1 ZINC000586911826 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(C3(c4ccc(O)cc4)CCOCC3)[nH]c2cc1F ZINC000586911939 FG Annotated Bother N[C@@H](N=O)c1ccc2nc(C3(c4ccc(O)cc4)CCOCC3)[nH]c2c1 ZINC000586911979 FG Annotated Anodyne N[C@H](N=O)c1ccc2nc(C3(c4ccc(O)cc4)CCOCC3)[nH]c2c1 ZINC000586911980 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc(C3(c4ccc(O)cc4)CCOCC3)[nH]c2c1 ZINC000586912022 FG Annotated Anodyne COc1ccc(NS(=O)(=O)c2ccc3nc(C4=COCC4)[nH]c3c2)cc1 ZINC000586912055 FG Annotated Anodyne COC(=O)c1ccc2nc(C3(c4ccc(O)cc4)CCOCC3)[nH]c2c1 ZINC000586912059 FG Annotated Anodyne O=C(O)c1cc2nc(C3(c4ccc(O)cc4)CCOCC3)[nH]c2cc1F ZINC000586912114 FG Annotated Anodyne COc1cc2nc(C3(c4ccc(O)cc4)CCOCC3)[nH]c2cc1OC ZINC000586912120 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(-c3cccc4c3OCC4(C)C)[nH]c12 ZINC000586912493 FG Annotated Anodyne COc1cc(OC)c2[nH]c(C3(c4ccc(O)cc4)CCOCC3)nc2c1 ZINC000586912534 FG Annotated Anodyne N#Cc1nc(Cl)cc2nc(C3(c4ccc(O)cc4)CCOCC3)[nH]c12 ZINC000586912570 FG Annotated Mild CC(C)COc1cc2nc(C3(O)CCOCC3)[nH]c2cc1Br ZINC000586912667 FG Annotated Anodyne CCCOc1cc2nc(C3(O)CCOCC3)[nH]c2cc1Br ZINC000586912825 FG Annotated Anodyne O=C(O)c1cc(F)cc2nc(C3(c4ccc(O)cc4)CCOCC3)[nH]c12 ZINC000586913043 FG Annotated Anodyne OC1(c2nc3cc(C(F)(F)F)c(Br)cc3[nH]2)CCOCC1 ZINC000586913099 FG Annotated Anodyne CC(C)Oc1cc2nc(C3(O)CCOCC3)[nH]c2cc1Br ZINC000586913192 FG Annotated Anodyne O=C1CCc2cc3nc(C4(c5ccc(O)cc5)CCOCC4)[nH]c3cc2N1 ZINC000586913594 FG Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc(C4(O)CCOCC4)[nH]c3c2)cc1 ZINC000586913632 FG Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@@H]3CCCO[C@H]3CC)[nH]c2c1 ZINC000586913736 FG Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@@H]3CCCO[C@@H]3CC)[nH]c2c1 ZINC000586913737 FG Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@H]3CCCO[C@@H]3CC)[nH]c2c1 ZINC000586913738 FG Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@H]3CCCO[C@H]3CC)[nH]c2c1 ZINC000586913739 FG Annotated Anodyne CC[C@H]1OCCC[C@@H]1c1nc2cc(I)cnc2[nH]1 ZINC000586913770 FG Annotated Anodyne CC[C@@H]1OCCC[C@H]1c1nc2cc(I)cnc2[nH]1 ZINC000586913771 FG Annotated Anodyne CC[C@H]1OCCC[C@H]1c1nc2cc(I)cnc2[nH]1 ZINC000586913772 FG Annotated Anodyne CC[C@@H]1OCCC[C@@H]1c1nc2cc(I)cnc2[nH]1 ZINC000586913773 FG Annotated Anodyne Oc1ccc(C2(c3nc4cc5c(cc4[nH]3)OCCO5)CCOCC2)cc1 ZINC000586913914 FG Annotated Anodyne Oc1ccc(C2(c3nc4cnc(C(F)(F)F)[nH]c-4n3)CCOCC2)cc1 ZINC000586914077 FG Annotated Anodyne OC1(c2nc3cc(C(F)(F)F)cc(Br)c3[nH]2)CCOCC1 ZINC000586914165 FG Annotated Anodyne OC1(c2nc3cc(Br)cc(C(F)(F)F)c3[nH]2)CCOCC1 ZINC000586914172 FG Annotated Anodyne OC1(c2nc3ccc(Br)c(C(F)(F)F)c3[nH]2)CCOCC1 ZINC000586914280 FG Annotated Anodyne O[C@@H](c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1)C1CCOCC1 ZINC000586914311 FG Annotated Anodyne O[C@H](c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1)C1CCOCC1 ZINC000586914312 FG Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000586915066 FG Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000586915067 FG Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000586915068 FG Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000586915069 FG Annotated Anodyne Brc1cnc(Br)c2[nH]c(C3CC4(COC4)C3)nc12 ZINC000586915457 FG Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000586915507 FG Annotated Bother COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000586915508 FG Annotated Bother COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000586915509 FG Annotated Bother COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000586915510 FG Annotated Bother COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2c(S)nc(S)nc2[nH]1 ZINC000586915758 FG Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2c(S)nc(S)nc2[nH]1 ZINC000586915760 FG Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2c(S)nc(S)nc2[nH]1 ZINC000586915762 FG Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2c(S)nc(S)nc2[nH]1 ZINC000586915763 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(C3CC4(COC4)C3)nc2c1 ZINC000586916105 FG Annotated Anodyne CC1=C(c2ccc3[nH]c(-c4ccc5oc(=O)ccc5c4)nc3c2)NNC(=O)C1 ZINC000586916918 FG Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@@H]3C[C@@H](C)CCO3)[nH]c2c1 ZINC000586916929 FG Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2cccc(C(=O)O)c2[nH]1 ZINC000586916998 FG Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2cccc(C(=O)O)c2[nH]1 ZINC000586917001 FG Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2cccc(C(=O)O)c2[nH]1 ZINC000586917002 FG Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2cccc(C(=O)O)c2[nH]1 ZINC000586917004 FG Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000586917353 FG Annotated Bother COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000586917355 FG Annotated Bother COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000586917356 FG Annotated Bother COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000586917357 FG Annotated Bother CCN(CC)S(=O)(=O)c1ccc2nc([C@@H]3C[C@@H](C)CCO3)[nH]c2c1 ZINC000586917600 FG Annotated Anodyne C[C@@H]1O[C@H]1c1nc2ccc(S(=O)(=O)Nc3ccc(Cl)cc3)cc2[nH]1 ZINC000586917875 FG Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(C3CC4(COC4)C3)nc2c1 ZINC000586918038 FG Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2ccc(CCO)cc2[nH]1 ZINC000586918357 FG Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2ccc(CCO)cc2[nH]1 ZINC000586918358 FG Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2ccc(CCO)cc2[nH]1 ZINC000586918359 FG Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2ccc(CCO)cc2[nH]1 ZINC000586918360 FG Annotated Anodyne Fc1cnc(Br)c2[nH]c([C@@H]3COc4ccccc4O3)nc12 ZINC000586918620 FG Annotated Anodyne COc1ccc2c(C)c(CCc3nc4ccnc(O)c4[nH]3)c(=O)oc2c1C ZINC000586918624 FG Annotated Anodyne COc1ccc2c(C)c(CCc3nc4c(N)ccnc4[nH]3)c(=O)oc2c1C ZINC000586918918 FG Annotated Anodyne O=c1ccc2cc(-c3nc4cc([N+](=O)[O-])c([N+](=O)[O-])cc4[nH]3)ccc2o1 ZINC000586919062 FG Annotated Bother FC(F)(F)c1nc(Cl)[nH]c2nc([C@@H]3COc4ccccc4O3)nc1-2 ZINC000586919120 FG Annotated Anodyne Cc1cc(Cl)cc2nc(CS(=O)(=O)c3ccc([N+](=O)[O-])cc3)[nH]c12 ZINC000586919672 FG Annotated Bother Cc1c(Cl)ccc2nc(CS(=O)(=O)c3ccc([N+](=O)[O-])cc3)[nH]c12 ZINC000586919737 FG Annotated Bother Cc1cc2nc(CS(=O)(=O)c3ccc([N+](=O)[O-])cc3)[nH]c2cc1Cl ZINC000586919780 FG Annotated Bother O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc3cc(Cl)cc(F)c3[nH]2)cc1 ZINC000586919797 FG Annotated Bother O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc3cc(Cl)c(F)cc3[nH]2)cc1 ZINC000586919871 FG Annotated Bother COc1ccc(S(=O)(=O)Cc2nc3cnc4ccccc4c3[nH]2)cc1 ZINC000586919879 FG Annotated Anodyne COc1ccc(S(=O)(=O)Cc2nc3ccc4ncccc4c3[nH]2)cc1 ZINC000586919994 FG Annotated Anodyne O=S(=O)(CCc1nc2ccnc(Cl)c2[nH]1)c1ccc2c(c1)CCC2 ZINC000586920004 FG Annotated Anodyne COc1cc2nc(CCS(=O)(=O)c3ccc4c(c3)CCC4)[nH]c2cc1C ZINC000586920010 FG Annotated Anodyne COc1ccc(S(=O)(=O)Cc2nc3c(F)c(F)c(F)c(F)c3[nH]2)cc1 ZINC000586920034 FG Annotated Anodyne O=S(=O)(CCc1nc2cc(Cl)ncc2[nH]1)c1ccc2c(c1)CCC2 ZINC000586920035 FG Annotated Anodyne COc1ccc(S(=O)(=O)Cc2nc3ccc4nc(C)ccc4c3[nH]2)cc1 ZINC000586920037 FG Annotated Anodyne O=S(=O)(CCc1nc2cc(F)c(F)cc2[nH]1)c1ccc2c(c1)CCC2 ZINC000586920145 FG Annotated Anodyne COc1ccc(S(=O)(=O)Cc2nc3c(Cl)cnc(Cl)c3[nH]2)cc1 ZINC000586920297 FG Annotated Anodyne O=S(=O)(CCc1nc2cc(Cl)cnc2[nH]1)c1ccc2c(c1)CCC2 ZINC000586920338 FG Annotated Anodyne N[C@@H](CP(=O)(O)O)c1nc2ccc(-c3nc4ccccc4s3)cc2[nH]1 ZINC000586920382 FG Annotated Anodyne COc1ccc(S(=O)(=O)Cc2nc3ccc4c(c3[nH]2)CCCC4)cc1 ZINC000586920467 FG Annotated Anodyne O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc3ccc(Cl)cc3[nH]2)cc1 ZINC000586920475 FG Annotated Bother COc1ccc(S(=O)(=O)Cc2nc3cc(Cl)c(Cl)nc3[nH]2)cc1 ZINC000586920478 FG Annotated Anodyne COc1ccc(S(=O)(=O)Cc2nc3cc(C#N)cc(Cl)c3[nH]2)cc1 ZINC000586920502 FG Annotated Mild O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc3cccc(Cl)c3[nH]2)cc1 ZINC000586920523 FG Annotated Bother COc1ccc(S(=O)(=O)Cc2nc3cc(Cl)c(F)c(F)c3[nH]2)cc1 ZINC000586920616 FG Annotated Anodyne C=CCc1cccc2nc(CS(=O)(=O)c3ccc([N+](=O)[O-])cc3)[nH]c12 ZINC000586920625 FG Annotated Mild COc1ccc(S(=O)(=O)Cc2nc3cc(Cl)cc(F)c3[nH]2)cc1 ZINC000586920638 FG Annotated Anodyne O=S(=O)(CCc1nc2ccc(F)c(F)c2[nH]1)c1ccc2c(c1)CCC2 ZINC000586920668 FG Annotated Anodyne COc1cc2nc(CCS(=O)(=O)c3ccc4c(c3)CCC4)[nH]c2cc1F ZINC000586920720 FG Annotated Anodyne COc1ccc(S(=O)(=O)Cc2nc3cc(Cl)nc(Cl)c3[nH]2)cc1 ZINC000586920732 FG Annotated Anodyne O=S(=O)(CCc1nc2cncc(Cl)c2[nH]1)c1ccc2c(c1)CCC2 ZINC000586920805 FG Annotated Anodyne COc1ccc(S(=O)(=O)Cc2nc3c(Cl)c(Cl)cnc3[nH]2)cc1 ZINC000586920823 FG Annotated Anodyne O=[N+]([O-])c1ccc(S(=O)(=O)Cc2nc3ccc4c(c3[nH]2)CCCC4)cc1 ZINC000586920861 FG Annotated Bother COc1ccc(S(=O)(=O)Cc2nc3cc(OC)c(Cl)cc3[nH]2)cc1 ZINC000586920877 FG Annotated Anodyne N=c1cc2nc(-c3ccccc3CS(=O)(=O)c3ccccc3)[nH]c2c[nH]1 ZINC000586920971 FG Annotated Anodyne O=S(=O)(CCc1nc2c(Cl)ccnc2[nH]1)c1ccc2c(c1)CCC2 ZINC000586921006 FG Annotated Anodyne O=S(=O)(CCc1nc2cc(F)cc(F)c2[nH]1)c1ccc2c(c1)CCC2 ZINC000586921027 FG Annotated Anodyne COc1ccc(S(=O)(=O)Cc2nc3cc(Cl)c(F)cc3[nH]2)cc1 ZINC000586921036 FG Annotated Anodyne CC(C)(C)c1ccc2nc(CS(=O)(=O)c3ccc([N+](=O)[O-])cc3)[nH]c2n1 ZINC000586921065 FG Annotated Bother O=S(=O)(CCc1nc2ccc(Cl)nc2[nH]1)c1ccc2c(c1)CCC2 ZINC000586921125 FG Annotated Anodyne CSc1ccc2nc(CS(=O)(=O)c3ccc([N+](=O)[O-])cc3)[nH]c2c1 ZINC000586921161 FG Annotated Bother N[C@@H](CP(=O)(O)O)c1nc2ccc(S(F)(F)(F)(F)F)cc2[nH]1 ZINC000586921404 FG Annotated Reactive CCS(=O)(=O)c1cccc(Cc2nc3cc(C(F)(F)F)cnc3[nH]2)c1 ZINC000586921444 FG Annotated Anodyne CCS(=O)(=O)c1ccccc1-c1nc2cc(Br)cnc2[nH]1 ZINC000586921480 FG Annotated Anodyne Cc1cc2[nH]c(CCS(=O)(=O)c3ccc4c(c3)CCC4)nc2c(C)n1 ZINC000586921574 FG Annotated Anodyne N=c1[nH]ccc2nc(-c3ccccc3CS(=O)(=O)c3ccccc3)[nH]c12 ZINC000586921714 FG Annotated Anodyne O=S(=O)(Cc1ccccc1-c1nc2ccnc(O)c2[nH]1)c1ccccc1 ZINC000586921896 FG Annotated Anodyne COc1ccc2nc(CCS(=O)(=O)c3ccc4c(c3)CCC4)[nH]c2c1 ZINC000586921972 FG Annotated Anodyne Nc1ccnc2[nH]c(-c3ccccc3CS(=O)(=O)c3ccccc3)nc12 ZINC000586922071 FG Annotated Anodyne CCS(=O)(=O)c1cccc(Cc2nc3ccc4ncccc4c3[nH]2)c1 ZINC000586922304 FG Annotated Anodyne CC(=O)c1ccc2nc(CCS(=O)(=O)c3ccc4c(c3)CCC4)[nH]c2c1 ZINC000586922440 FG Annotated Anodyne CCS(=O)(=O)c1ccccc1-c1nc2ccc(Br)nc2[nH]1 ZINC000586922564 FG Annotated Anodyne CCS(=O)(=O)c1ccccc1-c1nc2cncc(Br)c2[nH]1 ZINC000586922675 FG Annotated Anodyne CCS(=O)(=O)c1cccc(Cc2nc3cc(C#N)cc(Cl)c3[nH]2)c1 ZINC000586922695 FG Annotated Mild CCS(=O)(=O)c1cccc(Cc2nc3cnc4ccccc4c3[nH]2)c1 ZINC000586922813 FG Annotated Anodyne CCS(=O)(=O)c1ccccc1-c1nc2ccnc(Br)c2[nH]1 ZINC000586922850 FG Annotated Anodyne COc1cccc2nc(CCS(=O)(=O)c3ccc4c(c3)CCC4)[nH]c12 ZINC000586923028 FG Annotated Anodyne CCS(=O)(=O)c1ccccc1-c1nc2c(Br)ccnc2[nH]1 ZINC000586923059 FG Annotated Anodyne CCS(=O)(=O)c1cccc(Cc2nc3c(F)cnc(Cl)c3[nH]2)c1 ZINC000586923135 FG Annotated Anodyne CC(C)Oc1cc2nc(/C=C\S(C)(=O)=O)[nH]c2cc1Br ZINC000586923390 FG Annotated Anodyne CC(C)Oc1cc2nc(/C=C/S(C)(=O)=O)[nH]c2cc1Br ZINC000586923392 FG Annotated Anodyne CS(=O)(=O)/C=C\c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000586923408 FG Annotated Anodyne CS(=O)(=O)/C=C/c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000586923409 FG Annotated Anodyne CS(=O)(=O)/C=C\c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000586923462 FG Annotated Anodyne CS(=O)(=O)/C=C/c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000586923463 FG Annotated Anodyne CC(C)COc1cc2nc(/C=C\S(C)(=O)=O)[nH]c2cc1Br ZINC000586923464 FG Annotated Anodyne CC(C)COc1cc2nc(/C=C/S(C)(=O)=O)[nH]c2cc1Br ZINC000586923465 FG Annotated Anodyne CS(=O)(=O)/C=C\c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000586923806 FG Annotated Anodyne CS(=O)(=O)/C=C/c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000586923807 FG Annotated Anodyne CCCOc1cc2nc(/C=C/S(C)(=O)=O)[nH]c2cc1Br ZINC000586923810 FG Annotated Anodyne CCCOc1cc2nc(/C=C\S(C)(=O)=O)[nH]c2cc1Br ZINC000586923811 FG Annotated Anodyne Cc1cc2nc(CS(=O)(=O)C3CCCC3)[nH]c2cc1Br ZINC000586923951 FG Annotated Anodyne Cc1c(Br)ccc2nc(CS(=O)(=O)C3CCCC3)[nH]c12 ZINC000586923967 FG Annotated Anodyne O=S(=O)(Cc1nc2cc(F)cc(Br)c2[nH]1)C1CCCC1 ZINC000586923984 FG Annotated Anodyne O=S(=O)(/C=C\c1nc2cc(C(F)(F)F)ncc2[nH]1)c1ccccc1 ZINC000586923990 FG Annotated Anodyne O=S(=O)(/C=C/c1nc2cc(C(F)(F)F)ncc2[nH]1)c1ccccc1 ZINC000586923991 FG Annotated Anodyne N#Cc1cc2nc(CS(=O)(=O)C3CCCC3)[nH]c2cc1C(F)(F)F ZINC000586924006 FG Annotated Mild O=S(=O)(/C=C\c1nc2cc(Br)cnc2[nH]1)c1ccccc1 ZINC000586924072 FG Annotated Anodyne O=S(=O)(/C=C/c1nc2cc(Br)cnc2[nH]1)c1ccccc1 ZINC000586924073 FG Annotated Anodyne Nc1ccc(-c2ccc3nc(CS(=O)(=O)C4CCCC4)[nH]c3c2)cc1N ZINC000586924092 FG Annotated Anodyne O=S(=O)(/C=C\c1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1ccccc1 ZINC000586924200 FG Annotated Anodyne O=S(=O)(/C=C/c1nc2cc3c(cc2[nH]1)OC(F)(F)O3)c1ccccc1 ZINC000586924201 FG Annotated Anodyne O=S(=O)(Cc1nc2ccc(Br)c(F)c2[nH]1)C1CCCC1 ZINC000586924202 FG Annotated Anodyne O=S(=O)(/C=C\c1nc2cc(C(F)(F)F)cnc2[nH]1)c1ccccc1 ZINC000586924242 FG Annotated Anodyne O=S(=O)(/C=C/c1nc2cc(C(F)(F)F)cnc2[nH]1)c1ccccc1 ZINC000586924243 FG Annotated Anodyne O=S(=O)(/C=C\c1nc2ccnc(Br)c2[nH]1)c1ccccc1 ZINC000586924247 FG Annotated Anodyne O=S(=O)(/C=C/c1nc2ccnc(Br)c2[nH]1)c1ccccc1 ZINC000586924248 FG Annotated Anodyne O=S(=O)(Cc1nc2cc(Br)cc(F)c2[nH]1)C1CCCC1 ZINC000586924292 FG Annotated Anodyne N#Cc1cc(Br)c2[nH]c(CS(=O)(=O)C3CCCC3)nc2c1 ZINC000586924296 FG Annotated Mild Cc1cc(Br)c2[nH]c(CS(=O)(=O)C3CCCC3)nc2c1 ZINC000586924306 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(/C=C\S(=O)(=O)c3ccccc3)[nH]c2c1 ZINC000586924455 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(/C=C/S(=O)(=O)c3ccccc3)[nH]c2c1 ZINC000586924456 FG Annotated Anodyne O=S(=O)(Cc1nc2ccc(F)c(Br)c2[nH]1)C1CCCC1 ZINC000586924491 FG Annotated Anodyne Cc1cc(Br)cc2nc(CS(=O)(=O)C3CCCC3)[nH]c12 ZINC000586924511 FG Annotated Anodyne O=S(=O)(/C=C/c1nc2cc3c(cc2[nH]1)OCCCO3)c1ccccc1 ZINC000586924546 FG Annotated Anodyne O=S(=O)(/C=C\c1nc2cc3c(cc2[nH]1)OCCCO3)c1ccccc1 ZINC000586924548 FG Annotated Anodyne O=S(=O)(/C=C/c1nc2ccc(Br)nc2[nH]1)c1ccccc1 ZINC000586924692 FG Annotated Anodyne O=S(=O)(/C=C\c1nc2ccc(Br)nc2[nH]1)c1ccccc1 ZINC000586924693 FG Annotated Anodyne COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cnccc2[nH]1 ZINC000586925033 FG Annotated Unstable O=S(=O)(/C=C\c1nc2cc(Br)ncc2[nH]1)c1ccccc1 ZINC000586925122 FG Annotated Anodyne O=S(=O)(/C=C/c1nc2cc(Br)ncc2[nH]1)c1ccccc1 ZINC000586925123 FG Annotated Anodyne CCOC(=O)c1ccc2nc(/C=C\S(=O)(=O)c3ccccc3)[nH]c2c1 ZINC000586925125 FG Annotated Anodyne CCOC(=O)c1ccc2nc(/C=C/S(=O)(=O)c3ccccc3)[nH]c2c1 ZINC000586925136 FG Annotated Anodyne O=S(=O)(Cc1nc2cc(Br)c(F)cc2[nH]1)C1CCCC1 ZINC000586925139 FG Annotated Anodyne O=S(=O)(/C=C/c1nc2cc(-n3cccn3)c(F)cc2[nH]1)c1ccccc1 ZINC000586925168 FG Annotated Anodyne O=S(=O)(/C=C\c1nc2cc(-n3cccn3)c(F)cc2[nH]1)c1ccccc1 ZINC000586925171 FG Annotated Anodyne O=S(=O)(/C=C\c1nc2cncc(Br)c2[nH]1)c1ccccc1 ZINC000586925251 FG Annotated Anodyne O=S(=O)(/C=C/c1nc2cncc(Br)c2[nH]1)c1ccccc1 ZINC000586925252 FG Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc(/C=C\S(C)(=O)=O)[nH]c3c2)cc1 ZINC000586925390 FG Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc(/C=C/S(C)(=O)=O)[nH]c3c2)cc1 ZINC000586925391 FG Annotated Anodyne O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cnncc3[nH]2)c1Cl ZINC000586925525 FG Annotated Unstable COc1cc2nc(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)[nH]c2cn1 ZINC000586925710 FG Annotated Unstable O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cncnc3[nH]2)c1Cl ZINC000586925756 FG Annotated Unstable CS(=O)(=O)/C=C\c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000586926009 FG Annotated Anodyne CS(=O)(=O)/C=C/c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000586926011 FG Annotated Anodyne O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3ncc[nH]c-3n2)c1Cl ZINC000586926064 FG Annotated Unstable COc1ccc2nc(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)[nH]c2n1 ZINC000586926189 FG Annotated Unstable O=S(=O)(/C=C\c1nc2c(Br)ccnc2[nH]1)c1ccccc1 ZINC000586926352 FG Annotated Anodyne O=S(=O)(/C=C/c1nc2c(Br)ccnc2[nH]1)c1ccccc1 ZINC000586926354 FG Annotated Anodyne O=[N+]([O-])c1cncc2nc(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)[nH]c12 ZINC000586926433 FG Annotated Unstable O=S(=O)(Cl)c1cc(-c2nc3c(Cl)ncnc3[nH]2)ccc1Cl ZINC000586926512 FG Annotated Unstable COc1cncc2nc(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)[nH]c12 ZINC000586926515 FG Annotated Unstable CCc1ccc(-c2nc3ccnc(OC)c3[nH]2)cc1S(=O)(=O)Cl ZINC000586926525 FG Annotated Unstable CCc1ccc(-c2nc3nc(Cl)c[nH]c-3n2)cc1S(=O)(=O)Cl ZINC000586926529 FG Annotated Unstable O=[N+]([O-])c1cnc2[nH]c(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)nc2c1 ZINC000586926600 FG Annotated Unstable O=S(=O)(Cl)c1cc(-c2nc3cnc(Cl)[nH]c-3n2)ccc1Cl ZINC000586926664 FG Annotated Unstable O=S(=O)(Cl)c1cc(-c2nc3nc(Cl)c[nH]c-3n2)ccc1Cl ZINC000586926702 FG Annotated Unstable CCc1ccc(-c2nc3cc4c(cc3[nH]2)OCO4)cc1S(=O)(=O)Cl ZINC000586926754 FG Annotated Unstable CCc1ccc(-c2nc3cc([N+](=O)[O-])cnc3[nH]2)cc1S(=O)(=O)Cl ZINC000586926850 FG Annotated Unstable Cc1cc(-c2nc3c(C#N)nc(Cl)cc3[nH]2)ccc1S(=O)(=O)Cl ZINC000586926859 FG Annotated Unstable CS(=O)(=O)c1cc(-c2nc3cccc(F)c3[nH]2)cc([N+](=O)[O-])c1Cl ZINC000586926936 FG Annotated Bother CCc1ccc(-c2nc3cc(OC)ncc3[nH]2)cc1S(=O)(=O)Cl ZINC000586927064 FG Annotated Unstable Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(N)c(N)cc3[nH]2)c1Cl ZINC000586927085 FG Annotated Unstable O=S(=O)(Cl)c1ccc(-c2nc3cnc(Cl)[nH]c-3n2)cc1Cl ZINC000586927092 FG Annotated Unstable CCc1ccc(-c2nc3cncc(OC)c3[nH]2)cc1S(=O)(=O)Cl ZINC000586927149 FG Annotated Unstable COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cccnc2[nH]1 ZINC000586927215 FG Annotated Unstable COc1nccc2nc(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)[nH]c12 ZINC000586927217 FG Annotated Unstable CCc1ccc(-c2nc3c(Cl)ncnc3[nH]2)cc1S(=O)(=O)Cl ZINC000586927263 FG Annotated Unstable COc1nccc2nc(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)[nH]c12 ZINC000586927291 FG Annotated Unstable CCc1ccc(-c2nc3cnc(Cl)[nH]c-3n2)cc1S(=O)(=O)Cl ZINC000586927324 FG Annotated Unstable CCc1ccc(-c2nc3cncc([N+](=O)[O-])c3[nH]2)cc1S(=O)(=O)Cl ZINC000586927359 FG Annotated Unstable COc1ccc2nc(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)[nH]c2n1 ZINC000586927413 FG Annotated Unstable O=[N+]([O-])c1cncc2nc(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)[nH]c12 ZINC000586927483 FG Annotated Unstable Cc1cc(-c2nc3cc4c(cc3[nH]2)OCCO4)ccc1S(=O)(=O)Cl ZINC000586927524 FG Annotated Unstable COc1cncc2nc(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)[nH]c12 ZINC000586927591 FG Annotated Unstable O=[N+]([O-])c1cnc2[nH]c(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)nc2c1 ZINC000586927892 FG Annotated Unstable CCc1ccc(-c2nc3ccc(OC)nc3[nH]2)cc1S(=O)(=O)Cl ZINC000586927907 FG Annotated Unstable COc1cc2nc(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)[nH]c2cn1 ZINC000586928116 FG Annotated Unstable Cc1cc(-c2nc3cc4c(cc3[nH]2)OCO4)ccc1S(=O)(=O)Cl ZINC000586928281 FG Annotated Unstable O=S(=O)(Cl)c1ccc(-c2nc3nc(Cl)c[nH]c-3n2)cc1Cl ZINC000586928349 FG Annotated Unstable COc1cc(OC)c2nc(-c3ccc(S(=O)(=O)Cl)c(C)c3)[nH]c2c1 ZINC000586928367 FG Annotated Unstable Cc1cc(-c2nc3cc([C@@H](N)N=O)ccc3[nH]2)ccc1S(=O)(=O)Cl ZINC000586928382 FG Annotated Unstable Cc1cc(-c2nc3cc([C@H](N)N=O)ccc3[nH]2)ccc1S(=O)(=O)Cl ZINC000586928383 FG Annotated Unstable O=S(=O)(Cl)c1ccc(-c2nc3c(Cl)ncnc3[nH]2)cc1Cl ZINC000586928401 FG Annotated Unstable CN(Cc1nc2ccnc(Cl)c2[nH]1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000586928456 FG Annotated Anodyne CN(Cc1nc2ccc(C(C)(C)C)cc2[nH]1)S(=O)(=O)c1cccnc1 ZINC000586928471 FG Annotated Anodyne CN(Cc1nc2c(Cl)ccnc2[nH]1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000586928572 FG Annotated Anodyne Cc1cc2nc(CN(C)S(=O)(=O)c3ccc(C#N)cc3)[nH]c2cc1Cl ZINC000586928605 FG Annotated Mild CN(Cc1nc2cc(Cl)ncc2[nH]1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000586928607 FG Annotated Anodyne Cc1c(Cl)ccc2nc(CN(C)S(=O)(=O)c3ccc(C#N)cc3)[nH]c12 ZINC000586928692 FG Annotated Mild CN(Cc1nc2cc(Cl)c(Cl)cc2[nH]1)S(=O)(=O)c1cccnc1 ZINC000586928852 FG Annotated Anodyne Cc1cc2nc(CN(C)S(=O)(=O)c3ccc(Cl)cc3)[nH]c2cc1F ZINC000586928889 FG Annotated Anodyne Cc1c(F)ccc2nc(CN(C)S(=O)(=O)c3ccc(Cl)cc3)[nH]c12 ZINC000586928921 FG Annotated Anodyne Cc1cc(S(=O)(=O)Cl)cc(-c2nc3c(N)ccnc3[nH]2)c1Cl ZINC000586928965 FG Annotated Unstable Cc1cc(Cl)cc2nc(CN(C)S(=O)(=O)c3ccc(C#N)cc3)[nH]c12 ZINC000586929007 FG Annotated Mild CN(Cc1nc2ccc(F)c(F)c2[nH]1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000586929010 FG Annotated Anodyne CN(Cc1nc2cc(Cl)cc(Cl)c2[nH]1)S(=O)(=O)c1cccnc1 ZINC000586929096 FG Annotated Anodyne CN(Cc1nc2cccc(C(C)(C)C)c2[nH]1)S(=O)(=O)c1cccnc1 ZINC000586929101 FG Annotated Anodyne Cc1cc(F)c2[nH]c(CN(C)S(=O)(=O)c3ccc(Cl)cc3)nc2c1 ZINC000586929109 FG Annotated Anodyne Cc1cc2[nH]c(CN(C)S(=O)(=O)c3ccc(Cl)cc3)nc2c(C)n1 ZINC000586929236 FG Annotated Anodyne CN(Cc1nc2ccc(Cl)nc2[nH]1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000586929308 FG Annotated Anodyne CN(Cc1nc2cc(F)cc(F)c2[nH]1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000586929546 FG Annotated Anodyne CN(Cc1nc2cc(Cl)cnc2[nH]1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000586929547 FG Annotated Anodyne CN(Cc1nc2cncc(Cl)c2[nH]1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000586929580 FG Annotated Anodyne CN(Cc1nc2cc(F)c(F)cc2[nH]1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000586929584 FG Annotated Anodyne Cc1cc(S(=O)(=O)Cl)cc(-c2nc3ccnc(O)c3[nH]2)c1Cl ZINC000586929737 FG Annotated Unstable Cc1cc(S(N)(=O)=O)ccc1OCc1nc2cc(Cl)cc(C)c2[nH]1 ZINC000586929822 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1cccc(-c2nc3cccc(OC)c3[nH]2)c1 ZINC000586929850 FG Annotated Anodyne Cc1cc(S(N)(=O)=O)ccc1OCc1nc2cccc(C(C)(C)C)c2[nH]1 ZINC000586929924 FG Annotated Anodyne NS(=O)(=O)Cc1ccc(-c2nc3c(Cl)cc(Cl)cc3[nH]2)cc1 ZINC000586930156 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1cccc(-c2nc3cccc(C#N)c3[nH]2)c1 ZINC000586930262 FG Annotated Mild Cc1cc(S(N)(=O)=O)ccc1OCc1nc2ccc(C(C)(C)C)cc2[nH]1 ZINC000586930503 FG Annotated Anodyne Cc1cc(S(N)(=O)=O)ccc1OCc1nc2cc3ccccc3cc2[nH]1 ZINC000586930578 FG Annotated Anodyne Cc1cc2nc(COc3ccc(S(N)(=O)=O)cc3C)[nH]c2cc1Cl ZINC000586930580 FG Annotated Anodyne NS(=O)(=O)Cc1ccc(-c2nc3c(C(F)(F)F)cc(F)cc3[nH]2)cc1 ZINC000586930904 FG Annotated Anodyne Cc1cc(S(N)(=O)=O)ccc1OCc1nc2ccc(Cl)c(C)c2[nH]1 ZINC000586931040 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1cccc(-c2nc3c(C)nc(C)cc3[nH]2)c1 ZINC000586931189 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc(-c2nc3c(F)c(F)c(Cl)cc3[nH]2)o1 ZINC000586931300 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc(-c2nc3cc(C(F)(F)F)ccc3[nH]2)o1 ZINC000586931372 FG Annotated Anodyne Cc1cc2nc(COc3ccc(S(=O)(=O)N(C)C)cc3)[nH]c2cc1C ZINC000586931408 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc(-c2nc3cc(Cl)c(Cl)cc3[nH]2)o1 ZINC000586931471 FG Annotated Anodyne Cc1ccc2nc(COc3ccc(S(=O)(=O)N(C)C)cc3)[nH]c2c1C ZINC000586931813 FG Annotated Anodyne Cc1ccc(C)c2[nH]c(COc3ccc(S(=O)(=O)N(C)C)cc3)nc12 ZINC000586931828 FG Annotated Anodyne Cc1cc(C)c2[nH]c(COc3ccc(S(=O)(=O)N(C)C)cc3)nc2c1 ZINC000586931905 FG Annotated Anodyne CN(C)S(=O)(=O)CCc1nc2c3ccccc3c3ccccc3c2[nH]1 ZINC000586931927 FG Annotated Bother C=CCc1cccc2nc(COc3ccc(S(=O)(=O)N(C)C)cc3)[nH]c12 ZINC000586931969 FG Annotated Mild CN(C)S(=O)(=O)c1ccc(OCc2nc3cccc(Cl)c3[nH]2)cc1 ZINC000586931999 FG Annotated Anodyne CN(C)S(=O)(=O)CCc1nc2ccc(Sc3ccccc3)cc2[nH]1 ZINC000586932004 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc(-c2nc3c(Cl)cc(Cl)cc3[nH]2)o1 ZINC000586932161 FG Annotated Anodyne CCCCS(=O)(=O)N[C@H](c1nc2cc(OC)c(F)cc2[nH]1)C(C)C ZINC000586932168 FG Annotated Anodyne CCCCS(=O)(=O)N[C@@H](c1nc2cc(OC)c(F)cc2[nH]1)C(C)C ZINC000586932169 FG Annotated Anodyne CCCCS(=O)(=O)N[C@H](c1nc2cc([N+](=O)[O-])c(C)cc2[nH]1)C(C)C ZINC000586932172 FG Annotated Bother CCCCS(=O)(=O)N[C@@H](c1nc2cc([N+](=O)[O-])c(C)cc2[nH]1)C(C)C ZINC000586932175 FG Annotated Bother CCCCS(=O)(=O)N[C@H](c1nc2ccc(C(C)=O)cc2[nH]1)C(C)C ZINC000586932709 FG Annotated Anodyne CCCCS(=O)(=O)N[C@@H](c1nc2ccc(C(C)=O)cc2[nH]1)C(C)C ZINC000586932713 FG Annotated Anodyne NS(=O)(=O)c1c[nH]c(-c2nc3cc(Sc4ccccc4)ccc3[nH]2)c1 ZINC000586933137 FG Annotated Anodyne CCCCS(=O)(=O)N[C@@H](c1nc2cc(F)c(F)c(F)c2[nH]1)C(C)C ZINC000586933178 FG Annotated Anodyne CCCCS(=O)(=O)N[C@H](c1nc2cc(F)c(F)c(F)c2[nH]1)C(C)C ZINC000586933184 FG Annotated Anodyne CCCCS(=O)(=O)N[C@@H](c1nc2c(C)cnc(Cl)c2[nH]1)C(C)C ZINC000586933356 FG Annotated Anodyne CCCCS(=O)(=O)N[C@H](c1nc2c(C)cnc(Cl)c2[nH]1)C(C)C ZINC000586933359 FG Annotated Anodyne CCCCS(=O)(=O)N[C@H](c1nc2cc(OC)c(C)cc2[nH]1)C(C)C ZINC000586933454 FG Annotated Anodyne CCCCS(=O)(=O)N[C@@H](c1nc2cc(OC)c(C)cc2[nH]1)C(C)C ZINC000586933455 FG Annotated Anodyne CCCCS(=O)(=O)N[C@H](c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1)C(C)C ZINC000586933501 FG Annotated Bother CCCCS(=O)(=O)N[C@@H](c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1)C(C)C ZINC000586933502 FG Annotated Bother CCCCS(=O)(=O)N[C@H](c1nc2c(F)cnc(Cl)c2[nH]1)C(C)C ZINC000586933696 FG Annotated Anodyne CCCCS(=O)(=O)N[C@@H](c1nc2c(F)cnc(Cl)c2[nH]1)C(C)C ZINC000586933697 FG Annotated Anodyne CC(C)NS(=O)(=O)c1c[nH]c(-c2nc3c4c(ccc3[nH]2)CCCC4)c1 ZINC000586935436 FG Annotated Anodyne Cc1cc(Cl)cc2[nH]c(-c3cc(S(=O)(=O)NC(C)C)c[nH]3)nc12 ZINC000586935469 FG Annotated Anodyne CC(C)NS(=O)(=O)c1c[nH]c(-c2nc3c(F)c(F)c(Cl)cc3[nH]2)c1 ZINC000586935489 FG Annotated Anodyne CC(C)NS(=O)(=O)c1c[nH]c(-c2nc3cc(OC(C)C)ccc3[nH]2)c1 ZINC000586935949 FG Annotated Anodyne CC(C)NS(=O)(=O)c1c[nH]c(-c2nc3cc(F)c(Cl)cc3[nH]2)c1 ZINC000586936157 FG Annotated Anodyne CC(C)NS(=O)(=O)c1c[nH]c(-c2nc3cc4ccccc4cc3[nH]2)c1 ZINC000586936550 FG Annotated Anodyne CC(C)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nc2cccnc2[nH]1 ZINC000586937040 FG Annotated Anodyne CC(C)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nc2cccnc2[nH]1 ZINC000586937041 FG Annotated Anodyne Cc1ccc2c(ccc3[nH]c(-c4cc(S(=O)(=O)NC(C)C)c[nH]4)nc32)n1 ZINC000586937272 FG Annotated Anodyne CC(C)NS(=O)(=O)c1c[nH]c(-c2nc3cc(C(F)(F)F)ccc3[nH]2)c1 ZINC000586937277 FG Annotated Anodyne CC(C)NS(=O)(=O)c1c[nH]c(-c2nc3c(C(F)(F)F)cccc3[nH]2)c1 ZINC000586937370 FG Annotated Anodyne CC(C)NS(=O)(=O)c1c[nH]c(-c2nc3c(F)cc(Cl)cc3[nH]2)c1 ZINC000586937426 FG Annotated Anodyne CC[C@H](C)NS(=O)(=O)c1ccc(-c2nc3nc(Cl)ccc3[nH]2)cc1 ZINC000586937473 FG Annotated Anodyne CC[C@@H](C)NS(=O)(=O)c1ccc(-c2nc3nc(Cl)ccc3[nH]2)cc1 ZINC000586937475 FG Annotated Anodyne Cc1cc2[nH]c(-c3cc(S(=O)(=O)NC(C)C)c[nH]3)nc2cc1Cl ZINC000586937990 FG Annotated Anodyne CC[C@H](C)NS(=O)(=O)c1ccc(-c2nc3c(Cl)cncc3[nH]2)cc1 ZINC000586938120 FG Annotated Anodyne CC[C@@H](C)NS(=O)(=O)c1ccc(-c2nc3c(Cl)cncc3[nH]2)cc1 ZINC000586938122 FG Annotated Anodyne Cc1c(Cl)ccc2[nH]c(-c3cc(S(=O)(=O)NC(C)C)c[nH]3)nc12 ZINC000586939681 FG Annotated Anodyne CC(C)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nc2cnccc2[nH]1 ZINC000586939847 FG Annotated Anodyne CC(C)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nc2cnccc2[nH]1 ZINC000586939848 FG Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3cc(F)cc(F)c3[nH]2)cc1 ZINC000586940595 FG Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3cc(F)cc(F)c3[nH]2)cc1 ZINC000586940598 FG Annotated Anodyne CC(=O)c1ccc2nc(CNS(=O)(=O)/C=C\c3ccc(C)cc3)[nH]c2c1 ZINC000586940792 FG Annotated Anodyne CC(=O)c1ccc2nc(CNS(=O)(=O)/C=C/c3ccc(C)cc3)[nH]c2c1 ZINC000586940793 FG Annotated Anodyne COc1cc2nc(CNS(=O)(=O)/C=C/c3ccc(C)cc3)[nH]c2cc1C ZINC000586940867 FG Annotated Anodyne COc1cc2nc(CNS(=O)(=O)/C=C\c3ccc(C)cc3)[nH]c2cc1C ZINC000586940868 FG Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3cc(Cl)cnc3[nH]2)cc1 ZINC000586941028 FG Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3cc(Cl)cnc3[nH]2)cc1 ZINC000586941031 FG Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3cncc(Cl)c3[nH]2)cc1 ZINC000586941116 FG Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3cncc(Cl)c3[nH]2)cc1 ZINC000586941117 FG Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3cc(C)cc(F)c3[nH]2)cc1 ZINC000586941142 FG Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3cc(C)cc(F)c3[nH]2)cc1 ZINC000586941143 FG Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3ccc(Cl)nc3[nH]2)cc1 ZINC000586941365 FG Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3ccc(Cl)nc3[nH]2)cc1 ZINC000586941367 FG Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3c(Cl)ccnc3[nH]2)cc1 ZINC000586941396 FG Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3c(Cl)ccnc3[nH]2)cc1 ZINC000586941398 FG Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3ccc(F)c(C)c3[nH]2)cc1 ZINC000586941421 FG Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3ccc(F)c(C)c3[nH]2)cc1 ZINC000586941423 FG Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3cc(C)c(F)cc3[nH]2)cc1 ZINC000586941647 FG Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3cc(C)c(F)cc3[nH]2)cc1 ZINC000586941648 FG Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3ccc(F)c(F)c3[nH]2)cc1 ZINC000586941897 FG Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3ccc(F)c(F)c3[nH]2)cc1 ZINC000586941898 FG Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3ccnc(Cl)c3[nH]2)cc1 ZINC000586941904 FG Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3ccnc(Cl)c3[nH]2)cc1 ZINC000586941951 FG Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3cc(Cl)ncc3[nH]2)cc1 ZINC000586942013 FG Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3cc(Cl)ncc3[nH]2)cc1 ZINC000586942015 FG Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3cc(F)c(F)cc3[nH]2)cc1 ZINC000586942082 FG Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3cc(F)c(F)cc3[nH]2)cc1 ZINC000586942086 FG Annotated Anodyne CCS(=O)(=O)NCCCc1nc2cc(C(F)(F)F)cc(Cl)c2[nH]1 ZINC000586942221 FG Annotated Anodyne CCS(=O)(=O)NCCCc1nc2cc(C(F)(F)F)c(Cl)cc2[nH]1 ZINC000586942349 FG Annotated Anodyne CCS(=O)(=O)NCCCc1nc2ccc(SC(F)(F)F)cc2[nH]1 ZINC000586943103 FG Annotated Anodyne CCS(=O)(=O)NCCCc1nc2cccc(OCc3ccccc3)c2[nH]1 ZINC000586943580 FG Annotated Anodyne Cc1oc(CNS(C)(=O)=O)cc1-c1nc2cc(Cl)c(Cl)cc2[nH]1 ZINC000586944631 FG Annotated Anodyne Cc1oc(CNS(C)(=O)=O)cc1-c1nc2cc(Cl)cc(C)c2[nH]1 ZINC000586944877 FG Annotated Anodyne Cc1oc(CNS(C)(=O)=O)cc1-c1nc2cc(Cl)cc(Cl)c2[nH]1 ZINC000586944941 FG Annotated Anodyne Cc1oc(CNS(C)(=O)=O)cc1-c1nc2cccc(C(F)(F)F)c2[nH]1 ZINC000586945072 FG Annotated Anodyne Cc1cc2nc(-c3cc(CNS(C)(=O)=O)oc3C)[nH]c2cc1Cl ZINC000586945092 FG Annotated Anodyne Cc1oc(CNS(C)(=O)=O)cc1-c1nc2ccc(Cl)c(C)c2[nH]1 ZINC000586945105 FG Annotated Anodyne Cc1oc(CNS(C)(=O)=O)cc1-c1nc2ccc3c(c2[nH]1)CCCC3 ZINC000586945188 FG Annotated Anodyne Cc1nccc2[nH]c(-c3sccc3S(=O)(=O)NCc3ccco3)nc12 ZINC000586945249 FG Annotated Anodyne Cc1oc(CNS(C)(=O)=O)cc1-c1nc2cccc(C(C)(C)C)c2[nH]1 ZINC000586945582 FG Annotated Anodyne Cc1ccc2c(ccc3nc(-c4cc(CNS(C)(=O)=O)oc4C)[nH]c32)n1 ZINC000586945643 FG Annotated Anodyne O=S(=O)(NCc1ccco1)c1ccsc1-c1nc2ccccc2[nH]1 ZINC000586945734 FG Annotated Anodyne Cc1oc(CNS(C)(=O)=O)cc1-c1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC000586945929 FG Annotated Anodyne CNS(=O)(=O)c1ccc(CCc2nc3cc(Cl)cc(F)c3[nH]2)cc1 ZINC000586945955 FG Annotated Anodyne Cc1cnc2[nH]c(-c3sccc3S(=O)(=O)NCc3ccco3)nc2c1 ZINC000586946119 FG Annotated Anodyne Cc1ccc2nc(-c3sccc3S(=O)(=O)NCc3ccco3)[nH]c2n1 ZINC000586946124 FG Annotated Anodyne CNS(=O)(=O)c1ccc(CCc2nc3cc(Cl)c(F)cc3[nH]2)cc1 ZINC000586946346 FG Annotated Anodyne Cc1cncc2nc(-c3sccc3S(=O)(=O)NCc3ccco3)[nH]c12 ZINC000586946369 FG Annotated Anodyne Cc1ccnc2[nH]c(-c3sccc3S(=O)(=O)NCc3ccco3)nc12 ZINC000586946402 FG Annotated Anodyne CNS(=O)(=O)c1ccc(CCc2nc3cc(C)c(Cl)cc3[nH]2)cc1 ZINC000586946519 FG Annotated Anodyne CNS(=O)(=O)c1ccc(CCc2nc3ccc4c(c3[nH]2)CCCC4)cc1 ZINC000586946635 FG Annotated Anodyne CNS(=O)(=O)c1ccc(CCc2nc3ccc(OC(C)C)cc3[nH]2)cc1 ZINC000586946650 FG Annotated Anodyne CNS(=O)(=O)c1ccc(CCc2nc3ccc(Cl)c(C)c3[nH]2)cc1 ZINC000586947133 FG Annotated Anodyne CC(C)S(=O)(=O)Nc1ccc(-c2nc3c(Cl)nccc3[nH]2)cc1 ZINC000586947781 FG Annotated Anodyne CS(=O)(=O)Nc1ccc(O)c(-c2nc3cc(Cl)c(Cl)nc3[nH]2)c1 ZINC000586947994 FG Annotated Clean CC(C)(C)c1ccc2nc(Cc3ccccc3NS(C)(=O)=O)[nH]c2n1 ZINC000586947998 FG Annotated Anodyne Cc1ccc2c(ccc3nc(Cc4ccccc4NS(C)(=O)=O)[nH]c32)n1 ZINC000586948015 FG Annotated Anodyne CS(=O)(=O)Nc1ccc(O)c(-c2nc3cc(Cl)nc(Cl)c3[nH]2)c1 ZINC000586948054 FG Annotated Clean CS(=O)(=O)Nc1ccccc1Cc1nc2cnc3ccccc3c2[nH]1 ZINC000586948163 FG Annotated Anodyne CS(=O)(=O)Nc1ccc(O)c(-c2nc3ccc4c(c3[nH]2)CCCC4)c1 ZINC000586948248 FG Annotated Clean CS(=O)(=O)Nc1ccc(O)c(-c2nc3cc(Cl)c(F)c(F)c3[nH]2)c1 ZINC000586948453 FG Annotated Clean Cc1cc(Cl)cc2nc(-c3cc(NS(C)(=O)=O)ccc3O)[nH]c12 ZINC000586948539 FG Annotated Clean CC(C)Oc1ccc2nc(Cc3ccccc3NS(C)(=O)=O)[nH]c2c1 ZINC000586948642 FG Annotated Anodyne Cc1ccc2c(ccc3nc(-c4cc(NS(C)(=O)=O)ccc4O)[nH]c32)n1 ZINC000586948662 FG Annotated Clean CS(=O)(=O)Nc1ccc(O)c(-c2nc3c(Cl)cnc(Cl)c3[nH]2)c1 ZINC000586948826 FG Annotated Clean CS(=O)(=O)Nc1ccc(O)c(-c2nc3cc(Cl)cc(F)c3[nH]2)c1 ZINC000586948935 FG Annotated Clean CS(=O)(=O)Nc1ccc(O)c(-c2nc3cccc(C(F)(F)F)c3[nH]2)c1 ZINC000586949008 FG Annotated Clean CS(=O)(=O)Nc1ccccc1Cc1nc2ccc3c(c2[nH]1)CCCC3 ZINC000586949014 FG Annotated Anodyne CS(=O)(=O)Nc1ccc(O)c(-c2nc3c(Cl)c(Cl)cnc3[nH]2)c1 ZINC000586949378 FG Annotated Clean CS(=O)(=O)Nc1ccccc1Cc1nc2ccc3ncccc3c2[nH]1 ZINC000586949603 FG Annotated Anodyne Cc1c(Cl)ccc2nc(-c3cc(NS(C)(=O)=O)ccc3O)[nH]c12 ZINC000586949738 FG Annotated Clean CS(=O)(=O)Nc1ccccc1Cc1nc2cc(Cl)c(F)cc2[nH]1 ZINC000586949850 FG Annotated Anodyne COc1cc2nc(Cc3ccccc3NS(C)(=O)=O)[nH]c2cc1Cl ZINC000586949929 FG Annotated Anodyne CS(=O)(=O)Nc1ccccc1Cc1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000586949939 FG Annotated Anodyne CS(=O)(=O)Nc1ccccc1Cc1nc2cc(C#N)cc(Cl)c2[nH]1 ZINC000586949965 FG Annotated Mild CS(=O)(=O)Nc1ccccc1Cc1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000586949970 FG Annotated Anodyne CS(=O)(=O)Nc1ccccc1Cc1nc2cc(Cl)c(F)c(F)c2[nH]1 ZINC000586949993 FG Annotated Anodyne Cc1ccc(S(=O)(=O)Nc2ccccc2-c2nc3cncnc3[nH]2)cc1 ZINC000586949996 FG Annotated Anodyne CS(=O)(=O)Nc1ccccc1Cc1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000586949999 FG Annotated Anodyne CS(=O)(=O)Nc1ccccc1Cc1nc2cc(Cl)cc(F)c2[nH]1 ZINC000586950063 FG Annotated Anodyne CS(=O)(=O)Nc1ccccc1Cc1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000586950113 FG Annotated Anodyne CS(=O)(=O)Nc1ccc(-c2nc3c(F)c(F)c(F)c(F)c3[nH]2)cc1 ZINC000586950189 FG Annotated Anodyne CS(=O)(=O)Nc1ccccc1Cc1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000586950197 FG Annotated Anodyne Cc1ccc(S(=O)(=O)Nc2ccccc2-c2nc3ncc[nH]c-3n2)cc1 ZINC000586950546 FG Annotated Anodyne Cc1nc(NS(C)(=O)=O)sc1-c1nc2cc(Cl)cc(C)c2[nH]1 ZINC000586950708 FG Annotated Anodyne Cc1nc(NS(C)(=O)=O)sc1-c1nc2ccc(Cl)c(C)c2[nH]1 ZINC000586950713 FG Annotated Anodyne Cc1ccc2c(ccc3nc(-c4sc(NS(C)(=O)=O)nc4C)[nH]c32)n1 ZINC000586950826 FG Annotated Anodyne COc1cc2nc(-c3sc(NS(C)(=O)=O)nc3C)[nH]c2cc1Cl ZINC000586950840 FG Annotated Anodyne Cc1cc2nc(-c3sc(NS(C)(=O)=O)nc3C)[nH]c2cc1Cl ZINC000586950877 FG Annotated Anodyne Cc1nc(NS(C)(=O)=O)sc1-c1nc2ccc(C(C)(C)C)nc2[nH]1 ZINC000586951121 FG Annotated Anodyne Cc1nc(NS(C)(=O)=O)sc1-c1nc2ccc(OC(C)C)cc2[nH]1 ZINC000586951491 FG Annotated Anodyne O=S(=O)(Cc1nc2ccccc2[nH]1)Nc1ccc(N2CCCCC2)cc1 ZINC000586951500 FG Annotated Anodyne Cc1nc(NS(C)(=O)=O)sc1-c1nc2cc(Cl)cc(F)c2[nH]1 ZINC000586951722 FG Annotated Anodyne Cc1nc(NS(C)(=O)=O)sc1-c1nc2cc(Cl)c(F)cc2[nH]1 ZINC000586951744 FG Annotated Anodyne Cc1nc(NS(C)(=O)=O)sc1-c1nc2ccc3c(c2[nH]1)CCCC3 ZINC000586951783 FG Annotated Anodyne CCCS(=O)(=O)N1CCC(c2nc3cc(C#N)cc(Cl)c3[nH]2)CC1 ZINC000586951942 FG Annotated Mild CCCS(=O)(=O)N1CCC(c2nc3cnc4ccccc4c3[nH]2)CC1 ZINC000586951960 FG Annotated Anodyne COc1cc2nc(CS(=O)(=O)NC3CCC(C)CC3)[nH]c2cc1Cl ZINC000586952113 FG Annotated Anodyne CCCS(=O)(=O)N1CCC(c2nc3ccc4c(c3[nH]2)CCCC4)CC1 ZINC000586952234 FG Annotated Anodyne CCCS(=O)(=O)N1CCC(c2nc3ccc4nc(C)ccc4c3[nH]2)CC1 ZINC000586952393 FG Annotated Anodyne CC1CCC(NS(=O)(=O)Cc2nc3cc(Cl)cc(F)c3[nH]2)CC1 ZINC000586952465 FG Annotated Anodyne CC1CCC(NS(=O)(=O)Cc2nc3cc(Cl)c(F)cc3[nH]2)CC1 ZINC000586952558 FG Annotated Anodyne CC1CCC(NS(=O)(=O)Cc2nc3cnc4ccccc4c3[nH]2)CC1 ZINC000586952599 FG Annotated Anodyne CCCS(=O)(=O)N1CCC(c2nc3cc(Cl)cc(C)c3[nH]2)CC1 ZINC000586952707 FG Annotated Anodyne CCCS(=O)(=O)N1CCC(c2nc3ccc4ncccc4c3[nH]2)CC1 ZINC000586952812 FG Annotated Anodyne O=S(=O)(Nc1cccnc1)c1ccsc1-c1nc2cccc(O)c2[nH]1 ZINC000586952841 FG Annotated Anodyne O=S(=O)(Nc1cccnc1)c1ccsc1-c1nc2ccccc2[nH]1 ZINC000586952842 FG Annotated Anodyne CSc1ccc2nc(CS(=O)(=O)NC3CCC(C)CC3)[nH]c2c1 ZINC000586952967 FG Annotated Anodyne CC1CCC(NS(=O)(=O)Cc2nc3ccc4ncccc4c3[nH]2)CC1 ZINC000586953283 FG Annotated Anodyne Cc1cncc2nc(-c3sccc3S(=O)(=O)Nc3cccnc3)[nH]c12 ZINC000586953324 FG Annotated Anodyne Cc1ccc2c(ccc3nc(CS(=O)(=O)NC4CCC(C)CC4)[nH]c32)n1 ZINC000586953409 FG Annotated Anodyne Cc1ccnc2[nH]c(-c3sccc3S(=O)(=O)Nc3cccnc3)nc12 ZINC000586953452 FG Annotated Anodyne CC1CCC(NS(=O)(=O)Cc2nc3ccc4c(c3[nH]2)CCCC4)CC1 ZINC000586953584 FG Annotated Anodyne CCCS(=O)(=O)N1CCC(c2nc3cc(Cl)cc(F)c3[nH]2)CC1 ZINC000586953588 FG Annotated Anodyne CC1CCC(NS(=O)(=O)Cc2nc3ccc(C(C)(C)C)nc3[nH]2)CC1 ZINC000586953602 FG Annotated Anodyne Cc1nccc2[nH]c(-c3sccc3S(=O)(=O)Nc3cccnc3)nc12 ZINC000586953641 FG Annotated Anodyne CC1CCC(NS(=O)(=O)Cc2nc3ccc(OC(C)C)cc3[nH]2)CC1 ZINC000586953681 FG Annotated Anodyne CC1CCC(NS(=O)(=O)Cc2nc3cc(C#N)cc(Cl)c3[nH]2)CC1 ZINC000586953766 FG Annotated Mild CCCS(=O)(=O)N1CCC(c2nc3ccc(OC(C)C)cc3[nH]2)CC1 ZINC000586953782 FG Annotated Anodyne Cc1ccc2nc(-c3sccc3S(=O)(=O)Nc3cccnc3)[nH]c2n1 ZINC000586953826 FG Annotated Anodyne O=S(=O)(Nc1cccnc1)c1ccsc1-c1nc2ccc(O)cc2[nH]1 ZINC000586954039 FG Annotated Anodyne CCCS(=O)(=O)N1CCC(c2nc3ccc(C(C)(C)C)nc3[nH]2)CC1 ZINC000586954510 FG Annotated Anodyne CCCS(=O)(=O)N1CCC(c2nc3ccc(SC)cc3[nH]2)CC1 ZINC000586954672 FG Annotated Anodyne O=[S@@](CCCc1nc2cccnc2[nH]1)c1ccc(Br)cc1 ZINC000586957654 FG Annotated Anodyne O=[S@](CCCc1nc2cccnc2[nH]1)c1ccc(Br)cc1 ZINC000586957656 FG Annotated Anodyne CC(C)(SCc1nc2cc(C#N)cc(Br)c2[nH]1)C(=O)O ZINC000586957922 FG Annotated Mild CC(C)(SCC(=O)O)c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000586957965 FG Annotated Anodyne CC(C)(SCC(=O)O)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000586958056 FG Annotated Anodyne N=c1[nH]ccc2nc(C[S@@](=O)C(c3ccccc3)c3ccccc3)[nH]c12 ZINC000586958096 FG Annotated Anodyne N=c1[nH]ccc2nc(C[S@](=O)C(c3ccccc3)c3ccccc3)[nH]c12 ZINC000586958098 FG Annotated Anodyne CC(C)(SCC(=O)O)c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000586958502 FG Annotated Anodyne O=[S@](Cc1nc2cnnc(O)c2[nH]1)C(c1ccccc1)c1ccccc1 ZINC000586958542 FG Annotated Anodyne O=[S@@](Cc1nc2cnnc(O)c2[nH]1)C(c1ccccc1)c1ccccc1 ZINC000586958543 FG Annotated Anodyne CC(C)(SCc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1)C(=O)O ZINC000586958882 FG Annotated Bother O=[S@@](Cc1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1)CC1CC1 ZINC000586959108 FG Annotated Anodyne O=[S@](Cc1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1)CC1CC1 ZINC000586959110 FG Annotated Anodyne CC(C)(SCC(=O)O)c1nc2cc(C#N)cc(Br)c2[nH]1 ZINC000586959329 FG Annotated Mild CC(C)(C)c1ccc2nc([C@@](C)(N)c3ccc(S(=O)(=O)O)cc3)[nH]c2c1 ZINC000586959644 FG Annotated Anodyne CC(C)(C)c1ccc2nc([C@](C)(N)c3ccc(S(=O)(=O)O)cc3)[nH]c2c1 ZINC000586959645 FG Annotated Anodyne CC(C)(SCc1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1)C(=O)O ZINC000586959649 FG Annotated Bother CC(C)(SCc1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1)C(=O)O ZINC000586959753 FG Annotated Anodyne O=[S@@](CCCc1nc2cnccc2[nH]1)c1ccc(Br)cc1 ZINC000586959767 FG Annotated Anodyne O=[S@](CCCc1nc2cnccc2[nH]1)c1ccc(Br)cc1 ZINC000586959769 FG Annotated Anodyne CC(C)(SCC(=O)O)c1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1 ZINC000586959940 FG Annotated Anodyne CC(C)(SCc1nc2cc(Br)cc(C(=O)O)c2[nH]1)C(=O)O ZINC000586960080 FG Annotated Anodyne CC(C)(SCc1nc2c(Cl)c(Br)cnc2[nH]1)C(=O)O ZINC000586960156 FG Annotated Anodyne CC(C)(SCc1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1)C(=O)O ZINC000586960392 FG Annotated Anodyne C[C@H](Sc1nc(N)cc(O)n1)c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000586960405 FG Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000586960406 FG Annotated Anodyne CC(C)(C)c1cccc2nc([C@@](C)(N)c3ccc(S(=O)(=O)O)cc3)[nH]c12 ZINC000586960490 FG Annotated Anodyne CC(C)(C)c1cccc2nc([C@](C)(N)c3ccc(S(=O)(=O)O)cc3)[nH]c12 ZINC000586960492 FG Annotated Anodyne CC(C)(SCC(=O)O)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000586960600 FG Annotated Bother CC(C)(SCC(=O)O)c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000586960626 FG Annotated Anodyne CC(C)(SCc1nc2c(Br)cnc(Cl)c2[nH]1)C(=O)O ZINC000586960751 FG Annotated Anodyne N=c1cc2nc(C[S@@](=O)C(c3ccccc3)c3ccccc3)[nH]c2c[nH]1 ZINC000586960923 FG Annotated Anodyne N=c1cc2nc(C[S@](=O)C(c3ccccc3)c3ccccc3)[nH]c2c[nH]1 ZINC000586960924 FG Annotated Anodyne CC(C)(SCC(=O)O)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000586960973 FG Annotated Bother O=[S@](Cc1nc2c(O)ncnc2[nH]1)C(c1ccccc1)c1ccccc1 ZINC000586961323 FG Annotated Anodyne O=[S@@](Cc1nc2c(O)ncnc2[nH]1)C(c1ccccc1)c1ccccc1 ZINC000586961324 FG Annotated Anodyne C[C@H](Sc1nc(N)cc(O)n1)c1nc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000586961378 FG Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000586961379 FG Annotated Anodyne C[C@H](Sc1nc(N)cc(O)n1)c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000586961552 FG Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000586961553 FG Annotated Anodyne C[C@H](Sc1nc(N)cc(O)n1)c1nc2cccc(Br)c2[nH]1 ZINC000586961596 FG Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2cccc(Br)c2[nH]1 ZINC000586961599 FG Annotated Anodyne C[C@H](Sc1nc(N)cc(O)n1)c1nc2ccc(Br)cc2[nH]1 ZINC000586961717 FG Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2ccc(Br)cc2[nH]1 ZINC000586961718 FG Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000586961987 FG Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000586961988 FG Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000586962021 FG Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000586962023 FG Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000586962135 FG Annotated Bother C[C@H](Sc1nc(N)cc(O)n1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000586962137 FG Annotated Bother CC[C@H](Sc1nc(C)cc(O)n1)c1nc2cc(C#N)c(C#N)cc2[nH]1 ZINC000586962157 FG Annotated Mild CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2cc(C#N)c(C#N)cc2[nH]1 ZINC000586962165 FG Annotated Mild C[C@H](Sc1nc(N)cc(O)n1)c1nc2cc(Cl)c(F)c(F)c2[nH]1 ZINC000586962303 FG Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2cc(Cl)c(F)c(F)c2[nH]1 ZINC000586962305 FG Annotated Anodyne C[C@H](Sc1nc(N)cc(O)n1)c1nc2cccc(OC(F)(F)F)c2[nH]1 ZINC000586962337 FG Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2cccc(OC(F)(F)F)c2[nH]1 ZINC000586962338 FG Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000586962564 FG Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000586962565 FG Annotated Anodyne COc1cc2nc([C@H](C)Sc3nc(N)cc(O)n3)[nH]c2cc1Cl ZINC000586962636 FG Annotated Anodyne COc1cc2nc([C@@H](C)Sc3nc(N)cc(O)n3)[nH]c2cc1Cl ZINC000586962637 FG Annotated Anodyne Cc1ccc2c(ccc3nc([C@@H](C)Sc4nc(N)cc(O)n4)[nH]c32)n1 ZINC000586963001 FG Annotated Anodyne Cc1ccc2c(ccc3nc([C@H](C)Sc4nc(N)cc(O)n4)[nH]c32)n1 ZINC000586963004 FG Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000586963033 FG Annotated Anodyne C[C@H](Sc1nc(N)cc(O)n1)c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000586963034 FG Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2ccc(C(=O)N(C)C)cc2[nH]1 ZINC000586963060 FG Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2ccc(C(=O)N(C)C)cc2[nH]1 ZINC000586963061 FG Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000586963102 FG Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000586963103 FG Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2cccc(C(=O)OC)c2[nH]1 ZINC000586963107 FG Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2cccc(C(=O)OC)c2[nH]1 ZINC000586963108 FG Annotated Anodyne C[C@H](Sc1nc(N)cc(O)n1)c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000586963183 FG Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000586963184 FG Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2ccc(C(=O)OC)cc2[nH]1 ZINC000586963201 FG Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2ccc(C(=O)OC)cc2[nH]1 ZINC000586963203 FG Annotated Anodyne C[C@H](Sc1nc(N)cc(O)n1)c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000586963239 FG Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000586963241 FG Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2cc(F)cc(C(=O)O)c2[nH]1 ZINC000586963597 FG Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2cc(F)cc(C(=O)O)c2[nH]1 ZINC000586963598 FG Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2cc(C(=O)O)c(F)cc2[nH]1 ZINC000586964066 FG Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2cc(C(=O)O)c(F)cc2[nH]1 ZINC000586964067 FG Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000586964128 FG Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000586964129 FG Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000586964130 FG Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000586964131 FG Annotated Anodyne C[C@@H](Sc1ncccn1)c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000586964207 FG Annotated Anodyne C[C@H](Sc1ncccn1)c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000586964208 FG Annotated Anodyne CN1CCN(c2ccc3nc(CSc4ccccc4C#N)[nH]c3c2)CC1 ZINC000586964481 FG Annotated Mild CCn1c(Cn2ccc(C)n2)nnc1SCc1nc2ccc(C)cc2[nH]1 ZINC000586964774 FG Annotated Anodyne CCn1c(Cn2ccc(C)n2)nnc1SCc1nc2ccccc2[nH]1 ZINC000586964816 FG Annotated Anodyne CCn1c(Cn2ccc(C)n2)nnc1SCc1nc2cccc(F)c2[nH]1 ZINC000586965222 FG Annotated Anodyne Cc1ccc(-c2nnc(SCc3nc4cc(N)c(N)cc4[nH]3)n2C)cc1 ZINC000586965245 FG Annotated Anodyne COc1nccc2nc(CSc3nnc(-c4ccc(C)cc4)n3C)[nH]c12 ZINC000586965249 FG Annotated Anodyne CCn1c(Cn2ccc(C)n2)nnc1SCc1nc2ccc(F)cc2[nH]1 ZINC000586965328 FG Annotated Anodyne Cc1ccc(-c2nnc(SCc3nc4cc(F)cnc4[nH]3)n2C)cc1 ZINC000586965375 FG Annotated Anodyne Cc1ccc(-c2nnc(SCc3nc4nc(Cl)c[nH]c-4n3)n2C)cc1 ZINC000586965384 FG Annotated Anodyne Cc1ccc(-c2nnc(SCc3nc4ccnc(O)c4[nH]3)n2C)cc1 ZINC000586965533 FG Annotated Anodyne CCn1c(Cn2ccc(C)n2)nnc1SCc1nc2cccc(C)c2[nH]1 ZINC000586965575 FG Annotated Anodyne COc1cc2nc(CSc3nnc(-c4ccc(C)cc4)n3C)[nH]c2cn1 ZINC000586965579 FG Annotated Anodyne Cc1ccc(-c2nnc(SCc3nc4cnc(Cl)[nH]c-4n3)n2C)cc1 ZINC000586965587 FG Annotated Anodyne COc1cncc2nc(CSc3nnc(-c4ccc(C)cc4)n3C)[nH]c12 ZINC000586965695 FG Annotated Anodyne Cc1ccc(-c2nnc(SCc3nc4ccc(CO)cc4[nH]3)n2C)cc1 ZINC000586965789 FG Annotated Anodyne Cc1ccc(-c2nnc(SCc3nc4c(Cl)ncnc4[nH]3)n2C)cc1 ZINC000586965806 FG Annotated Anodyne c1ccc(Cn2c(SCc3nc4ncc[nH]c-4n3)nnc2C2CC2)cc1 ZINC000586966111 FG Annotated Anodyne Cc1ccc(-n2ccnc2SCc2nc3cnnc(O)c3[nH]2)c(C)c1 ZINC000586966112 FG Annotated Anodyne Cc1ccc(-n2ccnc2SCc2nc3c(O)ncnc3[nH]2)c(C)c1 ZINC000586966119 FG Annotated Anodyne Cc1ccc(-n2ccnc2SCc2nc3cc(=N)[nH]cc3[nH]2)c(C)c1 ZINC000586966134 FG Annotated Anodyne CCc1cc(O)nc(SCc2nc3cc(Br)cnc3[nH]2)n1 ZINC000586966204 FG Annotated Anodyne CCc1cc(O)nc(SCc2nc3cc4c(cc3[nH]2)OCCCO4)n1 ZINC000586966231 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(CSc3nc(O)cc(CC)n3)[nH]c2c1 ZINC000586966252 FG Annotated Anodyne Cc1c(Br)ccc2nc(CSc3nc(O)cc(O)n3)[nH]c12 ZINC000586966265 FG Annotated Anodyne CCc1cc(O)nc(SCc2nc3cc(C(F)(F)F)cnc3[nH]2)n1 ZINC000586966320 FG Annotated Anodyne O=C(O)c1cc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2cc1F ZINC000586966329 FG Annotated Anodyne c1cncc(-c2noc(SCc3nc4cc5c(cc4[nH]3)OCCO5)n2)c1 ZINC000586966333 FG Annotated Anodyne O=[N+]([O-])c1cccc2nc(CSc3nc(-c4cccnc4)no3)[nH]c12 ZINC000586966373 FG Annotated Bother O=C(O)c1cccnc1SCc1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000586966385 FG Annotated Anodyne c1ccc(Cn2c(SCc3nc4cncnc4[nH]3)nnc2C2CC2)cc1 ZINC000586966419 FG Annotated Anodyne O=C(O)c1cccnc1SCc1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000586966426 FG Annotated Anodyne COC(=O)c1cccc2nc(CSc3nc(-c4cccnc4)no3)[nH]c12 ZINC000586966437 FG Annotated Anodyne CCc1cc(O)nc(SCc2nc3cc4c(cc3[nH]2)OC(F)(F)O4)n1 ZINC000586966521 FG Annotated Anodyne CCc1cc(O)nc(SCc2nc3cncc(Br)c3[nH]2)n1 ZINC000586966555 FG Annotated Anodyne CCOC(=O)c1ccc2nc(CSc3nc(O)cc(CC)n3)[nH]c2c1 ZINC000586966590 FG Annotated Anodyne CCc1cc(O)nc(SCc2nc3cc([N+](=O)[O-])c(Cl)cc3[nH]2)n1 ZINC000586966592 FG Annotated Bother CCc1cc(O)nc(SCc2nc3c(F)c(F)c(F)c(F)c3[nH]2)n1 ZINC000586966593 FG Annotated Anodyne CCc1cc(O)nc(SCc2nc3ccc(Br)nc3[nH]2)n1 ZINC000586966603 FG Annotated Anodyne Oc1cc(O)nc(SCc2nc3cc(C(F)(F)F)c(F)cc3[nH]2)n1 ZINC000586966604 FG Annotated Anodyne O=C(O)c1cccnc1SCc1nc2cncc(Br)c2[nH]1 ZINC000586966616 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2cc1F ZINC000586966619 FG Annotated Bother O=[N+]([O-])c1ccc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2c1 ZINC000586966628 FG Annotated Bother O=C(O)c1cccnc1SCc1nc2ccc(Br)nc2[nH]1 ZINC000586966649 FG Annotated Anodyne Fc1cnc(Cl)c2[nH]c(CSc3nc(-c4cccnc4)no3)nc12 ZINC000586966662 FG Annotated Anodyne O=C(O)CSc1ncccc1-c1nc2ncc(C(F)(F)F)cc2[nH]1 ZINC000586966670 FG Annotated Anodyne N#Cc1cc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2cc1C#N ZINC000586966682 FG Annotated Mild N#Cc1nc(Cl)cc2nc(CSc3nc(-c4cccnc4)no3)[nH]c12 ZINC000586966698 FG Annotated Mild Cc1ccc(-n2ccnc2SCc2nc3c(N)ncnc3[nH]2)c(C)c1 ZINC000586966780 FG Annotated Anodyne Oc1cc(O)nc(SCc2nc3cc(F)cc(C(F)(F)F)c3[nH]2)n1 ZINC000586966816 FG Annotated Anodyne c1ccc(Cn2c(SCc3nc4cnncc4[nH]3)nnc2C2CC2)cc1 ZINC000586966823 FG Annotated Anodyne CCc1cc(O)nc(SCc2nc3cc(-n4cccn4)c(F)cc3[nH]2)n1 ZINC000586966827 FG Annotated Anodyne Cc1cc(Br)c2[nH]c(CSc3nc(O)cc(O)n3)nc2c1 ZINC000586966835 FG Annotated Anodyne N[C@@H](N=O)c1ccc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2c1 ZINC000586966925 FG Annotated Anodyne N[C@H](N=O)c1ccc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2c1 ZINC000586966926 FG Annotated Anodyne O=C(O)CSc1ncccc1-c1nc2cnc(C(F)(F)F)cc2[nH]1 ZINC000586966927 FG Annotated Anodyne COc1cc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2cc1F ZINC000586966941 FG Annotated Anodyne COC(=O)c1ccc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2c1 ZINC000586966956 FG Annotated Anodyne CCc1cc(O)nc(SCc2nc3cc(Br)ncc3[nH]2)n1 ZINC000586967001 FG Annotated Anodyne O=C(O)c1cccnc1SCc1nc2cc(Br)cnc2[nH]1 ZINC000586967026 FG Annotated Anodyne CCc1cc(O)nc(SCc2nc3cc(C(F)(F)F)ncc3[nH]2)n1 ZINC000586967132 FG Annotated Anodyne Cc1ccc(-n2ccnc2SCc2nc3cc[nH]c(=N)c3[nH]2)c(C)c1 ZINC000586967172 FG Annotated Anodyne O=C(O)CSc1ncccc1-c1nc2cc(F)c(-n3cccn3)cc2[nH]1 ZINC000586967290 FG Annotated Anodyne Cc1cc2nc(CSc3nc(O)cc(O)n3)[nH]c2cc1Br ZINC000586967302 FG Annotated Anodyne Cc1cc(Br)cc2nc(CSc3nc(O)cc(O)n3)[nH]c12 ZINC000586967313 FG Annotated Anodyne CCc1cc(O)nc(SCc2nc3ccnc(Br)c3[nH]2)n1 ZINC000586967329 FG Annotated Anodyne O=C(O)c1cccnc1SCc1nc2ccnc(Br)c2[nH]1 ZINC000586967346 FG Annotated Anodyne c1cncc(-c2noc(SCc3nc4cc5c(cc4[nH]3)OCO5)n2)c1 ZINC000586967371 FG Annotated Anodyne COc1cc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2cc1OC ZINC000586967399 FG Annotated Anodyne COc1cc(OC)c2[nH]c(CSc3nc(-c4cccnc4)no3)nc2c1 ZINC000586967413 FG Annotated Anodyne O=C(O)c1cccnc1SCc1nc2cc(Br)ncc2[nH]1 ZINC000586967445 FG Annotated Anodyne O=C(O)c1cccnc1SCc1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000586967451 FG Annotated Anodyne O=C(O)CSc1ncccc1-c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000586967457 FG Annotated Anodyne O=C(O)c1cc(F)cc2nc(CSc3nc(-c4cccnc4)no3)[nH]c12 ZINC000586967479 FG Annotated Anodyne O=C(O)c1cccnc1SCc1nc2c(Br)ccnc2[nH]1 ZINC000586967484 FG Annotated Anodyne CCOC(=O)c1ccc2nc(CSc3ncccc3C(=O)O)[nH]c2c1 ZINC000586967618 FG Annotated Anodyne CCc1cc(O)nc(SCc2nc3c(Br)ccnc3[nH]2)n1 ZINC000586968073 FG Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3c(N)ccnc3[nH]2)cc1Cl ZINC000586968104 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(CSc3ncccc3C(=O)O)[nH]c2c1 ZINC000586968144 FG Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3cc(=N)[nH]cc3[nH]2)cc1Cl ZINC000586968423 FG Annotated Anodyne CSCC(C)(C)c1nc2ccc(S(=O)(=O)C(F)(F)F)cc2[nH]1 ZINC000586968638 FG Annotated Anodyne [O-][n+]1ccccc1SCc1nc2cc(F)cc(Br)c2[nH]1 ZINC000586968651 FG Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3ncc[nH]c-3n2)cc1Cl ZINC000586968737 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc(C(C)(C)CSC)[nH]c2c1 ZINC000586968739 FG Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3cncnc3[nH]2)cc1Cl ZINC000586968864 FG Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3cc[nH]c(=N)c3[nH]2)cc1Cl ZINC000586968891 FG Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3ccnc(O)c3[nH]2)cc1Cl ZINC000586968934 FG Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3cnncc3[nH]2)cc1Cl ZINC000586968948 FG Annotated Anodyne O=C(O)c1cccnc1SCc1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000586968984 FG Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc(C(C)(C)CSC)[nH]c2c1 ZINC000586969210 FG Annotated Anodyne [O-][n+]1ccccc1SCc1nc2cc(Br)c(F)cc2[nH]1 ZINC000586969432 FG Annotated Anodyne [O-][n+]1ccccc1SCc1nc2cc(Br)cc(F)c2[nH]1 ZINC000586969577 FG Annotated Anodyne [O-][n+]1ccccc1SCc1nc2ccc(F)c(Br)c2[nH]1 ZINC000586969587 FG Annotated Anodyne N#Cc1cc2nc(CSc3cccc[n+]3[O-])[nH]c2cc1C(F)(F)F ZINC000586970048 FG Annotated Mild N#Cc1cc(Br)c2[nH]c(CSc3cccc[n+]3[O-])nc2c1 ZINC000586970060 FG Annotated Mild [O-][n+]1ccccc1SCc1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000586970072 FG Annotated Anodyne [O-][n+]1ccccc1SCc1nc2ccc(Br)c(F)c2[nH]1 ZINC000586970107 FG Annotated Anodyne Cc1ccc(CSCCc2nc3ccc(-n4cnnn4)cc3[nH]2)cc1 ZINC000586970240 FG Annotated Anodyne Nc1ccc(-c2ccc3nc(CSc4cccc[n+]4[O-])[nH]c3c2)cc1N ZINC000586970272 FG Annotated Anodyne CCCC(Br)(CCC)c1nc2ccc(C(=O)NN)cc2[nH]1 ZINC000586970318 FG Annotated Reactive [O-][n+]1ccccc1SCc1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000586970376 FG Annotated Anodyne COC(C)(C)[C@H](Br)c1nc2ccc(C(=O)N(C)C)cc2[nH]1 ZINC000586970545 FG Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2ccc(C(=O)N(C)C)cc2[nH]1 ZINC000586970549 FG Annotated Reactive COC(=O)c1cc2[nH]c([C@@H](Br)C(C)(C)OC)nc2cc1OC ZINC000586970693 FG Annotated Reactive COC(=O)c1cc2[nH]c([C@H](Br)C(C)(C)OC)nc2cc1OC ZINC000586970696 FG Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2ccc(OCCN(C)C)cc2[nH]1 ZINC000586970718 FG Annotated Reactive COC(C)(C)[C@H](Br)c1nc2ccc(OCCN(C)C)cc2[nH]1 ZINC000586970720 FG Annotated Reactive CCOC(=O)c1cc(Br)c2[nH]c(CBr)nc2c1 ZINC000586970771 FG Annotated Reactive BrCc1nc2c(Br)cnc(Br)c2[nH]1 ZINC000586970788 FG Annotated Reactive CCCC(Br)(CCC)c1nc2ccc(S(N)(=O)=O)cc2[nH]1 ZINC000586970995 FG Annotated Anodyne Cc1ccc(NC(=O)CSCCc2nc3nc(Cl)c[nH]c-3n2)cc1 ZINC000586971102 FG Annotated Anodyne COC(C)(C)[C@@H](Br)c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000586971454 FG Annotated Reactive COC(C)(C)[C@H](Br)c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000586971458 FG Annotated Reactive COC(C)(C)[C@H](Br)c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000586971488 FG Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000586971493 FG Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000586971605 FG Annotated Reactive COC(C)(C)[C@H](Br)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000586971606 FG Annotated Reactive COC(=O)c1ccc2nc([C@@H](Br)C(C)(C)OC)[nH]c2c1OC ZINC000586971786 FG Annotated Reactive COC(=O)c1ccc2nc([C@H](Br)C(C)(C)OC)[nH]c2c1OC ZINC000586971787 FG Annotated Reactive CCCC(Br)(CCC)c1nc2cccc(S(N)(=O)=O)c2[nH]1 ZINC000586971862 FG Annotated Anodyne COc1cc2nc([C@H](CSCc3ccccc3)NC(C)=O)[nH]c2cn1 ZINC000586971934 FG Annotated Anodyne COc1cc2nc([C@@H](CSCc3ccccc3)NC(C)=O)[nH]c2cn1 ZINC000586971935 FG Annotated Anodyne COc1ccc2nc([C@H](CSCc3ccccc3)NC(C)=O)[nH]c2n1 ZINC000586972032 FG Annotated Anodyne BrCCCCc1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000586972099 FG Annotated Reactive CC1=C(c2ccc3nc(CCCCBr)[nH]c3c2)NNC(=O)C1 ZINC000586972158 FG Annotated Reactive COc1ccc2nc([C@@H](CSCc3ccccc3)NC(C)=O)[nH]c2n1 ZINC000586972181 FG Annotated Anodyne CC(=O)N[C@H](CSCc1ccccc1)c1nc2cnc(Cl)[nH]c-2n1 ZINC000586972184 FG Annotated Anodyne CC(=O)N[C@@H](CSCc1ccccc1)c1nc2cnc(Cl)[nH]c-2n1 ZINC000586972185 FG Annotated Anodyne CC(C)CSc1ccc([N+](=O)[O-])cc1-c1nc2c(O)nc(O)nc2[nH]1 ZINC000586972236 FG Annotated Bother COc1nccc2nc([C@H](CSCc3ccccc3)NC(C)=O)[nH]c12 ZINC000586972278 FG Annotated Anodyne COc1nccc2nc([C@@H](CSCc3ccccc3)NC(C)=O)[nH]c12 ZINC000586972279 FG Annotated Anodyne Clc1ncc(I)c2nc(CBr)[nH]c12 ZINC000586972557 FG Annotated Reactive O=C(O)c1cc(Br)cc2nc(/C=C/CBr)[nH]c12 ZINC000586972666 FG Annotated Reactive O=C(O)c1cc(Br)cc2nc(/C=C\CBr)[nH]c12 ZINC000586972670 FG Annotated Reactive C[C@H](c1ccc(CBr)cc1)c1nc2[nH]c(=N)[nH]c(Cl)c-2n1 ZINC000586972958 FG Annotated Reactive C[C@@H](c1ccc(CBr)cc1)c1nc2[nH]c(=N)[nH]c(Cl)c-2n1 ZINC000586972959 FG Annotated Reactive C[C@H](c1ccc(CBr)cc1)c1nc2nc(C#N)c(C#N)nc2[nH]1 ZINC000586973137 FG Annotated Reactive C[C@@H](c1ccc(CBr)cc1)c1nc2nc(C#N)c(C#N)nc2[nH]1 ZINC000586973138 FG Annotated Reactive C[C@H](c1ccc(CBr)cc1)c1nc2c(O)nc(S)nc2[nH]1 ZINC000586973407 FG Annotated Reactive C[C@@H](c1ccc(CBr)cc1)c1nc2c(O)nc(S)nc2[nH]1 ZINC000586973408 FG Annotated Reactive CC(=O)N[C@@H](CSCc1ccccc1)c1nc2ccc(C(=O)O)cc2[nH]1 ZINC000586973435 FG Annotated Anodyne CC(=O)N[C@H](CSCc1ccccc1)c1nc2ccc(C(=O)O)cc2[nH]1 ZINC000586973436 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc(/C=C/CBr)[nH]c2c1 ZINC000586973573 FG Annotated Reactive CCN(CC)S(=O)(=O)c1ccc2nc(/C=C\CBr)[nH]c2c1 ZINC000586973574 FG Annotated Reactive CC(=O)N[C@@H](CSCc1ccccc1)c1nc2cc3c(cc2[nH]1)OCO3 ZINC000586973896 FG Annotated Anodyne CC(=O)N[C@H](CSCc1ccccc1)c1nc2cc3c(cc2[nH]1)OCO3 ZINC000586973900 FG Annotated Anodyne CC(=O)N[C@@H](CSCc1ccccc1)c1nc2ccc(CCO)cc2[nH]1 ZINC000586973960 FG Annotated Anodyne CC(=O)N[C@H](CSCc1ccccc1)c1nc2ccc(CCO)cc2[nH]1 ZINC000586973962 FG Annotated Anodyne CC(=O)N[C@H](CSCc1ccccc1)c1nc2nc(Cl)c[nH]c-2n1 ZINC000586973978 FG Annotated Anodyne CC(=O)N[C@@H](CSCc1ccccc1)c1nc2nc(Cl)c[nH]c-2n1 ZINC000586973980 FG Annotated Anodyne C[C@@H](c1ccc(CBr)cc1)c1nc2ccc(C(=O)NN)cc2[nH]1 ZINC000586974121 FG Annotated Reactive C[C@H](c1ccc(CBr)cc1)c1nc2ccc(C(=O)NN)cc2[nH]1 ZINC000586974126 FG Annotated Reactive Oc1nc(NCc2ccccc2)c2nc(/C=C\CBr)nc-2[nH]1 ZINC000586974553 FG Annotated Reactive Oc1nc(NCc2ccccc2)c2nc(/C=C/CBr)nc-2[nH]1 ZINC000586974556 FG Annotated Reactive CC(=O)N[C@@H](CSCc1ccccc1)c1nc2cccc(C(=O)O)c2[nH]1 ZINC000586974678 FG Annotated Anodyne CC(=O)N[C@H](CSCc1ccccc1)c1nc2cccc(C(=O)O)c2[nH]1 ZINC000586974679 FG Annotated Anodyne O=S(=O)(c1ccc2nc(/C=C/CBr)[nH]c2c1)C(F)(F)F ZINC000586974797 FG Annotated Reactive O=S(=O)(c1ccc2nc(/C=C\CBr)[nH]c2c1)C(F)(F)F ZINC000586974798 FG Annotated Reactive COc1cncc2nc([C@H](CSCc3ccccc3)NC(C)=O)[nH]c12 ZINC000586974988 FG Annotated Anodyne COc1cncc2nc([C@@H](CSCc3ccccc3)NC(C)=O)[nH]c12 ZINC000586974990 FG Annotated Anodyne N=c1[nH]cc2nc(-c3cc(Cl)cc(Cl)c3Br)nc-2[nH]1 ZINC000586975603 FG Annotated Anodyne COc1cc(Br)c([C@H](N)c2nc3ccccc3[nH]2)cc1OC ZINC000586975663 FG Annotated Anodyne COc1cc(Br)c([C@@H](N)c2nc3ccccc3[nH]2)cc1OC ZINC000586975665 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(Cc3ccc(Br)c(C)c3)nc12 ZINC000586975760 FG Annotated Anodyne Cc1cc(Cc2nc3c(O)nc(S)nc3[nH]2)ccc1Br ZINC000586975914 FG Annotated Anodyne Cc1cc(Cc2nc3ccc(-n4cnnn4)cc3[nH]2)ccc1Br ZINC000586975970 FG Annotated Anodyne Oc1nncc2nc(COc3ccc(Cl)cc3Br)[nH]c12 ZINC000586976400 FG Annotated Anodyne N=c1[nH]ccc2nc(COc3ccc(Cl)cc3Br)[nH]c12 ZINC000586977001 FG Annotated Anodyne COC(=O)c1cc2nc(Cc3ccc(Br)c(C)c3)[nH]c2cn1 ZINC000586977034 FG Annotated Anodyne Cc1cc(Cc2nc3[nH]c(=N)[nH]c(Cl)c-3n2)ccc1Br ZINC000586977110 FG Annotated Anodyne N=c1cc2nc(COc3ccc(Cl)cc3Br)[nH]c2c[nH]1 ZINC000586977176 FG Annotated Anodyne Oc1ncnc2[nH]c(COc3ccc(Cl)cc3Br)nc12 ZINC000586977445 FG Annotated Anodyne COC(=O)c1ccc2nc(Cc3ccc(Br)c(C)c3)[nH]c2n1 ZINC000586977501 FG Annotated Anodyne CCc1ccc(-c2nc3nc(C#N)c(C#N)nc3[nH]2)cc1Br ZINC000586977943 FG Annotated Mild CCc1ccc(-c2nc3c(O)nc(S)nc3[nH]2)cc1Br ZINC000586977973 FG Annotated Anodyne CCc1ccc(-c2nc3[nH]c(=N)[nH]c(Cl)c-3n2)cc1Br ZINC000586978241 FG Annotated Anodyne Cc1nn(Cc2nc3cc(C(=O)O)c(F)cc3[nH]2)c(C)c1Br ZINC000586978693 FG Annotated Anodyne Cc1nn(Cc2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)c(C)c1Br ZINC000586978701 FG Annotated Bother Cc1nn(Cc2nc3ccc([N+](=O)[O-])cc3[nH]2)c(C)c1Br ZINC000586978736 FG Annotated Bother COc1cc2nc(Cn3nc(C)c(Br)c3C)[nH]c2cc1OC ZINC000586978747 FG Annotated Anodyne Cc1nn(Cc2nc3cccc([N+](=O)[O-])c3[nH]2)c(C)c1Br ZINC000586978753 FG Annotated Bother Cc1nn(Cc2nc3cc4c(cc3[nH]2)NC(=O)CC4)c(C)c1Br ZINC000586978822 FG Annotated Anodyne Cc1nn(Cc2nc3cc(Cl)nc(C#N)c3[nH]2)c(C)c1Br ZINC000586978833 FG Annotated Mild Cc1nn(Cc2nc3c(F)cnc(Cl)c3[nH]2)c(C)c1Br ZINC000586978848 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3ccnc(Cl)c3Br)nc12 ZINC000586978862 FG Annotated Anodyne Cc1cc2[nH]c(Cn3nc(C)c(Br)c3C)nc2cc1[N+](=O)[O-] ZINC000586978914 FG Annotated Bother COc1cc2nc(Cn3nc(C)c(Br)c3C)[nH]c2cc1F ZINC000586978949 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3cnc(C)c(Br)c3C)nc12 ZINC000586978955 FG Annotated Anodyne Cc1nn(Cc2nc3cc(F)cc(C(=O)O)c3[nH]2)c(C)c1Br ZINC000586979009 FG Annotated Anodyne O=[N+]([O-])c1cncc2nc(-c3ccnc(Cl)c3Br)[nH]c12 ZINC000586979081 FG Annotated Bother Cc1ncc(-c2nc3cc4c(cc3[nH]2)OCC(=O)N4)c(C)c1Br ZINC000586979110 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3ccnc(Cl)c3Br)[nH]c2n1 ZINC000586979136 FG Annotated Anodyne CCOc1n[nH]c(-c2nc3cc(Cl)nc(C#N)c3[nH]2)c1Br ZINC000586979233 FG Annotated Mild COc1cc(OC)c2[nH]c(Cn3nc(C)c(Br)c3C)nc2c1 ZINC000586979416 FG Annotated Anodyne COC(=O)c1cc2nc(-c3cnc(C)c(Br)c3C)[nH]c2cn1 ZINC000586979561 FG Annotated Anodyne CCOc1n[nH]c(-c2nc3c(C)cnc(Cl)c3[nH]2)c1Br ZINC000586979687 FG Annotated Anodyne CCOc1n[nH]c(-c2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)c1Br ZINC000586979720 FG Annotated Bother CCOc1n[nH]c(-c2nc3ccc([N+](=O)[O-])cc3[nH]2)c1Br ZINC000586979739 FG Annotated Bother O=[N+]([O-])c1cnc2[nH]c(-c3ccnc(Cl)c3Br)nc2c1 ZINC000586979791 FG Annotated Bother Sc1nc(S)c2nc(-c3ccnc(Cl)c3Br)[nH]c2n1 ZINC000586979800 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3cnc(C)c(Br)c3C)[nH]c2n1 ZINC000586979824 FG Annotated Anodyne Cc1ncc(-c2nc3c(S)nc(S)nc3[nH]2)c(C)c1Br ZINC000586979934 FG Annotated Anodyne COC(=O)c1cc2nc(-c3ccnc(Cl)c3Br)[nH]c2cn1 ZINC000586979976 FG Annotated Anodyne CCOc1n[nH]c(-c2nc3c(F)cnc(Cl)c3[nH]2)c1Br ZINC000586980017 FG Annotated Anodyne Cc1c(-c2nc3cc(N)c(N)cc3[nH]2)cc(Br)cc1[N+](=O)[O-] ZINC000586980043 FG Annotated Bother CCOc1n[nH]c(-c2nc3cc([N+](=O)[O-])c(C)cc3[nH]2)c1Br ZINC000586980048 FG Annotated Bother CCOc1n[nH]c(-c2nc3cccc([N+](=O)[O-])c3[nH]2)c1Br ZINC000586980050 FG Annotated Bother N#Cc1nc2nc(-c3cc(Br)ccc3Cl)[nH]c2nc1C#N ZINC000586980064 FG Annotated Mild COc1cc(Br)cc(C=O)c1OCc1nc2cccnc2[nH]1 ZINC000586980124 FG Annotated Anodyne CCOc1n[nH]c(-c2nc3cc(OC)c(C)cc3[nH]2)c1Br ZINC000586980242 FG Annotated Anodyne N=c1[nH]c2nc(-c3cc(Br)ccc3Cl)nc-2c(Cl)[nH]1 ZINC000586980261 FG Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3cc(Br)ccc3Cl)nc12 ZINC000586980262 FG Annotated Anodyne CCOc1n[nH]c(-c2nc3cc(OC)c(OC)cc3[nH]2)c1Br ZINC000586980320 FG Annotated Anodyne CCOc1n[nH]c(-c2nc3cc(OC)c(F)cc3[nH]2)c1Br ZINC000586980403 FG Annotated Anodyne CCOc1n[nH]c(-c2nc3cc(OC)cc(OC)c3[nH]2)c1Br ZINC000586980420 FG Annotated Anodyne COc1cc(Br)cc(C=O)c1OCc1nc2cnccc2[nH]1 ZINC000586980532 FG Annotated Anodyne Cc1cc(Br)ccc1OCc1nc2[nH]c(=N)[nH]c(Cl)c-2n1 ZINC000586980567 FG Annotated Anodyne Cc1cc(Br)ccc1-n1cccc1-c1nc2ncnc(N)c2[nH]1 ZINC000586980957 FG Annotated Anodyne Cc1cc(Br)ccc1-n1cccc1-c1nc2nc(=N)[nH]cc2[nH]1 ZINC000586981471 FG Annotated Anodyne O=Cc1cc(Br)cc(-c2nc3cc4c(cc3[nH]2)OCC(=O)N4)c1 ZINC000586982630 FG Annotated Anodyne O=Cc1cc(Br)cc(-c2nc3c(S)nc(S)nc3[nH]2)c1 ZINC000586982975 FG Annotated Anodyne O=Cc1cc(Br)cc(-c2nc3cc4nc(O)[nH]c4cc3[nH]2)c1 ZINC000586983266 FG Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000586983360 FG Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000586983362 FG Annotated Anodyne COC(=O)c1cccc2nc([C@H](N)Cc3cccc(Br)c3)[nH]c12 ZINC000586983372 FG Annotated Anodyne COC(=O)c1cccc2nc([C@@H](N)Cc3cccc(Br)c3)[nH]c12 ZINC000586983376 FG Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2ccc(C(=O)O)cc2[nH]1 ZINC000586983547 FG Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2ccc(C(=O)O)cc2[nH]1 ZINC000586983548 FG Annotated Anodyne N[C@@H](N=O)c1ccc2nc([C@H](N)Cc3cccc(Br)c3)[nH]c2c1 ZINC000586983597 FG Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000586983598 FG Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000586983599 FG Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000586983600 FG Annotated Anodyne CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2cc(C)cnc2[nH]1 ZINC000586983646 FG Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2ccc([N+](=O)[O-])cc2[nH]1 ZINC000586983807 FG Annotated Bother N[C@@H](Cc1cccc(Br)c1)c1nc2ccc([N+](=O)[O-])cc2[nH]1 ZINC000586983808 FG Annotated Bother Brc1ccc([C@@H](c2nc3cnncc3[nH]2)N2CCCC2)cc1 ZINC000586983901 FG Annotated Anodyne Brc1ccc([C@H](c2nc3cnncc3[nH]2)N2CCCC2)cc1 ZINC000586983902 FG Annotated Anodyne N#Cc1cc2nc([C@@H](N)Cc3cccc(Br)c3)[nH]c2cc1C#N ZINC000586983944 FG Annotated Mild N#Cc1cc2nc([C@H](N)Cc3cccc(Br)c3)[nH]c2cc1C#N ZINC000586983954 FG Annotated Mild N[C@H](Cc1cccc(Br)c1)c1nc2cc3cn[nH]c3cc2[nH]1 ZINC000586984056 FG Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2cc3cn[nH]c3cc2[nH]1 ZINC000586984057 FG Annotated Anodyne Brc1ccc([C@H](c2nc3ncc[nH]c-3n2)N2CCCC2)cc1 ZINC000586984070 FG Annotated Anodyne Brc1ccc([C@@H](c2nc3ncc[nH]c-3n2)N2CCCC2)cc1 ZINC000586984073 FG Annotated Anodyne CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2cccnc2[nH]1 ZINC000586984075 FG Annotated Anodyne COC(=O)c1ccc2nc([C@H](N)Cc3cccc(Br)c3)[nH]c2c1 ZINC000586984204 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@H](N)Cc3cccc(Br)c3)[nH]c2c1 ZINC000586984206 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2c(C)nccc2[nH]1)c1ccc(Br)cc1 ZINC000586984252 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2c(C)nccc2[nH]1)c1ccc(Br)cc1 ZINC000586984253 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2ccc(C)nc2[nH]1)c1ccc(Br)cc1 ZINC000586984269 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccc(C)nc2[nH]1)c1ccc(Br)cc1 ZINC000586984270 FG Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2cc3c(cc2[nH]1)OCO3 ZINC000586984295 FG Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2cc3c(cc2[nH]1)OCO3 ZINC000586984297 FG Annotated Anodyne Nc1ccnc2[nH]c([C@H](c3ccc(Br)cc3)N3CCCC3)nc12 ZINC000586984366 FG Annotated Anodyne Nc1ccnc2[nH]c([C@@H](c3ccc(Br)cc3)N3CCCC3)nc12 ZINC000586984370 FG Annotated Anodyne CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2c(C)ccnc2[nH]1 ZINC000586984431 FG Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2c(Cl)ncnc2[nH]1 ZINC000586984454 FG Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2c(Cl)ncnc2[nH]1 ZINC000586984457 FG Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2ccc(CCO)cc2[nH]1 ZINC000586984560 FG Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2ccc(CCO)cc2[nH]1 ZINC000586984561 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cccc(O)c2[nH]1)c1ccc(Br)cc1 ZINC000586984726 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2cccc(O)c2[nH]1)c1ccc(Br)cc1 ZINC000586984727 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cccnc2[nH]1)c1ccc(Br)cc1 ZINC000586984737 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2cccnc2[nH]1)c1ccc(Br)cc1 ZINC000586984739 FG Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2cccc([N+](=O)[O-])c2[nH]1 ZINC000586984800 FG Annotated Bother CC(=O)N[C@@H](Cc1nc2cc(C)cnc2[nH]1)c1ccc(Br)cc1 ZINC000586984805 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(C)cnc2[nH]1)c1ccc(Br)cc1 ZINC000586984806 FG Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2cccc([N+](=O)[O-])c2[nH]1 ZINC000586984808 FG Annotated Bother N[C@H](Cc1cccc(Br)c1)c1nc2cccc(C(=O)O)c2[nH]1 ZINC000586984873 FG Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2cccc(C(=O)O)c2[nH]1 ZINC000586984875 FG Annotated Anodyne N=c1cc2nc([C@H](c3ccc(Br)cc3)N3CCCC3)[nH]c2c[nH]1 ZINC000586984891 FG Annotated Anodyne N=c1cc2nc([C@@H](c3ccc(Br)cc3)N3CCCC3)[nH]c2c[nH]1 ZINC000586984894 FG Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000586985066 FG Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000586985067 FG Annotated Anodyne Oc1ncnc2[nH]c([C@@H](c3ccc(Br)cc3)N3CCCC3)nc12 ZINC000586985210 FG Annotated Anodyne Oc1ncnc2[nH]c([C@H](c3ccc(Br)cc3)N3CCCC3)nc12 ZINC000586985216 FG Annotated Anodyne CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2ccc(C)nc2[nH]1 ZINC000586985241 FG Annotated Anodyne N=c1[nH]ccc2nc([C@H](c3ccc(Br)cc3)N3CCCC3)[nH]c12 ZINC000586985255 FG Annotated Anodyne N=c1[nH]ccc2nc([C@@H](c3ccc(Br)cc3)N3CCCC3)[nH]c12 ZINC000586985258 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2ccc(O)cc2[nH]1)c1ccc(Br)cc1 ZINC000586985289 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccc(O)cc2[nH]1)c1ccc(Br)cc1 ZINC000586985292 FG Annotated Anodyne Brc1ccc([C@@H](c2nc3cncnc3[nH]2)N2CCCC2)cc1 ZINC000586985347 FG Annotated Anodyne Brc1ccc([C@H](c2nc3cncnc3[nH]2)N2CCCC2)cc1 ZINC000586985348 FG Annotated Anodyne Cc1c(CNC(=O)CCl)nc2ccc(O)c3c2c1-c1ccccc1C3=O ZINC000586985364 FG Annotated Reactive CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2cncc(C)c2[nH]1 ZINC000586985641 FG Annotated Anodyne CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2c(C)nccc2[nH]1 ZINC000586985691 FG Annotated Anodyne Oc1nncc2nc([C@H](c3ccc(Br)cc3)N3CCCC3)[nH]c12 ZINC000586985761 FG Annotated Anodyne Oc1nncc2nc([C@@H](c3ccc(Br)cc3)N3CCCC3)[nH]c12 ZINC000586985764 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2c(C)ccnc2[nH]1)c1ccc(Br)cc1 ZINC000586985824 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2c(C)ccnc2[nH]1)c1ccc(Br)cc1 ZINC000586985826 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cncc(C)c2[nH]1)c1ccc(Br)cc1 ZINC000586986465 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2cncc(C)c2[nH]1)c1ccc(Br)cc1 ZINC000586986467 FG Annotated Anodyne Cn1nc([N+](=O)[O-])cc1-c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586986468 FG Annotated Bother Cn1cc([N+](=O)[O-])c(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)n1 ZINC000586986524 FG Annotated Bother CC(=O)N[C@@H](Cc1nc2cnccc2[nH]1)c1ccc(Br)cc1 ZINC000586986672 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2cnccc2[nH]1)c1ccc(Br)cc1 ZINC000586986673 FG Annotated Anodyne N=c1nc2c(c[nH]1)-c1nc3ccc(O)c4c3c(c1CC2)-c1ccccc1C4=O ZINC000586986839 FG Annotated Anodyne C[C@H](Cl)C(=O)NCc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586986964 FG Annotated Reactive C[C@@H](Cl)C(=O)NCc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586986966 FG Annotated Reactive Cn1cc(C(=O)Cc2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)cn1 ZINC000586987000 FG Annotated Anodyne Cc1nc(=N)[nH]cc1-c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586987038 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)CC[C@@H](n1cnnc1)C3 ZINC000586987150 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)CC[C@H](n1cnnc1)C3 ZINC000586987154 FG Annotated Anodyne CC(=O)N[C@@H]1CCc2nc3ccc(O)c4c3c(c2C1)-c1ccccc1C4=O ZINC000586987285 FG Annotated Anodyne CC(=O)N[C@H]1CCc2nc3ccc(O)c4c3c(c2C1)-c1ccccc1C4=O ZINC000586987287 FG Annotated Anodyne Cn1ncc([N+](=O)[O-])c1-c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586987375 FG Annotated Bother O=C1c2ccccc2-c2cc(Cn3cc([N+](=O)[O-])cn3)nc3ccc(O)c1c23 ZINC000586987694 FG Annotated Bother CN1CC[C@](C)(O)[C@H](c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)C1 ZINC000586987719 FG Annotated Anodyne CN1CC[C@](C)(O)[C@@H](c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)C1 ZINC000586987720 FG Annotated Anodyne CN1CC[C@@](C)(O)[C@H](c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)C1 ZINC000586987721 FG Annotated Anodyne CN1CC[C@@](C)(O)[C@@H](c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)C1 ZINC000586987723 FG Annotated Anodyne CC(=O)N1CCc2nc3ccc(O)c4c3c(c2CC1)-c1ccccc1C4=O ZINC000586987815 FG Annotated Anodyne O=C(O)c1cnc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)cn1 ZINC000586988005 FG Annotated Anodyne O=C1c2ccccc2-c2cc(/C=C/N3CCOCC3)nc3ccc(O)c1c23 ZINC000586988022 FG Annotated Anodyne Cn1cc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)cc1C(N)=O ZINC000586988029 FG Annotated Anodyne O=C1c2ccccc2-c2cc(Cn3ccc([N+](=O)[O-])n3)nc3ccc(O)c1c23 ZINC000586988067 FG Annotated Bother COC(=O)[C@H](N=O)c1nc2ccc(O)c3c2c(c1C)-c1ccccc1C3=O ZINC000586988519 FG Annotated Anodyne COC(=O)[C@@H](N=O)c1nc2ccc(O)c3c2c(c1C)-c1ccccc1C3=O ZINC000586988520 FG Annotated Anodyne O=C1c2ccccc2-c2cc(-c3cnc(O)nc3O)nc3ccc(O)c1c23 ZINC000586988624 FG Annotated Anodyne COC(=O)/C(=C\N(C)C)c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586988766 FG Annotated Anodyne COC(=O)/C(=C/N(C)C)c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586988767 FG Annotated Anodyne O=C1c2ccccc2-c2c(CCNC(=O)C3CC3)cnc3ccc(O)c1c23 ZINC000586988768 FG Annotated Anodyne CC(=O)N(Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2)C(C)=O ZINC000586988947 FG Annotated Anodyne O=CNC[C@H]1CCCc2c1nc1ccc(O)c3c1c2-c1ccccc1C3=O ZINC000586989117 FG Annotated Anodyne O=CNC[C@@H]1CCCc2c1nc1ccc(O)c3c1c2-c1ccccc1C3=O ZINC000586989118 FG Annotated Anodyne CN(C)/C=C1\C(=O)Cc2c1nc1ccc(O)c3c1c2-c1ccccc1C3=O ZINC000586989129 FG Annotated Mild CN(C)/C=C1/C(=O)Cc2c1nc1ccc(O)c3c1c2-c1ccccc1C3=O ZINC000586989130 FG Annotated Mild O=C1CC[C@@]2(CCc3nc4ccc(O)c5c4c(c3C2)-c2ccccc2C5=O)N1 ZINC000586989405 FG Annotated Anodyne O=C1CC[C@]2(CCc3nc4ccc(O)c5c4c(c3C2)-c2ccccc2C5=O)N1 ZINC000586989406 FG Annotated Anodyne O=C1C[C@]2(CCc3nc4ccc(O)c5c4c(c3C2)-c2ccccc2C5=O)CN1 ZINC000586989424 FG Annotated Anodyne O=C1C[C@@]2(CCc3nc4ccc(O)c5c4c(c3C2)-c2ccccc2C5=O)CN1 ZINC000586989425 FG Annotated Anodyne O=C1c2ccccc2-c2cc(-c3ccc4nnnn4c3)nc3ccc(O)c1c23 ZINC000586989478 FG Annotated Anodyne O=C(O)c1cc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)[nH]n1 ZINC000586989694 FG Annotated Anodyne CC1=CC(=O)[C@H](c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)C(=O)O1 ZINC000586990167 FG Annotated Mild CC1=CC(=O)[C@@H](c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)C(=O)O1 ZINC000586990170 FG Annotated Mild CCOC(=O)[C@H]1Cc2nc3ccc(O)c4c3c(c2C1)-c1ccccc1C4=O ZINC000586990204 FG Annotated Anodyne CCOC(=O)[C@@H]1Cc2nc3ccc(O)c4c3c(c2C1)-c1ccccc1C4=O ZINC000586990208 FG Annotated Anodyne COC(=O)[C@@H]1CCc2nc3ccc(O)c4c3c(c2C1)-c1ccccc1C4=O ZINC000586990211 FG Annotated Anodyne COC(=O)[C@H]1CCc2nc3ccc(O)c4c3c(c2C1)-c1ccccc1C4=O ZINC000586990214 FG Annotated Anodyne C=C1NC(=O)NC=C1c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586990436 FG Annotated Anodyne O=C(O)CCC(=O)Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586990500 FG Annotated Anodyne C=C1NC(=O)C(c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)=C(C)N1 ZINC000586990602 FG Annotated Anodyne CC(=O)[C@H]1C(=O)CCc2c1nc1ccc(O)c3c1c2-c1ccccc1C3=O ZINC000586990684 FG Annotated Anodyne CC(=O)[C@@H]1C(=O)CCc2c1nc1ccc(O)c3c1c2-c1ccccc1C3=O ZINC000586990685 FG Annotated Anodyne COC(=O)C[C@H]1Cc2nc3ccc(O)c4c3c(c2C1)-c1ccccc1C4=O ZINC000586990745 FG Annotated Anodyne COC(=O)C[C@@H]1Cc2nc3ccc(O)c4c3c(c2C1)-c1ccccc1C4=O ZINC000586990746 FG Annotated Anodyne COC(=O)[C@@H]1CCc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)C1 ZINC000586991513 FG Annotated Anodyne COC(=O)[C@H]1CCc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)C1 ZINC000586991515 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)CCC1(C3)OCCO1 ZINC000586992339 FG Annotated Anodyne CN=c1nc(Cc2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)[nH]s1 ZINC000586992531 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)CC1(CC3)OCCO1 ZINC000586992808 FG Annotated Anodyne CCS(=O)(=O)Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586992893 FG Annotated Anodyne CS(=O)(=O)[C@H]1CCc2c1nc1ccc(O)c3c1c2-c1ccccc1C3=O ZINC000586993133 FG Annotated Anodyne CS(=O)(=O)[C@@H]1CCc2c1nc1ccc(O)c3c1c2-c1ccccc1C3=O ZINC000586993138 FG Annotated Anodyne C#CCNC(=O)[C@H]1Cc2nc3c(C)ccc4c3c(c21)-c1ccccc1C4=O ZINC000586994923 FG Annotated Mild C#CCNC(=O)[C@@H]1Cc2nc3c(C)ccc4c3c(c21)-c1ccccc1C4=O ZINC000586994927 FG Annotated Mild Clc1c[nH]c2nc(CCNc3ccc(Br)cc3)nc-2n1 ZINC000586995302 FG Annotated Anodyne Clc1ncc2nc(CCNc3ccc(Br)cc3)nc-2[nH]1 ZINC000586995759 FG Annotated Anodyne O=[N+]([O-])c1cc2nc([C@H](O)c3ccc(Br)cc3)[nH]c2cc1F ZINC000586996170 FG Annotated Bother COc1cc(OC)c2[nH]c([C@H](O)c3ccc(Br)cc3)nc2c1 ZINC000586996181 FG Annotated Anodyne COC(=O)c1cccc2nc([C@H](O)c3ccc(Br)cc3)[nH]c12 ZINC000586996221 FG Annotated Anodyne N[C@H](Cc1nc2ccc([N+](=O)[O-])cc2[nH]1)c1ccc(Br)cc1 ZINC000586996237 FG Annotated Bother N[C@H](Cc1nc2cccc(C(=O)O)c2[nH]1)c1ccc(Br)cc1 ZINC000586996243 FG Annotated Anodyne N[C@H](Cc1nc2cc3nc(O)[nH]c3cc2[nH]1)c1ccc(Br)cc1 ZINC000586996311 FG Annotated Anodyne N[C@H](Cc1nc2ccc(CCO)cc2[nH]1)c1ccc(Br)cc1 ZINC000586996313 FG Annotated Anodyne COC(=O)c1ccc2nc([C@H](O)c3ccc(Br)cc3)[nH]c2c1 ZINC000586996315 FG Annotated Anodyne O=C1CCc2cc3nc([C@H](O)c4ccc(Br)cc4)[nH]c3cc2N1 ZINC000586996438 FG Annotated Anodyne Clc1ncnc2[nH]c(CCNc3ccc(Br)cc3)nc12 ZINC000586996572 FG Annotated Anodyne N#Cc1nc(Cl)cc2nc([C@H](O)c3ccc(Br)cc3)[nH]c12 ZINC000586996619 FG Annotated Mild N[C@H](Cc1nc2cc3c(cc2[nH]1)OCO3)c1ccc(Br)cc1 ZINC000586996656 FG Annotated Anodyne N[C@H](Cc1nc2ccc([C@H](N)N=O)cc2[nH]1)c1ccc(Br)cc1 ZINC000586996657 FG Annotated Anodyne N[C@@H](N=O)c1ccc2nc(C[C@@H](N)c3ccc(Br)cc3)[nH]c2c1 ZINC000586996658 FG Annotated Anodyne O=[N+]([O-])c1cnc2[nH]c(CCNc3ccc(Br)cc3)nc2c1 ZINC000586996711 FG Annotated Bother N[C@H](Cc1nc2cc3cn[nH]c3cc2[nH]1)c1ccc(Br)cc1 ZINC000586996814 FG Annotated Anodyne N[C@H](Cc1nc2cccc([N+](=O)[O-])c2[nH]1)c1ccc(Br)cc1 ZINC000586997016 FG Annotated Bother O=[N+]([O-])c1cncc2nc(CCNc3ccc(Br)cc3)[nH]c12 ZINC000586997136 FG Annotated Bother CN(C)C(=O)c1ccc2nc([C@H](O)c3ccc(Br)cc3)[nH]c2c1 ZINC000586997187 FG Annotated Anodyne Nc1cc2nc(/C=C/c3cc4c(cc3Br)OCO4)[nH]c2cc1N ZINC000586997230 FG Annotated Anodyne Nc1cc2nc(/C=C\c3cc4c(cc3Br)OCO4)[nH]c2cc1N ZINC000586997233 FG Annotated Anodyne Nc1ccnc2[nH]c(/C=C/c3cc4c(cc3Br)OCO4)nc12 ZINC000586997281 FG Annotated Anodyne Nc1ccnc2[nH]c(/C=C\c3cc4c(cc3Br)OCO4)nc12 ZINC000586997292 FG Annotated Anodyne O[C@H](c1ccc(Br)cc1)c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000586997683 FG Annotated Anodyne COC(=O)c1cccc2nc(C[C@@H](N)c3ccc(Br)cc3)[nH]c12 ZINC000586997689 FG Annotated Anodyne COc1cc2nc([C@H](O)c3ccc(Br)cc3)[nH]c2cc1OC ZINC000586997721 FG Annotated Anodyne N[C@H](Cc1nc2cc3c(cc2[nH]1)OCCO3)c1ccc(Br)cc1 ZINC000586997723 FG Annotated Anodyne COC(=O)c1ccc2nc(C[C@@H](N)c3ccc(Br)cc3)[nH]c2c1 ZINC000586997767 FG Annotated Anodyne N[C@@H](N=O)c1ccc2nc([C@H](O)c3ccc(Br)cc3)[nH]c2c1 ZINC000586997806 FG Annotated Anodyne N[C@H](N=O)c1ccc2nc([C@H](O)c3ccc(Br)cc3)[nH]c2c1 ZINC000586997807 FG Annotated Anodyne O[C@H](c1ccc(Br)cc1)c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000586997808 FG Annotated Anodyne N[C@H](Cc1nc2c(Cl)ncnc2[nH]1)c1ccc(Br)cc1 ZINC000586998034 FG Annotated Anodyne N#Cc1cc2nc(C[C@@H](N)c3ccc(Br)cc3)[nH]c2cc1C#N ZINC000586998125 FG Annotated Mild N#Cc1cc2nc([C@H](O)c3ccc(Br)cc3)[nH]c2cc1C#N ZINC000586998161 FG Annotated Mild N=c1cc2nc(/C=C/c3cc4c(cc3Br)OCO4)[nH]c2c[nH]1 ZINC000586998979 FG Annotated Anodyne N=c1cc2nc(/C=C\c3cc4c(cc3Br)OCO4)[nH]c2c[nH]1 ZINC000586998980 FG Annotated Anodyne N=c1[nH]ccc2nc(/C=C/c3cc4c(cc3Br)OCO4)[nH]c12 ZINC000586999076 FG Annotated Anodyne N=c1[nH]ccc2nc(/C=C\c3cc4c(cc3Br)OCO4)[nH]c12 ZINC000586999077 FG Annotated Anodyne Oc1nccc2nc(/C=C/c3cc4c(cc3Br)OCO4)[nH]c12 ZINC000586999212 FG Annotated Anodyne Oc1nccc2nc(/C=C\c3cc4c(cc3Br)OCO4)[nH]c12 ZINC000586999213 FG Annotated Anodyne O=c1oc2cc(O)c(Br)cc2cc1-c1nc2ncccc2[nH]1 ZINC000586999448 FG Annotated Anodyne O=c1oc2cc(O)c(Br)cc2cc1-c1nc2ccncc2[nH]1 ZINC000586999463 FG Annotated Anodyne Nc1ccnc2[nH]c([C@@H](N)Cc3c[nH]c4cc(Br)ccc34)nc12 ZINC000586999605 FG Annotated Anodyne CCn1cc(Br)c(Cc2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)n1 ZINC000586999693 FG Annotated Bother N[C@@H](Cc1c[nH]c2cc(Br)ccc12)c1nc2cnccc2[nH]1 ZINC000586999793 FG Annotated Anodyne CCn1cc(Br)c(Cc2nc3c(C)cnc(Cl)c3[nH]2)n1 ZINC000586999924 FG Annotated Anodyne CCn1cc(Br)c(Cc2nc3cc4c(cc3[nH]2)NC(=O)CC4)n1 ZINC000586999969 FG Annotated Anodyne CCn1cc(Br)c(Cc2nc3cccc([N+](=O)[O-])c3[nH]2)n1 ZINC000586999979 FG Annotated Bother CCn1cc(Br)c(Cc2nc3cc(OC)c(OC)cc3[nH]2)n1 ZINC000587000003 FG Annotated Anodyne Nc1ncnc2[nH]c(COc3ccc4ccccc4c3Br)nc12 ZINC000587000059 FG Annotated Anodyne CCn1cc(Br)c(Cc2nc3cc([N+](=O)[O-])c(C)cc3[nH]2)n1 ZINC000587000413 FG Annotated Bother Oc1nccc2nc(/C=C/c3cc(Br)c4c(c3)OCCO4)[nH]c12 ZINC000587000601 FG Annotated Anodyne Oc1nccc2nc(/C=C\c3cc(Br)c4c(c3)OCCO4)[nH]c12 ZINC000587000603 FG Annotated Anodyne Brc1cc(/C=C/c2nc3cnncc3[nH]2)cc2c1OCCO2 ZINC000587000643 FG Annotated Anodyne Brc1cc(/C=C\c2nc3cnncc3[nH]2)cc2c1OCCO2 ZINC000587000648 FG Annotated Anodyne CCn1cc(Br)c(Cc2nc3cc(OC)cc(OC)c3[nH]2)n1 ZINC000587000742 FG Annotated Anodyne COc1cc2nc(CCn3ncc4cc(Br)ccc43)[nH]c2cn1 ZINC000587000941 FG Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Br)ccc12)c1nc2ccnc(O)c2[nH]1 ZINC000587000980 FG Annotated Anodyne N=c1[nH]ccc2nc(/C=C/c3cc(Br)c4c(c3)OCCO4)[nH]c12 ZINC000587001028 FG Annotated Anodyne N=c1[nH]ccc2nc(/C=C\c3cc(Br)c4c(c3)OCCO4)[nH]c12 ZINC000587001035 FG Annotated Anodyne N=c1cc2nc(/C=C/c3cc(Br)c4c(c3)OCCO4)[nH]c2c[nH]1 ZINC000587001100 FG Annotated Anodyne CCn1cc(Br)c(Cc2nc3cc(OC)c(F)cc3[nH]2)n1 ZINC000587001101 FG Annotated Anodyne N=c1cc2nc(/C=C\c3cc(Br)c4c(c3)OCCO4)[nH]c2c[nH]1 ZINC000587001102 FG Annotated Anodyne Fc1cnc2[nH]c(CCn3ncc4cc(Br)ccc43)nc2c1 ZINC000587001217 FG Annotated Anodyne CCn1cc(Br)c(Cc2nc3ccc([N+](=O)[O-])cc3[nH]2)n1 ZINC000587001376 FG Annotated Bother CCn1cc(Br)c(Cc2nc3c(F)cnc(Cl)c3[nH]2)n1 ZINC000587001522 FG Annotated Anodyne O=C1COc2cc(Br)ccc2N1CCc1nc2ccccc2[nH]1 ZINC000587001653 FG Annotated Anodyne Nc1ccnc2[nH]c(/C=C/c3cc(Br)c4c(c3)OCCO4)nc12 ZINC000587001655 FG Annotated Anodyne Nc1ccnc2[nH]c(/C=C\c3cc(Br)c4c(c3)OCCO4)nc12 ZINC000587001657 FG Annotated Anodyne Oc1nccc2nc(CCn3ncc4cc(Br)ccc43)[nH]c12 ZINC000587001785 FG Annotated Anodyne N=c1[nH]cc2nc(COc3ccc4ccccc4c3Br)nc-2[nH]1 ZINC000587002016 FG Annotated Anodyne Brc1cc(/C=C/c2nc3cncnc3[nH]2)cc2c1OCCO2 ZINC000587002178 FG Annotated Anodyne Brc1cc(/C=C\c2nc3cncnc3[nH]2)cc2c1OCCO2 ZINC000587002180 FG Annotated Anodyne OCc1ccc2nc(CCn3ncc4cc(Br)ccc43)[nH]c2c1 ZINC000587002306 FG Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Br)ccc12)c1nc2cccnc2[nH]1 ZINC000587002344 FG Annotated Anodyne COc1nccc2nc(CCn3ncc4cc(Br)ccc43)[nH]c12 ZINC000587002347 FG Annotated Anodyne COc1ccc2nc(CCn3ncc4cc(Br)ccc43)[nH]c2n1 ZINC000587002350 FG Annotated Anodyne CCn1cc(Br)c(Cc2nc3cc(Cl)nc(C#N)c3[nH]2)n1 ZINC000587002401 FG Annotated Mild O=[N+]([O-])c1cncc2nc(-c3ccnc4[nH]cc(Br)c34)[nH]c12 ZINC000587002465 FG Annotated Bother Brc1cc(/C=C/c2nc3ncc[nH]c-3n2)cc2c1OCCO2 ZINC000587002519 FG Annotated Anodyne Brc1cc(/C=C\c2nc3ncc[nH]c-3n2)cc2c1OCCO2 ZINC000587002520 FG Annotated Anodyne O=C1C[C@@H](Cc2nc3cnccc3[nH]2)c2c(Br)cccc2O1 ZINC000587003002 FG Annotated Anodyne O=C1C[C@H](Cc2nc3cnccc3[nH]2)c2c(Br)cccc2O1 ZINC000587003003 FG Annotated Anodyne CCCn1cnc2cc(-c3nc4cnnc(O)c4[nH]3)cc(Br)c21 ZINC000587003317 FG Annotated Anodyne COc1cncc2nc(CCn3ncc4cc(Br)ccc43)[nH]c12 ZINC000587003334 FG Annotated Anodyne OCCc1ccc2nc(-c3ccnc4[nH]cc(Br)c34)[nH]c2c1 ZINC000587003578 FG Annotated Anodyne CCCn1cnc2cc(-c3nc4ncc[nH]c-4n3)cc(Br)c21 ZINC000587003941 FG Annotated Anodyne Nc1cc2nc(CCn3ncc4cc(Br)ccc43)[nH]c2cc1N ZINC000587003982 FG Annotated Anodyne O=C1C[C@@H](Cc2nc3cccnc3[nH]2)c2c(Br)cccc2O1 ZINC000587004041 FG Annotated Anodyne O=C1C[C@H](Cc2nc3cccnc3[nH]2)c2c(Br)cccc2O1 ZINC000587004045 FG Annotated Anodyne COC(=O)c1cc2nc(-c3ccnc4[nH]cc(Br)c34)[nH]c2cn1 ZINC000587004049 FG Annotated Anodyne Oc1nc2cc3nc(-c4ccnc5[nH]cc(Br)c45)[nH]c3cc2[nH]1 ZINC000587004254 FG Annotated Anodyne O=C1C[C@@H](Cc2nc3ccnc(O)c3[nH]2)c2c(Br)cccc2O1 ZINC000587004504 FG Annotated Anodyne O=C1C[C@H](Cc2nc3ccnc(O)c3[nH]2)c2c(Br)cccc2O1 ZINC000587004505 FG Annotated Anodyne O=[N+]([O-])c1cnc2[nH]c(-c3ccnc4[nH]cc(Br)c34)nc2c1 ZINC000587004557 FG Annotated Bother CCCn1cnc2cc(-c3nc4c(O)ncnc4[nH]3)cc(Br)c21 ZINC000587004637 FG Annotated Anodyne CCCn1cnc2cc(-c3nc4c(N)ncnc4[nH]3)cc(Br)c21 ZINC000587004638 FG Annotated Anodyne Cc1cc2c(Br)ccc(-c3nc4c(O)nc(O)nc4[nH]3)c2o1 ZINC000587004691 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3ccnc4[nH]cc(Br)c34)[nH]c2n1 ZINC000587004808 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3ccnc4[nH]cc(Br)c34)nc12 ZINC000587004816 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3nc(Br)ccc3Cl)[nH]c2n1 ZINC000587004957 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3nc(Cl)cnc3Br)[nH]c2cc1F ZINC000587005159 FG Annotated Bother Sc1nc(S)c2nc(-c3nc(Br)ccc3Cl)[nH]c2n1 ZINC000587005195 FG Annotated Anodyne O=C(O)c1cccc2nc(-c3nc(Cl)cnc3Br)[nH]c12 ZINC000587005242 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3nc(Br)ccc3Cl)nc12 ZINC000587005244 FG Annotated Anodyne N#Cc1nc(Cl)cc2nc(-c3nc(Cl)cnc3Br)[nH]c12 ZINC000587005364 FG Annotated Mild N[C@H](N=O)c1ccc2nc(-c3nc(Cl)cnc3Br)[nH]c2c1 ZINC000587005433 FG Annotated Anodyne N[C@@H](N=O)c1ccc2nc(-c3nc(Cl)cnc3Br)[nH]c2c1 ZINC000587005437 FG Annotated Anodyne O=[N+]([O-])c1ccc2nc(-c3nc(Cl)cnc3Br)[nH]c2c1 ZINC000587005450 FG Annotated Bother COC(=O)c1cc2nc(-c3nc(Br)ccc3Cl)[nH]c2cn1 ZINC000587005509 FG Annotated Anodyne COC(=O)c1cccc2nc(-c3nc(Cl)cnc3Br)[nH]c12 ZINC000587005561 FG Annotated Anodyne O=C(O)c1ccc2nc(-c3nc(Cl)cnc3Br)[nH]c2c1 ZINC000587005577 FG Annotated Anodyne O=[N+]([O-])c1cnc2[nH]c(-c3nc(Br)ccc3Cl)nc2c1 ZINC000587005583 FG Annotated Bother COC(=O)c1ccc2nc(-c3nc(Cl)cnc3Br)[nH]c2c1 ZINC000587005594 FG Annotated Anodyne O=[N+]([O-])c1cncc2nc(-c3nc(Br)ccc3Cl)[nH]c12 ZINC000587005628 FG Annotated Bother O=C(O)c1cc2nc(-c3nc(Cl)cnc3Br)[nH]c2cc1F ZINC000587005641 FG Annotated Anodyne COc1cc(OC)c2[nH]c(-c3nc(Cl)cnc3Br)nc2c1 ZINC000587005772 FG Annotated Anodyne O=C(O)c1cc(F)cc2nc(-c3nc(Cl)cnc3Br)[nH]c12 ZINC000587005778 FG Annotated Anodyne N#Cc1cc2nc(-c3nc(Cl)cnc3Br)[nH]c2cc1C#N ZINC000587005807 FG Annotated Mild COc1cc2nc(-c3nc(Cl)cnc3Br)[nH]c2cc1OC ZINC000587005836 FG Annotated Anodyne Clc1cnc(Br)c(-c2nc3cc4c(cc3[nH]2)OCCO4)n1 ZINC000587005847 FG Annotated Anodyne Clc1cnc(Br)c(-c2nc3cc4c(cc3[nH]2)OCO4)n1 ZINC000587005874 FG Annotated Anodyne Oc1nc2cc3nc(-c4nc(Cl)cnc4Br)[nH]c3cc2[nH]1 ZINC000587005890 FG Annotated Anodyne O=[N+]([O-])c1cccc2nc(-c3nc(Cl)cnc3Br)[nH]c12 ZINC000587005920 FG Annotated Bother Oc1nc(S)nc2[nH]c(-c3cc4ccc(Br)cn4c3)nc12 ZINC000587006025 FG Annotated Anodyne Cc1cnc(Cl)c2[nH]c(-c3cnn4cc(Br)cnc34)nc12 ZINC000587006051 FG Annotated Anodyne COC(=O)c1cc2nc(-c3cc4ccc(Br)cn4c3)[nH]c2cn1 ZINC000587006076 FG Annotated Anodyne O=C(O)c1ccc2nc(-c3cnn4cccc(Br)c34)[nH]c2c1 ZINC000587006080 FG Annotated Anodyne COC(=O)c1cc2nc(-c3ccc(Br)o3)[nH]c2cc1OC ZINC000587006137 FG Annotated Anodyne COC(=O)c1cccc2nc(-c3cnn4cccc(Br)c34)[nH]c12 ZINC000587006178 FG Annotated Anodyne N=c1[nH]c2nc(-c3cc4ccc(Br)cn4c3)nc-2c(Cl)[nH]1 ZINC000587006181 FG Annotated Anodyne OCCc1ccc2[nH]c(-c3cccn4c(Br)cnc34)nc2c1 ZINC000587006323 FG Annotated Anodyne OCCc1ccc2nc(-c3cnn4cccc(Br)c34)[nH]c2c1 ZINC000587006358 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3cc4ccc(Br)cn4c3)[nH]c2n1 ZINC000587006378 FG Annotated Anodyne O=[N+]([O-])c1cncc2nc(-c3ccc4[nH]nc(Br)c4c3)[nH]c12 ZINC000587006550 FG Annotated Bother N#Cc1cc2nc(-c3cccn4c(Br)cnc34)[nH]c2cc1C#N ZINC000587006553 FG Annotated Mild Sc1nc(S)c2nc(-c3ccnc(Br)c3Cl)[nH]c2n1 ZINC000587006605 FG Annotated Anodyne N[C@@H](N=O)c1ccc2nc(-c3cnn4cccc(Br)c34)[nH]c2c1 ZINC000587006632 FG Annotated Anodyne N[C@H](N=O)c1ccc2nc(-c3cnn4cccc(Br)c34)[nH]c2c1 ZINC000587006634 FG Annotated Anodyne COC(=O)c1ccc2[nH]c(-c3ccc(Br)o3)nc2c1OC ZINC000587006747 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3cc4ccc(Br)cn4c3)nc12 ZINC000587006772 FG Annotated Anodyne Brc1cnc2c(-c3nc4cc5c(cc4[nH]3)OCCO5)cccn12 ZINC000587006794 FG Annotated Anodyne CC1=C(c2ccc3[nH]c(-c4ccc(Br)o4)nc3c2)NNC(=O)C1 ZINC000587006818 FG Annotated Anodyne Brc1cccn2ncc(-c3nc4cc5c(cc4[nH]3)OCCO5)c12 ZINC000587006865 FG Annotated Anodyne Brc1cnc2c(-c3nc4cc5c(cc4[nH]3)OCO5)cccn12 ZINC000587006922 FG Annotated Anodyne Brc1cccn2ncc(-c3nc4cc5c(cc4[nH]3)OCO5)c12 ZINC000587006931 FG Annotated Anodyne O=C(O)c1cccc2nc(-c3cnn4cccc(Br)c34)[nH]c12 ZINC000587006937 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3ccc(Br)o3)[nH]c2cc1[N+](=O)[O-] ZINC000587007140 FG Annotated Bother COC(=O)c1cc2nc(-c3ccnc(Br)c3Cl)[nH]c2cn1 ZINC000587007154 FG Annotated Anodyne O=[N+]([O-])c1cnc2[nH]c(-c3ccnc(Br)c3Cl)nc2c1 ZINC000587007203 FG Annotated Bother Oc1nc2cc3nc(-c4cnn5cccc(Br)c45)[nH]c3cc2[nH]1 ZINC000587007224 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3cnn4cccc(Br)c34)[nH]c2c1 ZINC000587007249 FG Annotated Anodyne Oc1nc2cc3[nH]c(-c4cccn5c(Br)cnc45)nc3cc2[nH]1 ZINC000587007372 FG Annotated Anodyne N#Cc1cc2nc(-c3cnn4cccc(Br)c34)[nH]c2cc1C#N ZINC000587007477 FG Annotated Mild O=[N+]([O-])c1cncc2nc(-c3ccnc(Br)c3Cl)[nH]c12 ZINC000587007756 FG Annotated Bother Fc1ccc2nc(-c3cnn4cc(Br)cnc34)[nH]c2c1F ZINC000587007765 FG Annotated Anodyne OCCc1ccc2nc(-c3ccc4[nH]nc(Br)c4c3)[nH]c2c1 ZINC000587007838 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3ccnc(Br)c3Cl)nc12 ZINC000587007856 FG Annotated Anodyne N[C@H](N=O)c1ccc2[nH]c(-c3cccn4c(Br)cnc34)nc2c1 ZINC000587007893 FG Annotated Anodyne N[C@@H](N=O)c1ccc2[nH]c(-c3cccn4c(Br)cnc34)nc2c1 ZINC000587007895 FG Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@@H](Cl)CCl)[nH]c2c1 ZINC000587007983 FG Annotated Reactive CCCCNS(=O)(=O)c1ccc2nc([C@H](Cl)CCl)[nH]c2c1 ZINC000587007986 FG Annotated Reactive CC(=O)c1ccc2nc(-c3cnn4cc(Br)cnc34)[nH]c2c1 ZINC000587008072 FG Annotated Anodyne C[C@H](Br)c1nc2cc(I)cnc2[nH]1 ZINC000587008083 FG Annotated Reactive COc1cc2nc(-c3cnn4cc(Br)cnc34)[nH]c2cc1OC ZINC000587008268 FG Annotated Anodyne COc1cc(OC)c2[nH]c(-c3cnn4cc(Br)cnc34)nc2c1 ZINC000587008270 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc([C@@H](Cl)CCl)[nH]c2c1 ZINC000587008419 FG Annotated Reactive CCN(CC)S(=O)(=O)c1ccc2nc([C@H](Cl)CCl)[nH]c2c1 ZINC000587008423 FG Annotated Reactive Fc1cc(F)c2[nH]c(-c3cnn4cc(Br)cnc34)nc2c1 ZINC000587008508 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3ccnc(Br)c3Cl)[nH]c2n1 ZINC000587008532 FG Annotated Anodyne Cc1cc2[nH]c(-c3cnn4cc(Br)cnc34)nc2cc1[N+](=O)[O-] ZINC000587008764 FG Annotated Bother COc1cc2nc(-c3cnn4cc(Br)cnc34)[nH]c2cc1C ZINC000587008959 FG Annotated Anodyne Fc1cnc(Cl)c2[nH]c(-c3cnn4cc(Br)cnc34)nc12 ZINC000587009056 FG Annotated Anodyne COc1cc2nc(-c3cnn4cc(Br)cnc34)[nH]c2cc1F ZINC000587009094 FG Annotated Anodyne Fc1cc2nc(-c3cnn4cc(Br)cnc34)[nH]c2c(F)c1F ZINC000587009179 FG Annotated Anodyne Fc1cc2nc(-c3cnn4cc(Br)cnc34)[nH]c2cc1F ZINC000587009216 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc([C@H](C)Br)[nH]c2c1 ZINC000587009324 FG Annotated Reactive CC(C)(NC(=O)CCl)c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587009390 FG Annotated Reactive N[C@H](CCl)c1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587009478 FG Annotated Reactive N[C@H](CCl)c1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587009507 FG Annotated Reactive CC(C)(NC(=O)CCl)c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587009515 FG Annotated Reactive CC(C)(NC(=O)CCl)c1nc2c3cccnc3c3ncccc3c2[nH]1 ZINC000587009570 FG Annotated Reactive COC(=O)c1cc2nc([C@H](N)CCl)[nH]c2c(F)c1Nc1ccccc1 ZINC000587009864 FG Annotated Reactive N[C@H](CCl)c1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000587010546 FG Annotated Reactive Cc1nc(-c2ccccc2)sc1Cc1nc2nc(C#N)c(C#N)nc2[nH]1 ZINC000587011085 FG Annotated Mild Cc1nc(Br)sc1-c1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000587011280 FG Annotated Anodyne Cc1nc(Br)sc1-c1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000587011284 FG Annotated Anodyne Cc1nc(Br)sc1-c1nc2ccc(C(=O)N(C)C)cc2[nH]1 ZINC000587011369 FG Annotated Anodyne N[C@H](CCl)c1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000587011719 FG Annotated Reactive Cc1nc(-c2ccccc2)sc1Cc1nc2c(O)nc(S)nc2[nH]1 ZINC000587011866 FG Annotated Anodyne N[C@H](CCl)c1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000587012002 FG Annotated Reactive Nc1cc2nc(-c3nc(Br)sc3C3CC3)[nH]c2cc1N ZINC000587012222 FG Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3nc(Br)sc3C3CC3)nc12 ZINC000587012451 FG Annotated Anodyne Cc1nc(C)c(Cc2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)s1 ZINC000587012629 FG Annotated Anodyne Cc1nc(C)c(Cc2nc3cc(I)cnc3[nH]2)s1 ZINC000587012827 FG Annotated Anodyne N=c1[nH]c2nc(-c3nc(Br)sc3C3CC3)nc-2c(Cl)[nH]1 ZINC000587012861 FG Annotated Anodyne Cc1nc(-c2ccccc2)sc1Cc1nc2[nH]c(=N)[nH]c(Cl)c-2n1 ZINC000587012891 FG Annotated Anodyne Cc1nc(C2CC2)sc1-c1nc2cccc(S(=O)(=O)N(C)C)c2[nH]1 ZINC000587013231 FG Annotated Anodyne CCCc1sc(=N)[nH]c1-c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587013483 FG Annotated Anodyne CCCc1sc(=N)[nH]c1-c1nc2cc(C(=O)OC)cc(Cl)c2[nH]1 ZINC000587013538 FG Annotated Anodyne CCCc1sc(=N)[nH]c1-c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587013619 FG Annotated Anodyne CCO[C@@H](C)c1nc(C)c(-c2nc3ccc(-n4cnnn4)cc3[nH]2)s1 ZINC000587013636 FG Annotated Anodyne CCO[C@H](C)c1nc(C)c(-c2nc3ccc(-n4cnnn4)cc3[nH]2)s1 ZINC000587013642 FG Annotated Anodyne Cc1nc(Br)sc1-c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000587013709 FG Annotated Anodyne COc1cc2nc(-c3csc(CNC(=O)OC(C)(C)C)n3)[nH]c2cn1 ZINC000587013733 FG Annotated Anodyne CCO[C@H](C)c1nc(C)c(-c2nc3cc4c(cc3[nH]2)OCC(=O)N4)s1 ZINC000587013833 FG Annotated Anodyne CCO[C@@H](C)c1nc(C)c(-c2nc3cc4c(cc3[nH]2)OCC(=O)N4)s1 ZINC000587013836 FG Annotated Anodyne COc1nccc2nc(-c3csc(CNC(=O)OC(C)(C)C)n3)[nH]c12 ZINC000587013914 FG Annotated Anodyne Cc1nc(Br)sc1-c1nc2cc3c(cc2[nH]1)OCC(=O)N3 ZINC000587013943 FG Annotated Anodyne COc1ccc2nc(-c3csc(CNC(=O)OC(C)(C)C)n3)[nH]c2n1 ZINC000587014090 FG Annotated Anodyne COc1cncc2nc(-c3csc(CNC(=O)OC(C)(C)C)n3)[nH]c12 ZINC000587014126 FG Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3cccc(C(=O)O)c3[nH]2)cs1 ZINC000587014203 FG Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3nc(Cl)c[nH]c-3n2)cs1 ZINC000587014301 FG Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3c(Cl)ncnc3[nH]2)cs1 ZINC000587014442 FG Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3cnc(Cl)[nH]c-3n2)cs1 ZINC000587014595 FG Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3ccc(CCO)cc3[nH]2)cs1 ZINC000587014662 FG Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3ccc(C(=O)O)cc3[nH]2)cs1 ZINC000587014694 FG Annotated Anodyne Cc1nc(-c2ccc(Cl)cc2)sc1-c1nc2c(O)nc(=N)[nH]c2[nH]1 ZINC000587014770 FG Annotated Anodyne Cc1nc(Br)sc1-c1nc2c(S)nc(S)nc2[nH]1 ZINC000587014793 FG Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3cc4c(cc3[nH]2)OCO4)cs1 ZINC000587014808 FG Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3ccc(CO)cc3[nH]2)cs1 ZINC000587014813 FG Annotated Anodyne CCO[C@@H](C)c1nc(C)c(-c2nc3c(S)nc(S)nc3[nH]2)s1 ZINC000587014889 FG Annotated Anodyne CCO[C@H](C)c1nc(C)c(-c2nc3c(S)nc(S)nc3[nH]2)s1 ZINC000587014890 FG Annotated Anodyne Brc1c[nH]c2nc(-c3csc([C@H]4CCCO4)n3)nc-2n1 ZINC000587016038 FG Annotated Anodyne Brc1c[nH]c2nc(-c3csc([C@@H]4CCCO4)n3)nc-2n1 ZINC000587016039 FG Annotated Anodyne COC(=O)c1cc2[nH]c(-c3csc([C@H]4CCCO4)n3)nc2cc1OC ZINC000587016179 FG Annotated Anodyne COC(=O)c1cc2[nH]c(-c3csc([C@@H]4CCCO4)n3)nc2cc1OC ZINC000587016181 FG Annotated Anodyne CCc1ccc(-c2nc(-c3nc4nc(C#N)c(C#N)nc4[nH]3)cs2)cc1 ZINC000587016430 FG Annotated Mild CCOC(=O)c1cc(Br)c2[nH]c(-c3csc(O)n3)nc2c1 ZINC000587016606 FG Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3csc(-c4ncccc4Cl)n3)nc12 ZINC000587016716 FG Annotated Anodyne c1cc2nc(-c3csc([C@@H]4CCCO4)n3)[nH]c2cc1CN1CCOCC1 ZINC000587016742 FG Annotated Anodyne c1cc2nc(-c3csc([C@H]4CCCO4)n3)[nH]c2cc1CN1CCOCC1 ZINC000587016746 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3csc([C@H]4CCCO4)n3)[nH]c2cc1[N+](=O)[O-] ZINC000587016747 FG Annotated Bother O=[N+]([O-])c1cc2nc(-c3csc([C@@H]4CCCO4)n3)[nH]c2cc1[N+](=O)[O-] ZINC000587016753 FG Annotated Bother Brc1c[nH]c2nc(Cc3csc(-c4ccco4)n3)nc-2n1 ZINC000587016878 FG Annotated Anodyne O=C1COc2cc3[nH]c(Cc4csc(-c5ccco5)n4)nc3cc2N1 ZINC000587016986 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3csc([C@H]4CCCO4)n3)[nH]c2c1OC ZINC000587017373 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3csc([C@@H]4CCCO4)n3)[nH]c2c1OC ZINC000587017374 FG Annotated Anodyne Nc1ccnc2[nH]c(-c3csc(=Nc4cccc5ncccc45)[nH]3)nc12 ZINC000587017395 FG Annotated Anodyne O=S(=O)(O)c1ccc2nc(Cc3csc(-c4ccco4)n3)[nH]c2c1 ZINC000587017460 FG Annotated Anodyne N=c1cc2nc(-c3csc(=Nc4cccc5ncccc45)[nH]3)[nH]c2c[nH]1 ZINC000587017619 FG Annotated Anodyne N=c1[nH]c2nc(-c3csc(-c4ncccc4Cl)n3)nc-2c(Cl)[nH]1 ZINC000587017620 FG Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3csc(-c4ccc5c(c4)CCO5)n3)nc12 ZINC000587017684 FG Annotated Anodyne N=c1[nH]c2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)nc-2c(Cl)[nH]1 ZINC000587017949 FG Annotated Anodyne N=c1[nH]ccc2nc(-c3csc(=Nc4cccc5ncccc45)[nH]3)[nH]c12 ZINC000587018382 FG Annotated Anodyne O=C(Nc1nc(Cc2nc3ccnc(O)c3[nH]2)cs1)c1cccs1 ZINC000587018819 FG Annotated Anodyne N=c1[nH]ccc2nc(Cc3csc(NC(=O)Nc4ccccc4)n3)[nH]c12 ZINC000587018895 FG Annotated Anodyne O=C(Nc1ccccc1)Nc1nc(Cc2nc3ccnc(O)c3[nH]2)cs1 ZINC000587018906 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1nc(Cc2nc3nc(Cl)c[nH]c-3n2)cs1 ZINC000587018917 FG Annotated Anodyne Cc1cnc2[nH]c(Cc3csc(NC(=O)c4cccc(O)c4)n3)nc2c1 ZINC000587018951 FG Annotated Anodyne O=C(Nc1nc(Cc2nc3cc(F)cnc3[nH]2)cs1)c1cccs1 ZINC000587018971 FG Annotated Anodyne Nc1ccnc2[nH]c(Cc3csc(NC(=O)Nc4ccccc4)n3)nc12 ZINC000587018974 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1nc(Cc2nc3cnc(Cl)[nH]c-3n2)cs1 ZINC000587019108 FG Annotated Anodyne Cc1cncc2nc(Cc3csc(NC(=O)c4cccc(O)c4)n3)[nH]c12 ZINC000587019210 FG Annotated Anodyne Cc1nccc2[nH]c(Cc3csc(NC(=O)c4cccc(O)c4)n3)nc12 ZINC000587019241 FG Annotated Anodyne Cc1ccnc2[nH]c(Cc3csc(NC(=O)c4cccc(O)c4)n3)nc12 ZINC000587019351 FG Annotated Anodyne Oc1nccc2nc(Cc3csc(-c4ccc5c(c4)OCCO5)n3)[nH]c12 ZINC000587019382 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1nc(Cc2nc3c(Cl)ncnc3[nH]2)cs1 ZINC000587019431 FG Annotated Anodyne O=C(Nc1ccccc1)Nc1nc(Cc2nc3cnncc3[nH]2)cs1 ZINC000587019445 FG Annotated Anodyne COc1ccc2nc(Cc3csc(NC(=O)c4cccs4)n3)[nH]c2n1 ZINC000587019479 FG Annotated Anodyne O=C(Nc1ccccc1)Nc1nc(Cc2nc3cncnc3[nH]2)cs1 ZINC000587019490 FG Annotated Anodyne Nc1cc2nc(Cc3csc(NC(=O)c4cccs4)n3)[nH]c2cc1N ZINC000587019504 FG Annotated Anodyne COc1cncc2nc(Cc3csc(NC(=O)c4cccs4)n3)[nH]c12 ZINC000587019595 FG Annotated Anodyne COc1nccc2nc(Cc3csc(NC(=O)c4cccs4)n3)[nH]c12 ZINC000587019603 FG Annotated Anodyne N=c1cc2nc(Cc3csc(NC(=O)Nc4ccccc4)n3)[nH]c2c[nH]1 ZINC000587019678 FG Annotated Anodyne COc1cc2nc(Cc3csc(NC(=O)c4cccs4)n3)[nH]c2cn1 ZINC000587019835 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1nc(Cc2nc3ccc(CO)cc3[nH]2)cs1 ZINC000587020045 FG Annotated Anodyne O=C(Nc1nc(Cc2nc3cc(F)cnc3[nH]2)cs1)c1cccc(O)c1 ZINC000587020160 FG Annotated Anodyne COc1cncc2nc(Cc3csc(NC(=O)OC(C)(C)C)n3)[nH]c12 ZINC000587020184 FG Annotated Anodyne Cc1nc(COc2cccc(-c3nc4[nH]c(=N)[nH]c(Cl)c-4n3)c2)cs1 ZINC000587020252 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1nc(Cc2nc3cccc(C(N)=O)c3[nH]2)cs1 ZINC000587020261 FG Annotated Anodyne Cc1nc(COc2cccc(-c3nc4nc(C#N)c(C#N)nc4[nH]3)c2)cs1 ZINC000587020276 FG Annotated Mild COc1nccc2nc(Cc3csc(NC(=O)OC(C)(C)C)n3)[nH]c12 ZINC000587020278 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1nc(Cc2nc3cc(N)c(N)cc3[nH]2)cs1 ZINC000587020339 FG Annotated Anodyne COc1cc2nc(Cc3csc(NC(=O)OC(C)(C)C)n3)[nH]c2cn1 ZINC000587020354 FG Annotated Anodyne COc1ccc2nc(Cc3csc(NC(=O)OC(C)(C)C)n3)[nH]c2n1 ZINC000587020395 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1nc(Cc2nc3ccc(CCO)cc3[nH]2)cs1 ZINC000587020429 FG Annotated Anodyne N#Cc1ncc(-c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)s1 ZINC000587020476 FG Annotated Mild CC(C)(C)OC(=O)Nc1nc(Cc2nc3ccc(C(N)=O)cc3[nH]2)cs1 ZINC000587020506 FG Annotated Anodyne Cc1nc(-c2c[nH]cc2-c2nc3nc(Br)c[nH]c-3n2)cs1 ZINC000587020535 FG Annotated Anodyne N=c1[nH]c(-c2cccc(-c3nc4cc5c(cc4[nH]3)OCC(=O)N5)c2)cs1 ZINC000587020570 FG Annotated Anodyne Cc1nc(COc2cccc(-c3nc4c(O)nc(S)nc4[nH]3)c2)cs1 ZINC000587020600 FG Annotated Anodyne Cc1csc(SCc2ccc(-c3nc4c(O)nc(O)nc4[nH]3)cc2)n1 ZINC000587021047 FG Annotated Anodyne N=c1[nH]c(-c2cccc(-c3nc4nc(Br)c[nH]c-4n3)c2)cs1 ZINC000587021113 FG Annotated Anodyne C[C@@H](O)c1ncc(-c2nc3cc(Br)cc(C(=O)O)c3[nH]2)s1 ZINC000587021130 FG Annotated Anodyne C[C@H](O)c1ncc(-c2nc3cc(Br)cc(C(=O)O)c3[nH]2)s1 ZINC000587021132 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc(-c3cccc(-c4csc(=N)[nH]4)c3)[nH]c2c1 ZINC000587021179 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3cnc(Cc4ccccc4)s3)[nH]c2n1 ZINC000587021239 FG Annotated Anodyne C[C@@H](O)c1ncc(-c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)s1 ZINC000587021283 FG Annotated Bother C[C@H](O)c1ncc(-c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)s1 ZINC000587021284 FG Annotated Bother c1ccc(Cc2ncc(-c3nc4ccc(-n5cnnn5)cc4[nH]3)s2)cc1 ZINC000587021286 FG Annotated Anodyne Cn1cc(-c2ncc(-c3nc4c(Br)ccnc4[nH]3)s2)cn1 ZINC000587021343 FG Annotated Anodyne CN(C)CCOc1ccc2nc(-c3cnc(-c4cnn(C)c4)s3)[nH]c2c1 ZINC000587021363 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(-c3cnc(C#N)s3)nc2c1 ZINC000587021391 FG Annotated Mild Cc1csc(SCc2ccc(-c3nc4c(O)nc(=N)[nH]c4[nH]3)cc2)n1 ZINC000587021428 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3cnc(-c4cnn(C)c4)s3)[nH]c2c1 ZINC000587021522 FG Annotated Anodyne Cn1cc(-c2ncc(-c3nc4cc(-n5cccn5)c(F)cc4[nH]3)s2)cn1 ZINC000587021581 FG Annotated Anodyne N#Cc1ncc(-c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)s1 ZINC000587021625 FG Annotated Mild Cn1cc(-c2ncc(-c3nc4ccc(Br)nc4[nH]3)s2)cn1 ZINC000587021700 FG Annotated Anodyne Cn1cc(-c2ncc(-c3nc4cc5c(cc4[nH]3)OC(F)(F)O5)s2)cn1 ZINC000587021748 FG Annotated Anodyne N#Cc1ncc(-c2nc3ccc(I)cc3[nH]2)s1 ZINC000587021763 FG Annotated Mild N#Cc1ncc(-c2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)s1 ZINC000587021880 FG Annotated Mild COC(=O)c1cc2nc(-c3cnc(Cc4ccccc4)s3)[nH]c2cn1 ZINC000587022001 FG Annotated Anodyne Cn1cc(-c2ncc(-c3nc4cc(Br)cnc4[nH]3)s2)cn1 ZINC000587022065 FG Annotated Anodyne Cc1csc(SCc2ccc(-c3nc4nc(=N)[nH]cc4[nH]3)cc2)n1 ZINC000587022133 FG Annotated Anodyne Cn1cc(-c2ncc(-c3nc4cc5c(cc4[nH]3)OCCCO5)s2)cn1 ZINC000587022207 FG Annotated Anodyne Cn1cc(-c2ncc(-c3nc4ccnc(Br)c4[nH]3)s2)cn1 ZINC000587022264 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3cnc(Cc4ccccc4)s3)nc12 ZINC000587022277 FG Annotated Anodyne Cc1nc(-c2c[nH]cc2-c2nc3cc4c(cc3[nH]2)OCC(=O)N4)cs1 ZINC000587022346 FG Annotated Anodyne Cn1cc(-c2ncc(-c3nc4cncc(Br)c4[nH]3)s2)cn1 ZINC000587022387 FG Annotated Anodyne N=c1[nH]c(-c2cccc(-c3nc4ccc([C@@H](N)N=O)cc4[nH]3)c2)cs1 ZINC000587022410 FG Annotated Anodyne N=c1[nH]c(-c2cccc(-c3nc4ccc([C@H](N)N=O)cc4[nH]3)c2)cs1 ZINC000587022412 FG Annotated Anodyne N=c1[nH]c(-c2cccc(-c3nc4c(S)nc(S)nc4[nH]3)c2)cs1 ZINC000587022456 FG Annotated Anodyne Cn1cc(-c2ncc(-c3nc4cc(Br)ncc4[nH]3)s2)cn1 ZINC000587022498 FG Annotated Anodyne C[C@@H](O)c1ncc(-c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)s1 ZINC000587022624 FG Annotated Bother C[C@H](O)c1ncc(-c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)s1 ZINC000587022625 FG Annotated Bother C[C@H](O)c1ncc(-c2nc3ccc(I)cc3[nH]2)s1 ZINC000587022715 FG Annotated Anodyne C[C@@H](O)c1ncc(-c2nc3ccc(I)cc3[nH]2)s1 ZINC000587022716 FG Annotated Anodyne N#Cc1ncc(-c2nc3cccc(I)c3[nH]2)s1 ZINC000587022743 FG Annotated Mild C[C@H](O)c1ncc(-c2nc3cccc(I)c3[nH]2)s1 ZINC000587022836 FG Annotated Anodyne C[C@@H](O)c1ncc(-c2nc3cccc(I)c3[nH]2)s1 ZINC000587022837 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1cnc(-c2nc3ncnc(Cl)c3[nH]2)s1 ZINC000587022884 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1cnc(-c2nc3nc(Cl)c[nH]c-3n2)s1 ZINC000587022964 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1cnc(-c2nc3c([N+](=O)[O-])cncc3[nH]2)s1 ZINC000587023244 FG Annotated Bother CCCCNS(=O)(=O)c1ccc2nc(-c3cnc(Cl)s3)[nH]c2c1 ZINC000587023271 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1cnc(-c2nc3cnc(Cl)[nH]c-3n2)s1 ZINC000587023272 FG Annotated Anodyne Cc1ccc(C)c2[nH]c(Cc3n[nH]c(=NC(=O)OC(C)(C)C)s3)nc12 ZINC000587023377 FG Annotated Anodyne c1csc(-c2ccc(-c3nc4cc(-n5cnnn5)ccc4[nH]3)s2)n1 ZINC000587023453 FG Annotated Anodyne Cc1c(F)ccc2nc(Cc3n[nH]c(=NC(=O)OC(C)(C)C)s3)[nH]c12 ZINC000587023499 FG Annotated Anodyne CC(C)(C)OC(=O)N=c1[nH]nc(Cc2nc3cc(F)cc(F)c3[nH]2)s1 ZINC000587023508 FG Annotated Anodyne CC(C)(C)OC(=O)N=c1[nH]nc(Cc2nc3cc(F)c(F)cc3[nH]2)s1 ZINC000587023510 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1cnc(-c2nc3ncc([N+](=O)[O-])cc3[nH]2)s1 ZINC000587023671 FG Annotated Bother Cc1cc(C)c2[nH]c(Cc3n[nH]c(=NC(=O)OC(C)(C)C)s3)nc2c1 ZINC000587023729 FG Annotated Anodyne CC(C)(C)OC(=O)N=c1[nH]nc(Cc2nc3cccc(Cl)c3[nH]2)s1 ZINC000587023789 FG Annotated Anodyne O=C(CCc1nc2ccccc2[nH]1)Nc1nnc(-c2ccncc2)s1 ZINC000587023796 FG Annotated Anodyne CC(C)(C)OC(=O)N=c1[nH]nc(Cc2nc3ccc(Cl)cc3[nH]2)s1 ZINC000587023840 FG Annotated Anodyne Cc1cc(F)c2[nH]c(Cc3n[nH]c(=NC(=O)OC(C)(C)C)s3)nc2c1 ZINC000587023848 FG Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc(-c3cnc(Cl)s3)nc-2[nH]1 ZINC000587024000 FG Annotated Anodyne Clc1ncc(-c2nc3cc(I)cnc3[nH]2)s1 ZINC000587024019 FG Annotated Anodyne NS(=O)(=O)c1ccc2[nH]c(-c3ccc(-c4nccs4)s3)nc2c1 ZINC000587024055 FG Annotated Anodyne O=C(CCc1nc2ccc(F)cc2[nH]1)Nc1nnc(-c2ccncc2)s1 ZINC000587024107 FG Annotated Anodyne Cc1ccc2nc(CCC(=O)Nc3nnc(-c4ccncc4)s3)[nH]c2c1 ZINC000587024161 FG Annotated Anodyne Cc1cc2nc(Cc3n[nH]c(=NC(=O)OC(C)(C)C)s3)[nH]c2cc1C ZINC000587024177 FG Annotated Anodyne Cc1ccc2nc(Cc3n[nH]c(=NC(=O)OC(C)(C)C)s3)[nH]c2c1C ZINC000587024232 FG Annotated Anodyne NS(=O)(=O)c1cccc2[nH]c(-c3ccc(-c4nccs4)s3)nc12 ZINC000587024263 FG Annotated Anodyne CC(C)(C)OC(=O)N=c1[nH]nc(Cc2nc3ccc(F)c(F)c3[nH]2)s1 ZINC000587024266 FG Annotated Anodyne O=C(CCc1nc2cccc(F)c2[nH]1)Nc1nnc(-c2ccncc2)s1 ZINC000587024277 FG Annotated Anodyne Cc1cccc2nc(CCC(=O)Nc3nnc(-c4ccncc4)s3)[nH]c12 ZINC000587024317 FG Annotated Anodyne CCc1ccc2nc(Cc3n[nH]c(=NC(=O)OC(C)(C)C)s3)[nH]c2c1 ZINC000587024334 FG Annotated Anodyne Cc1cc2nc(Cc3n[nH]c(=NC(=O)OC(C)(C)C)s3)[nH]c2cc1F ZINC000587024418 FG Annotated Anodyne N[C@H](c1ccsc1)c1nc2ccc(I)cc2[nH]1 ZINC000587024619 FG Annotated Anodyne N[C@@H](c1ccsc1)c1nc2ccc(I)cc2[nH]1 ZINC000587024626 FG Annotated Anodyne N[C@@H](c1ccsc1)c1nc2cccc(I)c2[nH]1 ZINC000587024650 FG Annotated Anodyne N[C@H](c1ccsc1)c1nc2cccc(I)c2[nH]1 ZINC000587024651 FG Annotated Anodyne Fc1cc2[nH]c(CSc3nnc(S)s3)nc2cc1-n1cccn1 ZINC000587024672 FG Annotated Anodyne N[C@@H](c1ccsc1)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587024871 FG Annotated Bother N[C@H](c1ccsc1)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587024872 FG Annotated Bother COC(=O)c1cc(Br)c2[nH]c([C@H](N)c3ccsc3)nc2c1 ZINC000587025010 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c([C@@H](N)c3ccsc3)nc2c1 ZINC000587025011 FG Annotated Anodyne Sc1nnc(SCc2nc3c(Br)ccnc3[nH]2)s1 ZINC000587025034 FG Annotated Anodyne Sc1nnc(SCc2nc3cc(Br)ncc3[nH]2)s1 ZINC000587025200 FG Annotated Anodyne Sc1nnc(SCc2nc3cncc(Br)c3[nH]2)s1 ZINC000587025218 FG Annotated Anodyne N[C@@H](c1ccsc1)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587025334 FG Annotated Anodyne N[C@H](c1ccsc1)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587025335 FG Annotated Anodyne Cc1nc2[nH]c(CSc3nnc(S)s3)nc2cc1Br ZINC000587025353 FG Annotated Anodyne FC1(F)Oc2cc3nc(CSc4nnc(S)s4)[nH]c3cc2O1 ZINC000587025444 FG Annotated Anodyne CCOC(=O)c1ccc2nc(CSc3nnc(S)s3)[nH]c2c1 ZINC000587025496 FG Annotated Anodyne Sc1nnc(SCc2nc3cc(Br)cnc3[nH]2)s1 ZINC000587025548 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(CSCc3ccsc3)[nH]c12 ZINC000587025685 FG Annotated Anodyne N[C@H](c1ccsc1)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587025796 FG Annotated Bother N[C@@H](c1ccsc1)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587025797 FG Annotated Bother Cc1c(Br)cnc2[nH]c(CSc3nnc(S)s3)nc12 ZINC000587025892 FG Annotated Anodyne N[C@@H](c1ccsc1)c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587025956 FG Annotated Clean N[C@H](c1ccsc1)c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587025958 FG Annotated Clean O=C(Cc1ccsc1)N1[C@H](c2nc3cnncc3[nH]2)C[C@H]2CCCC[C@@H]21 ZINC000587025998 FG Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cnncc3[nH]2)C[C@@H]2CCCC[C@@H]21 ZINC000587025999 FG Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cnncc3[nH]2)C[C@@H]2CCCC[C@H]21 ZINC000587026000 FG Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cnncc3[nH]2)C[C@H]2CCCC[C@H]21 ZINC000587026001 FG Annotated Anodyne Sc1nnc(SCc2nc3ccnc(Br)c3[nH]2)s1 ZINC000587026192 FG Annotated Anodyne Sc1nnc(SCc2nc3cc4c(cc3[nH]2)OCCCO4)s1 ZINC000587026202 FG Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(CSc3nnc(S)s3)nc2c1 ZINC000587026296 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(CSc3nnc(S)s3)[nH]c2c1 ZINC000587026442 FG Annotated Anodyne Sc1nnc(SCc2nc3ccc(Br)nc3[nH]2)s1 ZINC000587026449 FG Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3ncc[nH]c-3n2)C[C@H]2CCCC[C@@H]21 ZINC000587027006 FG Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3ncc[nH]c-3n2)C[C@H]2CCCC[C@H]21 ZINC000587027008 FG Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3ncc[nH]c-3n2)C[C@@H]2CCCC[C@@H]21 ZINC000587027009 FG Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3ncc[nH]c-3n2)C[C@@H]2CCCC[C@H]21 ZINC000587027010 FG Annotated Anodyne Cc1oc(-c2ccsc2)nc1Cc1nc2ccc(-n3cnnn3)cc2[nH]1 ZINC000587027137 FG Annotated Anodyne O=C(c1ccccc1)c1ccc2nc(CNC(=O)c3cscn3)[nH]c2c1 ZINC000587027310 FG Annotated Anodyne N[C@H](Cc1cscn1)c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587027397 FG Annotated Anodyne O=C(NCc1nc2cc3nc4ccccc4nc3cc2[nH]1)c1cscn1 ZINC000587027499 FG Annotated Bother Cc1ncsc1-c1c[nH]cc1-c1nc2nc(Br)c[nH]c-2n1 ZINC000587027688 FG Annotated Anodyne O=C(NCc1nc2cc(Br)cc(Cl)c2[nH]1)c1cscn1 ZINC000587027799 FG Annotated Anodyne Cc1cc2nc(CNC(=O)c3cscn3)[nH]c2cc1Br ZINC000587027877 FG Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cncnc3[nH]2)C[C@H]2CCCC[C@H]21 ZINC000587027887 FG Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cncnc3[nH]2)C[C@@H]2CCCC[C@@H]21 ZINC000587027889 FG Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cncnc3[nH]2)C[C@@H]2CCCC[C@H]21 ZINC000587027892 FG Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cncnc3[nH]2)C[C@H]2CCCC[C@@H]21 ZINC000587027894 FG Annotated Anodyne NS(=O)(=O)c1cccc2nc(-c3ncsc3-c3ccccc3)[nH]c12 ZINC000587027994 FG Annotated Anodyne Cc1ncsc1CCc1nc2cc(I)cnc2[nH]1 ZINC000587027998 FG Annotated Anodyne Cc1ncsc1CCc1nc2[nH]c(O)nc(NCc3ccccc3)c-2n1 ZINC000587028002 FG Annotated Anodyne Cc1c(Br)cc2nc(CNC(=O)c3cscn3)[nH]c2c1C ZINC000587028246 FG Annotated Anodyne O=C(NCc1nc2cc(Cl)cc(Br)c2[nH]1)c1cscn1 ZINC000587028248 FG Annotated Anodyne Cc1cc(Br)cc2nc(CNC(=O)c3cscn3)[nH]c12 ZINC000587028277 FG Annotated Anodyne O=C(NCc1nc2c3cccnc3c3ncccc3c2[nH]1)c1cscn1 ZINC000587028441 FG Annotated Bother N[C@H](Cc1cscn1)c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587028570 FG Annotated Anodyne Cc1ncsc1-c1c[nH]cc1-c1nc2cc3c(cc2[nH]1)OCC(=O)N3 ZINC000587028755 FG Annotated Anodyne Cc1c(Br)ccc2nc(CNC(=O)c3cscn3)[nH]c12 ZINC000587028760 FG Annotated Anodyne Cc1cc(Br)c2[nH]c(CNC(=O)c3cscn3)nc2c1 ZINC000587028786 FG Annotated Anodyne Nc1ccc(Oc2ccc3nc(CNC(=O)c4cscn4)[nH]c3c2)cc1 ZINC000587028802 FG Annotated Clean Nc1ccc(-c2ccc3nc([C@H](N)Cc4cscn4)[nH]c3c2)cc1N ZINC000587028876 FG Annotated Anodyne COc1nccc2[nH]c(-c3sc4c(c3C)C(=O)N3CCC=C3N4)nc12 ZINC000587028880 FG Annotated Anodyne Cc1c(-c2nc3nc(Cl)ncc3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587028912 FG Annotated Anodyne COc1cc2[nH]c(-c3sc4c(c3C)C(=O)N3CCC=C3N4)nc2cn1 ZINC000587028953 FG Annotated Anodyne Cc1c(-c2nc3cc4c(cc3[nH]2)OCO4)sc2c1C(=O)N1CCC=C1N2 ZINC000587028967 FG Annotated Anodyne Cc1c(-c2nc3cc(CO)ccc3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029002 FG Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3ccccc3OCc3cscn3)nc12 ZINC000587029059 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3ccccc3OCc3cscn3)[nH]c2n1 ZINC000587029076 FG Annotated Anodyne N[C@H](Cc1cscn1)c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587029111 FG Annotated Clean COc1cncc2[nH]c(-c3sc4c(c3C)C(=O)N3CCC=C3N4)nc12 ZINC000587029233 FG Annotated Anodyne COC(=O)c1cc2nc(-c3ccccc3OCc3cscn3)[nH]c2cn1 ZINC000587029246 FG Annotated Anodyne Cc1c(-c2nc3nc(Cl)c[nH]c-3n2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029325 FG Annotated Anodyne Cc1c(-c2nc3ncc([N+](=O)[O-])cc3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029346 FG Annotated Bother Cc1c(-c2nc3ncnc(Cl)c3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029364 FG Annotated Anodyne Cc1c(-c2nc3cc(CCO)ccc3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029478 FG Annotated Anodyne COc1ccc2[nH]c(-c3sc4c(c3C)C(=O)N3CCC=C3N4)nc2n1 ZINC000587029483 FG Annotated Anodyne Cc1c(-c2nc3cc(C#N)c(C#N)cc3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029550 FG Annotated Mild COC(=O)c1ccnc2[nH]c(-c3ccccc3OCc3cscn3)nc12 ZINC000587029581 FG Annotated Anodyne N=c1[nH]c2nc(-c3ccccc3OCc3cscn3)nc-2c(Cl)[nH]1 ZINC000587029663 FG Annotated Anodyne N[C@H](Cc1cscn1)c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587029968 FG Annotated Anodyne N[C@H](Cc1cscn1)c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587030050 FG Annotated Anodyne Cc1c(-c2nc3c([N+](=O)[O-])cncc3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587030129 FG Annotated Bother C[C@@H]1CCCc2sc(-n3cccc3)c(-c3nc4c(O)nc(=N)[nH]c4[nH]3)c21 ZINC000587030510 FG Annotated Anodyne C[C@H]1CCCc2sc(-n3cccc3)c(-c3nc4c(O)nc(=N)[nH]c4[nH]3)c21 ZINC000587030511 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(-c3csc4ccc(O)cc34)[nH]c12 ZINC000587031291 FG Annotated Anodyne Nc1c(-c2nc3cnnc(O)c3[nH]2)sc2cc(Br)ccc12 ZINC000587031302 FG Annotated Anodyne Nc1c(-c2nc3c(O)ncnc3[nH]2)sc2cc(Br)ccc12 ZINC000587031359 FG Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@@H](C)c1nc3ncc[nH]c-3n1)N2 ZINC000587031507 FG Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@@H](C)c1nc3ncc[nH]c-3n1)N2 ZINC000587031522 FG Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@H](C)c1nc3ncc[nH]c-3n1)N2 ZINC000587031523 FG Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@H](C)c1nc3ncc[nH]c-3n1)N2 ZINC000587031525 FG Annotated Anodyne CC1=C(c2ccc3nc(-c4csc5c4CCOC5)[nH]c3c2)NNC(=O)C1 ZINC000587031686 FG Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@@H](C)c1nc3cncnc3[nH]1)N2 ZINC000587031930 FG Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@H](C)c1nc3cncnc3[nH]1)N2 ZINC000587031937 FG Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@H](C)c1nc3cncnc3[nH]1)N2 ZINC000587031941 FG Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@@H](C)c1nc3cncnc3[nH]1)N2 ZINC000587031944 FG Annotated Anodyne N=c1[nH]c2nc(-c3c(-n4cccc4)sc4c3CCC4)nc-2c(Cl)[nH]1 ZINC000587032615 FG Annotated Anodyne c1cc2nc(-c3csc4c3CCOC4)[nH]c2cc1CN1CCOCC1 ZINC000587032624 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCc2scc(-c3nc4cnncc4[nH]3)c2C1 ZINC000587032742 FG Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@@H](C)c1nc3cnncc3[nH]1)N2 ZINC000587033054 FG Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@H](C)c1nc3cnncc3[nH]1)N2 ZINC000587033058 FG Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@@H](C)c1nc3cnncc3[nH]1)N2 ZINC000587033060 FG Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@H](C)c1nc3cnncc3[nH]1)N2 ZINC000587033062 FG Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3c(-n4cccc4)sc4c3CCC4)nc12 ZINC000587033460 FG Annotated Anodyne N#Cc1nc2nc(-c3c(-n4cccc4)sc4c3CCC4)[nH]c2nc1C#N ZINC000587033475 FG Annotated Mild CCC[C@@H](NC(=O)c1cc2ccccc2s1)c1nc2c(N)ncnc2[nH]1 ZINC000587033913 FG Annotated Anodyne CCC[C@H](NC(=O)c1cc2ccccc2s1)c1nc2c(N)ncnc2[nH]1 ZINC000587033915 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCc2scc(-c3nc4ncc[nH]c-4n3)c2C1 ZINC000587033918 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCc2scc(-c3nc4cc[nH]c(=N)c4[nH]3)c2C1 ZINC000587033928 FG Annotated Anodyne CCOC(=O)c1ccc2nc(CNC(=O)c3cc4c(s3)CCC4)[nH]c2c1 ZINC000587033940 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCc2scc(-c3nc4cnnc(O)c4[nH]3)c2C1 ZINC000587034076 FG Annotated Anodyne Cc1cc2[nH]c(CNC(=O)c3cc4c(s3)CCC4)nc2cc1[N+](=O)[O-] ZINC000587034251 FG Annotated Bother COC(=O)c1cc2[nH]c(C[C@@H]3OCCc4ccsc43)nc2cc1OC ZINC000587034454 FG Annotated Anodyne COC(=O)c1cc2[nH]c(C[C@H]3OCCc4ccsc43)nc2cc1OC ZINC000587034458 FG Annotated Anodyne c1cc2c(s1)[C@@H](Cc1nc3ccc(CN4CCOCC4)cc3[nH]1)OCC2 ZINC000587034460 FG Annotated Anodyne c1cc2c(s1)[C@H](Cc1nc3ccc(CN4CCOCC4)cc3[nH]1)OCC2 ZINC000587034462 FG Annotated Anodyne CN(C)CCOc1ccc2nc(C[C@@H]3OCCc4ccsc43)[nH]c2c1 ZINC000587034482 FG Annotated Anodyne CN(C)CCOc1ccc2nc(C[C@H]3OCCc4ccsc43)[nH]c2c1 ZINC000587034484 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(C[C@H]3OCCc4ccsc43)[nH]c2cc1[N+](=O)[O-] ZINC000587034507 FG Annotated Bother O=[N+]([O-])c1cc2nc(C[C@@H]3OCCc4ccsc43)[nH]c2cc1[N+](=O)[O-] ZINC000587034511 FG Annotated Bother CC(C)(C)OC(=O)N1CCc2scc(-c3nc4c(O)ncnc4[nH]3)c2C1 ZINC000587034609 FG Annotated Anodyne O=C(NCc1nc2cc3c(cc2[nH]1)OCCCO3)c1cc2c(s1)CCC2 ZINC000587034774 FG Annotated Anodyne COC(=O)c1ccc2nc(C[C@H]3OCCc4ccsc43)[nH]c2c1OC ZINC000587034829 FG Annotated Anodyne COC(=O)c1ccc2nc(C[C@@H]3OCCc4ccsc43)[nH]c2c1OC ZINC000587034830 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCc2scc(-c3nc4cncnc4[nH]3)c2C1 ZINC000587034992 FG Annotated Anodyne O=C(NCc1nc2cc(C(F)(F)F)ncc2[nH]1)c1cc2c(s1)CCC2 ZINC000587035221 FG Annotated Anodyne O=C(NCc1nc2cc(F)c(F)c(F)c2[nH]1)c1cc2c(s1)CCC2 ZINC000587035270 FG Annotated Anodyne CCC[C@@H](NC(=O)c1cc2ccccc2s1)c1nc2c[nH]c(=N)[nH]c-2n1 ZINC000587035317 FG Annotated Anodyne CCC[C@H](NC(=O)c1cc2ccccc2s1)c1nc2c[nH]c(=N)[nH]c-2n1 ZINC000587035318 FG Annotated Anodyne CCS(=O)(=O)c1ccc2nc(C[C@@H]3OCCc4ccsc43)[nH]c2c1 ZINC000587035351 FG Annotated Anodyne CCS(=O)(=O)c1ccc2nc(C[C@H]3OCCc4ccsc43)[nH]c2c1 ZINC000587035354 FG Annotated Anodyne O=C(NCc1nc2cc([N+](=O)[O-])c(F)cc2[nH]1)c1cc2c(s1)CCC2 ZINC000587035420 FG Annotated Bother O=C(NCc1nc2c(F)cnc(Cl)c2[nH]1)c1cc2c(s1)CCC2 ZINC000587035461 FG Annotated Anodyne O=C(NCc1nc2cc(C(F)(F)F)cnc2[nH]1)c1cc2c(s1)CCC2 ZINC000587035468 FG Annotated Anodyne COc1cc2nc(CNC(=O)c3cc4c(s3)CCC4)[nH]c2cc1OC ZINC000587035626 FG Annotated Anodyne COc1cc(OC)c2[nH]c(CNC(=O)c3cc4c(s3)CCC4)nc2c1 ZINC000587035725 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCc2scc(-c3nc4cc(=N)[nH]cc4[nH]3)c2C1 ZINC000587035742 FG Annotated Anodyne CN1CCN(c2ccc3nc(C[C@H]4OCCc5ccsc54)[nH]c3c2)CC1 ZINC000587036035 FG Annotated Anodyne CN1CCN(c2ccc3nc(C[C@@H]4OCCc5ccsc54)[nH]c3c2)CC1 ZINC000587036045 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4cncc(C)c4[nH]3)cc12 ZINC000587036909 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4cncc(C)c4[nH]3)cc12 ZINC000587036910 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4ccc(C#N)cc4[nH]3)cc12 ZINC000587036950 FG Annotated Mild Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4ccc(C#N)cc4[nH]3)cc12 ZINC000587036952 FG Annotated Mild Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4c(Cl)ccnc4[nH]3)cc12 ZINC000587037003 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4c(Cl)ccnc4[nH]3)cc12 ZINC000587037004 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4cccc(O)c4[nH]3)cc12 ZINC000587037313 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4cccc(O)c4[nH]3)cc12 ZINC000587037314 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4c(C)ccnc4[nH]3)cc12 ZINC000587037319 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4c(C)ccnc4[nH]3)cc12 ZINC000587037320 FG Annotated Anodyne Cc1ccc2nc([C@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)[nH]c2n1 ZINC000587037341 FG Annotated Anodyne Cc1ccc2nc([C@@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)[nH]c2n1 ZINC000587037343 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4cccc(C#N)c4[nH]3)cc12 ZINC000587037416 FG Annotated Mild Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4cccc(C#N)c4[nH]3)cc12 ZINC000587037417 FG Annotated Mild Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4cncc(Cl)c4[nH]3)cc12 ZINC000587037499 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4cncc(Cl)c4[nH]3)cc12 ZINC000587037501 FG Annotated Anodyne COc1ccc2nc([C@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)[nH]c2c1 ZINC000587037623 FG Annotated Anodyne COc1ccc2nc([C@@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)[nH]c2c1 ZINC000587037624 FG Annotated Anodyne O=S(=O)(O)c1ccc2nc([C@@H]3SCCc4sccc43)[nH]c2c1 ZINC000587037668 FG Annotated Anodyne O=S(=O)(O)c1ccc2nc([C@H]3SCCc4sccc43)[nH]c2c1 ZINC000587037671 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1snnc1-c1nc2cc3[nH]ncc3cc2[nH]1 ZINC000587037934 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4ccc(F)cc4[nH]3)cc12 ZINC000587037935 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4ccc(F)cc4[nH]3)cc12 ZINC000587037936 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1snnc1-c1nc2cc3c(cc2[nH]1)OCO3 ZINC000587038071 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4ccnc(Cl)c4[nH]3)cc12 ZINC000587038080 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4ccnc(Cl)c4[nH]3)cc12 ZINC000587038081 FG Annotated Anodyne C=CCN1C(=O)S[C@@H](Cc2nc3cccc(Br)c3[nH]2)C1=O ZINC000587038100 FG Annotated Mild C=CCN1C(=O)S[C@H](Cc2nc3cccc(Br)c3[nH]2)C1=O ZINC000587038101 FG Annotated Mild C=CCN1C(=O)S[C@H](Cc2nc3cc(Cl)c(F)c(F)c3[nH]2)C1=O ZINC000587038199 FG Annotated Mild C=CCN1C(=O)S[C@@H](Cc2nc3cc(Cl)c(F)c(F)c3[nH]2)C1=O ZINC000587038200 FG Annotated Mild CC(C)(C)OC(=O)Nc1snnc1-c1nc2cc3[nH]c(O)nc3cc2[nH]1 ZINC000587038248 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1snnc1-c1nc2nccc(Cl)c2[nH]1 ZINC000587038266 FG Annotated Anodyne C=CCN1C(=O)S[C@H](Cc2nc3ccc(Br)cc3[nH]2)C1=O ZINC000587038296 FG Annotated Mild C=CCN1C(=O)S[C@@H](Cc2nc3ccc(Br)cc3[nH]2)C1=O ZINC000587038297 FG Annotated Mild COc1cccc2nc([C@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)[nH]c12 ZINC000587038325 FG Annotated Anodyne COc1cccc2nc([C@@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)[nH]c12 ZINC000587038326 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1snnc1-c1nc2c(Cl)cncc2[nH]1 ZINC000587038468 FG Annotated Anodyne CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000587038591 FG Annotated Anodyne C=CCN1C(=O)S[C@H](Cc2nc3cc(Cl)nc(Cl)c3[nH]2)C1=O ZINC000587038651 FG Annotated Mild C=CCN1C(=O)S[C@@H](Cc2nc3cc(Cl)nc(Cl)c3[nH]2)C1=O ZINC000587038654 FG Annotated Mild C=CCN1C(=O)S[C@@H](Cc2nc3ccc4nc(C)ccc4c3[nH]2)C1=O ZINC000587038691 FG Annotated Mild C=CCN1C(=O)S[C@H](Cc2nc3ccc4nc(C)ccc4c3[nH]2)C1=O ZINC000587038693 FG Annotated Mild O=C(O)c1cc2nc([C@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c2cc1F ZINC000587038784 FG Annotated Anodyne O=C(O)c1cc2nc([C@@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c2cc1F ZINC000587038785 FG Annotated Anodyne O=C(O)c1cc2nc([C@H]3CS[C@H](Cc4ccccc4)N3)[nH]c2cc1F ZINC000587038786 FG Annotated Anodyne C=CCN1C(=O)S[C@@H](Cc2nc3cccc(OC(F)(F)F)c3[nH]2)C1=O ZINC000587038806 FG Annotated Mild C=CCN1C(=O)S[C@H](Cc2nc3cccc(OC(F)(F)F)c3[nH]2)C1=O ZINC000587038807 FG Annotated Mild CC(C)(C)OC(=O)Nc1snnc1-c1nc2cc(C#N)c(C#N)cc2[nH]1 ZINC000587038861 FG Annotated Mild CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000587038904 FG Annotated Anodyne COC(=O)c1cccc2nc([C@@H]3CSCN3C(=O)OC(C)(C)C)[nH]c12 ZINC000587038909 FG Annotated Anodyne Cc1cc2[nH]c([C@@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)nc2c(C)n1 ZINC000587038910 FG Annotated Anodyne Cc1cc2[nH]c([C@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)nc2c(C)n1 ZINC000587038915 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4cc(Cl)cnc4[nH]3)cc12 ZINC000587038973 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4cc(Cl)cnc4[nH]3)cc12 ZINC000587038974 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4c(C)nccc4[nH]3)cc12 ZINC000587038989 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4c(C)nccc4[nH]3)cc12 ZINC000587038990 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4cc(Cl)ncc4[nH]3)cc12 ZINC000587039008 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4cc(Cl)ncc4[nH]3)cc12 ZINC000587039009 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4ccc(O)cc4[nH]3)cc12 ZINC000587039010 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4ccc(O)cc4[nH]3)cc12 ZINC000587039011 FG Annotated Anodyne O=C(O)c1cc2nc([C@@H]3CS[C@H](Cc4ccccc4)N3)[nH]c2cc1F ZINC000587039033 FG Annotated Anodyne C=CCN1C(=O)S[C@@H](Cc2nc3cccc(C(F)(F)F)c3[nH]2)C1=O ZINC000587039040 FG Annotated Mild C=CCN1C(=O)S[C@H](Cc2nc3cccc(C(F)(F)F)c3[nH]2)C1=O ZINC000587039041 FG Annotated Mild C=CCN1C(=O)S[C@H](Cc2nc3c(Cl)c(Cl)cnc3[nH]2)C1=O ZINC000587039048 FG Annotated Mild C=CCN1C(=O)S[C@@H](Cc2nc3c(Cl)c(Cl)cnc3[nH]2)C1=O ZINC000587039050 FG Annotated Mild C=CCN1C(=O)S[C@H](Cc2nc3ccc(OC(F)(F)F)cc3[nH]2)C1=O ZINC000587039092 FG Annotated Mild Oc1nc2cc3nc([C@H]4CS[C@@H](Cc5ccccc5)N4)[nH]c3cc2[nH]1 ZINC000587039093 FG Annotated Anodyne C=CCN1C(=O)S[C@@H](Cc2nc3ccc(OC(F)(F)F)cc3[nH]2)C1=O ZINC000587039094 FG Annotated Mild Oc1nc2cc3nc([C@@H]4CS[C@@H](Cc5ccccc5)N4)[nH]c3cc2[nH]1 ZINC000587039101 FG Annotated Anodyne Oc1nc2cc3nc([C@H]4CS[C@H](Cc5ccccc5)N4)[nH]c3cc2[nH]1 ZINC000587039102 FG Annotated Anodyne Oc1nc2cc3nc([C@@H]4CS[C@H](Cc5ccccc5)N4)[nH]c3cc2[nH]1 ZINC000587039103 FG Annotated Anodyne N#Cc1cc(Br)c2[nH]c(Cc3csc4nccn34)nc2c1 ZINC000587039298 FG Annotated Mild Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4ccc(Cl)nc4[nH]3)cc12 ZINC000587039360 FG Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4ccc(Cl)nc4[nH]3)cc12 ZINC000587039363 FG Annotated Anodyne C=CCN1C(=O)S[C@H](Cc2nc3ccc(C(F)(F)F)cc3[nH]2)C1=O ZINC000587039489 FG Annotated Mild C=CCN1C(=O)S[C@@H](Cc2nc3ccc(C(F)(F)F)cc3[nH]2)C1=O ZINC000587039491 FG Annotated Mild CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000587039540 FG Annotated Anodyne CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000587039554 FG Annotated Anodyne Cc1cnc2[nH]c([C@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)nc2c1 ZINC000587039591 FG Annotated Anodyne Cc1cnc2[nH]c([C@@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)nc2c1 ZINC000587039593 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1snnc1-c1nc2cnc(Cl)cc2[nH]1 ZINC000587039597 FG Annotated Anodyne C=CCN1C(=O)S[C@H](Cc2nc3cc(OC)c(Cl)cc3[nH]2)C1=O ZINC000587039599 FG Annotated Mild C=CCN1C(=O)S[C@@H](Cc2nc3cc(OC)c(Cl)cc3[nH]2)C1=O ZINC000587039605 FG Annotated Mild C=CCN1C(=O)S[C@H](Cc2nc3c(Cl)cnc(Cl)c3[nH]2)C1=O ZINC000587039633 FG Annotated Mild C=CCN1C(=O)S[C@@H](Cc2nc3c(Cl)cnc(Cl)c3[nH]2)C1=O ZINC000587039634 FG Annotated Mild CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2cc(F)cc(C(=O)O)c2[nH]1 ZINC000587039666 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@H]3CS[C@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587039713 FG Annotated Anodyne COC(=O)c1ccc2nc([C@H]3CS[C@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587039715 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587039716 FG Annotated Anodyne COC(=O)c1ccc2nc([C@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587039717 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@H]3CSCN3C(=O)OC(C)(C)C)[nH]c2c1 ZINC000587039738 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1snnc1-c1nc2c([N+](=O)[O-])cccc2[nH]1 ZINC000587039793 FG Annotated Bother N[C@H](N=O)c1ccc2nc([C@H]3CS[C@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587039826 FG Annotated Anodyne N[C@H](N=O)c1ccc2nc([C@@H]3CS[C@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587039827 FG Annotated Anodyne N[C@H](N=O)c1ccc2nc([C@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587039828 FG Annotated Anodyne N[C@H](N=O)c1ccc2nc([C@@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587039829 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1snnc1-c1nc2ncc(Cl)cc2[nH]1 ZINC000587039932 FG Annotated Anodyne C=CCN1C(=O)S[C@H](Cc2nc3cc(Cl)c(Cl)nc3[nH]2)C1=O ZINC000587039947 FG Annotated Mild C=CCN1C(=O)S[C@@H](Cc2nc3cc(Cl)c(Cl)nc3[nH]2)C1=O ZINC000587039948 FG Annotated Mild CC(C)(C)OC(=O)Nc1snnc1-c1nc2nc(Cl)ccc2[nH]1 ZINC000587040072 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1snnc1-c1nc2c(Cl)nccc2[nH]1 ZINC000587040077 FG Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3cccnc3[nH]2)cc1 ZINC000587040262 FG Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3cccnc3[nH]2)cc1 ZINC000587040263 FG Annotated Anodyne FC(F)(F)c1ncc2nc([C@H]3CS[C@@H](Cc4ccccc4)N3)nc-2[nH]1 ZINC000587040362 FG Annotated Anodyne FC(F)(F)c1ncc2nc([C@@H]3CS[C@H](Cc4ccccc4)N3)nc-2[nH]1 ZINC000587040363 FG Annotated Anodyne FC(F)(F)c1ncc2nc([C@@H]3CS[C@@H](Cc4ccccc4)N3)nc-2[nH]1 ZINC000587040364 FG Annotated Anodyne FC(F)(F)c1nc(Cl)[nH]c2nc(Cc3csc4nccn34)nc1-2 ZINC000587040445 FG Annotated Anodyne FC(F)(F)c1ncc2nc([C@H]3CS[C@H](Cc4ccccc4)N3)nc-2[nH]1 ZINC000587040494 FG Annotated Anodyne CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2cc(C#N)c(C#N)cc2[nH]1 ZINC000587040587 FG Annotated Mild O=C(O)c1cc(F)cc2nc([C@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c12 ZINC000587040629 FG Annotated Anodyne O=C(O)c1cc(F)cc2nc([C@@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c12 ZINC000587040630 FG Annotated Anodyne O=C(O)c1cc(F)cc2nc([C@H]3CS[C@H](Cc4ccccc4)N3)[nH]c12 ZINC000587040631 FG Annotated Anodyne O=C(O)c1cc(F)cc2nc([C@@H]3CS[C@H](Cc4ccccc4)N3)[nH]c12 ZINC000587040632 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cc(Br)ncc2[nH]1 ZINC000587040685 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cc(Br)ncc2[nH]1 ZINC000587040689 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cc(Br)cnc2[nH]1 ZINC000587040706 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cc(Br)cnc2[nH]1 ZINC000587040707 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2c(Br)ccnc2[nH]1 ZINC000587040820 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2c(Br)ccnc2[nH]1 ZINC000587040821 FG Annotated Anodyne CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2cccc([N+](=O)[O-])c2[nH]1 ZINC000587041015 FG Annotated Bother CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000587041059 FG Annotated Anodyne Fc1cnc(Br)c2[nH]c(Cc3csc4nccn34)nc12 ZINC000587041154 FG Annotated Anodyne c1ccc(C[C@@H]2N[C@@H](c3nc4cc5c(cc4[nH]3)OCCO5)CS2)cc1 ZINC000587041188 FG Annotated Anodyne c1ccc(C[C@@H]2N[C@H](c3nc4cc5c(cc4[nH]3)OCCO5)CS2)cc1 ZINC000587041189 FG Annotated Anodyne c1ccc(C[C@H]2N[C@@H](c3nc4cc5c(cc4[nH]3)OCCO5)CS2)cc1 ZINC000587041190 FG Annotated Anodyne c1ccc(C[C@H]2N[C@H](c3nc4cc5c(cc4[nH]3)OCCO5)CS2)cc1 ZINC000587041192 FG Annotated Anodyne O=C1CCc2cc3nc([C@@H]4CS[C@@H](Cc5ccccc5)N4)[nH]c3cc2N1 ZINC000587041195 FG Annotated Anodyne O=C1CCc2cc3nc([C@H]4CS[C@H](Cc5ccccc5)N4)[nH]c3cc2N1 ZINC000587041197 FG Annotated Anodyne O=C1CCc2cc3nc([C@H]4CS[C@@H](Cc5ccccc5)N4)[nH]c3cc2N1 ZINC000587041201 FG Annotated Anodyne O=C1CCc2cc3nc([C@@H]4CS[C@H](Cc5ccccc5)N4)[nH]c3cc2N1 ZINC000587041207 FG Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@@H]1Cc1nc2c(Cl)ncnc2[nH]1 ZINC000587041333 FG Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@H]1Cc1nc2c(Cl)ncnc2[nH]1 ZINC000587041337 FG Annotated Anodyne COc1cncc2nc(C[C@H]3Sc4ccc(Cl)cc4NC3=O)[nH]c12 ZINC000587041468 FG Annotated Anodyne COc1cncc2nc(C[C@@H]3Sc4ccc(Cl)cc4NC3=O)[nH]c12 ZINC000587041469 FG Annotated Anodyne CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2cc(Cl)nc(C#N)c2[nH]1 ZINC000587041488 FG Annotated Mild CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2ccc([N+](=O)[O-])cc2[nH]1 ZINC000587041511 FG Annotated Bother CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3cnccc3[nH]2)cc1 ZINC000587041583 FG Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3cnccc3[nH]2)cc1 ZINC000587041584 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc([C@@H]3Cc4ccccc4S3)[nH]c12 ZINC000587041617 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc([C@H]3Cc4ccccc4S3)[nH]c12 ZINC000587041618 FG Annotated Anodyne N#Cc1nc(Cl)cc2nc([C@@H]3CS[C@H](Cc4ccccc4)N3)[nH]c12 ZINC000587041655 FG Annotated Mild N#Cc1nc(Cl)cc2nc([C@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c12 ZINC000587041659 FG Annotated Mild N#Cc1nc(Cl)cc2nc([C@H]3CS[C@H](Cc4ccccc4)N3)[nH]c12 ZINC000587041660 FG Annotated Mild N#Cc1nc(Cl)cc2nc([C@@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c12 ZINC000587041661 FG Annotated Mild O=C1Nc2cc(Cl)ccc2S[C@H]1Cc1nc2ccc(CO)cc2[nH]1 ZINC000587042073 FG Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@@H]1Cc1nc2ccc(CO)cc2[nH]1 ZINC000587042074 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cc(C(=O)O)c(F)cc2[nH]1 ZINC000587042081 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cc(C(=O)O)c(F)cc2[nH]1 ZINC000587042082 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2ccc(Br)nc2[nH]1 ZINC000587042087 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2ccc(Br)nc2[nH]1 ZINC000587042088 FG Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3cc(F)cnc3[nH]2)cc1 ZINC000587042143 FG Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3cc(F)cnc3[nH]2)cc1 ZINC000587042145 FG Annotated Anodyne COc1cc2nc(C[C@H]3Sc4ccc(Cl)cc4NC3=O)[nH]c2cn1 ZINC000587042158 FG Annotated Anodyne COc1cc2nc(C[C@@H]3Sc4ccc(Cl)cc4NC3=O)[nH]c2cn1 ZINC000587042166 FG Annotated Anodyne COc1ccc2nc(C[C@H]3Sc4ccc(Cl)cc4NC3=O)[nH]c2n1 ZINC000587042180 FG Annotated Anodyne COc1ccc2nc(C[C@@H]3Sc4ccc(Cl)cc4NC3=O)[nH]c2n1 ZINC000587042181 FG Annotated Anodyne COC(=O)c1cccc2nc([C@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c12 ZINC000587042328 FG Annotated Anodyne COC(=O)c1cccc2nc([C@@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c12 ZINC000587042329 FG Annotated Anodyne COC(=O)c1cccc2nc([C@H]3CS[C@H](Cc4ccccc4)N3)[nH]c12 ZINC000587042330 FG Annotated Anodyne COC(=O)c1cccc2nc([C@@H]3CS[C@H](Cc4ccccc4)N3)[nH]c12 ZINC000587042331 FG Annotated Anodyne CCOC(=O)c1ccc2nc([C@@H]3CSCN3C(=O)C(C)(C)C)[nH]c2c1 ZINC000587042528 FG Annotated Anodyne CCOC(=O)c1ccc2nc([C@H]3CSCN3C(=O)C(C)(C)C)[nH]c2c1 ZINC000587042529 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc([C@@H]3Cc4ccccc4S3)[nH]c2c1 ZINC000587042692 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc([C@H]3Cc4ccccc4S3)[nH]c2c1 ZINC000587042693 FG Annotated Anodyne O=C1CSc2ccc(-c3nc4cc(Br)cnc4[nH]3)cc2N1 ZINC000587042709 FG Annotated Anodyne O=C1CSc2ccc(-c3nc4ccc(Br)nc4[nH]3)cc2N1 ZINC000587042711 FG Annotated Anodyne O=C1CSc2ccc(-c3nc4cc5c(cc4[nH]3)OCCCO5)cc2N1 ZINC000587042773 FG Annotated Anodyne COC(=O)c1cc2[nH]c(-c3ccc4c(c3)NC(=O)CS4)nc2cc1OC ZINC000587042812 FG Annotated Anodyne O=C1CSc2ccc(-c3nc4cc([N+](=O)[O-])c([N+](=O)[O-])cc4[nH]3)cc2N1 ZINC000587042825 FG Annotated Bother CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000587042916 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000587042917 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587043055 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587043056 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc([C@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587043088 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc([C@H]3CS[C@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587043091 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc([C@@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587043092 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc([C@@H]3CS[C@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587043095 FG Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@@H]1Cc1nc2nc(Cl)c[nH]c-2n1 ZINC000587043126 FG Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@H]1Cc1nc2nc(Cl)c[nH]c-2n1 ZINC000587043127 FG Annotated Anodyne COc1nccc2nc(C[C@H]3Sc4ccc(Cl)cc4NC3=O)[nH]c12 ZINC000587043192 FG Annotated Anodyne COc1nccc2nc(C[C@@H]3Sc4ccc(Cl)cc4NC3=O)[nH]c12 ZINC000587043193 FG Annotated Anodyne O=C1CCc2cc3nc(-c4ccc5c(c4)NC(=O)CS5)[nH]c3cc2N1 ZINC000587043348 FG Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@H]1Cc1nc2cnc(Cl)[nH]c-2n1 ZINC000587043616 FG Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@@H]1Cc1nc2cnc(Cl)[nH]c-2n1 ZINC000587043617 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2ccnc(Br)c2[nH]1 ZINC000587043638 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2ccnc(Br)c2[nH]1 ZINC000587043639 FG Annotated Anodyne O=C1CSc2ccc(-c3nc4cc(Br)ncc4[nH]3)cc2N1 ZINC000587043814 FG Annotated Anodyne CCCOc1cc2nc([C@H]3CSCC(=O)N3)[nH]c2cc1Br ZINC000587043815 FG Annotated Anodyne CCCOc1cc2nc([C@@H]3CSCC(=O)N3)[nH]c2cc1Br ZINC000587043818 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3ccc4c(c3)NC(=O)CS4)[nH]c2c1OC ZINC000587043829 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 ZINC000587044014 FG Annotated Bother CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 ZINC000587044015 FG Annotated Bother Nc1cc2nc(C[C@@H]3Sc4ccc(Cl)cc4NC3=O)[nH]c2cc1N ZINC000587044046 FG Annotated Anodyne Nc1cc2nc(C[C@H]3Sc4ccc(Cl)cc4NC3=O)[nH]c2cc1N ZINC000587044047 FG Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@H]1Cc1nc2ccc(CCO)cc2[nH]1 ZINC000587044104 FG Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@@H]1Cc1nc2ccc(CCO)cc2[nH]1 ZINC000587044105 FG Annotated Anodyne O=C1CSc2ccc(-c3nc4cnc(C(F)(F)F)[nH]c-4n3)cc2N1 ZINC000587044173 FG Annotated Anodyne O=C1CSc2ccc(-c3nc4ccnc(Br)c4[nH]3)cc2N1 ZINC000587044178 FG Annotated Anodyne O=C1CSc2ccc(-c3nc4c(Br)ccnc4[nH]3)cc2N1 ZINC000587044195 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cc(F)cc(C(=O)O)c2[nH]1 ZINC000587044252 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cc(F)cc(C(=O)O)c2[nH]1 ZINC000587044253 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cncc(Br)c2[nH]1 ZINC000587044270 FG Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cncc(Br)c2[nH]1 ZINC000587044271 FG Annotated Anodyne O=C1CSc2ccc(-c3nc4cncc(Br)c4[nH]3)cc2N1 ZINC000587044529 FG Annotated Anodyne CC(C)Oc1cc2nc([C@H]3CSCC(=O)N3)[nH]c2cc1Br ZINC000587044543 FG Annotated Anodyne CC(C)Oc1cc2nc([C@@H]3CSCC(=O)N3)[nH]c2cc1Br ZINC000587044544 FG Annotated Anodyne O=C1CSC[C@H](c2nc3cc(OC(F)(F)F)c(Cl)cc3[nH]2)N1 ZINC000587044575 FG Annotated Anodyne O=C1CSC[C@@H](c2nc3cc(OC(F)(F)F)c(Cl)cc3[nH]2)N1 ZINC000587044576 FG Annotated Anodyne COc1c(Cl)cc(Cl)c(OC)c1-c1nc2[nH]c(=N)[nH]c(Cl)c-2n1 ZINC000587044666 FG Annotated Anodyne COc1c(Cl)cc(Cl)c(OC)c1-c1nc2c(O)nc(S)nc2[nH]1 ZINC000587044908 FG Annotated Anodyne COc1cc(-c2nc3c(O)nc(O)nc3[nH]2)cc(Cl)c1OCC(C)C ZINC000587045837 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3cc(Cl)c(O)c(OC)c3)[nH]c2c1OC ZINC000587045925 FG Annotated Anodyne COc1cc(-c2nc3nc(Br)c[nH]c-3n2)cc(Cl)c1O ZINC000587046416 FG Annotated Anodyne COC(=O)c1ccc2nc(/C=C\c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2n1 ZINC000587047161 FG Annotated Bother COC(=O)c1ccc2nc(/C=C/c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2n1 ZINC000587047163 FG Annotated Bother N=c1[nH]c2nc(/C=C/c3ccc(Cl)c([N+](=O)[O-])c3)nc-2c(Cl)[nH]1 ZINC000587047303 FG Annotated Bother N=c1[nH]c2nc(/C=C\c3ccc(Cl)c([N+](=O)[O-])c3)nc-2c(Cl)[nH]1 ZINC000587047304 FG Annotated Bother COC(=O)c1ccnc2[nH]c(/C=C/c3ccc(Cl)c([N+](=O)[O-])c3)nc12 ZINC000587047987 FG Annotated Bother COC(=O)c1ccnc2[nH]c(/C=C\c3ccc(Cl)c([N+](=O)[O-])c3)nc12 ZINC000587047988 FG Annotated Bother O=[N+]([O-])c1cc(/C=C\c2nc3ccc(-n4cnnn4)cc3[nH]2)ccc1Cl ZINC000587048408 FG Annotated Bother O=[N+]([O-])c1cc(/C=C/c2nc3ccc(-n4cnnn4)cc3[nH]2)ccc1Cl ZINC000587048409 FG Annotated Bother COC(=O)c1cc2nc(/C=C/c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2cn1 ZINC000587048843 FG Annotated Bother COC(=O)c1cc2nc(/C=C\c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2cn1 ZINC000587048844 FG Annotated Bother N=c1nc(O)c2nc(-c3cc(-c4cccc(C=O)c4)ccc3Cl)[nH]c2[nH]1 ZINC000587049878 FG Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 ZINC000587051278 FG Annotated Bother N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587051391 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc([C@H](N)Cc3ccc(O)c(Cl)c3)[nH]c2c1 ZINC000587051826 FG Annotated Anodyne CN(C)CCOc1ccc2nc([C@H](N)Cc3ccc(O)c(Cl)c3)[nH]c2c1 ZINC000587052239 FG Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587052303 FG Annotated Anodyne COc1cccc(-c2ccc(-c3nc4c(O)nc(=N)[nH]c4[nH]3)c(Cl)c2)c1 ZINC000587052431 FG Annotated Anodyne CCOC(=O)c1ccc2nc([C@H](N)Cc3ccc(O)c(Cl)c3)[nH]c2c1 ZINC000587052436 FG Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000587052637 FG Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2ccnc(Br)c2[nH]1 ZINC000587052677 FG Annotated Anodyne CCc1cc(OCc2nc3cccc(S(N)(=O)=O)c3[nH]2)ccc1Cl ZINC000587052683 FG Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2ccc(Br)nc2[nH]1 ZINC000587052762 FG Annotated Anodyne CCc1cc(OCc2nc3ccc(S(N)(=O)=O)cc3[nH]2)ccc1Cl ZINC000587052782 FG Annotated Anodyne CCc1cc(OCc2nc3ccc(-n4cnnn4)cc3[nH]2)ccc1Cl ZINC000587052852 FG Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2cc(Br)cnc2[nH]1 ZINC000587052868 FG Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2cc(Br)ncc2[nH]1 ZINC000587052878 FG Annotated Anodyne NS(=O)(=O)c1cccc2nc(-c3cc(-n4cccc4)ccc3Cl)[nH]c12 ZINC000587052898 FG Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2c(Br)ccnc2[nH]1 ZINC000587052928 FG Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2cc3c(cc2[nH]1)OC(F)(F)O3 ZINC000587053002 FG Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2cncc(Br)c2[nH]1 ZINC000587053021 FG Annotated Anodyne O=c1ccc(-c2nc3ncc[nH]c-3n2)cn1Cc1ccc(Cl)cc1Cl ZINC000587054513 FG Annotated Anodyne CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2cncnc2[nH]1 ZINC000587054900 FG Annotated Bother CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2cncnc2[nH]1 ZINC000587054902 FG Annotated Bother CC1=C(c2ccc3nc(-c4ccc(O)cc4Cl)[nH]c3c2)NNC(=O)C1 ZINC000587055139 FG Annotated Anodyne CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2cnncc2[nH]1 ZINC000587056022 FG Annotated Bother CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2cnncc2[nH]1 ZINC000587056024 FG Annotated Bother CN(C)CCOc1ccc2nc(C[C@H](N)c3ccccc3Cl)[nH]c2c1 ZINC000587057292 FG Annotated Anodyne CN(C)CCOc1ccc2nc(C[C@@H](N)c3ccccc3Cl)[nH]c2c1 ZINC000587057295 FG Annotated Anodyne COC(=O)c1ccc2nc(C[C@@H](N)c3ccccc3Cl)[nH]c2c1OC ZINC000587057804 FG Annotated Anodyne COC(=O)c1ccc2nc(C[C@H](N)c3ccccc3Cl)[nH]c2c1OC ZINC000587057807 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(CCc3ccccc3Cl)[nH]c12 ZINC000587058132 FG Annotated Anodyne N[C@@H](Cc1ccccc1Cl)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587058786 FG Annotated Bother COC(=O)c1cc2[nH]c([C@@H](N)Cc3ccccc3Cl)nc2cc1OC ZINC000587059124 FG Annotated Anodyne CN(C)CCOc1ccc2nc([C@@H](N)Cc3ccccc3Cl)[nH]c2c1 ZINC000587059329 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@H](N)Cc3ccccc3Cl)[nH]c2c1OC ZINC000587059740 FG Annotated Anodyne N[C@@H](Cc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1)c1ccccc1Cl ZINC000587059961 FG Annotated Bother N[C@H](Cc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1)c1ccccc1Cl ZINC000587059962 FG Annotated Bother CC1=C(c2ccc3nc([C@H](O)c4ccccc4Cl)[nH]c3c2)NNC(=O)C1 ZINC000587060029 FG Annotated Anodyne CC1=C(c2ccc3nc([C@@H](O)c4ccccc4Cl)[nH]c3c2)NNC(=O)C1 ZINC000587060030 FG Annotated Anodyne N=c1nc(-c2ccccc2Cl)c(-c2nc3cc([N+](=O)[O-])cnc3[nH]2)c[nH]1 ZINC000587060392 FG Annotated Bother N=c1nc(-c2ccccc2Cl)c(-c2nc3cnc(Cl)[nH]c-3n2)c[nH]1 ZINC000587060532 FG Annotated Anodyne COc1cc2nc(-c3c[nH]c(=N)nc3-c3ccccc3Cl)[nH]c2cn1 ZINC000587060596 FG Annotated Anodyne N=c1nc(-c2ccccc2Cl)c(-c2nc3nc(Cl)c[nH]c-3n2)c[nH]1 ZINC000587060606 FG Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3c(N)ccnc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587060647 FG Annotated Anodyne N=c1nc(-c2ccccc2Cl)c(-c2nc3cc4c(cc3[nH]2)OCO4)c[nH]1 ZINC000587060819 FG Annotated Anodyne N=c1nc(-c2ccccc2Cl)c(-c2nc3ccc(CCO)cc3[nH]2)c[nH]1 ZINC000587060862 FG Annotated Anodyne COc1ccc2nc(-c3c[nH]c(=N)nc3-c3ccccc3Cl)[nH]c2n1 ZINC000587060960 FG Annotated Anodyne COc1cncc2nc(-c3c[nH]c(=N)nc3-c3ccccc3Cl)[nH]c12 ZINC000587061233 FG Annotated Anodyne N=c1nc(-c2ccccc2Cl)c(-c2nc3cncc([N+](=O)[O-])c3[nH]2)c[nH]1 ZINC000587061261 FG Annotated Bother N=c1nc(-c2ccccc2Cl)c(-c2nc3cccc(C(=O)O)c3[nH]2)c[nH]1 ZINC000587061629 FG Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3cc(=N)[nH]cc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587061640 FG Annotated Anodyne N=c1nc(-c2ccccc2Cl)c(-c2nc3c(Cl)ncnc3[nH]2)c[nH]1 ZINC000587061659 FG Annotated Anodyne NS(=O)(=O)c1cccc2nc(-c3coc(-c4ccccc4Cl)n3)[nH]c12 ZINC000587061683 FG Annotated Anodyne N#Cc1cc2nc(-c3c[nH]c(=N)nc3-c3ccccc3Cl)[nH]c2cc1C#N ZINC000587061806 FG Annotated Mild CCN1C(=O)C[C@@H](c2nc3cc[nH]c(=N)c3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587061954 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(CNc3ccccc3Cl)[nH]c12 ZINC000587062030 FG Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3ccnc(O)c3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587062112 FG Annotated Anodyne CC[C@@H](Oc1ccccc1Cl)c1nc2cccc(S(N)(=O)=O)c2[nH]1 ZINC000587062293 FG Annotated Anodyne CC[C@H](Oc1ccccc1Cl)c1nc2cccc(S(N)(=O)=O)c2[nH]1 ZINC000587062294 FG Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3cc(N)c(N)cc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587062506 FG Annotated Anodyne N=c1nc(O)c2nc(Cc3ccc(-c4ccccc4Cl)cc3)[nH]c2[nH]1 ZINC000587063126 FG Annotated Anodyne N=c1nc(O)c2nc(-c3ccc(COc4ccccc4Cl)cc3)[nH]c2[nH]1 ZINC000587063412 FG Annotated Anodyne Cc1onc(-c2nc3c(O)nncc3[nH]2)c1COc1ccccc1Cl ZINC000587063605 FG Annotated Anodyne Cc1onc(-c2nc3c(O)ncnc3[nH]2)c1COc1ccccc1Cl ZINC000587063689 FG Annotated Anodyne Cc1onc(-c2nc3ncnc(N)c3[nH]2)c1COc1ccccc1Cl ZINC000587063777 FG Annotated Anodyne CCOc1n[nH]c(-c2nc3cc(C(=O)OC)cc(Cl)c3[nH]2)c1Cl ZINC000587064349 FG Annotated Anodyne CCOc1n[nH]c(-c2nc3c(F)cnc(Br)c3[nH]2)c1Cl ZINC000587064781 FG Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000587064836 FG Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000587064839 FG Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc(-c3ncccc3Cl)nc-2[nH]1 ZINC000587064850 FG Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2cc(C#N)c(C#N)cc2[nH]1 ZINC000587064868 FG Annotated Mild Oc1nc(O)c2nc(-c3ccc(COc4ccccc4Cl)o3)[nH]c2n1 ZINC000587065002 FG Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2cnc(Cl)[nH]c-2n1 ZINC000587065149 FG Annotated Anodyne COC(=O)c1ccc2nc(COc3c(C=O)cc(Cl)cc3OC)[nH]c2c1 ZINC000587065153 FG Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2c(Cl)ncnc2[nH]1 ZINC000587065456 FG Annotated Anodyne COc1cnc(-c2nc3cc(C4=C(C)CC(=O)NN4)ccc3[nH]2)cc1Cl ZINC000587065476 FG Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2nc(Cl)c[nH]c-2n1 ZINC000587065480 FG Annotated Anodyne CCOc1n[nH]c(-c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)c1Cl ZINC000587065510 FG Annotated Anodyne CCOc1n[nH]c(-c2nc3cc(Br)c(C)nc3[nH]2)c1Cl ZINC000587065632 FG Annotated Anodyne Cc1nn(-c2cccc(-c3nc4c(O)nc(S)nc4[nH]3)c2)c(C)c1Cl ZINC000587065695 FG Annotated Anodyne Clc1cccnc1-c1nc2cc(I)cnc2[nH]1 ZINC000587065739 FG Annotated Anodyne CCOc1n[nH]c(-c2nc3ccc(Br)c(O)c3[nH]2)c1Cl ZINC000587065762 FG Annotated Anodyne Cc1nn(-c2cccc(-c3nc4[nH]c(=N)[nH]c(Cl)c-4n3)c2)c(C)c1Cl ZINC000587065803 FG Annotated Anodyne Cc1nn(-c2cccc(-c3nc4nc(C#N)c(C#N)nc4[nH]3)c2)c(C)c1Cl ZINC000587065828 FG Annotated Mild Cc1cc(Cl)ccc1OCCCc1nc2[nH]c(=N)[nH]c(Cl)c-2n1 ZINC000587065886 FG Annotated Anodyne COc1cc(Cl)ccc1-c1nc2cccc(S(=O)(=O)N(C)C)c2[nH]1 ZINC000587066070 FG Annotated Anodyne Cc1cc(Cl)ccc1OCCCc1nc2nc(C#N)c(C#N)nc2[nH]1 ZINC000587066335 FG Annotated Mild COc1cc(Cl)cc(C=O)c1OCc1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000587066595 FG Annotated Anodyne Cc1cc(Cl)ccc1OCCCc1nc2c(O)nc(S)nc2[nH]1 ZINC000587066777 FG Annotated Anodyne Cc1cc(Cl)ccc1-n1cccc1-c1nc2nc(C#N)c(C#N)[nH]c-2n1 ZINC000587066888 FG Annotated Mild CNc1cc(Cl)ccc1-c1nc2cccc(S(=O)(=O)N(C)C)c2[nH]1 ZINC000587067041 FG Annotated Anodyne Cc1cc(Cl)ccc1C#Cc1nc2cccc(S(=O)(=O)N(C)C)c2[nH]1 ZINC000587067093 FG Annotated Mild COC(=O)c1cccc2nc(COc3c(C=O)cc(Cl)cc3OC)[nH]c12 ZINC000587067124 FG Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2cccc(C(=O)O)c2[nH]1 ZINC000587067327 FG Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2cc3cn[nH]c3cc2[nH]1 ZINC000587067401 FG Annotated Anodyne N=c1[nH]cc2nc(-c3cc(Cl)cc(-c4ccc(CO)cc4)c3)nc-2[nH]1 ZINC000587067637 FG Annotated Anodyne COC(=O)c1ccc2[nH]c(-c3cc(-c4cccc(Cl)c4)[nH]n3)nc2n1 ZINC000587067935 FG Annotated Anodyne OCc1ccc(-c2cc(Cl)cc(-c3nc4c(O)nc(O)nc4[nH]3)c2)cc1 ZINC000587068020 FG Annotated Anodyne Cc1cc(Cl)ccc1O[C@H](C)c1nc2cccc(S(N)(=O)=O)c2[nH]1 ZINC000587068063 FG Annotated Anodyne Cc1cc(Cl)ccc1O[C@H](C)c1nc2ccc(S(N)(=O)=O)cc2[nH]1 ZINC000587068099 FG Annotated Anodyne Nc1ncnc2[nH]c(-c3cc(Cl)cc(-c4ccc(CO)cc4)c3)nc12 ZINC000587068136 FG Annotated Anodyne COC(=O)c1cc2[nH]c(-c3cc(-c4cccc(Cl)c4)[nH]n3)nc2cn1 ZINC000587068319 FG Annotated Anodyne Clc1cccc(-c2cc(-c3nc4cc(-n5cnnn5)ccc4[nH]3)n[nH]2)c1 ZINC000587068396 FG Annotated Anodyne C[C@H](CC(=O)c1ccc(Cl)cc1)c1nc2nc(C#N)c(C#N)nc2[nH]1 ZINC000587068483 FG Annotated Mild C[C@@H](CC(=O)c1ccc(Cl)cc1)c1nc2nc(C#N)c(C#N)nc2[nH]1 ZINC000587068486 FG Annotated Mild CN(C)CCOc1ccc2nc([C@H](CN)Cc3ccc(Cl)cc3)[nH]c2c1 ZINC000587068789 FG Annotated Anodyne CN(C)CCOc1ccc2nc([C@@H](CN)Cc3ccc(Cl)cc3)[nH]c2c1 ZINC000587068791 FG Annotated Anodyne C[C@@H](CC(=O)c1ccc(Cl)cc1)c1nc2ccc(C(=O)NN)cc2[nH]1 ZINC000587068999 FG Annotated Reactive C[C@H](CC(=O)c1ccc(Cl)cc1)c1nc2ccc(C(=O)NN)cc2[nH]1 ZINC000587069001 FG Annotated Reactive O=C(Cc1ccc(Cl)cc1)c1nc2nc(Br)c[nH]c-2n1 ZINC000587069131 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc([C@H](CN)Cc3ccc(Cl)cc3)[nH]c2c1 ZINC000587069204 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc([C@@H](CN)Cc3ccc(Cl)cc3)[nH]c2c1 ZINC000587069205 FG Annotated Anodyne NC[C@@H](Cc1ccc(Cl)cc1)c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000587069753 FG Annotated Anodyne NC[C@H](Cc1ccc(Cl)cc1)c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000587069762 FG Annotated Anodyne COC(=O)c1cc2[nH]c([C@@H](CN)Cc3ccc(Cl)cc3)nc2cc1OC ZINC000587069969 FG Annotated Anodyne COC(=O)c1cc2[nH]c([C@H](CN)Cc3ccc(Cl)cc3)nc2cc1OC ZINC000587069974 FG Annotated Anodyne C[C@H](CC(=O)c1ccc(Cl)cc1)c1nc2[nH]c(=N)[nH]c(Cl)c-2n1 ZINC000587070957 FG Annotated Anodyne C[C@@H](CC(=O)c1ccc(Cl)cc1)c1nc2[nH]c(=N)[nH]c(Cl)c-2n1 ZINC000587070961 FG Annotated Anodyne O=C(Cc1ccc(Cl)cc1)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587071157 FG Annotated Bother COC(=O)c1ccc2nc([C@@H](CN)Cc3ccc(Cl)cc3)[nH]c2c1OC ZINC000587071247 FG Annotated Anodyne COC(=O)c1ccc2nc([C@H](CN)Cc3ccc(Cl)cc3)[nH]c2c1OC ZINC000587071248 FG Annotated Anodyne NC[C@@H](Cc1ccc(Cl)cc1)c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000587071286 FG Annotated Anodyne NC[C@H](Cc1ccc(Cl)cc1)c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000587071287 FG Annotated Anodyne NC[C@@H](Cc1ccc(Cl)cc1)c1nc2nc(Br)c[nH]c-2n1 ZINC000587071296 FG Annotated Anodyne NC[C@H](Cc1ccc(Cl)cc1)c1nc2nc(Br)c[nH]c-2n1 ZINC000587071297 FG Annotated Anodyne COC(=O)c1ccc2[nH]c(C(=O)Cc3ccc(Cl)cc3)nc2c1OC ZINC000587071641 FG Annotated Anodyne COC(=O)c1cc2nc(C(=O)Cc3ccc(Cl)cc3)[nH]c2cc1OC ZINC000587071998 FG Annotated Anodyne COc1cncc2nc(-c3nnn(Cc4ccc(Cl)cc4)c3C)[nH]c12 ZINC000587073096 FG Annotated Anodyne Cc1c(-c2nc3ccc(CCO)cc3[nH]2)nnn1Cc1ccc(Cl)cc1 ZINC000587073104 FG Annotated Anodyne Cc1c(-c2nc3cncc([N+](=O)[O-])c3[nH]2)nnn1Cc1ccc(Cl)cc1 ZINC000587073133 FG Annotated Bother COc1nccc2nc(-c3nnn(Cc4ccc(Cl)cc4)c3C)[nH]c12 ZINC000587073156 FG Annotated Anodyne Cc1c(-c2nc3cc([N+](=O)[O-])cnc3[nH]2)nnn1Cc1ccc(Cl)cc1 ZINC000587073288 FG Annotated Bother Clc1ccc(CC2(c3nc4ccc(-n5cnnn5)cc4[nH]3)CC2)cc1 ZINC000587073324 FG Annotated Anodyne COc1ccc2nc(-c3nnn(Cc4ccc(Cl)cc4)c3C)[nH]c2n1 ZINC000587073382 FG Annotated Anodyne Cc1c(-c2nc3ccc(CO)cc3[nH]2)nnn1Cc1ccc(Cl)cc1 ZINC000587073531 FG Annotated Anodyne Cc1c(-c2nc3c(Cl)ncnc3[nH]2)nnn1Cc1ccc(Cl)cc1 ZINC000587073647 FG Annotated Anodyne Cc1c(-c2nc3cnc(Cl)[nH]c-3n2)nnn1Cc1ccc(Cl)cc1 ZINC000587073652 FG Annotated Anodyne NS(=O)(=O)c1cccc2nc(C3(Cc4ccc(Cl)cc4)CC3)[nH]c12 ZINC000587073718 FG Annotated Anodyne NS(=O)(=O)c1cccc2nc(C3(c4ccc(Cl)cc4)CCC3)[nH]c12 ZINC000587073982 FG Annotated Anodyne Oc1nc(S)nc2[nH]c([C@H]3CCCN3Cc3ccc(Cl)cc3)nc12 ZINC000587074455 FG Annotated Anodyne Oc1nc(S)nc2[nH]c([C@@H]3CCCN3Cc3ccc(Cl)cc3)nc12 ZINC000587074459 FG Annotated Anodyne NS(=O)(=O)c1ccc2nc(C3(c4ccc(Cl)cc4)CCC3)[nH]c2c1 ZINC000587074464 FG Annotated Anodyne COc1cc2nc(-c3nnn(Cc4ccc(Cl)cc4)c3C)[nH]c2cn1 ZINC000587074731 FG Annotated Anodyne N=c1[nH]c2nc([C@H]3CCCN3Cc3ccc(Cl)cc3)nc-2c(Cl)[nH]1 ZINC000587074759 FG Annotated Anodyne N=c1[nH]c2nc([C@@H]3CCCN3Cc3ccc(Cl)cc3)nc-2c(Cl)[nH]1 ZINC000587074760 FG Annotated Anodyne Cc1c(-c2nc3nc(Cl)c[nH]c-3n2)nnn1Cc1ccc(Cl)cc1 ZINC000587074777 FG Annotated Anodyne Clc1ccc(-n2cc(-c3nc4cc5c(cc4[nH]3)OCCO5)nn2)cc1 ZINC000587074940 FG Annotated Anodyne COC(=O)c1cccc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c12 ZINC000587074943 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@H]3C=C(c4ccc(Cl)cc4)NO3)[nH]c2n1 ZINC000587075030 FG Annotated Anodyne COC(=O)c1ccc2nc([C@H]3C=C(c4ccc(Cl)cc4)NO3)[nH]c2n1 ZINC000587075032 FG Annotated Anodyne Cc1nn(-c2ccc(Cl)cc2)cc1-c1nc2[nH]c(=N)[nH]c(Cl)c-2n1 ZINC000587075133 FG Annotated Anodyne Cc1nn(-c2ccc(Cl)cc2)cc1-c1nc2c(O)nc(S)nc2[nH]1 ZINC000587075188 FG Annotated Anodyne N[C@@H](N=O)c1ccc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c2c1 ZINC000587075436 FG Annotated Anodyne N[C@H](N=O)c1ccc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c2c1 ZINC000587075437 FG Annotated Anodyne COc1nccc2nc(CCc3nnc(-c4ccc(Cl)cc4)o3)[nH]c12 ZINC000587075529 FG Annotated Anodyne O=[N+]([O-])c1cnc2[nH]c(CCc3nnc(-c4ccc(Cl)cc4)o3)nc2c1 ZINC000587075703 FG Annotated Bother Cc1c(-c2nc3c(O)nc(S)nc3[nH]2)cnn1-c1ccc(Cl)cc1 ZINC000587075740 FG Annotated Anodyne COc1cc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c2cc1OC ZINC000587075758 FG Annotated Anodyne Cc1onc(-c2nc3c(O)ncnc3[nH]2)c1COc1ccc(Cl)cc1 ZINC000587075791 FG Annotated Anodyne Oc1nc2cc3nc(-c4cn(-c5ccc(Cl)cc5)nn4)[nH]c3cc2[nH]1 ZINC000587075822 FG Annotated Anodyne COc1cc(OC)c2[nH]c(-c3cn(-c4ccc(Cl)cc4)nn3)nc2c1 ZINC000587075828 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c2c1 ZINC000587075847 FG Annotated Anodyne O=C1CCc2cc3nc(-c4cn(-c5ccc(Cl)cc5)nn4)[nH]c3cc2N1 ZINC000587075902 FG Annotated Anodyne O=C(O)c1cc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c2cc1F ZINC000587075956 FG Annotated Anodyne N#Cc1nc2nc(-c3ccncc3-c3ccc(Cl)cc3)nc-2[nH]c1C#N ZINC000587076044 FG Annotated Mild COc1ccc2nc(CCc3nnc(-c4ccc(Cl)cc4)o3)[nH]c2n1 ZINC000587076119 FG Annotated Anodyne Cc1c(-c2nc3[nH]c(=N)[nH]c(Cl)c-3n2)cnn1-c1ccc(Cl)cc1 ZINC000587076263 FG Annotated Anodyne FC(F)(F)c1ncc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)nc-2[nH]1 ZINC000587076350 FG Annotated Anodyne N#Cc1nc(Cl)cc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c12 ZINC000587076356 FG Annotated Mild O=C(O)c1cc(F)cc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c12 ZINC000587076372 FG Annotated Anodyne Cc1onc(-c2nc3c(O)nncc3[nH]2)c1COc1ccc(Cl)cc1 ZINC000587076382 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c([C@H]3C=C(c4ccc(Cl)cc4)NO3)nc12 ZINC000587076576 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c([C@@H]3C=C(c4ccc(Cl)cc4)NO3)nc12 ZINC000587076578 FG Annotated Anodyne O=C1COc2cc3[nH]c([C@@H]4C=C(c5ccc(Cl)cc5)NO4)nc3cc2N1 ZINC000587076639 FG Annotated Anodyne O=C1COc2cc3[nH]c([C@H]4C=C(c5ccc(Cl)cc5)NO4)nc3cc2N1 ZINC000587076642 FG Annotated Anodyne N#Cc1nc2nc(-c3ccc(-c4ccc(Cl)cc4)nc3O)nc-2[nH]c1C#N ZINC000587076720 FG Annotated Mild Cc1onc(-c2nc3ncnc(N)c3[nH]2)c1COc1ccc(Cl)cc1 ZINC000587076830 FG Annotated Anodyne Oc1nc2cc3nc([C@@H]4C=C(c5ccc(Cl)cc5)NO4)[nH]c3cc2[nH]1 ZINC000587077038 FG Annotated Anodyne Oc1nc2cc3nc([C@H]4C=C(c5ccc(Cl)cc5)NO4)[nH]c3cc2[nH]1 ZINC000587077039 FG Annotated Anodyne N#Cc1nc2nc([C@@H]3CCCN3Cc3ccc(Cl)cc3)[nH]c2nc1C#N ZINC000587077130 FG Annotated Mild N#Cc1nc2nc([C@H]3CCCN3Cc3ccc(Cl)cc3)[nH]c2nc1C#N ZINC000587077134 FG Annotated Mild Oc1nc(-c2ccc(Cl)cc2)ccc1-c1nc2c(O)nc(S)nc2[nH]1 ZINC000587077173 FG Annotated Anodyne COC(=O)c1cc2nc([C@@H]3C=C(c4ccc(Cl)cc4)NO3)[nH]c2cn1 ZINC000587077211 FG Annotated Anodyne COC(=O)c1cc2nc([C@H]3C=C(c4ccc(Cl)cc4)NO3)[nH]c2cn1 ZINC000587077212 FG Annotated Anodyne Clc1ccc(-c2nnc(CCc3nc4c(Cl)ncnc4[nH]3)o2)cc1 ZINC000587077226 FG Annotated Anodyne Clc1ccc(-c2nnc(CCc3nc4nc(Cl)c[nH]c-4n3)o2)cc1 ZINC000587077248 FG Annotated Anodyne Nc1cc2nc(CCc3nnc(-c4ccc(Cl)cc4)o3)[nH]c2cc1N ZINC000587077250 FG Annotated Anodyne COc1cncc2nc(CCc3nnc(-c4ccc(Cl)cc4)o3)[nH]c12 ZINC000587077292 FG Annotated Anodyne O=[N+]([O-])c1cncc2nc(CCc3nnc(-c4ccc(Cl)cc4)o3)[nH]c12 ZINC000587077577 FG Annotated Bother Sc1nc(S)c2nc([C@H]3C=C(c4ccc(Cl)cc4)NO3)[nH]c2n1 ZINC000587077578 FG Annotated Anodyne Sc1nc(S)c2nc([C@@H]3C=C(c4ccc(Cl)cc4)NO3)[nH]c2n1 ZINC000587077579 FG Annotated Anodyne Clc1ccc(-c2nnc(CCc3nc4cnc(Cl)[nH]c-4n3)o2)cc1 ZINC000587077776 FG Annotated Anodyne Oc1nc(O)c2nc([C@H]3Nc4ccc(Cl)cc4[C@H]4C=CC[C@H]43)[nH]c2n1 ZINC000587078381 FG Annotated Clean C[C@@H](c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1)n1cc(Cl)cn1 ZINC000587078709 FG Annotated Anodyne C[C@H](c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1)n1cc(Cl)cn1 ZINC000587078710 FG Annotated Anodyne C[C@@H](c1nc2cc(I)cnc2[nH]1)n1cc(Cl)cn1 ZINC000587078895 FG Annotated Anodyne C[C@H](c1nc2cc(I)cnc2[nH]1)n1cc(Cl)cn1 ZINC000587078896 FG Annotated Anodyne N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000587078919 FG Annotated Bother N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000587078923 FG Annotated Bother Cc1ccc2[nH]c(-c3noc(C)c3Cn3cc(Cl)c([N+](=O)[O-])n3)nc2n1 ZINC000587079021 FG Annotated Bother O=S(=O)(O)c1ccc2nc(Cn3ccc4ccc(Cl)cc43)[nH]c2c1 ZINC000587079059 FG Annotated Anodyne Cc1cnc2nc(-c3noc(C)c3Cn3cc(Cl)c([N+](=O)[O-])n3)[nH]c2c1 ZINC000587079086 FG Annotated Bother C[C@@H](c1nc2cc(Br)cc(C(=O)O)c2[nH]1)n1cc(Cl)cn1 ZINC000587079099 FG Annotated Anodyne C[C@H](c1nc2cc(Br)cc(C(=O)O)c2[nH]1)n1cc(Cl)cn1 ZINC000587079100 FG Annotated Anodyne NC(=O)c1cccc2nc([C@H](N)Cc3c[nH]c4cc(Cl)ccc34)[nH]c12 ZINC000587079157 FG Annotated Anodyne NC(=O)c1cccc2nc([C@@H](N)Cc3c[nH]c4cc(Cl)ccc34)[nH]c12 ZINC000587079161 FG Annotated Anodyne Cc1onc(-c2nc3ccccc3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 ZINC000587079191 FG Annotated Bother Cc1onc(-c2nc3ccnc(C)c3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 ZINC000587079434 FG Annotated Bother COC(=O)c1cc2nc([C@H](N)Cc3c[nH]c4cc(Cl)ccc34)[nH]c2cn1 ZINC000587079529 FG Annotated Anodyne COC(=O)c1cc2nc([C@@H](N)Cc3c[nH]c4cc(Cl)ccc34)[nH]c2cn1 ZINC000587079530 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c([C@H](N)Cc3c[nH]c4cc(Cl)ccc34)nc12 ZINC000587079552 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c([C@@H](N)Cc3c[nH]c4cc(Cl)ccc34)nc12 ZINC000587079553 FG Annotated Anodyne Cc1onc(-c2nc3c(O)cccc3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 ZINC000587079605 FG Annotated Bother C[C@@H](c1nc2[nH]c(O)nc(NCc3ccccc3)c-2n1)n1cc(Cl)cn1 ZINC000587079633 FG Annotated Anodyne C[C@H](c1nc2[nH]c(O)nc(NCc3ccccc3)c-2n1)n1cc(Cl)cn1 ZINC000587079638 FG Annotated Anodyne Cc1onc(-c2nc3c(C)cncc3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 ZINC000587079883 FG Annotated Bother NC(=O)c1ccc2nc([C@H](N)Cc3c[nH]c4cc(Cl)ccc34)[nH]c2c1 ZINC000587079888 FG Annotated Anodyne NC(=O)c1ccc2nc([C@@H](N)Cc3c[nH]c4cc(Cl)ccc34)[nH]c2c1 ZINC000587079889 FG Annotated Anodyne O=S(=O)(O)c1ccc2nc([C@@H]3Cc4cc(Cl)ccc4O3)[nH]c2c1 ZINC000587080036 FG Annotated Anodyne O=S(=O)(O)c1ccc2nc([C@H]3Cc4cc(Cl)ccc4O3)[nH]c2c1 ZINC000587080037 FG Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2ccc(CCO)cc2[nH]1 ZINC000587080203 FG Annotated Anodyne N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2ccc(CCO)cc2[nH]1 ZINC000587080205 FG Annotated Anodyne Oc1ncnc2[nH]c(-c3cc(-c4ccccc4)nc4c(Cl)cnn34)nc12 ZINC000587080250 FG Annotated Anodyne Cc1onc(-c2nc3cc(O)ccc3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 ZINC000587080280 FG Annotated Bother O=C(CCCc1nc2c(S)nc(S)nc2[nH]1)c1ccc(Cl)cn1 ZINC000587080376 FG Annotated Anodyne Cc1onc(-c2nc3nccc(C)c3[nH]2)c1Cn1cc(Cl)c([N+](=O)[O-])n1 ZINC000587080467 FG Annotated Bother COC(=O)c1ccc2nc([C@H](N)Cc3c[nH]c4cc(Cl)ccc34)[nH]c2n1 ZINC000587080949 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@H](N)Cc3c[nH]c4cc(Cl)ccc34)[nH]c2n1 ZINC000587080950 FG Annotated Anodyne O=C1COc2cc3[nH]c(CCCC(=O)c4ccc(Cl)cn4)nc3cc2N1 ZINC000587080970 FG Annotated Anodyne Clc1ccc2c(c1)C[C@H](c1nc3nc(Br)c[nH]c-3n1)O2 ZINC000587081103 FG Annotated Anodyne Clc1ccc2c(c1)C[C@@H](c1nc3nc(Br)c[nH]c-3n1)O2 ZINC000587081104 FG Annotated Anodyne N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000587081181 FG Annotated Bother N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000587081182 FG Annotated Bother Oc1nncc2[nH]c(-c3cc(-c4ccccc4)nc4c(Cl)cnn34)nc12 ZINC000587081538 FG Annotated Anodyne N=c1[nH]ccc2[nH]c(-c3cc(-c4ccccc4)nc4c(Cl)cnn34)nc12 ZINC000587081588 FG Annotated Anodyne O=[N+]([O-])c1cncc2nc(-c3cccc(OCn4cc(Cl)cn4)c3)[nH]c12 ZINC000587081917 FG Annotated Bother N=c1cc2[nH]c(-c3cc(-c4ccccc4)nc4c(Cl)cnn34)nc2c[nH]1 ZINC000587081931 FG Annotated Anodyne O=C(CCCc1nc2cc3nc(O)[nH]c3cc2[nH]1)c1ccc(Cl)cn1 ZINC000587081937 FG Annotated Anodyne O=[N+]([O-])c1cnc2[nH]c(-c3cccc(OCn4cc(Cl)cn4)c3)nc2c1 ZINC000587082131 FG Annotated Bother Nc1cc2nc(-c3cccc(OCn4cc(Cl)cn4)c3)[nH]c2cc1N ZINC000587082149 FG Annotated Anodyne COc1ccc(-c2nc3ccc(C4=C(C)CC(=O)NN4)cc3[nH]2)c(Cl)n1 ZINC000587083628 FG Annotated Anodyne COc1ccc(-c2nc3ccc(CN4CCOCC4)cc3[nH]2)c(Cl)n1 ZINC000587083690 FG Annotated Anodyne N#Cc1nc2nc(-c3ccc(-c4ccccc4)c(Cl)n3)[nH]c2nc1C#N ZINC000587083744 FG Annotated Mild COC(=O)c1cc2[nH]c(C3(c4cccc(Cl)n4)CC3)nc2cc1OC ZINC000587083884 FG Annotated Anodyne Clc1cccc(C2(c3nc4nc(Br)c[nH]c-4n3)CC2)n1 ZINC000587083963 FG Annotated Anodyne COC(=O)c1ccc2nc(C3(c4cccc(Cl)n4)CC3)[nH]c2c1OC ZINC000587084095 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2[nH]c(-c3ccc(Cl)c(Cl)n3)nc12 ZINC000587084166 FG Annotated Anodyne O=[N+]([O-])c1cccc2nc(C3CCN(c4nccnc4Cl)CC3)[nH]c12 ZINC000587084427 FG Annotated Bother O=[N+]([O-])c1ccc2nc(C3CCN(c4nccnc4Cl)CC3)[nH]c2c1 ZINC000587084600 FG Annotated Bother NS(=O)(=O)c1cccc2nc(-c3cc(Cl)nc4ccccc34)[nH]c12 ZINC000587084730 FG Annotated Anodyne O=C(O)c1cccc2nc(C3CCN(c4nccnc4Cl)CC3)[nH]c12 ZINC000587084765 FG Annotated Anodyne NS(=O)(=O)c1cccc2nc(-c3ccc4cc(Cl)ncc4c3)[nH]c12 ZINC000587084865 FG Annotated Anodyne N#Cc1nc(Cl)cc2nc(C3CCN(c4nccnc4Cl)CC3)[nH]c12 ZINC000587084992 FG Annotated Mild Clc1nccnc1N1CCC(c2nc3cc4cn[nH]c4cc3[nH]2)CC1 ZINC000587085185 FG Annotated Anodyne COC(=O)c1cccc2nc(C3CCN(c4nccnc4Cl)CC3)[nH]c12 ZINC000587085281 FG Annotated Anodyne N=c1nc2nc(-c3ccc(-c4ccc(Cl)nn4)cc3)[nH]c2c(Cl)[nH]1 ZINC000587085363 FG Annotated Anodyne N[C@@H](N=O)c1ccc2nc(C3CCN(c4nccnc4Cl)CC3)[nH]c2c1 ZINC000587085502 FG Annotated Anodyne N[C@H](N=O)c1ccc2nc(C3CCN(c4nccnc4Cl)CC3)[nH]c2c1 ZINC000587085503 FG Annotated Anodyne O=C(O)c1cc(Br)cc2nc(-c3cnc(Cl)nc3)[nH]c12 ZINC000587085747 FG Annotated Anodyne Clc1ncc(-c2nc3cccc(I)c3[nH]2)cn1 ZINC000587085812 FG Annotated Anodyne O=[N+]([O-])c1cc(Br)cc2nc(-c3cnc(Cl)nc3)[nH]c12 ZINC000587085822 FG Annotated Bother COC(=O)c1cc(Br)c2[nH]c(-c3cnc(Cl)nc3)nc2c1 ZINC000587085862 FG Annotated Anodyne O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3cnc(Cl)nc3)[nH]c21 ZINC000587085913 FG Annotated Clean NS(=O)(=O)c1cccc2nc(-c3cc4ccccc4c(Cl)n3)[nH]c12 ZINC000587085936 FG Annotated Anodyne O=[N+]([O-])c1c(Br)ccc2nc(-c3cnc(Cl)nc3)[nH]c12 ZINC000587086249 FG Annotated Bother Nc1ncc(Cl)nc1-c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587086419 FG Annotated Anodyne O=C(O)c1cc(F)cc2nc(C(F)(Br)Br)[nH]c12 ZINC000587086485 FG Annotated Anodyne CC(C)(F)[C@H](Br)c1nc2nc(Br)c[nH]c-2n1 ZINC000587086488 FG Annotated Reactive CC(C)(F)[C@@H](Br)c1nc2nc(Br)c[nH]c-2n1 ZINC000587086489 FG Annotated Reactive N[C@H](N=O)c1ccc2nc(C(F)(Br)Br)[nH]c2c1 ZINC000587086531 FG Annotated Anodyne N[C@@H](N=O)c1ccc2nc(C(F)(Br)Br)[nH]c2c1 ZINC000587086532 FG Annotated Anodyne Oc1nc2cc3nc(C(F)(Br)Br)[nH]c3cc2[nH]1 ZINC000587086592 FG Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3ccc(-c4ccc(Cl)nn4)cc3)nc12 ZINC000587086621 FG Annotated Anodyne N#Cc1cc2nc(C(F)(Br)Br)[nH]c2cc1C#N ZINC000587086920 FG Annotated Mild O=C(O)c1ccc2nc(C(F)(Br)Br)[nH]c2c1 ZINC000587086944 FG Annotated Anodyne COC(=O)c1cccc2nc(C(F)(Br)Br)[nH]c12 ZINC000587086958 FG Annotated Anodyne COc1cc2nc(C(F)(Br)Br)[nH]c2cc1OC ZINC000587087190 FG Annotated Anodyne COc1cc(OC)c2[nH]c(C(F)(Br)Br)nc2c1 ZINC000587087422 FG Annotated Anodyne FC(Br)(Br)c1nc2cc3c(cc2[nH]1)OCO3 ZINC000587087664 FG Annotated Anodyne FC(Br)(Br)c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000587087840 FG Annotated Anodyne O=[N+]([O-])c1cccc2nc(C(F)(Br)Br)[nH]c12 ZINC000587087863 FG Annotated Bother O=C(O)c1cccc2nc(C(F)(Br)Br)[nH]c12 ZINC000587087874 FG Annotated Anodyne Nc1ncc(Cl)nc1-c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587088178 FG Annotated Anodyne CC1=C(c2ccc3nc(C(C[C@H]4CCCN4)=C(F)F)[nH]c3c2)NNC(=O)C1 ZINC000587088338 FG Annotated Anodyne CC1=C(c2ccc3nc(C(C[C@@H]4CCCN4)=C(F)F)[nH]c3c2)NNC(=O)C1 ZINC000587088342 FG Annotated Anodyne Nc1ccc(-c2ccc3nc(-c4nc(Cl)cnc4N)[nH]c3c2)cc1N ZINC000587088445 FG Annotated Anodyne Nc1ncc(Cl)nc1-c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587088446 FG Annotated Anodyne COC(=O)c1ccc2nc(C(C[C@H]3CCCN3)=C(F)F)[nH]c2c1OC ZINC000587088537 FG Annotated Anodyne COC(=O)c1ccc2nc(C(C[C@@H]3CCCN3)=C(F)F)[nH]c2c1OC ZINC000587088544 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(C(C[C@H]3CCCN3)=C(F)F)[nH]c2cc1[N+](=O)[O-] ZINC000587088559 FG Annotated Bother O=[N+]([O-])c1cc2nc(C(C[C@@H]3CCCN3)=C(F)F)[nH]c2cc1[N+](=O)[O-] ZINC000587088560 FG Annotated Bother O=[N+]([O-])c1cc2nc(C(F)(Br)Br)[nH]c2cc1F ZINC000587088591 FG Annotated Bother N#Cc1nc(Cl)cc2nc(C(F)(Br)Br)[nH]c12 ZINC000587088598 FG Annotated Mild FC(F)=C(C[C@@H]1CCCN1)c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587088811 FG Annotated Anodyne FC(F)=C(C[C@H]1CCCN1)c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587088813 FG Annotated Anodyne CN(C)CCOc1ccc2nc(C(C[C@H]3CCCN3)=C(F)F)[nH]c2c1 ZINC000587088827 FG Annotated Anodyne CN(C)CCOc1ccc2nc(C(C[C@@H]3CCCN3)=C(F)F)[nH]c2c1 ZINC000587088829 FG Annotated Anodyne O=C(O)c1cc2nc(C(F)(Br)Br)[nH]c2cc1F ZINC000587088876 FG Annotated Anodyne O=S(=O)(c1ccc2nc(C(F)(F)C(F)F)[nH]c2c1)C(F)(F)F ZINC000587089135 FG Annotated Mild O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)c1nc2cccnc2[nH]1 ZINC000587089141 FG Annotated Mild COC(=O)c1cc2[nH]c(C(C[C@H]3CCCN3)=C(F)F)nc2cc1OC ZINC000587089205 FG Annotated Anodyne COC(=O)c1cc2[nH]c(C(C[C@@H]3CCCN3)=C(F)F)nc2cc1OC ZINC000587089206 FG Annotated Anodyne O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)c1nc2cnccc2[nH]1 ZINC000587089272 FG Annotated Mild Oc1nc(NCc2ccccc2)c2nc(C(F)(F)c3ccccn3)nc-2[nH]1 ZINC000587089398 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(C(F)(F)C(F)F)nc2c1 ZINC000587089828 FG Annotated Anodyne N=c1cc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c2c[nH]1 ZINC000587089848 FG Annotated Mild FC(F)(F)[C@@](F)(Cl)c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587089918 FG Annotated Anodyne FC(F)(F)[C@](F)(Cl)c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587089919 FG Annotated Anodyne N=c1[nH]ccc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c12 ZINC000587089996 FG Annotated Mild Nc1ccnc2[nH]c(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)nc12 ZINC000587090064 FG Annotated Mild CC1=C(c2ccc3nc([C@](F)(Cl)C(F)(F)F)[nH]c3c2)NNC(=O)C1 ZINC000587090223 FG Annotated Anodyne CC1=C(c2ccc3nc([C@@](F)(Cl)C(F)(F)F)[nH]c3c2)NNC(=O)C1 ZINC000587090226 FG Annotated Anodyne FC(F)(c1ccccn1)c1nc2cc(I)cnc2[nH]1 ZINC000587090748 FG Annotated Anodyne COC(=O)c1cccc2nc(-c3ccnc(OCC(F)(F)F)c3)[nH]c12 ZINC000587090891 FG Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2cnc(Cl)[nH]c-2n1)C(F)(F)F ZINC000587091107 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2cnc(Cl)[nH]c-2n1)C(F)(F)F ZINC000587091108 FG Annotated Anodyne COc1cc2nc(-c3cc([N+](=O)[O-])n(CC(F)(F)F)n3)[nH]c2cc1F ZINC000587091163 FG Annotated Bother N#Cc1nc(Cl)cc2nc(-c3ccnc(OCC(F)(F)F)c3)[nH]c12 ZINC000587091164 FG Annotated Mild CCOc1ccccc1[C@](N)(c1nc2ccc(CO)cc2[nH]1)C(F)(F)F ZINC000587091200 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2ccc(CO)cc2[nH]1)C(F)(F)F ZINC000587091202 FG Annotated Anodyne FC(F)(F)COc1cc(-c2nc3cc4c(cc3[nH]2)OCCO4)ccn1 ZINC000587091206 FG Annotated Anodyne FC(F)(F)COc1nc(C(F)(F)F)ccc1-c1nc2ncncc2[nH]1 ZINC000587091222 FG Annotated Anodyne O=C1CCc2cc3nc(-c4ccnc(OCC(F)(F)F)c4)[nH]c3cc2N1 ZINC000587091245 FG Annotated Anodyne FC(F)(F)COc1cc(-c2nc3cnc(C(F)(F)F)[nH]c-3n2)ccn1 ZINC000587091270 FG Annotated Anodyne Cc1cnc(Cl)c2[nH]c(-c3cc([N+](=O)[O-])n(CC(F)(F)F)n3)nc12 ZINC000587091355 FG Annotated Bother FC(F)(F)COc1cc(-c2nc3nc(Br)c[nH]c-3n2)ccn1 ZINC000587091414 FG Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2ccc(C)nc2[nH]1)C(F)(F)F ZINC000587091461 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2ccc(C)nc2[nH]1)C(F)(F)F ZINC000587091462 FG Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2ccc(OC)nc2[nH]1)C(F)(F)F ZINC000587091513 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2ccc(OC)nc2[nH]1)C(F)(F)F ZINC000587091514 FG Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2ccc(O)cc2[nH]1)C(F)(F)F ZINC000587091517 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2ccc(O)cc2[nH]1)C(F)(F)F ZINC000587091518 FG Annotated Anodyne N[C@H](N=O)c1ccc2nc(-c3ccnc(OCC(F)(F)F)c3)[nH]c2c1 ZINC000587091527 FG Annotated Anodyne N[C@@H](N=O)c1ccc2nc(-c3ccnc(OCC(F)(F)F)c3)[nH]c2c1 ZINC000587091528 FG Annotated Anodyne O=[N+]([O-])c1cc(-c2nc3cc(F)c(F)c(F)c3[nH]2)nn1CC(F)(F)F ZINC000587091536 FG Annotated Bother CCOc1ccccc1[C@](N)(c1nc2cncc(C)c2[nH]1)C(F)(F)F ZINC000587091542 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2cncc(C)c2[nH]1)C(F)(F)F ZINC000587091543 FG Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2nc(Cl)c[nH]c-2n1)C(F)(F)F ZINC000587091549 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2nc(Cl)c[nH]c-2n1)C(F)(F)F ZINC000587091550 FG Annotated Anodyne Cc1cc2[nH]c(-c3cc([N+](=O)[O-])n(CC(F)(F)F)n3)nc2cc1[N+](=O)[O-] ZINC000587091737 FG Annotated Bother COc1cc2nc(-c3cc([N+](=O)[O-])n(CC(F)(F)F)n3)[nH]c2cc1C ZINC000587091739 FG Annotated Bother CCOc1ccccc1[C@](N)(c1nc2c(C)nccc2[nH]1)C(F)(F)F ZINC000587091865 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2c(C)nccc2[nH]1)C(F)(F)F ZINC000587091866 FG Annotated Anodyne N#Cc1cc(Cl)c2[nH]c(-c3cc([N+](=O)[O-])n(CC(F)(F)F)n3)nc2c1 ZINC000587091940 FG Annotated Mild N=c1[nH]c2nc(-c3ccnc(SCC(F)(F)F)c3)nc-2c(Cl)[nH]1 ZINC000587092177 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc(-c3ncoc3CCC(F)(F)F)[nH]c2c1 ZINC000587092201 FG Annotated Anodyne FC(F)(F)COc1nc(C(F)(F)F)ccc1-c1nc2ncc[nH]c-2n1 ZINC000587092240 FG Annotated Anodyne O=C(O)c1cc(F)cc2nc(-c3ccnc(OCC(F)(F)F)c3)[nH]c12 ZINC000587092273 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3ccnc(SCC(F)(F)F)c3)[nH]c2n1 ZINC000587092326 FG Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2c(C)ccnc2[nH]1)C(F)(F)F ZINC000587092395 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2c(C)ccnc2[nH]1)C(F)(F)F ZINC000587092396 FG Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2ccnc(OC)c2[nH]1)C(F)(F)F ZINC000587092448 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2ccnc(OC)c2[nH]1)C(F)(F)F ZINC000587092449 FG Annotated Anodyne O=C1COc2cc3[nH]c(-c4ncoc4CCC(F)(F)F)nc3cc2N1 ZINC000587092519 FG Annotated Anodyne FC(F)(F)CCc1ocnc1-c1nc2nc(Br)c[nH]c-2n1 ZINC000587092543 FG Annotated Anodyne FC(F)(F)CCc1ocnc1-c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000587092567 FG Annotated Anodyne CC(=O)c1ccc2nc(-c3cc([N+](=O)[O-])n(CC(F)(F)F)n3)[nH]c2c1 ZINC000587092604 FG Annotated Bother FC(F)(F)COc1nc(C(F)(F)F)ccc1-c1nc2cnncc2[nH]1 ZINC000587092721 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3ccnc(SCC(F)(F)F)c3)nc12 ZINC000587092747 FG Annotated Anodyne FC(F)(F)[C@H]1C[C@@H]1c1nc2cc(I)cnc2[nH]1 ZINC000587092828 FG Annotated Anodyne COc1cccc2nc(C[C@](O)(c3nc(C)cs3)C(F)(F)F)[nH]c12 ZINC000587092893 FG Annotated Anodyne COc1cccc2nc(C[C@@](O)(c3nc(C)cs3)C(F)(F)F)[nH]c12 ZINC000587092895 FG Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2cncc(OC)c2[nH]1)C(F)(F)F ZINC000587092909 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2cncc(OC)c2[nH]1)C(F)(F)F ZINC000587092910 FG Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2c(Cl)ncnc2[nH]1)C(F)(F)F ZINC000587092977 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2c(Cl)ncnc2[nH]1)C(F)(F)F ZINC000587092978 FG Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2cccc(O)c2[nH]1)C(F)(F)F ZINC000587093015 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2cccc(O)c2[nH]1)C(F)(F)F ZINC000587093017 FG Annotated Anodyne O=[N+]([O-])c1cc(-c2nc3ccc4ncccc4c3[nH]2)nn1CC(F)(F)F ZINC000587093054 FG Annotated Bother O=[N+]([O-])c1cc(-c2nc3cnc4ccccc4c3[nH]2)nn1CC(F)(F)F ZINC000587093107 FG Annotated Bother O=[N+]([O-])c1cc(-c2nc3c(F)cnc(Cl)c3[nH]2)nn1CC(F)(F)F ZINC000587093155 FG Annotated Bother CCOc1ccccc1[C@](N)(c1nc2cc(C)cnc2[nH]1)C(F)(F)F ZINC000587093325 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2cc(C)cnc2[nH]1)C(F)(F)F ZINC000587093326 FG Annotated Anodyne C[C@@H](NC(=O)CC(F)(F)F)c1nc2ccc(Br)c(O)c2[nH]1 ZINC000587093357 FG Annotated Anodyne C[C@H](NC(=O)CC(F)(F)F)c1nc2ccc(Br)c(O)c2[nH]1 ZINC000587093359 FG Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cccc([N+](=O)[O-])c3[nH]2)C(F)(F)F)n1 ZINC000587093417 FG Annotated Bother Cc1csc([C@@](O)(Cc2nc3cccc([N+](=O)[O-])c3[nH]2)C(F)(F)F)n1 ZINC000587093422 FG Annotated Bother CCOc1ccccc1[C@](N)(c1nc2cc(F)cnc2[nH]1)C(F)(F)F ZINC000587093453 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2cc(F)cnc2[nH]1)C(F)(F)F ZINC000587093455 FG Annotated Anodyne Cc1c(Br)cnc2[nH]c([C@H](C)NC(=O)CC(F)(F)F)nc12 ZINC000587093523 FG Annotated Anodyne Cc1c(Br)cnc2[nH]c([C@@H](C)NC(=O)CC(F)(F)F)nc12 ZINC000587093525 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc([C@H]3C[C@@H]3C(F)(F)F)[nH]c2c1 ZINC000587093562 FG Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3ccnc(SCC(F)(F)F)c3)nc12 ZINC000587093717 FG Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cc4cn[nH]c4cc3[nH]2)C(F)(F)F)n1 ZINC000587093801 FG Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cc4cn[nH]c4cc3[nH]2)C(F)(F)F)n1 ZINC000587093803 FG Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2cc(OC)ncc2[nH]1)C(F)(F)F ZINC000587093904 FG Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2cc(OC)ncc2[nH]1)C(F)(F)F ZINC000587093906 FG Annotated Anodyne C[C@@H](NC(=O)CC(F)(F)F)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000587093926 FG Annotated Bother C[C@H](NC(=O)CC(F)(F)F)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000587093927 FG Annotated Bother COC(=O)c1cc2nc(-c3ccnc(SCC(F)(F)F)c3)[nH]c2cn1 ZINC000587094023 FG Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cccc(C(=O)O)c3[nH]2)C(F)(F)F)n1 ZINC000587094064 FG Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cccc(C(=O)O)c3[nH]2)C(F)(F)F)n1 ZINC000587094065 FG Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3ccc(C(=O)O)cc3[nH]2)C(F)(F)F)n1 ZINC000587094130 FG Annotated Anodyne Cc1csc([C@](O)(Cc2nc3ccc(C(=O)O)cc3[nH]2)C(F)(F)F)n1 ZINC000587094131 FG Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3ccc(C#N)cc3[nH]2)C(F)(F)F)n1 ZINC000587094156 FG Annotated Mild Cc1csc([C@](O)(Cc2nc3ccc(C#N)cc3[nH]2)C(F)(F)F)n1 ZINC000587094157 FG Annotated Mild Cc1csc([C@](O)(Cc2nc3c(Cl)ccnc3[nH]2)C(F)(F)F)n1 ZINC000587094222 FG Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3c(Cl)ccnc3[nH]2)C(F)(F)F)n1 ZINC000587094223 FG Annotated Anodyne C[C@H](NC(=O)CC(F)(F)F)c1nc2ccc(Br)cc2[nH]1 ZINC000587094256 FG Annotated Anodyne C[C@@H](NC(=O)CC(F)(F)F)c1nc2ccc(Br)cc2[nH]1 ZINC000587094257 FG Annotated Anodyne Cc1csc([C@](O)(Cc2nc3ccnc(Cl)c3[nH]2)C(F)(F)F)n1 ZINC000587094334 FG Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3ccnc(Cl)c3[nH]2)C(F)(F)F)n1 ZINC000587094335 FG Annotated Anodyne Cc1csc([C@](O)(Cc2nc3ccc([N+](=O)[O-])cc3[nH]2)C(F)(F)F)n1 ZINC000587094356 FG Annotated Bother Cc1csc([C@@](O)(Cc2nc3ccc([N+](=O)[O-])cc3[nH]2)C(F)(F)F)n1 ZINC000587094357 FG Annotated Bother C[C@H](NC(=O)CC(F)(F)F)c1nc2cccc(Br)c2[nH]1 ZINC000587094358 FG Annotated Anodyne C[C@@H](NC(=O)CC(F)(F)F)c1nc2cccc(Br)c2[nH]1 ZINC000587094359 FG Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cncc(Cl)c3[nH]2)C(F)(F)F)n1 ZINC000587094364 FG Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cncc(Cl)c3[nH]2)C(F)(F)F)n1 ZINC000587094365 FG Annotated Anodyne Cc1nc2[nH]c([C@H](C)NC(=O)CC(F)(F)F)nc2cc1Br ZINC000587094392 FG Annotated Anodyne Cc1nc2[nH]c([C@@H](C)NC(=O)CC(F)(F)F)nc2cc1Br ZINC000587094393 FG Annotated Anodyne C[C@@H](NC(=O)CC(F)(F)F)c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587094404 FG Annotated Anodyne C[C@H](NC(=O)CC(F)(F)F)c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587094405 FG Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cc4c(cc3[nH]2)OCO4)C(F)(F)F)n1 ZINC000587094670 FG Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cc4c(cc3[nH]2)OCO4)C(F)(F)F)n1 ZINC000587094671 FG Annotated Anodyne Oc1nc(O)c2nc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)[nH]c2n1 ZINC000587094856 FG Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cc(Cl)cnc3[nH]2)C(F)(F)F)n1 ZINC000587094892 FG Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cc(Cl)cnc3[nH]2)C(F)(F)F)n1 ZINC000587094893 FG Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3c(C)nc(C)cc3[nH]2)C(F)(F)F)n1 ZINC000587094906 FG Annotated Anodyne Cc1csc([C@](O)(Cc2nc3c(C)nc(C)cc3[nH]2)C(F)(F)F)n1 ZINC000587094907 FG Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cc(Cl)ncc3[nH]2)C(F)(F)F)n1 ZINC000587094941 FG Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cc(Cl)ncc3[nH]2)C(F)(F)F)n1 ZINC000587094942 FG Annotated Anodyne Cc1csc([C@](O)(Cc2nc3ccc(Cl)nc3[nH]2)C(F)(F)F)n1 ZINC000587094955 FG Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3ccc(Cl)nc3[nH]2)C(F)(F)F)n1 ZINC000587094956 FG Annotated Anodyne N=c1nc(O)c2nc(-c3cc(C(F)(F)F)ccc3C(F)(F)F)[nH]c2[nH]1 ZINC000587094973 FG Annotated Anodyne N=c1nc(O)c2nc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)[nH]c2[nH]1 ZINC000587094990 FG Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cccc(C#N)c3[nH]2)C(F)(F)F)n1 ZINC000587095165 FG Annotated Mild Cc1csc([C@](O)(Cc2nc3cccc(C#N)c3[nH]2)C(F)(F)F)n1 ZINC000587095166 FG Annotated Mild COC(=O)c1cc(Cl)c2[nH]c([C@H](C)NC(=O)CC(F)(F)F)nc2c1 ZINC000587095286 FG Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c([C@@H](C)NC(=O)CC(F)(F)F)nc2c1 ZINC000587095292 FG Annotated Anodyne Oc1nc(O)c2nc(-c3cc(C(F)(F)F)ccc3C(F)(F)F)[nH]c2n1 ZINC000587095425 FG Annotated Anodyne Cc1ccc(Cc2nc3cccc(S(N)(=O)=O)c3[nH]2)cc1C(F)(F)F ZINC000587095615 FG Annotated Anodyne Cc1ccc2c3c(cc(-c4cnc(O)n(C)c4=O)nc13)-c1ccccc1C2=O ZINC000587095777 FG Annotated Anodyne Nc1ccc(-c2nc3nc(Br)c[nH]c-3n2)c(C(F)(F)F)c1 ZINC000587095862 FG Annotated Anodyne Cc1ccc(Cc2nc3ccc(S(N)(=O)=O)cc3[nH]2)cc1C(F)(F)F ZINC000587095883 FG Annotated Anodyne Cc1ccc(Cc2nc3ccc(-n4cnnn4)cc3[nH]2)cc1C(F)(F)F ZINC000587095893 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)[C@@H]1CN[C@@H](C(=O)O)[C@H]1C4)-c1ccccc1C2=O ZINC000587096070 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)[C@@H]1CN[C@@H](C(=O)O)[C@@H]1C4)-c1ccccc1C2=O ZINC000587096071 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)[C@@H]1CN[C@H](C(=O)O)[C@@H]1C4)-c1ccccc1C2=O ZINC000587096072 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)[C@@H]1CN[C@H](C(=O)O)[C@H]1C4)-c1ccccc1C2=O ZINC000587096073 FG Annotated Anodyne COCCOC(=O)Cc1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000587096383 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)C[C@@H]1[C@@H](C(=O)O)NC[C@H]41)-c1ccccc1C2=O ZINC000587096528 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)C[C@@H]1[C@H](C(=O)O)NC[C@@H]41)-c1ccccc1C2=O ZINC000587096533 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)C[C@H]1[C@@H]4CN[C@H]1C(=O)O)-c1ccccc1C2=O ZINC000587096536 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)C[C@@H]1[C@@H](C(=O)O)NC[C@@H]41)-c1ccccc1C2=O ZINC000587096540 FG Annotated Anodyne Cc1ccc2c3c(cc(CC(=O)N4CCOCC4)nc13)-c1ccccc1C2=O ZINC000587096687 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3ccc(OC)cc3C(F)(F)F)[nH]c2n1 ZINC000587096852 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)C[C@@H]1CN[C@@H](C(=O)O)[C@H]41)-c1ccccc1C2=O ZINC000587097005 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)C[C@@H]1CN[C@H](C(=O)O)[C@H]41)-c1ccccc1C2=O ZINC000587097006 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)C[C@@H]1CN[C@H](C(=O)O)[C@@H]41)-c1ccccc1C2=O ZINC000587097007 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)C[C@@H]1CN[C@@H](C(=O)O)[C@@H]41)-c1ccccc1C2=O ZINC000587097008 FG Annotated Anodyne C[C@@H](c1nc2cccc(S(N)(=O)=O)c2[nH]1)c1ccccc1C(F)(F)F ZINC000587097481 FG Annotated Anodyne C[C@H](c1nc2cccc(S(N)(=O)=O)c2[nH]1)c1ccccc1C(F)(F)F ZINC000587097482 FG Annotated Anodyne COC(=O)c1cc2nc(-c3ccc(OC)cc3C(F)(F)F)[nH]c2cn1 ZINC000587097657 FG Annotated Anodyne Cc1ccc2c3c(cc(Cn4cnc([N+](=O)[O-])n4)nc13)-c1ccccc1C2=O ZINC000587098086 FG Annotated Bother CCOC(=O)C(=O)Cc1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000587098171 FG Annotated Anodyne COc1ccc(-c2nc3ccc(-n4cnnn4)cc3[nH]2)c(C(F)(F)F)c1 ZINC000587098825 FG Annotated Anodyne NS(=O)(=O)c1cccc2nc(-c3cccc(F)c3C(F)(F)F)[nH]c12 ZINC000587098877 FG Annotated Anodyne Cc1ccc2c3c(cc(CN4C(=O)CCC4=O)nc13)-c1ccccc1C2=O ZINC000587098953 FG Annotated Anodyne C[C@@H](c1nc2ccc(S(N)(=O)=O)cc2[nH]1)c1ccccc1C(F)(F)F ZINC000587099085 FG Annotated Anodyne C[C@H](c1nc2ccc(S(N)(=O)=O)cc2[nH]1)c1ccccc1C(F)(F)F ZINC000587099087 FG Annotated Anodyne Cc1ccc2c3c(c(CCC(=O)O)c(C(=O)O)nc13)-c1ccccc1C2=O ZINC000587100658 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)C[C@@H](C(=O)O)[C@H]4C(=O)O)-c1ccccc1C2=O ZINC000587101710 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)C[C@@H](C(=O)O)[C@@H]4C(=O)O)-c1ccccc1C2=O ZINC000587101714 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)C[C@H](C(=O)O)[C@@H]4C(=O)O)-c1ccccc1C2=O ZINC000587101715 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)C[C@H](C(=O)O)[C@H]4C(=O)O)-c1ccccc1C2=O ZINC000587101716 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)CC(=O)C[C@@H]4C(=O)O)-c1ccccc1C2=O ZINC000587102171 FG Annotated Anodyne Cc1ccc2c3c(c4c(nc13)CC(=O)C[C@H]4C(=O)O)-c1ccccc1C2=O ZINC000587102175 FG Annotated Anodyne COC(=O)C(=O)[C@@H](Cl)c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587102526 FG Annotated Reactive COC(=O)C(=O)[C@H](Cl)c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587102527 FG Annotated Reactive Cc1cc(=NC(=O)Cc2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)[nH]o1 ZINC000587103713 FG Annotated Anodyne Cn1cc(-c2nc3cccc4c3c(c2CC(=O)O)-c2ccccc2C4=O)cn1 ZINC000587104689 FG Annotated Anodyne O=C(Cc1cc2c3c(cccc3n1)C(=O)c1ccccc1-2)Nc1ncccn1 ZINC000587104721 FG Annotated Anodyne O=C1c2ccccc2-c2cc(CCn3cnc([N+](=O)[O-])n3)nc3cccc1c23 ZINC000587104842 FG Annotated Bother CCOC(=O)[C@@H](NC(C)=O)c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587104929 FG Annotated Anodyne CCOC(=O)[C@H](NC(C)=O)c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587104930 FG Annotated Anodyne N=c1nc2c(c[nH]1)-c1nc3cccc4c3c(c1CC2)-c1ccccc1C4=O ZINC000587105246 FG Annotated Anodyne C=C1NC(=O)C(c2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)=C(C)N1 ZINC000587105614 FG Annotated Anodyne O=C1C[C@]2(CCc3nc4cccc5c4c(c3C2)-c2ccccc2C5=O)CN1 ZINC000587105660 FG Annotated Anodyne O=C1C[C@@]2(CCc3nc4cccc5c4c(c3C2)-c2ccccc2C5=O)CN1 ZINC000587105661 FG Annotated Anodyne CN1CCN(CCc2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)CC1 ZINC000587105781 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)CC[C@H]1[C@@H]3CN[C@H]1C(=O)O ZINC000587105957 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)CC[C@@H]1[C@@H](C(=O)O)NC[C@@H]31 ZINC000587105961 FG Annotated Anodyne CC1=C(c2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)CN2NC=NC2=N1 ZINC000587106008 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)CC[C@@H]1[C@@H](C(=O)O)NC[C@H]31 ZINC000587106054 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)CC[C@@H]1[C@H](C(=O)O)NC[C@@H]31 ZINC000587106056 FG Annotated Anodyne COC(=O)[C@H]1C(=O)Cc2nc3cccc4c3c(c2[C@@H]1C)-c1ccccc1C4=O ZINC000587106193 FG Annotated Anodyne COC(=O)[C@H]1C(=O)Cc2nc3cccc4c3c(c2[C@H]1C)-c1ccccc1C4=O ZINC000587106196 FG Annotated Anodyne COC(=O)[C@@H]1C(=O)Cc2nc3cccc4c3c(c2[C@@H]1C)-c1ccccc1C4=O ZINC000587106198 FG Annotated Anodyne COC(=O)[C@@H]1C(=O)Cc2nc3cccc4c3c(c2[C@H]1C)-c1ccccc1C4=O ZINC000587106200 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)[C@@H]1CN[C@@H](C(=O)O)[C@H]1CC3 ZINC000587106632 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)[C@@H]1CN[C@H](C(=O)O)[C@@H]1CC3 ZINC000587106634 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)[C@@H]1CN[C@H](C(=O)O)[C@H]1CC3 ZINC000587106637 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)[C@@H]1CN[C@@H](C(=O)O)[C@@H]1CC3 ZINC000587106639 FG Annotated Anodyne CC(=O)[C@@H](c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2)[C@@H]1CCC(=O)N1 ZINC000587106739 FG Annotated Anodyne CC(=O)[C@H](c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2)[C@H]1CCC(=O)N1 ZINC000587106744 FG Annotated Anodyne CC(=O)[C@H](c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2)[C@@H]1CCC(=O)N1 ZINC000587106750 FG Annotated Anodyne CC(=O)[C@@H](c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2)[C@H]1CCC(=O)N1 ZINC000587106751 FG Annotated Anodyne O=S(=O)(O)c1ccc2nc(Cc3ccccc3C(F)(F)F)[nH]c2c1 ZINC000587107014 FG Annotated Anodyne FC(F)(F)c1cccnc1-c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587107422 FG Annotated Anodyne COC(=O)[C@H]1CC(=O)Cc2nc3cccc4c3c(c21)-c1ccccc1C4=O ZINC000587107524 FG Annotated Anodyne COC(=O)[C@@H]1CC(=O)Cc2nc3cccc4c3c(c21)-c1ccccc1C4=O ZINC000587107533 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)[C@@H]1[C@@H](CC3)CN[C@H]1C(=O)O ZINC000587107729 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)[C@@H]1[C@H](CC3)CN[C@H]1C(=O)O ZINC000587107730 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)[C@@H]1[C@H](CC3)CN[C@@H]1C(=O)O ZINC000587107731 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)[C@H]1[C@@H](C(=O)O)NC[C@@H]1CC3 ZINC000587107732 FG Annotated Anodyne CCOC(=O)C(=O)Cc1nc2cccc3c2c(c1C)-c1ccccc1C3=O ZINC000587108176 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)CC[C@@H]1CN[C@@H](C(=O)O)[C@H]31 ZINC000587108254 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)CC[C@@H]1CN[C@H](C(=O)O)[C@H]31 ZINC000587108255 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)CC[C@@H]1CN[C@H](C(=O)O)[C@@H]31 ZINC000587108256 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)CC[C@@H]1CN[C@@H](C(=O)O)[C@@H]31 ZINC000587108257 FG Annotated Anodyne COC(=O)C(=O)[C@H]1CCc2c1nc1cccc3c1c2-c1ccccc1C3=O ZINC000587108314 FG Annotated Anodyne COC(=O)C(=O)[C@@H]1CCc2c1nc1cccc3c1c2-c1ccccc1C3=O ZINC000587108315 FG Annotated Anodyne O=C(O)c1cc(C(F)(F)F)ccc1-c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000587108579 FG Annotated Bother O=C(O)c1cc(C(F)(F)F)ccc1-c1nc2c(S)nc(S)nc2[nH]1 ZINC000587108608 FG Annotated Anodyne O=[N+]([O-])c1cc(C(F)(F)F)ccc1Cc1nc2cnc(Cl)[nH]c-2n1 ZINC000587108854 FG Annotated Bother NC(=O)c1ccc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c2c1 ZINC000587108876 FG Annotated Bother COc1ccc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c2n1 ZINC000587108930 FG Annotated Bother O=[N+]([O-])c1cc(C(F)(F)F)ccc1Cc1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000587108964 FG Annotated Bother N=c1[nH]cc2nc(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)nc-2[nH]1 ZINC000587109216 FG Annotated Anodyne O=C(O)c1cc(C(F)(F)F)ccc1-c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000587109341 FG Annotated Bother COc1cncc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c12 ZINC000587109387 FG Annotated Bother O=C(O)c1ccc(C(F)(F)F)cc1-c1nc2ccc(CCO)cc2[nH]1 ZINC000587109390 FG Annotated Anodyne O=[N+]([O-])c1cc(C(F)(F)F)ccc1Cc1nc2nc(Cl)c[nH]c-2n1 ZINC000587109433 FG Annotated Bother COc1nccc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c12 ZINC000587109446 FG Annotated Bother O=[N+]([O-])c1cnc2[nH]c(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])nc2c1 ZINC000587109757 FG Annotated Bother O=C(O)c1ccc(C(F)(F)F)cc1-c1nc2c(S)nc(S)nc2[nH]1 ZINC000587109771 FG Annotated Anodyne O=C(O)c1ccc(C(F)(F)F)cc1-c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000587109789 FG Annotated Bother Nc1cc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c2cc1N ZINC000587109837 FG Annotated Bother O=C(O)c1ccc(C(F)(F)F)cc1-c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000587109990 FG Annotated Bother COC(=O)c1ccnc2[nH]c(-c3cc(C(F)(F)F)ccc3C(=O)O)nc12 ZINC000587110028 FG Annotated Anodyne NS(=O)(=O)c1cccc2nc(-c3ccc(C(F)(F)F)cc3F)[nH]c12 ZINC000587110092 FG Annotated Anodyne NC(=O)c1cccc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c12 ZINC000587110136 FG Annotated Bother N=C(N)c1ccc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c2c1 ZINC000587110150 FG Annotated Bother COc1cc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c2cn1 ZINC000587110217 FG Annotated Bother Cc1cc2[nH]c(Cn3nnc(-c4ccc(C(F)(F)F)cc4)n3)nc2c(C)n1 ZINC000587111058 FG Annotated Anodyne COC(=O)c1cc2[nH]c(-c3cn(C)cc3C(F)(F)F)nc2cc1OC ZINC000587111180 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(-c3cccc(C(F)(F)F)c3)[nH]c12 ZINC000587111379 FG Annotated Anodyne N[C@@H](Cc1cccc(C(F)(F)F)c1)c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000587111794 FG Annotated Anodyne N[C@@H](Cc1cccc(C(F)(F)F)c1)c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000587112081 FG Annotated Bother COC(=O)c1ccc2nc(-c3cn(C)cc3C(F)(F)F)[nH]c2c1OC ZINC000587112104 FG Annotated Anodyne Fc1cccc2nc(Cn3nnc(-c4ccc(C(F)(F)F)cc4)n3)[nH]c12 ZINC000587112128 FG Annotated Anodyne Fc1ccc2nc(Cn3nnc(-c4ccc(C(F)(F)F)cc4)n3)[nH]c2c1 ZINC000587112153 FG Annotated Anodyne N[C@@H](Cc1cccc(C(F)(F)F)c1)c1nc2c(S)nc(S)nc2[nH]1 ZINC000587112746 FG Annotated Anodyne COC(=O)c1cc2nc([C@@H](N)Cc3cccc(C(F)(F)F)c3)[nH]c2cn1 ZINC000587113119 FG Annotated Anodyne O=C(CSCc1nc2ncc[nH]c-2n1)Nc1ccc(C(F)(F)F)cc1 ZINC000587113293 FG Annotated Anodyne N#Cc1cccc2nc(Cn3nnc(-c4ccc(C(F)(F)F)cc4)n3)[nH]c12 ZINC000587113311 FG Annotated Mild N#Cc1ccc2nc(Cn3nnc(-c4ccc(C(F)(F)F)cc4)n3)[nH]c2c1 ZINC000587113429 FG Annotated Mild N[C@@H](Cc1cccc(C(F)(F)F)c1)c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000587113476 FG Annotated Bother N#Cc1nc2nc(-c3cnc4ccc(C(F)(F)F)cc4c3)[nH]c2nc1C#N ZINC000587113626 FG Annotated Mild COc1ccc2nc(Cn3nnc(-c4ccc(C(F)(F)F)cc4)n3)[nH]c2c1 ZINC000587113900 FG Annotated Anodyne CC(=O)N[C@@](C)(c1cccc(C(F)(F)F)c1)c1nc2ccnc(O)c2[nH]1 ZINC000587114219 FG Annotated Anodyne CC(=O)N[C@](C)(c1cccc(C(F)(F)F)c1)c1nc2ccnc(O)c2[nH]1 ZINC000587114221 FG Annotated Anodyne C[C@H](Cc1cccc(C(F)(F)F)c1)c1nc2nc(C#N)c(C#N)nc2[nH]1 ZINC000587114251 FG Annotated Mild C[C@@H](Cc1cccc(C(F)(F)F)c1)c1nc2nc(C#N)c(C#N)nc2[nH]1 ZINC000587114264 FG Annotated Mild O=C(CSCc1nc2cnncc2[nH]1)Nc1ccc(C(F)(F)F)cc1 ZINC000587114449 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@H](N)Cc3cccc(C(F)(F)F)c3)[nH]c2n1 ZINC000587114862 FG Annotated Anodyne Cn1cc(-c2nc3ccc(CN4CCOCC4)cc3[nH]2)c(C(F)(F)F)c1 ZINC000587114949 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3cncc(C(F)(F)F)c3)[nH]c2c1OC ZINC000587114983 FG Annotated Anodyne Cn1cc(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)c(C(F)(F)F)c1 ZINC000587115015 FG Annotated Bother CC1=C(c2ccc3nc(-c4cncc(C(F)(F)F)c4)[nH]c3c2)NNC(=O)C1 ZINC000587115172 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3cncc(C(F)(F)F)c3)[nH]c2cc1[N+](=O)[O-] ZINC000587115197 FG Annotated Bother COC(=O)c1cc2[nH]c(-c3cncc(C(F)(F)F)c3)nc2cc1OC ZINC000587115210 FG Annotated Anodyne FC(F)(F)c1cncc(-c2nc3ccc(CN4CCOCC4)cc3[nH]2)c1 ZINC000587115733 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3cc4cnccc4nc3C(F)(F)F)nc12 ZINC000587115805 FG Annotated Anodyne O=[N+]([O-])c1cncc2nc(-c3cc4cnccc4nc3C(F)(F)F)[nH]c12 ZINC000587115810 FG Annotated Bother Nc1ccnc2[nH]c(-c3cc(C(F)(F)F)ncc3Br)nc12 ZINC000587115913 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3cc4cnccc4nc3C(F)(F)F)[nH]c2n1 ZINC000587115972 FG Annotated Anodyne N=c1[nH]ccc2nc(-c3cc(C(F)(F)F)ncc3Br)[nH]c12 ZINC000587115975 FG Annotated Anodyne COC(=O)c1cc2nc(-c3cc4cnccc4nc3C(F)(F)F)[nH]c2cn1 ZINC000587115987 FG Annotated Anodyne O=[N+]([O-])c1cnc2[nH]c(-c3cc4cnccc4nc3C(F)(F)F)nc2c1 ZINC000587116008 FG Annotated Bother N=c1cc2nc(-c3cc(C(F)(F)F)ncc3Br)[nH]c2c[nH]1 ZINC000587116094 FG Annotated Anodyne Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2c(Cl)ccnc2[nH]1 ZINC000587116293 FG Annotated Bother CN(C)C(=O)c1ccc2nc(-c3c(Cl)c(C(F)(F)F)nn3C)[nH]c2c1 ZINC000587116331 FG Annotated Anodyne Oc1ncnc2[nH]c(CCn3nc(C(F)(F)F)c(Cl)c3C3CC3)nc12 ZINC000587116348 FG Annotated Anodyne Cn1nc(C(F)(F)F)c(Cl)c1-c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000587116528 FG Annotated Anodyne FC(F)(F)c1nn(CCc2nc3ncc[nH]c-3n2)c(C2CC2)c1Cl ZINC000587116530 FG Annotated Anodyne N=c1[nH]ccc2nc(CCn3nc(C(F)(F)F)c(Cl)c3C3CC3)[nH]c12 ZINC000587116635 FG Annotated Anodyne Cc1c(Br)cnc2[nH]c(-c3cc(C(F)(F)F)nn3C)nc12 ZINC000587116683 FG Annotated Anodyne Cn1nc(C(F)(F)F)cc1-c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587116721 FG Annotated Anodyne N[C@@H](N=O)c1ccc2nc(Cn3nc(C(F)(F)F)cc3C3CC3)[nH]c2c1 ZINC000587116733 FG Annotated Anodyne N[C@H](N=O)c1ccc2nc(Cn3nc(C(F)(F)F)cc3C3CC3)[nH]c2c1 ZINC000587116735 FG Annotated Anodyne Cn1nc(C(F)(F)F)cc1-c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587116797 FG Annotated Anodyne Oc1nncc2nc(CCn3nc(C(F)(F)F)c(Cl)c3C3CC3)[nH]c12 ZINC000587116836 FG Annotated Anodyne COc1cc2nc(Cn3nc(C(F)(F)F)c([N+](=O)[O-])c3C)[nH]c2cc1C ZINC000587116865 FG Annotated Bother O=C(O)c1cccc2nc(Cn3nc(C(F)(F)F)cc3C3CC3)[nH]c12 ZINC000587116878 FG Annotated Anodyne Cc1cnc(Cl)c2[nH]c(Cn3nc(C(F)(F)F)c([N+](=O)[O-])c3C)nc12 ZINC000587116902 FG Annotated Bother Cn1nc(C(F)(F)F)c(Cl)c1-c1nc2cc(C(=O)O)c(F)cc2[nH]1 ZINC000587116947 FG Annotated Anodyne FC(F)(F)c1nn(CCc2nc3cncnc3[nH]2)c(C2CC2)c1Cl ZINC000587116973 FG Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(-c3cc(C(F)(F)F)nn3C)nc2c1 ZINC000587117071 FG Annotated Anodyne Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cc(F)cc(F)c2[nH]1 ZINC000587117106 FG Annotated Bother Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2ccc(F)c(F)c2[nH]1 ZINC000587117159 FG Annotated Bother Cc1cncc2nc(CCn3cc(Br)c(C(F)(F)F)n3)[nH]c12 ZINC000587117184 FG Annotated Anodyne Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cc(Cl)cnc2[nH]1 ZINC000587117195 FG Annotated Bother Cc1cc2[nH]c(Cn3nc(C(F)(F)F)c([N+](=O)[O-])c3C)nc2c(C)n1 ZINC000587117239 FG Annotated Bother Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cc(F)c(F)cc2[nH]1 ZINC000587117294 FG Annotated Bother Cn1nc(C(F)(F)F)c(Cl)c1-c1nc2cc(C#N)c(C#N)cc2[nH]1 ZINC000587117308 FG Annotated Mild Cc1nc2[nH]c(CCn3ccc(C(F)(F)F)n3)nc2cc1Br ZINC000587117339 FG Annotated Anodyne O=[N+]([O-])c1cnc2[nH]c(Cn3nc(C(F)(F)F)cc3C3CC3)nc2c1 ZINC000587117381 FG Annotated Bother OCCc1ccc2nc(Cn3nc(C(F)(F)F)cc3C3CC3)[nH]c2c1 ZINC000587117392 FG Annotated Anodyne CC(=O)c1ccc2nc(Cn3nc(C(F)(F)F)c([N+](=O)[O-])c3C)[nH]c2c1 ZINC000587117395 FG Annotated Bother FC(F)(F)c1cc(C2CC2)n(Cc2nc3cc4c(cc3[nH]2)OCCO4)n1 ZINC000587117422 FG Annotated Anodyne Cn1nc(C(F)(F)F)c(Cl)c1-c1nc2c(S)nc(S)nc2[nH]1 ZINC000587117428 FG Annotated Anodyne Cn1nc(C(F)(F)F)c(Cl)c1-c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000587117454 FG Annotated Anodyne CCOC(=O)c1ccc2nc(CCn3ccc(C(F)(F)F)n3)[nH]c2c1 ZINC000587117462 FG Annotated Anodyne FC(F)(F)c1nn(CCc2nc3cnncc3[nH]2)c(C2CC2)c1Cl ZINC000587117477 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3c(Cl)c(C(F)(F)F)nn3C)[nH]c2c1 ZINC000587117482 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(CCn3ccc(C(F)(F)F)n3)[nH]c2c1 ZINC000587117546 FG Annotated Anodyne Cn1nc(C(F)(F)F)cc1-c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587117550 FG Annotated Anodyne COC(=O)c1cccc2nc(-c3c(Cl)c(C(F)(F)F)nn3C)[nH]c12 ZINC000587117554 FG Annotated Anodyne FC(F)(F)c1ccn(CCc2nc3cc4c(cc3[nH]2)OCCCO4)n1 ZINC000587117582 FG Annotated Anodyne Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2ccnc(Cl)c2[nH]1 ZINC000587117590 FG Annotated Bother COC(=O)c1ccc2nc(Cn3nc(C(F)(F)F)cc3C3CC3)[nH]c2c1 ZINC000587117635 FG Annotated Anodyne N=c1cc2nc(CCn3nc(C(F)(F)F)c(Cl)c3C3CC3)[nH]c2c[nH]1 ZINC000587117707 FG Annotated Anodyne Cc1cc(F)c2[nH]c(Cn3nc(C(F)(F)F)c([N+](=O)[O-])c3C)nc2c1 ZINC000587117738 FG Annotated Bother Cn1nc(C(F)(F)F)c(Cl)c1-c1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000587117784 FG Annotated Anodyne Cn1nc(C(F)(F)F)c(Cl)c1-c1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000587117787 FG Annotated Anodyne N#Cc1ccc2[nH]c(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)nc2c1 ZINC000587117875 FG Annotated Mild Cc1cc2nc(Cn3nc(C(F)(F)F)c([N+](=O)[O-])c3C)[nH]c2cc1F ZINC000587117893 FG Annotated Bother Cn1nc(C(F)(F)F)c(Cl)c1-c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000587117914 FG Annotated Anodyne COc1ccc2[nH]c(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)nc2c1 ZINC000587117918 FG Annotated Anodyne Cn1nc(C(F)(F)F)c(Cl)c1-c1nc2cc(F)cc(C(=O)O)c2[nH]1 ZINC000587117963 FG Annotated Anodyne Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cc(Cl)ncc2[nH]1 ZINC000587117995 FG Annotated Bother COc1cc2nc(Cn3nc(C(F)(F)F)c([N+](=O)[O-])c3C)[nH]c2cc1F ZINC000587118001 FG Annotated Bother COc1cccc2[nH]c(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)nc12 ZINC000587118042 FG Annotated Anodyne Cc1ccnc2[nH]c(CCn3cc(Br)c(C(F)(F)F)n3)nc12 ZINC000587118054 FG Annotated Anodyne COc1ccc2nc(Cn3nc(C(F)(F)F)c([N+](=O)[O-])c3C)[nH]c2c1 ZINC000587118196 FG Annotated Bother O=[N+]([O-])c1cncc2nc(Cn3nc(C(F)(F)F)cc3C3CC3)[nH]c12 ZINC000587118289 FG Annotated Bother Fc1cc2[nH]c(CCn3ccc(C(F)(F)F)n3)nc2cc1-n1cccn1 ZINC000587118355 FG Annotated Anodyne Cc1c(F)ccc2nc(Cn3nc(C(F)(F)F)c([N+](=O)[O-])c3C)[nH]c12 ZINC000587118429 FG Annotated Bother Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cncc(Cl)c2[nH]1 ZINC000587118487 FG Annotated Bother FC(F)(F)c1ccn(CCc2nc3cc(Br)cnc3[nH]2)n1 ZINC000587118542 FG Annotated Anodyne Fc1cnc2nc(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)[nH]c2c1 ZINC000587118543 FG Annotated Anodyne Cn1nc(C(F)(F)F)cc1-c1nc2ccc(Br)c(O)c2[nH]1 ZINC000587118591 FG Annotated Anodyne FC(F)(F)c1nn(CCc2nc3cnccc3[nH]2)cc1Br ZINC000587118618 FG Annotated Anodyne FC(F)(F)c1cc(C2CC2)n(Cc2nc3cc4c(cc3[nH]2)OCO4)n1 ZINC000587118723 FG Annotated Anodyne COC(=O)c1cccc2nc(Cn3nc(C(F)(F)F)cc3C3CC3)[nH]c12 ZINC000587118755 FG Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(CCn3ccc(C(F)(F)F)n3)nc2c1 ZINC000587118765 FG Annotated Anodyne N#Cc1cccc2[nH]c(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)nc12 ZINC000587118823 FG Annotated Mild FC1(F)Oc2cc3nc(CCn4ccc(C(F)(F)F)n4)[nH]c3cc2O1 ZINC000587118871 FG Annotated Anodyne COc1cccc2nc(Cn3nc(C(F)(F)F)c([N+](=O)[O-])c3C)[nH]c12 ZINC000587118956 FG Annotated Bother Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2ccc(Cl)nc2[nH]1 ZINC000587118958 FG Annotated Bother FC(F)(F)c1nn(CCc2nc3cccnc3[nH]2)cc1Br ZINC000587118981 FG Annotated Anodyne FC(F)(F)c1ccn(CCc2nc3c(Br)ccnc3[nH]2)n1 ZINC000587119011 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3cc(C(F)(F)F)nn3C)[nH]c2c1 ZINC000587119149 FG Annotated Anodyne FC(F)(F)c1ccn(Cc2cc(-c3nc4cc5[nH]ncc5cc4[nH]3)no2)n1 ZINC000587119219 FG Annotated Anodyne OCc1ccc2nc(Cn3nc(C(F)(F)F)c4c3CCCC4)[nH]c2c1 ZINC000587119260 FG Annotated Anodyne Cc1cc2nc(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)[nH]c2c(C)n1 ZINC000587119293 FG Annotated Anodyne Cc1c(Br)cnc2[nH]c(CCn3ccc(C(F)(F)F)n3)nc12 ZINC000587119320 FG Annotated Anodyne Oc1nc2cc3nc(Cn4nc(C(F)(F)F)cc4C4CC4)[nH]c3cc2[nH]1 ZINC000587119334 FG Annotated Anodyne FC(F)(F)c1nn(Cc2nc3cnc(Cl)[nH]c-3n2)c2c1CCCC2 ZINC000587119338 FG Annotated Anodyne N#Cc1cc2nc(Cn3nc(C(F)(F)F)c4c3CCCC4)[nH]c2cc1C#N ZINC000587119351 FG Annotated Mild COc1nccc2nc(Cn3nc(C(F)(F)F)c4c3CCCC4)[nH]c12 ZINC000587119368 FG Annotated Anodyne FC(F)(F)c1ccn(CCc2nc3cncc(Br)c3[nH]2)n1 ZINC000587119447 FG Annotated Anodyne Cc1cnc2[nH]c(CCn3cc(Br)c(C(F)(F)F)n3)nc2c1 ZINC000587119496 FG Annotated Anodyne FC(F)(F)c1ccn(CCc2nc3ccnc(Br)c3[nH]2)n1 ZINC000587119512 FG Annotated Anodyne Cc1nccc2[nH]c(CCn3cc(Br)c(C(F)(F)F)n3)nc12 ZINC000587119529 FG Annotated Anodyne Cc1ccc2nc(CCn3cc(Br)c(C(F)(F)F)n3)[nH]c2n1 ZINC000587119543 FG Annotated Anodyne FC(F)(F)c1ccn(CCc2nc3ccc(Br)nc3[nH]2)n1 ZINC000587119574 FG Annotated Anodyne FC(F)(F)c1ccn(CCc2nc3cc(Br)ncc3[nH]2)n1 ZINC000587119578 FG Annotated Anodyne N#Cc1cc2nc(Cn3nc(C(F)(F)F)cc3C3CC3)[nH]c2cc1C#N ZINC000587119714 FG Annotated Mild FC(F)(F)c1cc(C2CC2)n(Cc2nc3c(S)nc(S)nc3[nH]2)n1 ZINC000587119765 FG Annotated Anodyne O=C(O)c1ccc2nc(Cn3nc(C(F)(F)F)cc3C3CC3)[nH]c2c1 ZINC000587119954 FG Annotated Anodyne COc1cncc2nc(Cn3nc(C(F)(F)F)c4c3CCCC4)[nH]c12 ZINC000587119977 FG Annotated Anodyne OCCc1ccc2nc(Cn3nc(C(F)(F)F)c4c3CCCC4)[nH]c2c1 ZINC000587120058 FG Annotated Anodyne FC(F)(F)c1nn(Cc2nc3cc4c(cc3[nH]2)OCO4)c2c1CCCC2 ZINC000587120094 FG Annotated Anodyne FC(F)(F)c1nn(Cc2nc3c(Cl)ncnc3[nH]2)c2c1CCCC2 ZINC000587120098 FG Annotated Anodyne FC(F)(F)c1nn(Cc2nc3nc(Cl)c[nH]c-3n2)c2c1CCCC2 ZINC000587120110 FG Annotated Anodyne COc1ccc2nc(Cn3nc(C(F)(F)F)c4c3CCCC4)[nH]c2n1 ZINC000587120117 FG Annotated Anodyne COc1cc2nc(Cn3nc(C(F)(F)F)c4c3CCCC4)[nH]c2cn1 ZINC000587120265 FG Annotated Anodyne O=[N+]([O-])c1cncc2nc(Cn3nc(C(F)(F)F)c4c3CCCC4)[nH]c12 ZINC000587120287 FG Annotated Bother O=[N+]([O-])c1cnc2[nH]c(Cn3nc(C(F)(F)F)c4c3CCCC4)nc2c1 ZINC000587120294 FG Annotated Bother FC(F)(F)c1n[nH]c(C(F)(F)F)c1-c1nc2cnc(Cl)[nH]c-2n1 ZINC000587120362 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3ccc4nc(C(F)(F)F)[nH]c4c3)nc12 ZINC000587120417 FG Annotated Anodyne FC(F)(F)c1nc2ccc(-c3nc4c(S)nc(S)nc4[nH]3)cc2[nH]1 ZINC000587120437 FG Annotated Anodyne Nc1cc2nc(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)[nH]c2cc1N ZINC000587120474 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3ccc4nc(C(F)(F)F)[nH]c4c3)[nH]c2n1 ZINC000587120505 FG Annotated Anodyne OCc1ccc2nc(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)[nH]c2c1 ZINC000587120586 FG Annotated Anodyne FC(F)(F)c1nc2ccc(-c3nc4ccc(-n5cnnn5)cc4[nH]3)cc2[nH]1 ZINC000587120700 FG Annotated Anodyne O=[N+]([O-])c1cncc2nc(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)[nH]c12 ZINC000587120736 FG Annotated Bother FC(F)(F)c1n[nH]c(C(F)(F)F)c1-c1nc2c(Cl)ncnc2[nH]1 ZINC000587120762 FG Annotated Anodyne FC(F)(F)c1n[nH]c(C(F)(F)F)c1-c1nc2nc(Cl)c[nH]c-2n1 ZINC000587120772 FG Annotated Anodyne O=[N+]([O-])c1cnc2[nH]c(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)nc2c1 ZINC000587121115 FG Annotated Bother COc1cc2nc(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)[nH]c2cn1 ZINC000587121150 FG Annotated Anodyne COc1nccc2nc(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)[nH]c12 ZINC000587121175 FG Annotated Anodyne COc1ccc2nc(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)[nH]c2n1 ZINC000587121203 FG Annotated Anodyne COc1cncc2nc(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)[nH]c12 ZINC000587121251 FG Annotated Anodyne Oc1nncc2nc(CSCc3cccc(OC(F)(F)F)c3)[nH]c12 ZINC000587121574 FG Annotated Anodyne Oc1nc(O)c2nc(CSCc3cccc(OC(F)(F)F)c3)[nH]c2n1 ZINC000587121672 FG Annotated Anodyne Cc1nc2ccc(OC(F)(F)F)cc2cc1-c1nc2c(N)ncnc2[nH]1 ZINC000587122002 FG Annotated Anodyne Nc1ncnc2[nH]c(CSCc3cccc(OC(F)(F)F)c3)nc12 ZINC000587122087 FG Annotated Anodyne Cc1nc2ccc(OC(F)(F)F)cc2cc1-c1nc2c[nH]c(=N)[nH]c-2n1 ZINC000587122128 FG Annotated Anodyne Oc1ncnc2[nH]c(CSCc3cccc(OC(F)(F)F)c3)nc12 ZINC000587122406 FG Annotated Anodyne CN(C)CCOc1ccc2[nH]c(-c3cccc(OCC(F)F)n3)nc2c1 ZINC000587122663 FG Annotated Anodyne Cc1nc2ccc(OC(F)(F)F)cc2cc1-c1nc2cnnc(O)c2[nH]1 ZINC000587122776 FG Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cncc([N+](=O)[O-])c4[nH]3)cc2N1 ZINC000587122780 FG Annotated Bother C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cncc([N+](=O)[O-])c4[nH]3)cc2N1 ZINC000587122783 FG Annotated Bother C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cncc([N+](=O)[O-])c4[nH]3)cc2N1 ZINC000587122785 FG Annotated Bother C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cncc([N+](=O)[O-])c4[nH]3)cc2N1 ZINC000587122787 FG Annotated Bother Cc1nc2ccc(OC(F)(F)F)cc2cc1-c1nc2c(O)ncnc2[nH]1 ZINC000587122849 FG Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc(C#N)c(C#N)cc4[nH]3)cc2N1 ZINC000587122936 FG Annotated Mild C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc(C#N)c(C#N)cc4[nH]3)cc2N1 ZINC000587122984 FG Annotated Mild C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc(C#N)c(C#N)cc4[nH]3)cc2N1 ZINC000587122985 FG Annotated Mild C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc(C#N)c(C#N)cc4[nH]3)cc2N1 ZINC000587122986 FG Annotated Mild COC(=O)c1cc(Br)c2[nH]c(COC(F)(F)F)nc2c1 ZINC000587123077 FG Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc([N+](=O)[O-])cnc4[nH]3)cc2N1 ZINC000587123232 FG Annotated Bother C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc([N+](=O)[O-])cnc4[nH]3)cc2N1 ZINC000587123235 FG Annotated Bother C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc([N+](=O)[O-])cnc4[nH]3)cc2N1 ZINC000587123236 FG Annotated Bother C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc([N+](=O)[O-])cnc4[nH]3)cc2N1 ZINC000587123238 FG Annotated Bother C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4ccc(CO)cc4[nH]3)cc2N1 ZINC000587123269 FG Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4ccc(CO)cc4[nH]3)cc2N1 ZINC000587123277 FG Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4ccc(CO)cc4[nH]3)cc2N1 ZINC000587123279 FG Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4ccc(CO)cc4[nH]3)cc2N1 ZINC000587123281 FG Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4ccc(CCO)cc4[nH]3)cc2N1 ZINC000587123294 FG Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4ccc(CCO)cc4[nH]3)cc2N1 ZINC000587123304 FG Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4ccc(CCO)cc4[nH]3)cc2N1 ZINC000587123307 FG Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4ccc(CCO)cc4[nH]3)cc2N1 ZINC000587123312 FG Annotated Anodyne Cc1cc(-c2nc3ncc(F)cc3[nH]2)ccc1NS(=O)(=O)C(F)(F)F ZINC000587123356 FG Annotated Anodyne FC(F)COc1cccc(-c2nc3ncc(Br)cc3[nH]2)n1 ZINC000587123485 FG Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc5c(cc4[nH]3)OCO5)cc2N1 ZINC000587124028 FG Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc5c(cc4[nH]3)OCO5)cc2N1 ZINC000587124029 FG Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc5c(cc4[nH]3)OCO5)cc2N1 ZINC000587124030 FG Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc5c(cc4[nH]3)OCO5)cc2N1 ZINC000587124031 FG Annotated Anodyne COc1ccc2nc(-c3cc4n(n3)[C@@H](C(F)(F)F)C[C@@H](C)N4)[nH]c2n1 ZINC000587124104 FG Annotated Anodyne COc1ccc2nc(-c3cc4n(n3)[C@@H](C(F)(F)F)C[C@H](C)N4)[nH]c2n1 ZINC000587124105 FG Annotated Anodyne COc1ccc2nc(-c3cc4n(n3)[C@H](C(F)(F)F)C[C@@H](C)N4)[nH]c2n1 ZINC000587124107 FG Annotated Anodyne COc1ccc2nc(-c3cc4n(n3)[C@H](C(F)(F)F)C[C@H](C)N4)[nH]c2n1 ZINC000587124108 FG Annotated Anodyne N=c1[nH]cc2nc(CSCc3cccc(OC(F)(F)F)c3)nc-2[nH]1 ZINC000587124334 FG Annotated Anodyne COC(=O)c1cc2nc(-c3cccc(OCC(F)F)n3)[nH]c2cc1OC ZINC000587124384 FG Annotated Anodyne COc1cc2nc(-c3cc4n(n3)[C@H](C(F)(F)F)C[C@H](C)N4)[nH]c2cn1 ZINC000587124654 FG Annotated Anodyne COc1cc2nc(-c3cc4n(n3)[C@H](C(F)(F)F)C[C@@H](C)N4)[nH]c2cn1 ZINC000587124656 FG Annotated Anodyne COc1cc2nc(-c3cc4n(n3)[C@@H](C(F)(F)F)C[C@@H](C)N4)[nH]c2cn1 ZINC000587124657 FG Annotated Anodyne COc1cc2nc(-c3cc4n(n3)[C@@H](C(F)(F)F)C[C@H](C)N4)[nH]c2cn1 ZINC000587124658 FG Annotated Anodyne C[C@@H](F)[C@@H](N)c1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587124796 FG Annotated Anodyne C[C@@H](F)[C@H](N)c1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587124798 FG Annotated Anodyne C[C@H](F)[C@H](N)c1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587124800 FG Annotated Anodyne C[C@H](F)[C@@H](N)c1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587124802 FG Annotated Anodyne C[C@H](F)[C@@H](N)c1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587124953 FG Annotated Anodyne C[C@@H](F)[C@@H](N)c1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587124954 FG Annotated Anodyne C[C@H](F)[C@H](N)c1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587124955 FG Annotated Anodyne C[C@@H](F)[C@H](N)c1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587124956 FG Annotated Anodyne COC(=O)c1ccc2[nH]c(-c3cccc(OCC(F)F)n3)nc2c1OC ZINC000587125060 FG Annotated Anodyne FC(F)COc1cccc(-c2nc3c(Br)cncc3[nH]2)n1 ZINC000587125084 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(C3(O)CCC(C(F)(F)F)CC3)[nH]c2cc1[N+](=O)[O-] ZINC000587125234 FG Annotated Bother O=C1CCc2cc3nc(C4(O)CCC(C(F)(F)F)CC4)[nH]c3cc2N1 ZINC000587125332 FG Annotated Anodyne COc1cncc2nc(-c3cc4n(n3)[C@H](C(F)(F)F)C[C@H](C)N4)[nH]c12 ZINC000587125781 FG Annotated Anodyne COc1cncc2nc(-c3cc4n(n3)[C@H](C(F)(F)F)C[C@@H](C)N4)[nH]c12 ZINC000587125782 FG Annotated Anodyne COc1cncc2nc(-c3cc4n(n3)[C@@H](C(F)(F)F)C[C@@H](C)N4)[nH]c12 ZINC000587125783 FG Annotated Anodyne COc1cncc2nc(-c3cc4n(n3)[C@@H](C(F)(F)F)C[C@H](C)N4)[nH]c12 ZINC000587125784 FG Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cccc(C(=O)O)c4[nH]3)cc2N1 ZINC000587125791 FG Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cccc(C(=O)O)c4[nH]3)cc2N1 ZINC000587125792 FG Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cccc(C(=O)O)c4[nH]3)cc2N1 ZINC000587125793 FG Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cccc(C(=O)O)c4[nH]3)cc2N1 ZINC000587125795 FG Annotated Anodyne N=c1nc(O)c2nc(/C=C\c3ccc(SC(F)(F)F)cc3)[nH]c2[nH]1 ZINC000587125838 FG Annotated Anodyne N=c1nc(O)c2nc(/C=C/c3ccc(SC(F)(F)F)cc3)[nH]c2[nH]1 ZINC000587125839 FG Annotated Anodyne Cc1cc(-c2nc3ncccc3[nH]2)ccc1NS(=O)(=O)C(F)(F)F ZINC000587125928 FG Annotated Anodyne FC(F)COc1cccc(-c2nc3cnc(Br)cc3[nH]2)n1 ZINC000587125962 FG Annotated Anodyne FC(F)COc1cccc(-c2nc3nc(Br)ccc3[nH]2)n1 ZINC000587125977 FG Annotated Anodyne COC(=O)c1cc2[nH]c(C3(O)CCC(C(F)(F)F)CC3)nc2cc1OC ZINC000587126030 FG Annotated Anodyne FC(F)COc1cccc(-c2nc3c(Br)nccc3[nH]2)n1 ZINC000587126044 FG Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4ccc(C(=O)O)cc4[nH]3)cc2N1 ZINC000587126161 FG Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4ccc(C(=O)O)cc4[nH]3)cc2N1 ZINC000587126162 FG Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4ccc(C(=O)O)cc4[nH]3)cc2N1 ZINC000587126163 FG Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4ccc(C(=O)O)cc4[nH]3)cc2N1 ZINC000587126164 FG Annotated Anodyne O=[N+]([O-])c1cnc2nc(-c3n[nH]c4cc(OC(F)(F)F)ccc34)[nH]c2c1 ZINC000587126399 FG Annotated Bother FC(F)(F)Oc1ccc2c(-c3nc4nc(Cl)c[nH]c-4n3)n[nH]c2c1 ZINC000587126425 FG Annotated Anodyne O=S(=O)(c1ncccc1-c1nc2c(F)c(F)ccc2[nH]1)C(F)(F)F ZINC000587126496 FG Annotated Anodyne FC(F)(F)Oc1ccc2c(-c3nc4nc(Cl)ncc4[nH]3)n[nH]c2c1 ZINC000587126500 FG Annotated Anodyne COc1nccc2nc(-c3cc4n(n3)[C@@H](C(F)(F)F)C[C@@H](C)N4)[nH]c12 ZINC000587126566 FG Annotated Anodyne COc1nccc2nc(-c3cc4n(n3)[C@@H](C(F)(F)F)C[C@H](C)N4)[nH]c12 ZINC000587126568 FG Annotated Anodyne COc1nccc2nc(-c3cc4n(n3)[C@H](C(F)(F)F)C[C@@H](C)N4)[nH]c12 ZINC000587126571 FG Annotated Anodyne COc1nccc2nc(-c3cc4n(n3)[C@H](C(F)(F)F)C[C@H](C)N4)[nH]c12 ZINC000587126572 FG Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4c(Cl)ncnc4[nH]3)cc2N1 ZINC000587126639 FG Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4c(Cl)ncnc4[nH]3)cc2N1 ZINC000587126641 FG Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4c(Cl)ncnc4[nH]3)cc2N1 ZINC000587126643 FG Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4c(Cl)ncnc4[nH]3)cc2N1 ZINC000587126645 FG Annotated Anodyne FC(F)COc1cccc(-c2nc3nccc(Br)c3[nH]2)n1 ZINC000587126729 FG Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4nc(Cl)c[nH]c-4n3)cc2N1 ZINC000587126845 FG Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4nc(Cl)c[nH]c-4n3)cc2N1 ZINC000587126846 FG Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4nc(Cl)c[nH]c-4n3)cc2N1 ZINC000587126847 FG Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4nc(Cl)c[nH]c-4n3)cc2N1 ZINC000587126848 FG Annotated Anodyne O=[N+]([O-])c1cncc2[nH]c(-c3n[nH]c4cc(OC(F)(F)F)ccc34)nc12 ZINC000587126947 FG Annotated Bother CN(C)CCOc1ccc2nc(C3(O)CCC(C(F)(F)F)CC3)[nH]c2c1 ZINC000587126969 FG Annotated Anodyne FC(F)(F)Oc1ccc2c(-c3nc4ncnc(Cl)c4[nH]3)n[nH]c2c1 ZINC000587126982 FG Annotated Anodyne Cc1cc(F)c2nc(-c3cccnc3S(=O)(=O)C(F)(F)F)[nH]c2c1 ZINC000587127000 FG Annotated Anodyne COc1cc2[nH]c(-c3cccnc3S(=O)(=O)C(F)(F)F)nc2cc1C ZINC000587127080 FG Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cnc(Cl)[nH]c-4n3)cc2N1 ZINC000587127163 FG Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cnc(Cl)[nH]c-4n3)cc2N1 ZINC000587127165 FG Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cnc(Cl)[nH]c-4n3)cc2N1 ZINC000587127166 FG Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cnc(Cl)[nH]c-4n3)cc2N1 ZINC000587127168 FG Annotated Anodyne OC1(c2nc3cnc(C(F)(F)F)[nH]c-3n2)CCC(C(F)(F)F)CC1 ZINC000587127295 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc(C3(O)CCC(C(F)(F)F)CC3)[nH]c2c1 ZINC000587127309 FG Annotated Anodyne COC(=O)c1ccc2nc(C3(O)CCC(C(F)(F)F)CC3)[nH]c2c1OC ZINC000587127336 FG Annotated Anodyne O=S(=O)(c1ncccc1-c1nc2c(F)cc(F)cc2[nH]1)C(F)(F)F ZINC000587127369 FG Annotated Anodyne OC1(c2nc3nc(Br)c[nH]c-3n2)CCC(C(F)(F)F)CC1 ZINC000587127481 FG Annotated Anodyne FC(F)c1c(-c2nc3cc(Cl)c(Cl)nc3[nH]2)cnc2ncnn12 ZINC000587127770 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3cnc4ncnn4c3C(F)F)[nH]c2cc1Cl ZINC000587127778 FG Annotated Bother Cc1ccc2c(ccc3nc(-c4cnc5ncnn5c4C(F)F)[nH]c32)n1 ZINC000587127787 FG Annotated Anodyne Cn1nnc(-c2nc3cc(Br)c(F)c(F)c3[nH]2)c1C(F)F ZINC000587127849 FG Annotated Anodyne Cn1nnc(-c2nc3c(Br)cnc(Cl)c3[nH]2)c1C(F)F ZINC000587127861 FG Annotated Anodyne FC(F)c1c(-c2nc3cc(Cl)nc(Cl)c3[nH]2)cnc2ncnn12 ZINC000587127898 FG Annotated Anodyne N=c1nc(O)c2nc(-c3sc(-c4ccccc4)nc3C(F)F)[nH]c2[nH]1 ZINC000587127945 FG Annotated Anodyne COc1cc2nc(-c3cnc4ncnn4c3C(F)F)[nH]c2cc1Cl ZINC000587128103 FG Annotated Anodyne FC(F)c1c(-c2nc3cc(C(F)(F)F)cnc3[nH]2)cnc2ncnn12 ZINC000587128155 FG Annotated Anodyne C[C@H](c1nc2c(N)ncnc2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587128163 FG Annotated Anodyne C[C@@H](c1nc2c(N)ncnc2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587128166 FG Annotated Anodyne FC(F)c1c(-c2nc3cc(C(F)(F)F)ncc3[nH]2)cnc2ncnn12 ZINC000587128305 FG Annotated Anodyne FC(F)c1c(-c2nc3ccc(Br)cc3[nH]2)cnc2ncnn12 ZINC000587128417 FG Annotated Anodyne Fc1c(F)c(F)c2[nH]c(-c3cnc4ncnn4c3C(F)F)nc2c1F ZINC000587128422 FG Annotated Anodyne FC(F)c1c(-c2nc3c(Cl)cnc(Cl)c3[nH]2)cnc2ncnn12 ZINC000587128753 FG Annotated Anodyne Oc1nc(O)c2nc(-c3sc(-c4ccccc4)nc3C(F)F)[nH]c2n1 ZINC000587128807 FG Annotated Anodyne Cn1nnc(-c2nc3c(Cl)c(Br)cnc3[nH]2)c1C(F)F ZINC000587128846 FG Annotated Anodyne C[C@H](c1nc2cnnc(O)c2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587128885 FG Annotated Anodyne C[C@@H](c1nc2cnnc(O)c2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587128890 FG Annotated Anodyne Cn1nnc(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)c1C(F)F ZINC000587129153 FG Annotated Bother Cn1nnc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c1C(F)F ZINC000587129238 FG Annotated Bother FC(F)c1c(-c2nc3cccc(Br)c3[nH]2)cnc2ncnn12 ZINC000587129344 FG Annotated Anodyne C[C@H](c1nc2c[nH]c(=N)[nH]c-2n1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587129350 FG Annotated Anodyne C[C@@H](c1nc2c[nH]c(=N)[nH]c-2n1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587129351 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3cccc(OCC(F)F)n3)[nH]c2cc1[N+](=O)[O-] ZINC000587129374 FG Annotated Bother FC(F)c1c(-c2nc3c(Cl)c(Cl)cnc3[nH]2)cnc2ncnn12 ZINC000587129422 FG Annotated Anodyne Cn1nnc(-c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c1C(F)F ZINC000587129609 FG Annotated Mild Cn1nnc(-c2nc3ccc(-c4ccc(N)c(N)c4)cc3[nH]2)c1C(F)F ZINC000587129686 FG Annotated Anodyne C[C@H](c1nc2c(O)ncnc2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587129695 FG Annotated Anodyne C[C@@H](c1nc2c(O)ncnc2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587129696 FG Annotated Anodyne CC(C)OC(=O)C1(c2nc3cc(Cl)nc(C#N)c3[nH]2)CC(F)(F)C1 ZINC000587129992 FG Annotated Mild CC(C)OC(=O)C1(c2nc3c(Br)ccnc3[nH]2)CC(F)(F)C1 ZINC000587130152 FG Annotated Anodyne CC(C)OC(=O)C1(c2nc3ccnc(Br)c3[nH]2)CC(F)(F)C1 ZINC000587130453 FG Annotated Anodyne CC(C)OC(=O)C1(c2nc3cc(Br)ncc3[nH]2)CC(F)(F)C1 ZINC000587130481 FG Annotated Anodyne CC(C)OC(=O)C1(c2nc3cncc(Br)c3[nH]2)CC(F)(F)C1 ZINC000587130659 FG Annotated Anodyne CC(C)OC(=O)C1(c2nc3cc(Br)cnc3[nH]2)CC(F)(F)C1 ZINC000587130992 FG Annotated Anodyne CC(C)OC(=O)C1(c2nc3ccc(Br)nc3[nH]2)CC(F)(F)C1 ZINC000587131087 FG Annotated Anodyne Fc1cccc(C2(F)CC(c3nc4ccc(-n5cnnn5)cc4[nH]3)C2)c1 ZINC000587131288 FG Annotated Anodyne CC(C)OC(=O)C1(c2nc3cc4c(cc3[nH]2)OCCCO4)CC(F)(F)C1 ZINC000587131421 FG Annotated Anodyne COc1cc(OC)c2[nH]c(C3(C(=O)OC(C)C)CC(F)(F)C3)nc2c1 ZINC000587131533 FG Annotated Anodyne CC(C)OC(=O)C1(c2nc3cc(F)cc(C(=O)O)c3[nH]2)CC(F)(F)C1 ZINC000587131577 FG Annotated Anodyne CC(C)OC(=O)C1(c2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)CC(F)(F)C1 ZINC000587131614 FG Annotated Bother COc1cc2nc(C3(C(=O)OC(C)C)CC(F)(F)C3)[nH]c2cc1OC ZINC000587131654 FG Annotated Anodyne CCOC(=O)c1ccc2nc(C3(C(=O)OC(C)C)CC(F)(F)C3)[nH]c2c1 ZINC000587131658 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](c2nc3cc(C#N)c(C#N)cc3[nH]2)C(F)(F)C1 ZINC000587131662 FG Annotated Mild CC(C)(C)OC(=O)N1C[C@@H](c2nc3cc(C#N)c(C#N)cc3[nH]2)C(F)(F)C1 ZINC000587131666 FG Annotated Mild CC(C)OC(=O)C1(c2nc3cc4c(cc3[nH]2)NC(=O)CC4)CC(F)(F)C1 ZINC000587131673 FG Annotated Anodyne CC(C)OC(=O)C1(c2nc3cc(C(=O)O)c(F)cc3[nH]2)CC(F)(F)C1 ZINC000587131679 FG Annotated Anodyne NS(=O)(=O)c1cccc2nc(C3CC(F)(c4cccc(F)c4)C3)[nH]c12 ZINC000587131692 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](c2nc3cccc(C(=O)O)c3[nH]2)C(F)(F)C1 ZINC000587131711 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](c2nc3cccc(C(=O)O)c3[nH]2)C(F)(F)C1 ZINC000587131712 FG Annotated Anodyne Cc1cc2[nH]c(C3(C(=O)OC(C)C)CC(F)(F)C3)nc2cc1[N+](=O)[O-] ZINC000587131987 FG Annotated Bother CC(C)(C)OC(=O)N1C[C@H](c2nc3cccc([N+](=O)[O-])c3[nH]2)C(F)(F)C1 ZINC000587132041 FG Annotated Bother CC(C)(C)OC(=O)N1C[C@@H](c2nc3cccc([N+](=O)[O-])c3[nH]2)C(F)(F)C1 ZINC000587132042 FG Annotated Bother CC(C)(C)OC(=O)N1C[C@H](c2nc3ccc(CO)cc3[nH]2)C(F)(F)C1 ZINC000587132104 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](c2nc3ccc(CO)cc3[nH]2)C(F)(F)C1 ZINC000587132105 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](c2nc3ccc(CCO)cc3[nH]2)C(F)(F)C1 ZINC000587132195 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](c2nc3ccc(CCO)cc3[nH]2)C(F)(F)C1 ZINC000587132196 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](c2nc3cc4c(cc3[nH]2)OCO4)C(F)(F)C1 ZINC000587132241 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](c2nc3cc4c(cc3[nH]2)OCO4)C(F)(F)C1 ZINC000587132242 FG Annotated Anodyne COc1c(F)ccc(-c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)c1N ZINC000587132406 FG Annotated Anodyne O=C(c1nc2c(O)nc(S)nc2[nH]1)c1c(Cl)ccc(F)c1Cl ZINC000587132447 FG Annotated Anodyne N=c1nc2nc(C(=O)c3c(Cl)ccc(F)c3Cl)[nH]c2c(Cl)[nH]1 ZINC000587132868 FG Annotated Anodyne COc1c(F)ccc(F)c1-c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587132903 FG Annotated Bother CC(C)(C)OC(=O)N1C[C@@H](c2nc3cc4cn[nH]c4cc3[nH]2)C(F)(F)C1 ZINC000587133087 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](c2nc3cc4cn[nH]c4cc3[nH]2)C(F)(F)C1 ZINC000587133088 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](c2nc3ccc([N+](=O)[O-])cc3[nH]2)C(F)(F)C1 ZINC000587133166 FG Annotated Bother CC(C)(C)OC(=O)N1C[C@H](c2nc3ccc([N+](=O)[O-])cc3[nH]2)C(F)(F)C1 ZINC000587133167 FG Annotated Bother COc1c(F)ccc(F)c1-c1nc2ccc(C3=C(C)CC(=O)NN3)cc2[nH]1 ZINC000587133427 FG Annotated Anodyne COC(=O)c1ccnc2nc(C(=O)c3c(Cl)ccc(F)c3Cl)[nH]c12 ZINC000587133444 FG Annotated Anodyne COC(=O)c1ccc2[nH]c(C(=O)c3c(Cl)ccc(F)c3Cl)nc2n1 ZINC000587133586 FG Annotated Anodyne COC(=O)c1cc2[nH]c(C(=O)c3c(Cl)ccc(F)c3Cl)nc2cn1 ZINC000587133589 FG Annotated Anodyne COc1c(F)ccc(-c2nc3c(F)cnc(Br)c3[nH]2)c1N ZINC000587133641 FG Annotated Anodyne N=c1[nH]c2nc(/C=C/c3c(F)c(F)c(F)c(F)c3F)nc-2c(Cl)[nH]1 ZINC000587133743 FG Annotated Anodyne N=c1[nH]c2nc(/C=C\c3c(F)c(F)c(F)c(F)c3F)nc-2c(Cl)[nH]1 ZINC000587133744 FG Annotated Anodyne Oc1c(F)cc(F)cc1-c1nc2cc(I)cnc2[nH]1 ZINC000587133811 FG Annotated Anodyne Cc1cc(C)c2[nH]c(CNS(=O)(=O)c3ccc(F)c(F)c3F)nc2c1 ZINC000587133845 FG Annotated Anodyne Cc1cc2nc(CNS(=O)(=O)c3ccc(F)c(F)c3F)[nH]c2cc1C ZINC000587133872 FG Annotated Anodyne Cc1ccc(C)c2[nH]c(CNS(=O)(=O)c3ccc(F)c(F)c3F)nc12 ZINC000587134031 FG Annotated Anodyne Fc1c(F)c(-c2nc3ccc(-n4cnnn4)cc3[nH]2)c(F)c(F)c1S ZINC000587134116 FG Annotated Anodyne Fc1c(F)c(-c2nc3c(S)nc(S)nc3[nH]2)c(F)c(F)c1S ZINC000587134219 FG Annotated Anodyne COc1c(F)ccc(-c2nc3ccc(Br)c(O)c3[nH]2)c1N ZINC000587134223 FG Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc(-c3cc(F)cc(F)c3O)nc-2[nH]1 ZINC000587134396 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3c(F)c(F)c(S)c(F)c3F)nc12 ZINC000587134450 FG Annotated Anodyne NNC(=O)c1ccc2nc(/C=C/c3c(F)c(F)c(F)c(F)c3F)[nH]c2c1 ZINC000587134521 FG Annotated Reactive NNC(=O)c1ccc2nc(/C=C\c3c(F)c(F)c(F)c(F)c3F)[nH]c2c1 ZINC000587134522 FG Annotated Reactive Nc1c(F)cc(-c2nc3cc(I)cnc3[nH]2)cc1F ZINC000587134560 FG Annotated Anodyne COc1c(F)cc(-c2nc3ccc(C4=C(C)CC(=O)NN4)cc3[nH]2)cc1F ZINC000587134609 FG Annotated Anodyne CCc1ccc2nc(CNS(=O)(=O)c3ccc(F)c(F)c3F)[nH]c2c1 ZINC000587134645 FG Annotated Anodyne Cc1ccc2nc(CNS(=O)(=O)c3ccc(F)c(F)c3F)[nH]c2c1C ZINC000587134676 FG Annotated Anodyne O=C1COc2cc3[nH]c(-c4c(F)c(F)c(S)c(F)c4F)nc3cc2N1 ZINC000587135112 FG Annotated Anodyne COc1c(F)ccc(-c2nc3cc(Br)c(C)nc3[nH]2)c1N ZINC000587135181 FG Annotated Anodyne Oc1nc(S)nc2[nH]c(/C=C/c3c(F)c(F)c(F)c(F)c3F)nc12 ZINC000587135195 FG Annotated Anodyne Oc1nc(S)nc2[nH]c(/C=C\c3c(F)c(F)c(F)c(F)c3F)nc12 ZINC000587135196 FG Annotated Anodyne Nc1c(F)cc(-c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)cc1F ZINC000587135227 FG Annotated Anodyne COC(=O)c1cc2nc(-c3c(F)c(F)c(S)c(F)c3F)[nH]c2cn1 ZINC000587135280 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3c(F)c(F)c(S)c(F)c3F)[nH]c2n1 ZINC000587135362 FG Annotated Anodyne CNc1c(F)cccc1-c1nc2cc(I)cnc2[nH]1 ZINC000587135505 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3cc(Br)c(F)cc3F)[nH]c2n1 ZINC000587135724 FG Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3cc(Br)c(F)cc3F)nc12 ZINC000587135725 FG Annotated Anodyne COC(=O)c1cc2nc(-c3cc(OC(C)(C)C)c(F)cc3N)[nH]c2cn1 ZINC000587135754 FG Annotated Anodyne CC(C)(C)Oc1cc(-c2nc3c(S)nc(S)nc3[nH]2)c(N)cc1F ZINC000587135785 FG Annotated Anodyne CC(C)(C)Oc1cc(-c2nc3cc4c(cc3[nH]2)OCC(=O)N4)c(N)cc1F ZINC000587135832 FG Annotated Anodyne Nc1cc(F)c(-c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)cc1N ZINC000587135891 FG Annotated Bother COC(=O)c1ccc2nc(-c3cc(OC(C)(C)C)c(F)cc3N)[nH]c2n1 ZINC000587135965 FG Annotated Anodyne CNc1c(F)cccc1-c1nc2[nH]c(O)nc(NCc3ccccc3)c-2n1 ZINC000587135978 FG Annotated Anodyne Cc1cc(N(C)Cc2nc3cc4c(cc3[nH]2)OCO4)c([N+](=O)[O-])cc1F ZINC000587136099 FG Annotated Bother COC(=O)c1ccnc2[nH]c(-c3cc(OC(C)(C)C)c(F)cc3N)nc12 ZINC000587136110 FG Annotated Anodyne CC(C)(C)Oc1cc(-c2nc3ccc(-n4cnnn4)cc3[nH]2)c(N)cc1F ZINC000587136154 FG Annotated Anodyne Cc1cc(N(C)Cc2nc3cc4cn[nH]c4cc3[nH]2)c([N+](=O)[O-])cc1F ZINC000587136210 FG Annotated Bother CN(C)CCOc1ccc2nc(-c3cc(F)c(F)c(N)c3F)[nH]c2c1 ZINC000587136240 FG Annotated Anodyne COC(=O)c1cc2nc(-c3cc(Br)c(F)cc3F)[nH]c2cn1 ZINC000587136341 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3cc(Br)c(F)cc3F)nc12 ZINC000587136501 FG Annotated Anodyne Cc1cc(N(C)Cc2nc3cccc([N+](=O)[O-])c3[nH]2)c([N+](=O)[O-])cc1F ZINC000587136520 FG Annotated Bother Cc1cc(N(C)Cc2nc3cc4c(cc3[nH]2)OCCO4)c([N+](=O)[O-])cc1F ZINC000587136684 FG Annotated Bother Cc1cc(N(C)Cc2nc3ccc(CCO)cc3[nH]2)c([N+](=O)[O-])cc1F ZINC000587136696 FG Annotated Bother Nc1cc(F)c(-c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)cc1N ZINC000587136920 FG Annotated Bother Nc1cc(F)c(-c2nc3c(Br)cnc(Cl)c3[nH]2)cc1N ZINC000587136924 FG Annotated Anodyne Cc1cc(N(C)Cc2nc3cccc(C(=O)O)c3[nH]2)c([N+](=O)[O-])cc1F ZINC000587137003 FG Annotated Bother Nc1c(F)c(F)cc(-c2nc3ccc(CN4CCOCC4)cc3[nH]2)c1F ZINC000587137036 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3cc(F)c(F)c(N)c3F)[nH]c2c1OC ZINC000587137063 FG Annotated Anodyne Cc1c(F)cccc1-c1cc(-c2nc3c[nH]c(=N)[nH]c-3n2)cc([N+](=O)[O-])c1 ZINC000587137070 FG Annotated Bother Nc1c(F)c(F)cc(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)c1F ZINC000587137087 FG Annotated Bother COC(=O)c1cc2[nH]c(-c3cc(F)c(F)c(N)c3F)nc2cc1OC ZINC000587137104 FG Annotated Anodyne Cc1cc(N(C)Cc2nc3cc(C#N)c(C#N)cc3[nH]2)c([N+](=O)[O-])cc1F ZINC000587137136 FG Annotated Mild Cc1cc(N(C)Cc2nc3ccc(C(=O)O)cc3[nH]2)c([N+](=O)[O-])cc1F ZINC000587137165 FG Annotated Bother Cc1cc(N(C)Cc2nc3cc(Cl)nc(C#N)c3[nH]2)c([N+](=O)[O-])cc1F ZINC000587137176 FG Annotated Mild Cc1cc(N(C)Cc2nc3ccc([N+](=O)[O-])cc3[nH]2)c([N+](=O)[O-])cc1F ZINC000587137205 FG Annotated Bother Cc1cc(N(C)Cc2nc3cc4nc(O)[nH]c4cc3[nH]2)c([N+](=O)[O-])cc1F ZINC000587137221 FG Annotated Bother COC(=O)c1cccc2nc(CN(C)c3cc(C)c(F)cc3[N+](=O)[O-])[nH]c12 ZINC000587137335 FG Annotated Bother COC(=O)c1ccc2nc(CN(C)c3cc(C)c(F)cc3[N+](=O)[O-])[nH]c2c1 ZINC000587137387 FG Annotated Bother Cc1cc(N(C)Cc2nc3ccc([C@@H](N)N=O)cc3[nH]2)c([N+](=O)[O-])cc1F ZINC000587137397 FG Annotated Bother Cc1cc(N(C)Cc2nc3ccc([C@H](N)N=O)cc3[nH]2)c([N+](=O)[O-])cc1F ZINC000587137398 FG Annotated Bother Nc1cc(F)c(-c2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)cc1N ZINC000587137420 FG Annotated Clean Cc1cc(Br)c(-c2nc3ccc(-n4cnnn4)cc3[nH]2)cc1F ZINC000587137815 FG Annotated Anodyne N=c1[nH]c2nc(-c3cc(Br)c(F)cc3F)nc-2c(Cl)[nH]1 ZINC000587137901 FG Annotated Anodyne Cc1cc(Br)c(-c2nc3[nH]c(=N)[nH]c(Cl)c-3n2)cc1F ZINC000587137936 FG Annotated Anodyne Cc1cc(Br)c(-c2nc3c(O)nc(S)nc3[nH]2)cc1F ZINC000587137976 FG Annotated Anodyne O=S(=O)(O)c1ccc2nc(CCc3cc(F)c(F)c(F)c3)[nH]c2c1 ZINC000587137999 FG Annotated Anodyne O=C(O)c1ccc(-c2cc(-c3nc4c(O)ncnc4[nH]3)ccc2F)cc1F ZINC000587138251 FG Annotated Anodyne N=c1[nH]cc2nc(-c3ccc(F)c(-c4ccc(C(=O)O)c(F)c4)c3)nc-2[nH]1 ZINC000587138381 FG Annotated Anodyne O=C(O)c1ccc(F)c(-c2ccc(-c3nc4c(O)ncnc4[nH]3)c(F)c2)c1 ZINC000587138464 FG Annotated Anodyne Nc1ncnc2[nH]c(-c3ccc(-c4cc(C(=O)O)ccc4F)cc3F)nc12 ZINC000587138511 FG Annotated Anodyne Nc1ncnc2[nH]c(-c3ccc(F)c(-c4ccc(C(=O)O)c(F)c4)c3)nc12 ZINC000587138641 FG Annotated Anodyne N=c1[nH]cc2nc(-c3ccc(-c4cc(C(=O)O)ccc4F)cc3F)nc-2[nH]1 ZINC000587138920 FG Annotated Anodyne O=C(O)c1ccc(F)c(-c2ccc(-c3nc4cnnc(O)c4[nH]3)c(F)c2)c1 ZINC000587138988 FG Annotated Anodyne O=C(O)c1ccc(-c2cc(-c3nc4cnnc(O)c4[nH]3)ccc2F)cc1F ZINC000587139001 FG Annotated Anodyne CC(=O)c1ccc(-c2cc(-c3nc4c(O)nc(O)nc4[nH]3)ccc2F)cc1 ZINC000587139243 FG Annotated Anodyne Nc1cc(-c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)ccc1F ZINC000587139251 FG Annotated Anodyne COC(=O)c1cc2nc(-c3cc(Cl)cc([N+](=O)[O-])c3F)[nH]c2cn1 ZINC000587139622 FG Annotated Bother Fc1cc(CCc2nc3nc(Br)c[nH]c-3n2)cc(F)c1F ZINC000587139626 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3cc(Cl)cc([N+](=O)[O-])c3F)nc12 ZINC000587139638 FG Annotated Bother CC(=O)c1ccc(-c2cc(-c3nc4c(O)nc(=N)[nH]c4[nH]3)ccc2F)cc1 ZINC000587139766 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3cc(Cl)cc([N+](=O)[O-])c3F)[nH]c2n1 ZINC000587139884 FG Annotated Bother O=[N+]([O-])c1cc(Cl)cc(-c2nc3nc(Br)c[nH]c-3n2)c1F ZINC000587139966 FG Annotated Bother O=C(O)c1cc(Br)cc2nc(-c3cc(CO)ccc3F)[nH]c12 ZINC000587139983 FG Annotated Anodyne OCc1ccc(F)c(-c2nc3cccc(I)c3[nH]2)c1 ZINC000587140089 FG Annotated Anodyne O=[N+]([O-])c1cc(Cl)cc(-c2nc3c(S)nc(S)nc3[nH]2)c1F ZINC000587140280 FG Annotated Bother O=C1COc2cc3[nH]c(-c4cc(Cl)cc([N+](=O)[O-])c4F)nc3cc2N1 ZINC000587140304 FG Annotated Bother Nc1ccc(F)c(Cc2nc3cccc(I)c3[nH]2)c1 ZINC000587140639 FG Annotated Anodyne Nc1ccc(F)c(Cc2nc3cc(Br)cc(C(=O)O)c3[nH]2)c1 ZINC000587141162 FG Annotated Anodyne Nc1ccc(F)c(Cc2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)c1 ZINC000587141606 FG Annotated Anodyne Nc1ccc(F)c(Cc2nc3ccc(I)cc3[nH]2)c1 ZINC000587141658 FG Annotated Anodyne NS(=O)(=O)c1ccc(F)c(-c2nc3cccc(C(F)(F)F)c3[nH]2)c1 ZINC000587142374 FG Annotated Anodyne N[C@H](Cc1nc2c(Cl)ncnc2[nH]1)c1ccc(Br)cc1F ZINC000587142472 FG Annotated Anodyne N[C@@H](Cc1nc2c(Cl)ncnc2[nH]1)c1ccc(Br)cc1F ZINC000587142473 FG Annotated Anodyne COC(=O)c1cc2nc(-c3ccc(Br)cc3F)[nH]c2cn1 ZINC000587142540 FG Annotated Anodyne Fc1cc(Br)ccc1-c1nc2c(S)nc(S)nc2[nH]1 ZINC000587142570 FG Annotated Anodyne CC1=C(c2ccc3nc(-c4cc(S)ccc4F)[nH]c3c2)NNC(=O)C1 ZINC000587142581 FG Annotated Anodyne O=C1COc2cc3[nH]c(-c4ccc(Br)cc4F)nc3cc2N1 ZINC000587142587 FG Annotated Anodyne N[C@H](Cc1nc2nc(Cl)c[nH]c-2n1)c1ccc(Br)cc1F ZINC000587142618 FG Annotated Anodyne N[C@@H](Cc1nc2nc(Cl)c[nH]c-2n1)c1ccc(Br)cc1F ZINC000587142619 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3ccc(Br)cc3F)[nH]c2n1 ZINC000587142657 FG Annotated Anodyne Fc1cc(Br)ccc1-c1nc2ccc(-n3cnnn3)cc2[nH]1 ZINC000587142698 FG Annotated Anodyne N[C@H](Cc1nc2cnc(Cl)[nH]c-2n1)c1ccc(Br)cc1F ZINC000587142701 FG Annotated Anodyne N[C@@H](Cc1nc2cnc(Cl)[nH]c-2n1)c1ccc(Br)cc1F ZINC000587142702 FG Annotated Anodyne N#Cc1ccc(-c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)cc1F ZINC000587142789 FG Annotated Mild N#Cc1ccc(-c2nc3cc(I)cnc3[nH]2)cc1F ZINC000587142935 FG Annotated Mild COC(=O)c1ccnc2[nH]c(-c3ccc(Br)cc3F)nc12 ZINC000587143183 FG Annotated Anodyne COc1cc(-c2nc3ncc[nH]c-3n2)cc(-c2ccc(C(=O)O)cc2F)c1 ZINC000587143381 FG Annotated Anodyne COc1cc2nc(C[C@@H](N)c3ccc(Br)cc3F)[nH]c2cn1 ZINC000587143594 FG Annotated Anodyne COc1cc2nc(C[C@H](N)c3ccc(Br)cc3F)[nH]c2cn1 ZINC000587143595 FG Annotated Anodyne COc1ccc(C(=O)c2ccccc2-c2nc3cc[nH]c(=N)c3[nH]2)cc1F ZINC000587143699 FG Annotated Anodyne N[C@H](Cc1nc2cc(F)cnc2[nH]1)c1ccc(Br)cc1F ZINC000587144175 FG Annotated Anodyne N[C@@H](Cc1nc2cc(F)cnc2[nH]1)c1ccc(Br)cc1F ZINC000587144186 FG Annotated Anodyne N[C@H](Cc1nc2cccc(O)c2[nH]1)c1ccc(Br)cc1F ZINC000587144222 FG Annotated Anodyne Cc1cc(-c2nc3ncnc(N)c3[nH]2)ccc1-c1ccc(C(=O)O)c(F)c1 ZINC000587144223 FG Annotated Anodyne N[C@@H](Cc1nc2cccc(O)c2[nH]1)c1ccc(Br)cc1F ZINC000587144224 FG Annotated Anodyne COc1ccc(C(=O)c2ccccc2-c2nc3cc(=N)[nH]cc3[nH]2)cc1F ZINC000587144311 FG Annotated Anodyne COc1ccc2nc(C[C@@H](N)c3ccc(Br)cc3F)[nH]c2n1 ZINC000587144315 FG Annotated Anodyne COc1ccc2nc(C[C@H](N)c3ccc(Br)cc3F)[nH]c2n1 ZINC000587144319 FG Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4ncc[nH]c-4n3)cc2F)c1 ZINC000587144445 FG Annotated Anodyne COc1cncc2nc(C[C@@H](N)c3ccc(Br)cc3F)[nH]c12 ZINC000587144498 FG Annotated Anodyne COc1cncc2nc(C[C@H](N)c3ccc(Br)cc3F)[nH]c12 ZINC000587144499 FG Annotated Anodyne Cc1cc(-c2nc3nc(=N)[nH]cc3[nH]2)ccc1-c1ccc(C(=O)O)c(F)c1 ZINC000587144720 FG Annotated Anodyne COc1nccc2nc(C[C@@H](N)c3ccc(Br)cc3F)[nH]c12 ZINC000587144874 FG Annotated Anodyne COc1nccc2nc(C[C@H](N)c3ccc(Br)cc3F)[nH]c12 ZINC000587144875 FG Annotated Anodyne N[C@H](Cc1nc2ccc(CO)cc2[nH]1)c1ccc(Br)cc1F ZINC000587144914 FG Annotated Anodyne N[C@@H](Cc1nc2ccc(CO)cc2[nH]1)c1ccc(Br)cc1F ZINC000587144915 FG Annotated Anodyne Cc1cc(C(=O)O)ccc1-c1ccc(-c2nc3c[nH]c(=N)[nH]c-3n2)c(F)c1 ZINC000587145017 FG Annotated Anodyne N#Cc1nc2nc(Cc3ccc(-c4ccccc4)c(F)c3)[nH]c2nc1C#N ZINC000587145271 FG Annotated Mild N[C@H](Cc1nc2ccc(O)cc2[nH]1)c1ccc(Br)cc1F ZINC000587145444 FG Annotated Anodyne N[C@@H](Cc1nc2ccc(O)cc2[nH]1)c1ccc(Br)cc1F ZINC000587145446 FG Annotated Anodyne Cc1cc(C(=O)O)ccc1-c1ccc(-c2nc3c(N)ncnc3[nH]2)c(F)c1 ZINC000587145474 FG Annotated Anodyne COc1ccc(C(=O)c2ccccc2-c2nc3cnnc(O)c3[nH]2)cc1F ZINC000587145490 FG Annotated Anodyne Cc1ccc(/C=C\c2nc3cccc(S(=O)(=O)N(C)C)c3[nH]2)cc1F ZINC000587146360 FG Annotated Anodyne Cc1ccc(/C=C/c2nc3cccc(S(=O)(=O)N(C)C)c3[nH]2)cc1F ZINC000587146361 FG Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4ncc[nH]c-4n3)c(F)c2)c1 ZINC000587147296 FG Annotated Anodyne O=C1C[C@H](c2nc3cc(Cl)cnc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587147843 FG Annotated Anodyne O=C1C[C@@H](c2nc3cc(Cl)cnc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587147844 FG Annotated Anodyne O=C1C[C@@H](c2nc3cc4c(cc3[nH]2)OCO4)CN1Cc1ccc(F)cc1F ZINC000587147964 FG Annotated Anodyne O=C1C[C@H](c2nc3cc4c(cc3[nH]2)OCO4)CN1Cc1ccc(F)cc1F ZINC000587147967 FG Annotated Anodyne COC(=O)c1cc2[nH]c(-c3cc(-c4ccc(F)c(F)c4)nn3C)nc2cn1 ZINC000587147979 FG Annotated Anodyne COc1ccc(Cc2nc3ccc(C4=C(C)CC(=O)NN4)cc3[nH]2)c(F)c1 ZINC000587148208 FG Annotated Anodyne O=C1C[C@@H](c2nc3cccc([N+](=O)[O-])c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587148271 FG Annotated Bother O=C1C[C@H](c2nc3cccc([N+](=O)[O-])c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587148276 FG Annotated Bother Cc1cc2[nH]c([C@@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)nc2c(C)n1 ZINC000587148361 FG Annotated Anodyne Cc1cc2[nH]c([C@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)nc2c(C)n1 ZINC000587148366 FG Annotated Anodyne O=C1CCc2cc3nc(COc4ccc([N+](=O)[O-])c(F)c4)[nH]c3cc2N1 ZINC000587148420 FG Annotated Bother CCOC(=O)Cc1ccc2nc(COc3ccc([N+](=O)[O-])c(F)c3)[nH]c2c1 ZINC000587148548 FG Annotated Bother Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2cc3[nH]c(O)nc3cc2[nH]1 ZINC000587148572 FG Annotated Anodyne O=C1C[C@H](c2nc3cncc(Cl)c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587148598 FG Annotated Anodyne O=C1C[C@@H](c2nc3cncc(Cl)c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587148601 FG Annotated Anodyne COc1cccc2nc([C@@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c12 ZINC000587148603 FG Annotated Anodyne COc1cccc2nc([C@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c12 ZINC000587148607 FG Annotated Anodyne O=C1C[C@H](c2nc3cc(Cl)ncc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587148636 FG Annotated Anodyne O=C1C[C@@H](c2nc3cc(Cl)ncc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587148637 FG Annotated Anodyne COc1ccc2nc([C@@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c2c1 ZINC000587148645 FG Annotated Anodyne COc1ccc2nc([C@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c2c1 ZINC000587148646 FG Annotated Anodyne N#Cc1ccc2nc([C@@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c2c1 ZINC000587148668 FG Annotated Mild N#Cc1ccc2nc([C@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c2c1 ZINC000587148669 FG Annotated Mild O=C1C[C@H](c2nc3ccc(Cl)nc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587148676 FG Annotated Anodyne O=C1C[C@@H](c2nc3ccc(Cl)nc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587148678 FG Annotated Anodyne O=[N+]([O-])c1ccc(OCc2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)cc1F ZINC000587148809 FG Annotated Bother N[C@H](c1nc2ccc(Br)c(O)c2[nH]1)c1ccc(F)cc1F ZINC000587148830 FG Annotated Anodyne N=c1[nH]cc2nc([C@@H](Oc3ccc(F)c(F)c3)c3ccccc3)nc-2[nH]1 ZINC000587149036 FG Annotated Anodyne N=c1[nH]cc2nc([C@H](Oc3ccc(F)c(F)c3)c3ccccc3)nc-2[nH]1 ZINC000587149050 FG Annotated Anodyne O=C(O)c1cccc2nc([C@@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c12 ZINC000587149150 FG Annotated Anodyne O=C(O)c1cccc2nc([C@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c12 ZINC000587149151 FG Annotated Anodyne N#Cc1nc2nc([C@@H](Nc3ccccc3)c3ccccc3F)[nH]c2nc1C#N ZINC000587149227 FG Annotated Mild N#Cc1nc2nc([C@H](Nc3ccccc3)c3ccccc3F)[nH]c2nc1C#N ZINC000587149228 FG Annotated Mild CN(C)CCOc1ccc2nc(COc3ccc([N+](=O)[O-])c(F)c3)[nH]c2c1 ZINC000587149502 FG Annotated Bother COC(=O)c1ccc2[nH]c(-c3cc(-c4ccc(F)c(F)c4)nn3C)nc2n1 ZINC000587149591 FG Annotated Anodyne N[C@H](c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1)c1ccc(F)cc1F ZINC000587149627 FG Annotated Anodyne O=C(O)c1ccc2nc([C@@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c2c1 ZINC000587149649 FG Annotated Anodyne O=C(O)c1ccc2nc([C@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c2c1 ZINC000587149650 FG Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2ncc([N+](=O)[O-])cc2[nH]1 ZINC000587149695 FG Annotated Bother CCOC(=O)c1ccc2nc(COc3ccc([N+](=O)[O-])c(F)c3)[nH]c2c1 ZINC000587150097 FG Annotated Bother O=[N+]([O-])c1ccc(OCc2nc3cc4c(cc3[nH]2)OCCCO4)cc1F ZINC000587150103 FG Annotated Bother Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2cc(CCO)ccc2[nH]1 ZINC000587150181 FG Annotated Anodyne Cc1nc2[nH]c([C@@H](N)c3ccc(F)cc3F)nc2cc1Br ZINC000587150195 FG Annotated Anodyne N#Cc1cccc2nc([C@@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c12 ZINC000587150230 FG Annotated Mild N#Cc1cccc2nc([C@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c12 ZINC000587150234 FG Annotated Mild COc1ccc(-c2ccc(-c3nc4c(O)nc(=N)[nH]c4[nH]3)c(F)c2)c(F)c1 ZINC000587150347 FG Annotated Anodyne O=C1C[C@@H](c2nc3cc4cn[nH]c4cc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587150357 FG Annotated Anodyne O=C1C[C@H](c2nc3cc4cn[nH]c4cc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587150359 FG Annotated Anodyne CC1=C(c2ccc3nc(CCc4ccccc4F)[nH]c3c2)NNC(=O)C1 ZINC000587150466 FG Annotated Anodyne Oc1nc(O)c2nc([C@H](Nc3ccccc3)c3ccccc3F)[nH]c2n1 ZINC000587150505 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(/C=C\c3ccc(F)cc3F)[nH]c12 ZINC000587150660 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(/C=C/c3ccc(F)cc3F)[nH]c12 ZINC000587150666 FG Annotated Anodyne O=[N+]([O-])c1ccc(OCc2nc3cc(Br)cnc3[nH]2)cc1F ZINC000587150668 FG Annotated Bother Oc1nc(O)c2nc([C@@H](Nc3ccccc3)c3ccccc3F)[nH]c2n1 ZINC000587150753 FG Annotated Anodyne O=C1C[C@H](c2nc3ccnc(Cl)c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587150852 FG Annotated Anodyne O=C1C[C@@H](c2nc3ccnc(Cl)c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587150855 FG Annotated Anodyne Fc1ccccc1CCc1nc2cc(I)cnc2[nH]1 ZINC000587150930 FG Annotated Anodyne O=[N+]([O-])c1ccc(OCc2nc3ccnc(Br)c3[nH]2)cc1F ZINC000587151158 FG Annotated Bother O=C1C[C@H](c2nc3c(Cl)ccnc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587151183 FG Annotated Anodyne O=C1C[C@@H](c2nc3c(Cl)ccnc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587151184 FG Annotated Anodyne COc1ccc(-c2ccc(-c3nc4c(O)nc(O)nc4[nH]3)c(F)c2)c(F)c1 ZINC000587151209 FG Annotated Anodyne O=C1C[C@@H](c2nc3ccc([N+](=O)[O-])cc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587151256 FG Annotated Bother O=C1C[C@H](c2nc3ccc([N+](=O)[O-])cc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587151259 FG Annotated Bother Cc1c(Br)cnc2[nH]c([C@@H](N)c3ccc(F)cc3F)nc12 ZINC000587151288 FG Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2c([N+](=O)[O-])cncc2[nH]1 ZINC000587151386 FG Annotated Bother COC(=O)c1cc(Cl)c2[nH]c([C@@H](N)c3ccc(F)cc3F)nc2c1 ZINC000587151662 FG Annotated Anodyne C[C@H](Oc1ccc(F)c(F)c1)c1nc2nc(Br)c[nH]c-2n1 ZINC000587151669 FG Annotated Anodyne C[C@@H](Oc1ccc(F)c(F)c1)c1nc2nc(Br)c[nH]c-2n1 ZINC000587151671 FG Annotated Anodyne O=[N+]([O-])c1ccc(OCc2nc3cncc(Br)c3[nH]2)cc1F ZINC000587151705 FG Annotated Bother N[C@H](c1nc2c(F)cnc(Br)c2[nH]1)c1ccc(F)cc1F ZINC000587151752 FG Annotated Anodyne Nc1ncnc2[nH]c([C@@H](Oc3ccc(F)c(F)c3)c3ccccc3)nc12 ZINC000587151888 FG Annotated Anodyne Nc1ncnc2[nH]c([C@H](Oc3ccc(F)c(F)c3)c3ccccc3)nc12 ZINC000587151889 FG Annotated Anodyne C[C@@H](Oc1ccc(F)c(F)c1)c1nc2ccc(S(=O)(=O)O)cc2[nH]1 ZINC000587151911 FG Annotated Anodyne C[C@H](Oc1ccc(F)c(F)c1)c1nc2ccc(S(=O)(=O)O)cc2[nH]1 ZINC000587151914 FG Annotated Anodyne Oc1nc(O)c2nc([C@@H](Oc3ccc(F)c(F)c3)c3ccccc3)[nH]c2n1 ZINC000587152167 FG Annotated Anodyne Oc1nc(O)c2nc([C@H](Oc3ccc(F)c(F)c3)c3ccccc3)[nH]c2n1 ZINC000587152168 FG Annotated Anodyne O=[N+]([O-])c1ccc(OCc2nc3cc(Br)ncc3[nH]2)cc1F ZINC000587152183 FG Annotated Bother O=[N+]([O-])c1ccc(OCc2nc3ccc(Br)nc3[nH]2)cc1F ZINC000587152215 FG Annotated Bother O=[N+]([O-])c1ccc(OCc2nc3c(Br)ccnc3[nH]2)cc1F ZINC000587152216 FG Annotated Bother COc1ccc(-c2ccc(-c3nc4c[nH]c(=N)[nH]c-4n3)c(F)c2)c(F)c1 ZINC000587152232 FG Annotated Anodyne O=S(=O)(O)c1ccc2nc([C@@H]3C[C@@H]3c3cccc(F)c3F)[nH]c2c1 ZINC000587152415 FG Annotated Anodyne O=S(=O)(O)c1ccc2nc([C@H]3C[C@@H]3c3cccc(F)c3F)[nH]c2c1 ZINC000587152416 FG Annotated Anodyne O=S(=O)(O)c1ccc2nc([C@H]3C[C@H]3c3cccc(F)c3F)[nH]c2c1 ZINC000587152417 FG Annotated Anodyne O=S(=O)(O)c1ccc2nc([C@@H]3C[C@H]3c3cccc(F)c3F)[nH]c2c1 ZINC000587152418 FG Annotated Anodyne C[C@]1(c2nc3cc(F)cc(C(=O)O)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587153825 FG Annotated Anodyne C[C@@]1(c2nc3cc(F)cc(C(=O)O)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587153826 FG Annotated Anodyne O=C(COc1ccccc1-c1nc2ncc[nH]c-2n1)Nc1ccccc1F ZINC000587153920 FG Annotated Anodyne O=C(COc1ccccc1-c1nc2cnncc2[nH]1)Nc1ccccc1F ZINC000587153959 FG Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c([C@@]3(N)C[C@@H]3c3ccccc3F)nc2c1 ZINC000587154015 FG Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c([C@@]3(N)C[C@H]3c3ccccc3F)nc2c1 ZINC000587154016 FG Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c([C@]3(N)C[C@H]3c3ccccc3F)nc2c1 ZINC000587154017 FG Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c([C@]3(N)C[C@@H]3c3ccccc3F)nc2c1 ZINC000587154018 FG Annotated Anodyne C[C@@]1(c2nc3cc(Cl)nc(C#N)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587154067 FG Annotated Mild C[C@]1(c2nc3cc(Cl)nc(C#N)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587154068 FG Annotated Mild O=C(COc1ccccc1-c1nc2cncnc2[nH]1)Nc1ccccc1F ZINC000587154462 FG Annotated Anodyne O=C(O)c1cc(F)cc2[nH]c(-c3ccc(F)c(Br)n3)nc12 ZINC000587154581 FG Annotated Anodyne Fc1ccc(-c2nc3cc4c(cc3[nH]2)OCCO4)nc1Br ZINC000587154658 FG Annotated Anodyne Fc1ccc(-c2nc3nc(Br)c[nH]c-3n2)nc1Br ZINC000587154725 FG Annotated Anodyne Fc1cc(Br)cnc1-c1nc2nc(Br)c[nH]c-2n1 ZINC000587154947 FG Annotated Anodyne CCCc1nc(-c2nc3c([N+](=O)[O-])cncc3[nH]2)nn1-c1ccccc1F ZINC000587154965 FG Annotated Bother N[C@H](N=O)c1ccc2[nH]c(-c3ccc(F)c(Br)n3)nc2c1 ZINC000587155003 FG Annotated Anodyne N[C@@H](N=O)c1ccc2[nH]c(-c3ccc(F)c(Br)n3)nc2c1 ZINC000587155004 FG Annotated Anodyne C[C@]1(c2nc3cc4nc(O)[nH]c4cc3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587155049 FG Annotated Anodyne N#Cc1nc(Cl)cc2[nH]c(-c3ccc(F)c(Br)n3)nc12 ZINC000587155052 FG Annotated Mild C[C@@]1(c2nc3cc4nc(O)[nH]c4cc3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587155053 FG Annotated Anodyne CCCc1nc(-c2nc3c(OC)cncc3[nH]2)nn1-c1ccccc1F ZINC000587155077 FG Annotated Anodyne CCCc1nc(-c2nc3cc(CCO)ccc3[nH]2)nn1-c1ccccc1F ZINC000587155237 FG Annotated Anodyne COc1cc(-c2nc3cccc([N+](=O)[O-])c3[nH]2)nn1-c1ccccc1F ZINC000587155270 FG Annotated Bother COc1cc(-c2nc3cc4c(cc3[nH]2)OCO4)nn1-c1ccccc1F ZINC000587155395 FG Annotated Anodyne Fc1cc(Br)cnc1-c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000587155409 FG Annotated Anodyne Fc1ccc(-c2nc3cnc(C(F)(F)F)[nH]c-3n2)nc1Br ZINC000587155424 FG Annotated Anodyne COC(=O)c1cccc2nc([C@]3(C)C=C(c4ccccc4F)NO3)[nH]c12 ZINC000587155619 FG Annotated Anodyne COC(=O)c1cccc2nc([C@@]3(C)C=C(c4ccccc4F)NO3)[nH]c12 ZINC000587155623 FG Annotated Anodyne CCCc1nc(-c2nc3nc(OC)ccc3[nH]2)nn1-c1ccccc1F ZINC000587155640 FG Annotated Anodyne N[C@]1(c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)C[C@H]1c1ccccc1F ZINC000587155644 FG Annotated Anodyne N[C@]1(c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)C[C@@H]1c1ccccc1F ZINC000587155645 FG Annotated Anodyne N[C@@]1(c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)C[C@@H]1c1ccccc1F ZINC000587155646 FG Annotated Anodyne N[C@@]1(c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)C[C@H]1c1ccccc1F ZINC000587155647 FG Annotated Anodyne CCCc1nc(-c2nc3cc(CO)ccc3[nH]2)nn1-c1ccccc1F ZINC000587155807 FG Annotated Anodyne O=C(O)c1cc2nc(-c3ncc(Br)cc3F)[nH]c2cc1F ZINC000587155810 FG Annotated Anodyne CCCc1nc(-c2nc3cc(N)c(N)cc3[nH]2)nn1-c1ccccc1F ZINC000587155849 FG Annotated Anodyne CCCOc1cc2nc(-c3nn(C)c(O)c3F)[nH]c2cc1Br ZINC000587155857 FG Annotated Anodyne CCCc1nc(-c2nc3nc(Cl)c[nH]c-3n2)nn1-c1ccccc1F ZINC000587155863 FG Annotated Anodyne CC(C)Oc1cc2nc(-c3nn(C)c(O)c3F)[nH]c2cc1Br ZINC000587155906 FG Annotated Anodyne COc1cc(-c2nc3cc(C#N)c(C#N)cc3[nH]2)nn1-c1ccccc1F ZINC000587155917 FG Annotated Mild CCCc1nc(-c2nc3nc(Cl)ncc3[nH]2)nn1-c1ccccc1F ZINC000587155957 FG Annotated Anodyne CCCc1nc(-c2nc3ncnc(Cl)c3[nH]2)nn1-c1ccccc1F ZINC000587155981 FG Annotated Anodyne Cn1nc(-c2nc3cc(OC(F)(F)F)c(Cl)cc3[nH]2)c(F)c1O ZINC000587155999 FG Annotated Anodyne O=C1CCc2cc3[nH]c(-c4ccc(F)c(Br)n4)nc3cc2N1 ZINC000587156144 FG Annotated Anodyne O=C(O)c1cc(F)cc2nc(-c3ncc(Br)cc3F)[nH]c12 ZINC000587156172 FG Annotated Anodyne O=C(O)c1cc2[nH]c(-c3ccc(F)c(Br)n3)nc2cc1F ZINC000587156190 FG Annotated Anodyne N#Cc1nc(Cl)cc2nc(-c3ncc(Br)cc3F)[nH]c12 ZINC000587156211 FG Annotated Mild CCCc1nc(-c2nc3ncc([N+](=O)[O-])cc3[nH]2)nn1-c1ccccc1F ZINC000587156224 FG Annotated Bother CCCc1nc(-c2nc3c(OC)nccc3[nH]2)nn1-c1ccccc1F ZINC000587156236 FG Annotated Anodyne COc1cc(-c2nc3cc(Cl)nc(C#N)c3[nH]2)nn1-c1ccccc1F ZINC000587156516 FG Annotated Mild CCCc1nc(-c2nc3cnc(OC)cc3[nH]2)nn1-c1ccccc1F ZINC000587156600 FG Annotated Anodyne C[C@@]1(c2nc3cc4c(cc3[nH]2)OCCO4)C=C(c2ccccc2F)NO1 ZINC000587156644 FG Annotated Anodyne C[C@]1(c2nc3cc4c(cc3[nH]2)OCCO4)C=C(c2ccccc2F)NO1 ZINC000587156645 FG Annotated Anodyne COc1cc(-c2nc3ccc([N+](=O)[O-])cc3[nH]2)nn1-c1ccccc1F ZINC000587156676 FG Annotated Bother COc1cc(-c2nc3cc4c(cc3[nH]2)OCCO4)nn1-c1ccccc1F ZINC000587156772 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc([C@@]3(N)C[C@@H]3c3ccccc3F)[nH]c2c1 ZINC000587156783 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc([C@@]3(N)C[C@H]3c3ccccc3F)[nH]c2c1 ZINC000587156785 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc([C@]3(N)C[C@@H]3c3ccccc3F)[nH]c2c1 ZINC000587156787 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc([C@]3(N)C[C@H]3c3ccccc3F)[nH]c2c1 ZINC000587156788 FG Annotated Anodyne COc1cc(-c2nc3ccc([C@@H](N)N=O)cc3[nH]2)nn1-c1ccccc1F ZINC000587156845 FG Annotated Anodyne COc1cc(-c2nc3ccc([C@H](N)N=O)cc3[nH]2)nn1-c1ccccc1F ZINC000587156846 FG Annotated Anodyne COc1cc(-c2nc3ccc(CCO)cc3[nH]2)nn1-c1ccccc1F ZINC000587156877 FG Annotated Anodyne COc1cc(-c2nc3cc4nc(O)[nH]c4cc3[nH]2)nn1-c1ccccc1F ZINC000587157136 FG Annotated Anodyne O=C1CCc2cc3nc(-c4ncc(Br)cc4F)[nH]c3cc2N1 ZINC000587157213 FG Annotated Anodyne Fc1cc(Br)cnc1-c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000587157279 FG Annotated Anodyne C[C@]1(c2nc3cc(C(=O)O)c(F)cc3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587157299 FG Annotated Anodyne C[C@@]1(c2nc3cc(C(=O)O)c(F)cc3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587157300 FG Annotated Anodyne C[C@@]1(c2nc3ccc([C@H](N)N=O)cc3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587157347 FG Annotated Anodyne C[C@]1(c2nc3ccc([C@@H](N)N=O)cc3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587157348 FG Annotated Anodyne C[C@]1(c2nc3ccc([C@H](N)N=O)cc3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587157349 FG Annotated Anodyne C[C@@]1(c2nc3ccc([C@@H](N)N=O)cc3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587157350 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3ncc(Br)cc3F)[nH]c2c1 ZINC000587157554 FG Annotated Anodyne N[C@@]1(c2nc3cc(-n4cccn4)c(F)cc3[nH]2)C[C@@H]1c1ccccc1F ZINC000587157843 FG Annotated Anodyne N[C@@]1(c2nc3cc(-n4cccn4)c(F)cc3[nH]2)C[C@H]1c1ccccc1F ZINC000587157844 FG Annotated Anodyne N[C@]1(c2nc3cc(-n4cccn4)c(F)cc3[nH]2)C[C@@H]1c1ccccc1F ZINC000587157845 FG Annotated Anodyne N[C@]1(c2nc3cc(-n4cccn4)c(F)cc3[nH]2)C[C@H]1c1ccccc1F ZINC000587157846 FG Annotated Anodyne C[C@@]1(c2nc3cc4c(cc3[nH]2)NC(=O)CC4)C=C(c2ccccc2F)NO1 ZINC000587157849 FG Annotated Anodyne C[C@]1(c2nc3cc4c(cc3[nH]2)NC(=O)CC4)C=C(c2ccccc2F)NO1 ZINC000587157850 FG Annotated Anodyne C[C@@]1(c2nc3cnc(C(F)(F)F)[nH]c-3n2)C=C(c2ccccc2F)NO1 ZINC000587157864 FG Annotated Anodyne C[C@]1(c2nc3cnc(C(F)(F)F)[nH]c-3n2)C=C(c2ccccc2F)NO1 ZINC000587157865 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc(-c3ncc(Br)cc3F)[nH]c2c1 ZINC000587157903 FG Annotated Anodyne N[C@H](N=O)c1ccc2nc(-c3ncc(Br)cc3F)[nH]c2c1 ZINC000587157987 FG Annotated Anodyne N[C@@H](N=O)c1ccc2nc(-c3ncc(Br)cc3F)[nH]c2c1 ZINC000587157988 FG Annotated Anodyne N#Cc1cc(F)ccc1-c1nc2ncc(I)cc2[nH]1 ZINC000587158044 FG Annotated Mild CCOC(=O)c1ccc2nc(COc3cc(F)ccc3[N+](=O)[O-])[nH]c2c1 ZINC000587158235 FG Annotated Bother O=[N+]([O-])c1ccc(F)cc1OCc1nc2cncc(Br)c2[nH]1 ZINC000587158257 FG Annotated Bother COC(=O)c1ccc2nc([C@]3(C)C=C(c4ccccc4F)NO3)[nH]c2c1 ZINC000587158319 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@]3(C)C=C(c4ccccc4F)NO3)[nH]c2c1 ZINC000587158322 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(COc3cc(F)ccc3[N+](=O)[O-])[nH]c2cc1F ZINC000587158365 FG Annotated Bother COC(=O)c1cccc2nc(-c3ncc(Br)cc3F)[nH]c12 ZINC000587158456 FG Annotated Anodyne O=[N+]([O-])c1ccc(F)cc1OCc1nc2c(Br)ccnc2[nH]1 ZINC000587158771 FG Annotated Bother O=[N+]([O-])c1ccc(F)cc1OCc1nc2ccc(Br)nc2[nH]1 ZINC000587158793 FG Annotated Bother N[C@]1(c2nc3c(F)cnc(Br)c3[nH]2)C[C@@H]1c1ccccc1F ZINC000587158920 FG Annotated Anodyne N[C@@]1(c2nc3c(F)cnc(Br)c3[nH]2)C[C@H]1c1ccccc1F ZINC000587158921 FG Annotated Anodyne N[C@@]1(c2nc3c(F)cnc(Br)c3[nH]2)C[C@@H]1c1ccccc1F ZINC000587158922 FG Annotated Anodyne N[C@]1(c2nc3c(F)cnc(Br)c3[nH]2)C[C@H]1c1ccccc1F ZINC000587158924 FG Annotated Anodyne N#Cc1nc2nc(-c3ccc(F)cc3-c3ccc(C=O)cc3)nc-2[nH]c1C#N ZINC000587158977 FG Annotated Mild CN(C)C(=O)c1ccc2nc([C@]3(C)C=C(c4ccccc4F)NO3)[nH]c2c1 ZINC000587159127 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc([C@@]3(C)C=C(c4ccccc4F)NO3)[nH]c2c1 ZINC000587159129 FG Annotated Anodyne O=[N+]([O-])c1ccc(F)cc1OCc1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587159155 FG Annotated Bother O=[N+]([O-])c1ccc(F)cc1OCc1nc2ccnc(Br)c2[nH]1 ZINC000587159177 FG Annotated Bother O=Cc1ccc(-c2cc(F)ccc2-c2nc3c(O)nc(O)nc3[nH]2)cc1 ZINC000587159326 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(COc3cc(F)ccc3[N+](=O)[O-])[nH]c2c1 ZINC000587159538 FG Annotated Bother CN(C)CCOc1ccc2nc(COc3cc(F)ccc3[N+](=O)[O-])[nH]c2c1 ZINC000587159565 FG Annotated Bother O=C1CCc2cc3nc(COc4cc(F)ccc4[N+](=O)[O-])[nH]c3cc2N1 ZINC000587159583 FG Annotated Bother O=[N+]([O-])c1ccc(F)cc1OCc1nc2cc(Br)ncc2[nH]1 ZINC000587159590 FG Annotated Bother O=[N+]([O-])c1ccc(F)cc1OCc1nc2cc(Br)cnc2[nH]1 ZINC000587159799 FG Annotated Bother O=[N+]([O-])c1cc(F)cc(-c2nc3ccc(CN4CCOCC4)cc3[nH]2)c1 ZINC000587160012 FG Annotated Bother COc1cccc(-c2cc(F)cc(-c3nc4c(O)nc(O)nc4[nH]3)c2)c1 ZINC000587160048 FG Annotated Anodyne O=C1COc2cc3[nH]c(-c4cc(F)cc(Br)c4)nc3cc2N1 ZINC000587160695 FG Annotated Anodyne COC(=O)c1cc2nc(-c3cc(F)cc(Br)c3)[nH]c2cn1 ZINC000587160732 FG Annotated Anodyne OCCc1ccc2nc(-c3nnn(Cc4cccc(F)c4)c3Cl)[nH]c2c1 ZINC000587160802 FG Annotated Anodyne Fc1cccc(Cn2nnc(-c3nc4c(Cl)ncnc4[nH]3)c2Cl)c1 ZINC000587160887 FG Annotated Anodyne COc1cncc2nc(-c3nnn(Cc4cccc(F)c4)c3Cl)[nH]c12 ZINC000587160936 FG Annotated Anodyne COc1cc2nc(-c3nnn(Cc4cccc(F)c4)c3Cl)[nH]c2cn1 ZINC000587160966 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3cc(F)cc(Br)c3)nc12 ZINC000587161037 FG Annotated Anodyne OCc1ccc2nc(-c3nnn(Cc4cccc(F)c4)c3Cl)[nH]c2c1 ZINC000587161162 FG Annotated Anodyne O=C(O)c1cccc2nc(-c3nnn(Cc4cccc(F)c4)c3Cl)[nH]c12 ZINC000587161356 FG Annotated Anodyne COc1nccc2nc(-c3nnn(Cc4cccc(F)c4)c3Cl)[nH]c12 ZINC000587161403 FG Annotated Anodyne Fc1cc(Br)cc(-c2nc3c(S)nc(S)nc3[nH]2)c1 ZINC000587161518 FG Annotated Anodyne Fc1cc(Br)cc(-c2nc3ccc(-n4cnnn4)cc3[nH]2)c1 ZINC000587161567 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3cc(F)cc(Br)c3)[nH]c2n1 ZINC000587161634 FG Annotated Anodyne COc1ccc2nc(-c3nnn(Cc4cccc(F)c4)c3Cl)[nH]c2n1 ZINC000587161694 FG Annotated Anodyne Fc1cccc(Cn2nnc(-c3nc4cnc(Cl)[nH]c-4n3)c2Cl)c1 ZINC000587161731 FG Annotated Anodyne Fc1cccc(Cn2nnc(-c3nc4cc5c(cc4[nH]3)OCO5)c2Cl)c1 ZINC000587161739 FG Annotated Anodyne Fc1cccc(Cn2nnc(-c3nc4nc(Cl)c[nH]c-4n3)c2Cl)c1 ZINC000587161780 FG Annotated Anodyne O=C(O)c1ccc2nc(-c3nnn(Cc4cccc(F)c4)c3Cl)[nH]c2c1 ZINC000587161888 FG Annotated Anodyne O=C(CCc1nc2ccnc(Br)c2[nH]1)Nc1cccc(F)c1 ZINC000587162127 FG Annotated Anodyne O=C(c1ccc(F)cc1)c1ccccc1-c1nc2c(O)nc(S)nc2[nH]1 ZINC000587162187 FG Annotated Anodyne O=C1CC=C(c2nc3ccc(F)c(F)c3[nH]2)NN1Cc1ccc(F)cc1 ZINC000587162250 FG Annotated Anodyne O=C1CC=C(c2nc3ccc(Cl)nc3[nH]2)NN1Cc1ccc(F)cc1 ZINC000587162286 FG Annotated Anodyne COC(=O)c1cc2[nH]c(CCC(=O)c3ccc(F)cc3)nc2cc1OC ZINC000587162298 FG Annotated Anodyne COC(=O)c1cc2[nH]c([C@H](c3ccc(F)cc3)N(C)C)nc2cc1OC ZINC000587162475 FG Annotated Anodyne COC(=O)c1cc2[nH]c([C@@H](c3ccc(F)cc3)N(C)C)nc2cc1OC ZINC000587162476 FG Annotated Anodyne COc1cc2nc(C3=CCC(=O)N(Cc4ccc(F)cc4)N3)[nH]c2cc1C ZINC000587162485 FG Annotated Anodyne O=C(CCc1nc2ccc(CN3CCOCC3)cc2[nH]1)c1ccc(F)cc1 ZINC000587162694 FG Annotated Anodyne O=C(CCc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1)c1ccc(F)cc1 ZINC000587162813 FG Annotated Bother O=C(CCc1nc2c(Br)ccnc2[nH]1)Nc1cccc(F)c1 ZINC000587162881 FG Annotated Anodyne N=c1[nH]c2nc(-c3ccccc3C(=O)c3ccc(F)cc3)nc-2c(Cl)[nH]1 ZINC000587162892 FG Annotated Anodyne O=C(CCc1nc2cc3c(cc2[nH]1)OCCCO3)Nc1cccc(F)c1 ZINC000587163184 FG Annotated Anodyne CN(C)[C@@H](c1ccc(F)cc1)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587163253 FG Annotated Bother CN(C)[C@H](c1ccc(F)cc1)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587163255 FG Annotated Bother Cc1cc2nc(C3=CCC(=O)N(Cc4ccc(F)cc4)N3)[nH]c2cc1F ZINC000587163303 FG Annotated Anodyne CCOC(=O)c1ccc2nc(CCC(=O)Nc3cccc(F)c3)[nH]c2c1 ZINC000587163583 FG Annotated Anodyne CN(C)[C@@H](c1ccc(F)cc1)c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587163595 FG Annotated Anodyne CN(C)[C@H](c1ccc(F)cc1)c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587163600 FG Annotated Anodyne O=C(CCc1nc2ccc(Br)nc2[nH]1)Nc1cccc(F)c1 ZINC000587163602 FG Annotated Anodyne O=C(CCc1nc2cncc(Br)c2[nH]1)Nc1cccc(F)c1 ZINC000587163649 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc([C@H]3C[C@H]3c3cccc(F)c3)[nH]c12 ZINC000587163657 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc([C@H]3C[C@@H]3c3cccc(F)c3)[nH]c12 ZINC000587163658 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc([C@@H]3C[C@H]3c3cccc(F)c3)[nH]c12 ZINC000587163659 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc([C@@H]3C[C@@H]3c3cccc(F)c3)[nH]c12 ZINC000587163660 FG Annotated Anodyne COC(=O)c1ccc2nc(CCC(=O)c3ccc(F)cc3)[nH]c2c1OC ZINC000587163671 FG Annotated Anodyne O=C1CC=C(c2nc3cncc(Cl)c3[nH]2)NN1Cc1ccc(F)cc1 ZINC000587163725 FG Annotated Anodyne N=c1nc(O)c2nc(/C(=C/c3ccc(F)cc3)c3cccs3)[nH]c2[nH]1 ZINC000587163873 FG Annotated Anodyne N=c1nc(O)c2nc(/C(=C\c3ccc(F)cc3)c3cccs3)[nH]c2[nH]1 ZINC000587163874 FG Annotated Anodyne O=C1CC=C(c2nc3ccnc(Cl)c3[nH]2)NN1Cc1ccc(F)cc1 ZINC000587163934 FG Annotated Anodyne O=C1CC=C(c2nc3cc(Cl)cnc3[nH]2)NN1Cc1ccc(F)cc1 ZINC000587163972 FG Annotated Anodyne O=C(CCc1nc2cnc(C(F)(F)F)[nH]c-2n1)Nc1cccc(F)c1 ZINC000587163999 FG Annotated Anodyne N#Cc1nc2nc(-c3ccccc3C(=O)c3ccc(F)cc3)[nH]c2nc1C#N ZINC000587164083 FG Annotated Mild Cc1cc(F)c2[nH]c(C3=CCC(=O)N(Cc4ccc(F)cc4)N3)nc2c1 ZINC000587164121 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(CCC(=O)Nc3cccc(F)c3)[nH]c2c1 ZINC000587164152 FG Annotated Anodyne O=C1CC=C(c2nc3cc(F)c(F)cc3[nH]2)NN1Cc1ccc(F)cc1 ZINC000587164367 FG Annotated Anodyne COC(=O)c1ccc2nc([C@H](c3ccc(F)cc3)N(C)C)[nH]c2c1OC ZINC000587164399 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@H](c3ccc(F)cc3)N(C)C)[nH]c2c1OC ZINC000587164400 FG Annotated Anodyne O=C1CC=C(c2nc3cc(Cl)ncc3[nH]2)NN1Cc1ccc(F)cc1 ZINC000587164418 FG Annotated Anodyne CN(C)CCOc1ccc2nc([C@H](c3ccc(F)cc3)N(C)C)[nH]c2c1 ZINC000587164512 FG Annotated Anodyne CN(C)CCOc1ccc2nc([C@@H](c3ccc(F)cc3)N(C)C)[nH]c2c1 ZINC000587164516 FG Annotated Anodyne O=C1CC=C(c2nc3cc(F)cc(F)c3[nH]2)NN1Cc1ccc(F)cc1 ZINC000587164557 FG Annotated Anodyne COc1cc2nc(C3=CCC(=O)N(Cc4ccc(F)cc4)N3)[nH]c2cc1F ZINC000587164587 FG Annotated Anodyne Cc1c(F)ccc2nc(C3=CCC(=O)N(Cc4ccc(F)cc4)N3)[nH]c12 ZINC000587164633 FG Annotated Anodyne Cc1cnc(Cl)c2[nH]c(C3=CCC(=O)N(Cc4ccc(F)cc4)N3)nc12 ZINC000587164675 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc([C@H](c3ccc(F)cc3)N(C)C)[nH]c2c1 ZINC000587164687 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc([C@@H](c3ccc(F)cc3)N(C)C)[nH]c2c1 ZINC000587164691 FG Annotated Anodyne O=C1CC=C(c2nc3c(Cl)ccnc3[nH]2)NN1Cc1ccc(F)cc1 ZINC000587164748 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc(Cn3cc(-c4ccc(F)cc4)cn3)[nH]c2c1 ZINC000587164787 FG Annotated Anodyne Fc1ccc(-c2cnn(Cc3nc4nc(Br)c[nH]c-4n3)c2)cc1 ZINC000587164810 FG Annotated Anodyne N[C@H](N=O)c1ccc2nc(Cn3cc(-c4ccc(F)cc4)cn3)[nH]c2c1 ZINC000587164997 FG Annotated Anodyne N[C@@H](N=O)c1ccc2nc(Cn3cc(-c4ccc(F)cc4)cn3)[nH]c2c1 ZINC000587164998 FG Annotated Anodyne O=C(O)c1cc2nc(Cn3cc(-c4ccc(F)cc4)cn3)[nH]c2cc1F ZINC000587164999 FG Annotated Anodyne O=C1CCc2cc3nc(Cn4cc(-c5ccc(F)cc5)cn4)[nH]c3cc2N1 ZINC000587165156 FG Annotated Anodyne COC(=O)c1ccc2nc(Cn3cc(-c4ccc(F)cc4)cn3)[nH]c2c1 ZINC000587165163 FG Annotated Anodyne COC(=O)c1cccc2nc(Cn3cc(-c4ccc(F)cc4)cn3)[nH]c12 ZINC000587165260 FG Annotated Anodyne Fc1ccc(-c2cnn(Cc3nc4cnc(C(F)(F)F)[nH]c-4n3)c2)cc1 ZINC000587165354 FG Annotated Anodyne Fc1ccc(-c2cnn(Cc3nc4cc5c(cc4[nH]3)OCCO5)c2)cc1 ZINC000587165377 FG Annotated Anodyne O=C(O)c1cc(F)cc2nc(Cn3cc(-c4ccc(F)cc4)cn3)[nH]c12 ZINC000587165507 FG Annotated Anodyne Cc1c(-c2nc3[nH]c(=N)[nH]c(Cl)c-3n2)cc(-c2ccc(F)cc2)n1C ZINC000587165677 FG Annotated Anodyne Fc1ccc(-c2cn3c(Cc4nc5cnncc5[nH]4)csc3n2)cc1 ZINC000587165743 FG Annotated Anodyne Oc1nncc2nc(Cc3csc4nc(-c5ccc(F)cc5)cn34)[nH]c12 ZINC000587165752 FG Annotated Anodyne N=c1cc2nc(Cc3csc4nc(-c5ccc(F)cc5)cn34)[nH]c2c[nH]1 ZINC000587165971 FG Annotated Anodyne Fc1ccc(-c2cn3c(Cc4nc5ncc[nH]c-5n4)csc3n2)cc1 ZINC000587166045 FG Annotated Anodyne Cc1c(-c2nc3c(O)nc(S)nc3[nH]2)cc(-c2ccc(F)cc2)n1C ZINC000587166438 FG Annotated Anodyne Fc1ccc(-c2cn3c(Cc4nc5cncnc5[nH]4)csc3n2)cc1 ZINC000587166487 FG Annotated Anodyne N=c1[nH]ccc2nc(Cc3csc4nc(-c5ccc(F)cc5)cn34)[nH]c12 ZINC000587166595 FG Annotated Anodyne Cc1c(-c2nc3nc(C#N)c(C#N)nc3[nH]2)cc(-c2ccc(F)cc2)n1C ZINC000587166623 FG Annotated Mild Oc1ncnc2[nH]c(Cc3csc4nc(-c5ccc(F)cc5)cn34)nc12 ZINC000587166652 FG Annotated Anodyne Nc1ncnc2[nH]c(Cc3csc4nc(-c5ccc(F)cc5)cn34)nc12 ZINC000587166665 FG Annotated Anodyne O=C(/C=C/c1nc2cnc(C(F)(F)F)[nH]c-2n1)Nc1ccc(F)cc1 ZINC000587166765 FG Annotated Anodyne O=C(/C=C\c1nc2cnc(C(F)(F)F)[nH]c-2n1)Nc1ccc(F)cc1 ZINC000587166766 FG Annotated Anodyne O=C(/C=C/c1nc2cc3c(cc2[nH]1)NC(=O)CC3)Nc1ccc(F)cc1 ZINC000587167001 FG Annotated Anodyne O=C(/C=C\c1nc2cc3c(cc2[nH]1)NC(=O)CC3)Nc1ccc(F)cc1 ZINC000587167002 FG Annotated Anodyne O=C(Nc1ccc(F)cc1)N1CCC[C@@H]1c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000587167256 FG Annotated Bother O=C(Nc1ccc(F)cc1)N1CCC[C@H]1c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000587167257 FG Annotated Bother O=C(Nc1ccc(F)cc1)N1CCC[C@@H]1c1nc2cnc(Cl)[nH]c-2n1 ZINC000587167290 FG Annotated Anodyne O=C(Nc1ccc(F)cc1)N1CCC[C@H]1c1nc2cnc(Cl)[nH]c-2n1 ZINC000587167291 FG Annotated Anodyne O=[N+]([O-])c1cncc2nc(-c3nnn(-c4ccc(F)cc4)c3C3CC3)[nH]c12 ZINC000587167611 FG Annotated Bother COc1ccc2nc(-c3nnn(-c4ccc(F)cc4)c3C3CC3)[nH]c2n1 ZINC000587167630 FG Annotated Anodyne Fc1ccc(-n2nnc(-c3nc4cnc(Cl)[nH]c-4n3)c2C2CC2)cc1 ZINC000587167693 FG Annotated Anodyne COc1cncc2nc(-c3nnn(-c4ccc(F)cc4)c3C3CC3)[nH]c12 ZINC000587167718 FG Annotated Anodyne COC(=O)c1cc2[nH]c(/C=C/C(=O)Nc3ccc(F)cc3)nc2cc1OC ZINC000587167823 FG Annotated Anodyne COC(=O)c1cc2[nH]c(/C=C\C(=O)Nc3ccc(F)cc3)nc2cc1OC ZINC000587167824 FG Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc(COc3ccc(F)cc3)nc-2[nH]1 ZINC000587167867 FG Annotated Anodyne Fc1ccc(-n2nnc(-c3nc4c(Cl)ncnc4[nH]3)c2C2CC2)cc1 ZINC000587168350 FG Annotated Anodyne Fc1ccc(-n2nnc(-c3nc4nc(Cl)c[nH]c-4n3)c2C2CC2)cc1 ZINC000587168370 FG Annotated Anodyne O=C(Nc1ccc(F)cc1)N1CCC[C@@H]1c1nc2nc(Cl)c[nH]c-2n1 ZINC000587168500 FG Annotated Anodyne O=C(Nc1ccc(F)cc1)N1CCC[C@H]1c1nc2nc(Cl)c[nH]c-2n1 ZINC000587168501 FG Annotated Anodyne O=[N+]([O-])c1cnc2[nH]c(-c3nnn(-c4ccc(F)cc4)c3C3CC3)nc2c1 ZINC000587168681 FG Annotated Bother COc1nccc2nc(-c3nnn(-c4ccc(F)cc4)c3C3CC3)[nH]c12 ZINC000587168729 FG Annotated Anodyne COc1cc2nc(-c3nnn(-c4ccc(F)cc4)c3C3CC3)[nH]c2cn1 ZINC000587168859 FG Annotated Anodyne Fc1ccc(OCc2nc3cc(I)cnc3[nH]2)cc1 ZINC000587168940 FG Annotated Anodyne C[C@@H](Oc1ccc(F)cc1)c1nc2cccc(S(=O)(=O)N(C)C)c2[nH]1 ZINC000587168981 FG Annotated Anodyne C[C@H](Oc1ccc(F)cc1)c1nc2cccc(S(=O)(=O)N(C)C)c2[nH]1 ZINC000587168982 FG Annotated Anodyne OCCc1ccc2nc(-c3nnn(-c4ccc(F)cc4)c3C3CC3)[nH]c2c1 ZINC000587169206 FG Annotated Anodyne Cc1cc(Cl)cc2nc(CN(C)S(=O)(=O)c3ccc(F)cc3)[nH]c12 ZINC000587169350 FG Annotated Anodyne CN(Cc1nc2cccc(Cl)c2[nH]1)S(=O)(=O)c1ccc(F)cc1 ZINC000587169389 FG Annotated Anodyne CN(Cc1nc2ccc3ncccc3c2[nH]1)S(=O)(=O)c1ccc(F)cc1 ZINC000587169682 FG Annotated Anodyne CN(Cc1nc2cc(Cl)c(F)cc2[nH]1)S(=O)(=O)c1ccc(F)cc1 ZINC000587169732 FG Annotated Anodyne CC1=C(c2ccc3nc(COc4ccc(F)cc4)[nH]c3c2)NNC(=O)C1 ZINC000587169763 FG Annotated Anodyne C=CCc1cccc2nc(CN(C)S(=O)(=O)c3ccc(F)cc3)[nH]c12 ZINC000587169776 FG Annotated Mild CN(Cc1nc2cc(Cl)cc(F)c2[nH]1)S(=O)(=O)c1ccc(F)cc1 ZINC000587169932 FG Annotated Anodyne Cc1c(Cl)ccc2nc(CN(C)S(=O)(=O)c3ccc(F)cc3)[nH]c12 ZINC000587170261 FG Annotated Anodyne CN(Cc1nc2ccc3c(c2[nH]1)CCCC3)S(=O)(=O)c1ccc(F)cc1 ZINC000587170373 FG Annotated Anodyne Fc1cc2c(c(Cc3nc4c(Br)ccnc4[nH]3)c1)OCOC2 ZINC000587170547 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(Cc3cc(F)cc4c3OCOC4)[nH]c2c1 ZINC000587170579 FG Annotated Anodyne Fc1cc2c(c(Cc3nc4cc5c(cc4[nH]3)OC(F)(F)O5)c1)OCOC2 ZINC000587170829 FG Annotated Anodyne Cc1cc2nc(CN(C)S(=O)(=O)c3ccc(F)cc3)[nH]c2cc1Cl ZINC000587170954 FG Annotated Anodyne Fc1cc2c(c(Cc3nc4ccnc(Br)c4[nH]3)c1)OCOC2 ZINC000587171064 FG Annotated Anodyne Fc1cc2c(c(Cc3nc4cc(Br)cnc4[nH]3)c1)OCOC2 ZINC000587171247 FG Annotated Anodyne C[C@@H](CSc1ccc(F)cc1)c1nc2cccc(S(N)(=O)=O)c2[nH]1 ZINC000587171299 FG Annotated Anodyne C[C@H](CSc1ccc(F)cc1)c1nc2cccc(S(N)(=O)=O)c2[nH]1 ZINC000587171300 FG Annotated Anodyne Fc1cc2c(c(Cc3nc4cncc(Br)c4[nH]3)c1)OCOC2 ZINC000587171323 FG Annotated Anodyne CN(Cc1nc2cnc3ccccc3c2[nH]1)S(=O)(=O)c1ccc(F)cc1 ZINC000587171413 FG Annotated Anodyne Fc1cc2c(c(Cc3nc4cc(Br)ncc4[nH]3)c1)OCOC2 ZINC000587171568 FG Annotated Anodyne CCOC(=O)c1ccc2nc(Cc3cc(F)cc4c3OCOC4)[nH]c2c1 ZINC000587171577 FG Annotated Anodyne Fc1cc2c(c(Cc3nc4cc5c(cc4[nH]3)OCCCO5)c1)OCOC2 ZINC000587171583 FG Annotated Anodyne O=C1CCc2cc3nc(Cc4cc(F)cc5c4OCOC5)[nH]c3cc2N1 ZINC000587171597 FG Annotated Anodyne Fc1cc2c(c(Cc3nc4cc(-n5cccn5)c(F)cc4[nH]3)c1)OCOC2 ZINC000587171911 FG Annotated Anodyne C[C@@]1(c2nc3cc(Cl)nc(C#N)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587171988 FG Annotated Mild C[C@]1(c2nc3cc(Cl)nc(C#N)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587171989 FG Annotated Mild Fc1cc2c(c(Cc3nc4ccc(Br)nc4[nH]3)c1)OCOC2 ZINC000587172118 FG Annotated Anodyne CN(C)CCOc1ccc2nc(Cc3cc(F)cc4c3OCOC4)[nH]c2c1 ZINC000587172145 FG Annotated Anodyne O=c1c(-c2nc3ccnc(O)c3[nH]2)cn(C2CC2)c2cc(F)c(F)cc12 ZINC000587172931 FG Annotated Anodyne Nc1cc2nc(-c3cn(C4CC4)c4cc(F)c(F)cc4c3=O)[nH]c2cc1N ZINC000587173219 FG Annotated Anodyne Nc1ccnc2[nH]c(-c3cn(C4CC4)c4cc(F)c(F)cc4c3=O)nc12 ZINC000587173436 FG Annotated Anodyne C[C@@]1(c2nc3cc4c(cc3[nH]2)OCCCO4)Cc2ccc(F)cc2C(=O)O1 ZINC000587173522 FG Annotated Anodyne C[C@]1(c2nc3cc4c(cc3[nH]2)OCCCO4)Cc2ccc(F)cc2C(=O)O1 ZINC000587173523 FG Annotated Anodyne C[C@@]1(c2nc3cc4c(cc3[nH]2)OCCO4)Cc2ccc(F)cc2C(=O)O1 ZINC000587173933 FG Annotated Anodyne C[C@]1(c2nc3cc4c(cc3[nH]2)OCCO4)Cc2ccc(F)cc2C(=O)O1 ZINC000587173937 FG Annotated Anodyne C[C@@]1(c2nc3cc4c(cc3[nH]2)NC(=O)CC4)Cc2ccc(F)cc2C(=O)O1 ZINC000587174141 FG Annotated Anodyne C[C@]1(c2nc3cc4c(cc3[nH]2)NC(=O)CC4)Cc2ccc(F)cc2C(=O)O1 ZINC000587174143 FG Annotated Anodyne COc1cc2nc([C@]3(C)Cc4ccc(F)cc4C(=O)O3)[nH]c2cc1OC ZINC000587174344 FG Annotated Anodyne COc1cc2nc([C@@]3(C)Cc4ccc(F)cc4C(=O)O3)[nH]c2cc1OC ZINC000587174349 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc([C@]3(C)Cc4ccc(F)cc4C(=O)O3)[nH]c2c1 ZINC000587174405 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc([C@@]3(C)Cc4ccc(F)cc4C(=O)O3)[nH]c2c1 ZINC000587174406 FG Annotated Anodyne Fc1ccc2c(c1)C[C@@H](c1nc3ccc(CN4CCOCC4)cc3[nH]1)O2 ZINC000587174517 FG Annotated Anodyne Fc1ccc2c(c1)C[C@H](c1nc3ccc(CN4CCOCC4)cc3[nH]1)O2 ZINC000587174518 FG Annotated Anodyne NS(=O)(=O)c1cccc2nc(-c3[nH]c4ccc(F)cc4c3Cl)[nH]c12 ZINC000587174809 FG Annotated Anodyne C[C@]1(c2nc3ccc([C@H](N)N=O)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175022 FG Annotated Anodyne C[C@]1(c2nc3ccc([C@@H](N)N=O)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175023 FG Annotated Anodyne C[C@@]1(c2nc3ccc([C@H](N)N=O)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175024 FG Annotated Anodyne C[C@@]1(c2nc3ccc([C@@H](N)N=O)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175025 FG Annotated Anodyne C[C@]1(c2nc3cc(F)cc(C(=O)O)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175051 FG Annotated Anodyne C[C@@]1(c2nc3cc(F)cc(C(=O)O)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175067 FG Annotated Anodyne COc1ncc(F)cc1-c1nc2c([N+](=O)[O-])c(Br)ccc2[nH]1 ZINC000587175162 FG Annotated Bother Fc1cncc(Cl)c1Cc1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587175275 FG Annotated Anodyne CC1=C(c2ccc3nc([C@@H]4Cc5cc(F)ccc5O4)[nH]c3c2)NNC(=O)C1 ZINC000587175305 FG Annotated Anodyne CC1=C(c2ccc3nc([C@H]4Cc5cc(F)ccc5O4)[nH]c3c2)NNC(=O)C1 ZINC000587175306 FG Annotated Anodyne C[C@@]1(c2nc3cnc(C(F)(F)F)[nH]c-3n2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175318 FG Annotated Anodyne C[C@]1(c2nc3cnc(C(F)(F)F)[nH]c-3n2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175319 FG Annotated Anodyne C[C@]1(c2nc3cc(C(=O)O)c(F)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175325 FG Annotated Anodyne C[C@@]1(c2nc3cc(C(=O)O)c(F)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175326 FG Annotated Anodyne COc1cc(OC)c2[nH]c([C@]3(C)Cc4ccc(F)cc4C(=O)O3)nc2c1 ZINC000587175353 FG Annotated Anodyne COc1cc(OC)c2[nH]c([C@@]3(C)Cc4ccc(F)cc4C(=O)O3)nc2c1 ZINC000587175354 FG Annotated Anodyne C[C@@]1(c2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175564 FG Annotated Bother C[C@]1(c2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175578 FG Annotated Bother COC(=O)c1cccc2nc([C@]3(C)Cc4ccc(F)cc4C(=O)O3)[nH]c12 ZINC000587175580 FG Annotated Anodyne COC(=O)c1cccc2nc([C@@]3(C)Cc4ccc(F)cc4C(=O)O3)[nH]c12 ZINC000587175581 FG Annotated Anodyne Fc1ccc2[nH]c(-c3nc4ccc(-n5cnnn5)cc4[nH]3)c(Cl)c2c1 ZINC000587175711 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3cnc4c(F)cccc4c3N)[nH]c2c1OC ZINC000587175856 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(-c3coc4cc(F)ccc34)[nH]c12 ZINC000587175963 FG Annotated Anodyne COc1ncc(F)cc1-c1nc2c(C(=O)O)cc(Br)cc2[nH]1 ZINC000587176099 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(Cc3c(F)cncc3Cl)[nH]c2cc1[N+](=O)[O-] ZINC000587176146 FG Annotated Bother CN(C)CCOc1ccc2nc(-c3cnc4c(F)cccc4c3N)[nH]c2c1 ZINC000587176193 FG Annotated Anodyne COc1ncc(F)cc1-c1nc2c(I)cccc2[nH]1 ZINC000587176393 FG Annotated Anodyne CC1=C(c2ccc3nc(Cc4c(F)cncc4Cl)[nH]c3c2)NNC(=O)C1 ZINC000587176415 FG Annotated Anodyne COc1ncc(F)cc1-c1nc2c([N+](=O)[O-])cc(Br)cc2[nH]1 ZINC000587176421 FG Annotated Bother COc1ncc(F)cc1-c1nc2cc(I)ccc2[nH]1 ZINC000587176437 FG Annotated Anodyne Nc1c(-c2nc3nc(Br)c[nH]c-3n2)cnc2c(F)cccc12 ZINC000587176447 FG Annotated Anodyne Nc1c(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)cnc2c(F)cccc12 ZINC000587176470 FG Annotated Bother COC(=O)c1cc2[nH]c(-c3cnc4c(F)cccc4c3N)nc2cc1OC ZINC000587177026 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(-c3cncc(F)c3)nc2c1 ZINC000587177055 FG Annotated Anodyne Fc1cncc(-c2nc3c(I)cnc(Cl)c3[nH]2)c1 ZINC000587177059 FG Annotated Anodyne Fc1cc(-c2nc3cnc(C(F)(F)F)[nH]c-3n2)cc(N2CCCC2)n1 ZINC000587177204 FG Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3cc(F)nc(N4CCCC4)c3)[nH]c2cc1[N+](=O)[O-] ZINC000587177210 FG Annotated Bother COC(=O)c1ccc2nc(-c3cc(F)nc(N4CCCC4)c3)[nH]c2c1OC ZINC000587177214 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3cc(F)nc(N4CCCC4)c3)[nH]c2c1 ZINC000587177225 FG Annotated Anodyne O=C1CCc2cc3nc(-c4cc(F)nc(N5CCCC5)c4)[nH]c3cc2N1 ZINC000587177236 FG Annotated Anodyne CC1=C(c2ccc3[nH]c(-c4n[nH]c5c(F)cccc45)nc3c2)NNC(=O)C1 ZINC000587177391 FG Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc(-c3ccc(Cl)nc3F)nc-2[nH]1 ZINC000587177561 FG Annotated Anodyne CN(C)CCOc1ccc2nc(-c3cc(F)nc(N4CCCC4)c3)[nH]c2c1 ZINC000587177608 FG Annotated Anodyne COC(=O)c1cc2[nH]c(-c3cc(F)nc(N4CCCC4)c3)nc2cc1OC ZINC000587177665 FG Annotated Anodyne Fc1nc(Cl)ccc1-c1nc2cc(I)cnc2[nH]1 ZINC000587177755 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc(-c3cc(F)nc(N4CCCC4)c3)[nH]c2c1 ZINC000587177782 FG Annotated Anodyne CC1=C(c2ccc3nc(-c4ccc(Cl)nc4F)[nH]c3c2)NNC(=O)C1 ZINC000587177807 FG Annotated Anodyne O=C1CCc2cc3nc(-c4cc(Br)cnc4F)[nH]c3cc2N1 ZINC000587177839 FG Annotated Anodyne Fc1ncc(Br)cc1-c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000587177932 FG Annotated Anodyne N#Cc1nc(Cl)cc2nc(-c3cc(S(=O)(=O)F)ccc3Cl)[nH]c12 ZINC000587177935 FG Annotated Unstable Fc1ncc(Br)cc1-c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000587177941 FG Annotated Anodyne Fc1ncc(Br)cc1-c1nc2nc(Br)c[nH]c-2n1 ZINC000587177947 FG Annotated Anodyne COC(=O)c1cccc2nc(-c3cc(Br)cnc3F)[nH]c12 ZINC000587177956 FG Annotated Anodyne N#Cc1nc(Cl)cc2nc(-c3cc(Br)cnc3F)[nH]c12 ZINC000587177965 FG Annotated Mild COC(=O)c1ccc2nc(-c3cc(Br)cnc3F)[nH]c2c1 ZINC000587177972 FG Annotated Anodyne N[C@H](N=O)c1ccc2nc(-c3cc(Br)cnc3F)[nH]c2c1 ZINC000587178166 FG Annotated Anodyne N[C@@H](N=O)c1ccc2nc(-c3cc(Br)cnc3F)[nH]c2c1 ZINC000587178167 FG Annotated Anodyne O=C(O)c1cc(F)cc2nc(-c3cc(Br)cnc3F)[nH]c12 ZINC000587178174 FG Annotated Anodyne O=C(O)c1cc2nc(-c3cc(Br)cnc3F)[nH]c2cc1F ZINC000587178188 FG Annotated Anodyne O=C(O)c1cc(F)cc2nc(-c3cc(S(=O)(=O)F)ccc3Cl)[nH]c12 ZINC000587178190 FG Annotated Unstable COc1ccc(-c2nc3cnccc3[nH]2)c(I)c1 ZINC000587179529 FG Annotated Anodyne COc1ccc(-c2nc3cccnc3[nH]2)c(I)c1 ZINC000587180621 FG Annotated Anodyne O=S(=O)(F)c1ccc(Cl)c(-c2nc3cc4cn[nH]c4cc3[nH]2)c1 ZINC000587180776 FG Annotated Unstable O=C(O)c1cccc2nc(-c3cc(S(=O)(=O)F)ccc3Cl)[nH]c12 ZINC000587180780 FG Annotated Unstable CC[C@@H](C)n1ncc(I)c1-c1nc2ncccc2[nH]1 ZINC000587181060 FG Annotated Anodyne CC[C@H](C)n1ncc(I)c1-c1nc2ncccc2[nH]1 ZINC000587181061 FG Annotated Anodyne O=[N+]([O-])c1cccc2nc(-c3cc(S(=O)(=O)F)ccc3Cl)[nH]c12 ZINC000587181250 FG Annotated Unstable CC[C@@H](C)n1ncc(I)c1-c1nc2ccncc2[nH]1 ZINC000587181474 FG Annotated Anodyne CC[C@H](C)n1ncc(I)c1-c1nc2ccncc2[nH]1 ZINC000587181475 FG Annotated Anodyne Cc1c(I)cnn1[C@H](C)c1nc2ccc(F)cc2[nH]1 ZINC000587181927 FG Annotated Anodyne Cc1c(I)cnn1[C@@H](C)c1nc2ccc(F)cc2[nH]1 ZINC000587181928 FG Annotated Anodyne Cc1c(I)cnn1[C@H](C)c1nc2ccccc2[nH]1 ZINC000587181960 FG Annotated Anodyne Cc1c(I)cnn1[C@@H](C)c1nc2ccccc2[nH]1 ZINC000587181962 FG Annotated Anodyne Oc1nccc2nc(-c3cc(I)ccc3F)[nH]c12 ZINC000587182081 FG Annotated Anodyne Fc1ccc(I)cc1-c1nc2c(Cl)ncnc2[nH]1 ZINC000587182237 FG Annotated Anodyne COc1nccc2nc(-c3cc(I)ccc3F)[nH]c12 ZINC000587182317 FG Annotated Anodyne N=c1[nH]ccc2nc(-c3cc(I)ccc3Cl)[nH]c12 ZINC000587182321 FG Annotated Anodyne Fc1ccc(I)cc1-c1nc2nc(Cl)c[nH]c-2n1 ZINC000587182394 FG Annotated Anodyne Clc1ccc(I)cc1-c1nc2ncc[nH]c-2n1 ZINC000587182397 FG Annotated Anodyne Nc1ccnc2[nH]c(-c3cc(I)ccc3Cl)nc12 ZINC000587182615 FG Annotated Anodyne Clc1ccc(I)cc1-c1nc2cncnc2[nH]1 ZINC000587182677 FG Annotated Anodyne Fc1ccc(I)cc1-c1nc2cnc(Cl)[nH]c-2n1 ZINC000587182702 FG Annotated Anodyne COc1cncc2nc(-c3cc(I)ccc3F)[nH]c12 ZINC000587182836 FG Annotated Anodyne Nc1cc2nc(-c3cc(I)ccc3F)[nH]c2cc1N ZINC000587182856 FG Annotated Anodyne N=c1cc2nc(-c3cc(I)ccc3Cl)[nH]c2c[nH]1 ZINC000587182899 FG Annotated Anodyne COc1ccc2nc(-c3cc(I)ccc3F)[nH]c2n1 ZINC000587182931 FG Annotated Anodyne COc1cc2nc(-c3cc(I)ccc3F)[nH]c2cn1 ZINC000587182992 FG Annotated Anodyne N=c1cc2nc(-c3cc(Cl)cc(I)c3)[nH]c2c[nH]1 ZINC000587183020 FG Annotated Anodyne Oc1nccc2nc(/C=C\c3cccc(I)c3)[nH]c12 ZINC000587183139 FG Annotated Anodyne Oc1nccc2nc(/C=C/c3cccc(I)c3)[nH]c12 ZINC000587183141 FG Annotated Anodyne Clc1ccc(I)cc1-c1nc2cnncc2[nH]1 ZINC000587183305 FG Annotated Anodyne Clc1cc(I)cc(-c2nc3cnncc3[nH]2)c1 ZINC000587183309 FG Annotated Anodyne Cc1c(I)cnn1[C@H](C)c1nc2cccc(F)c2[nH]1 ZINC000587183322 FG Annotated Anodyne Cc1c(I)cnn1[C@@H](C)c1nc2cccc(F)c2[nH]1 ZINC000587183325 FG Annotated Anodyne Clc1cc(I)cc(-c2nc3cncnc3[nH]2)c1 ZINC000587183555 FG Annotated Anodyne N=c1[nH]ccc2nc(-c3cc(Cl)cc(I)c3)[nH]c12 ZINC000587183857 FG Annotated Anodyne N=c1cc2nc(/C=C\c3cccc(I)c3)[nH]c2c[nH]1 ZINC000587184008 FG Annotated Anodyne N=c1cc2nc(/C=C/c3cccc(I)c3)[nH]c2c[nH]1 ZINC000587184009 FG Annotated Anodyne Fc1cnc(Cl)c2[nH]c(-c3cncc(I)c3)nc12 ZINC000587184029 FG Annotated Anodyne Clc1cncc2nc(-c3cncc(I)c3)[nH]c12 ZINC000587184051 FG Annotated Anodyne N=c1[nH]ccc2nc(/C=C\c3cccc(I)c3)[nH]c12 ZINC000587184114 FG Annotated Anodyne N=c1[nH]ccc2nc(/C=C/c3cccc(I)c3)[nH]c12 ZINC000587184115 FG Annotated Anodyne Nc1ccnc2[nH]c(-c3cc(Cl)cc(I)c3)nc12 ZINC000587184140 FG Annotated Anodyne Clc1cc(I)cc(-c2nc3ncc[nH]c-3n2)c1 ZINC000587184205 FG Annotated Anodyne O=[N+]([O-])c1cccc2nc(-c3cncc(I)c3)[nH]c12 ZINC000587184224 FG Annotated Bother CC[C@H](c1nc2cccnc2[nH]1)n1cc(I)c(C)n1 ZINC000587184244 FG Annotated Anodyne CC[C@@H](c1nc2cccnc2[nH]1)n1cc(I)c(C)n1 ZINC000587184245 FG Annotated Anodyne Clc1ccc2nc(-c3cncc(I)c3)[nH]c2n1 ZINC000587184268 FG Annotated Anodyne Clc1cnc2[nH]c(-c3cncc(I)c3)nc2c1 ZINC000587184947 FG Annotated Anodyne COc1cccc2nc(-c3cncc(I)c3)[nH]c12 ZINC000587185164 FG Annotated Anodyne Nc1ccnc2[nH]c(/C=C\c3cccc(I)c3)nc12 ZINC000587185180 FG Annotated Anodyne Nc1ccnc2[nH]c(/C=C/c3cccc(I)c3)nc12 ZINC000587185181 FG Annotated Anodyne Clc1nccc2nc(-c3cncc(I)c3)[nH]c12 ZINC000587185293 FG Annotated Anodyne Cc1cc2[nH]c(-c3cncc(I)c3)nc2c(C)n1 ZINC000587185310 FG Annotated Anodyne CC[C@H](c1nc2cnccc2[nH]1)n1cc(I)c(C)n1 ZINC000587185351 FG Annotated Anodyne CC[C@@H](c1nc2cnccc2[nH]1)n1cc(I)c(C)n1 ZINC000587185353 FG Annotated Anodyne Clc1ccnc2[nH]c(-c3cncc(I)c3)nc12 ZINC000587185393 FG Annotated Anodyne N[C@H](Cc1ccc(I)cc1)c1nc2ccccc2[nH]1 ZINC000587185419 FG Annotated Anodyne N[C@@H](Cc1ccc(I)cc1)c1nc2ccccc2[nH]1 ZINC000587185427 FG Annotated Anodyne Clc1cc2nc(-c3cncc(I)c3)[nH]c2cn1 ZINC000587185785 FG Annotated Anodyne Ic1cncc(-c2nc3cc4cn[nH]c4cc3[nH]2)c1 ZINC000587186027 FG Annotated Anodyne COc1cc2nc(-c3cncc(I)c3)[nH]c2cc1F ZINC000587186037 FG Annotated Anodyne Fc1cc2[nH]c(-c3nccnc3I)nc2cc1Cl ZINC000587186066 FG Annotated Anodyne Cc1cc(C)c2[nH]c(-c3nccnc3I)nc2c1 ZINC000587186400 FG Annotated Anodyne Clc1cccc2nc(-c3nccnc3I)[nH]c12 ZINC000587186641 FG Annotated Anodyne Cc1cc(F)c2[nH]c(-c3nccnc3I)nc2c1 ZINC000587186646 FG Annotated Anodyne Cc1cc2nc(-c3nccnc3I)[nH]c2cc1F ZINC000587186649 FG Annotated Anodyne Ic1nccnc1-c1nc2cnc3ccccc3c2[nH]1 ZINC000587186660 FG Annotated Anodyne Clc1ccc2nc(-c3nccnc3I)[nH]c2c1 ZINC000587186679 FG Annotated Anodyne C=CCc1cccc2nc(-c3nccnc3I)[nH]c12 ZINC000587186680 FG Annotated Mild Cc1ccc2nc(-c3nccnc3I)[nH]c2c1C ZINC000587186683 FG Annotated Anodyne Cc1cc2nc(-c3nccnc3I)[nH]c2cc1C ZINC000587186786 FG Annotated Anodyne Cc1c(F)ccc2nc(-c3nccnc3I)[nH]c12 ZINC000587186806 FG Annotated Anodyne Ic1nccnc1-c1nc2ccc3ncccc3c2[nH]1 ZINC000587186854 FG Annotated Anodyne Cc1ccc(C)c2[nH]c(-c3nccnc3I)nc12 ZINC000587186888 FG Annotated Anodyne Fc1cc(Cl)cc2nc(-c3nccnc3I)[nH]c12 ZINC000587186907 FG Annotated Anodyne CCc1ccc2nc(-c3nccnc3I)[nH]c2c1 ZINC000587186911 FG Annotated Anodyne N#Cc1cc(-c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)ccc1O ZINC000587187162 FG Annotated Mild Cc1ccc(-c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)cc1C#N ZINC000587187219 FG Annotated Mild C[C@H](C#N)c1cccc(-c2nc3cccc(S(=O)(=O)N(C)C)c3[nH]2)c1 ZINC000587187467 FG Annotated Mild C[C@@H](C#N)c1cccc(-c2nc3cccc(S(=O)(=O)N(C)C)c3[nH]2)c1 ZINC000587187468 FG Annotated Mild Cc1ccc(/C=C(/C#N)c2nc3cccc(S(=O)(=O)N(C)C)c3[nH]2)cc1 ZINC000587187919 FG Annotated Reactive Cc1ccc(/C=C(\C#N)c2nc3cccc(S(=O)(=O)N(C)C)c3[nH]2)cc1 ZINC000587187921 FG Annotated Reactive Cc1ccc(-c2nc3cc(I)cnc3[nH]2)cc1C#N ZINC000587187963 FG Annotated Mild Cc1ccc(/C=C(/C#N)c2nc3ccc(S(=O)(=O)N(C)C)cc3[nH]2)cc1 ZINC000587188135 FG Annotated Reactive Cc1ccc(/C=C(\C#N)c2nc3ccc(S(=O)(=O)N(C)C)cc3[nH]2)cc1 ZINC000587188139 FG Annotated Reactive CC1=C(c2ccc3nc(/C(C#N)=C/c4ccccc4)[nH]c3c2)NNC(=O)C1 ZINC000587188340 FG Annotated Reactive CC1=C(c2ccc3nc(/C(C#N)=C\c4ccccc4)[nH]c3c2)NNC(=O)C1 ZINC000587188341 FG Annotated Reactive N#Cc1cc(-c2nc3cccc(I)c3[nH]2)ccc1O ZINC000587188513 FG Annotated Mild N#Cc1cc(-c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)ccc1O ZINC000587188650 FG Annotated Mild COC(=O)c1cc(Br)c2[nH]c(-c3cc(O)cc(C#N)c3)nc2c1 ZINC000587189314 FG Annotated Mild N#Cc1cc(O)cc(-c2nc3cccc(I)c3[nH]2)c1 ZINC000587189426 FG Annotated Mild CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2c(O)ncnc2[nH]1 ZINC000587189725 FG Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2c(O)ncnc2[nH]1 ZINC000587189726 FG Annotated Anodyne N#Cc1ccc(OCc2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)cc1 ZINC000587189797 FG Annotated Mild Oc1nc(NCc2ccccc2)c2nc(C=NOCc3ccccc3)nc-2[nH]1 ZINC000587189809 FG Annotated Mild CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2cnnc(O)c2[nH]1 ZINC000587190119 FG Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2cnnc(O)c2[nH]1 ZINC000587190120 FG Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2cc(=N)[nH]cc2[nH]1 ZINC000587190241 FG Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2cc(=N)[nH]cc2[nH]1 ZINC000587190246 FG Annotated Anodyne COC(=O)c1cc2[nH]c([C@@H](C)Oc3ccc(C#N)cc3)nc2cc1OC ZINC000587190444 FG Annotated Mild COC(=O)c1cc2[nH]c([C@H](C)Oc3ccc(C#N)cc3)nc2cc1OC ZINC000587190453 FG Annotated Mild CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2c(N)ccnc2[nH]1 ZINC000587190517 FG Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2c(N)ccnc2[nH]1 ZINC000587190522 FG Annotated Anodyne N#Cc1cc(O)cc(-c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)c1 ZINC000587190602 FG Annotated Mild C=C(CN(C)C)c1nc2cc(C(=O)OCC)cc(Br)c2[nH]1 ZINC000587190794 FG Annotated Mild N#Cc1ccc(OCc2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)cc1 ZINC000587191064 FG Annotated Mild CC1=C(c2ccc3nc([C@@H](C)Oc4ccc(C#N)cc4)[nH]c3c2)NNC(=O)C1 ZINC000587191121 FG Annotated Mild CC1=C(c2ccc3nc([C@H](C)Oc4ccc(C#N)cc4)[nH]c3c2)NNC(=O)C1 ZINC000587191124 FG Annotated Mild N#Cc1ccc(OCc2nc3cc(Br)cc(C(=O)O)c3[nH]2)cc1 ZINC000587191166 FG Annotated Mild C=C(CN(C)C)c1nc2c(Br)cnc(Br)c2[nH]1 ZINC000587191201 FG Annotated Mild O=NCc1ccc(-c2nc3ncc(I)cc3[nH]2)cc1 ZINC000587191306 FG Annotated Anodyne N#Cc1cc(O)cc(-c2nc3cc(Br)cc(C(=O)O)c3[nH]2)c1 ZINC000587191448 FG Annotated Mild CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2cc[nH]c(=N)c2[nH]1 ZINC000587191720 FG Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2cc[nH]c(=N)c2[nH]1 ZINC000587191721 FG Annotated Anodyne C[C@@H](Oc1ccc(C#N)cc1)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587191863 FG Annotated Mild C[C@H](Oc1ccc(C#N)cc1)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587191875 FG Annotated Mild N#Cc1cc(O)cc(-c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)c1 ZINC000587192217 FG Annotated Mild C[C@H](Oc1ccc(C#N)cc1)c1nc2ccc(N3CCN(C)CC3)cc2[nH]1 ZINC000587192235 FG Annotated Mild C[C@@H](Oc1ccc(C#N)cc1)c1nc2ccc(N3CCN(C)CC3)cc2[nH]1 ZINC000587192239 FG Annotated Mild COC(=O)c1ccc2nc([C@@H](C)Oc3ccc(C#N)cc3)[nH]c2c1OC ZINC000587192288 FG Annotated Mild COC(=O)c1ccc2nc([C@H](C)Oc3ccc(C#N)cc3)[nH]c2c1OC ZINC000587192289 FG Annotated Mild CN(CCO)c1ccc(-c2nc3c(Br)cc(C#N)cc3[nH]2)cc1 ZINC000587192787 FG Annotated Mild Cc1nc2nc(-c3ccc(N(C)CCO)cc3)[nH]c2cc1Br ZINC000587192860 FG Annotated Clean CN(CCO)c1ccc(-c2nc3nc(Cl)nc(C(F)(F)F)c3[nH]2)cc1 ZINC000587192879 FG Annotated Clean O=C(O)CCN(CCc1nc2c(Cl)ccnc2[nH]1)Cc1ccccc1 ZINC000587193090 FG Annotated Anodyne O=C(O)CCN(CCc1nc2ccnc(Cl)c2[nH]1)Cc1ccccc1 ZINC000587193173 FG Annotated Anodyne COc1cc2nc(CCN(CCC(=O)O)Cc3ccccc3)[nH]c2cc1F ZINC000587193174 FG Annotated Anodyne O=C(O)CCN(CCc1nc2ccc(Cl)nc2[nH]1)Cc1ccccc1 ZINC000587193221 FG Annotated Anodyne Cc1cnc(Cl)c2[nH]c(CCN(CCC(=O)O)Cc3ccccc3)nc12 ZINC000587193298 FG Annotated Anodyne CC(=O)c1ccc2nc(CCN(CCC(=O)O)Cc3ccccc3)[nH]c2c1 ZINC000587193312 FG Annotated Anodyne O=C(O)CCN(CCc1nc2cncc(Cl)c2[nH]1)Cc1ccccc1 ZINC000587193575 FG Annotated Anodyne O=C(O)CCN(CCc1nc2cc(F)cc(F)c2[nH]1)Cc1ccccc1 ZINC000587193587 FG Annotated Anodyne O=C(O)CCN(CCc1nc2cc(F)c(F)cc2[nH]1)Cc1ccccc1 ZINC000587193777 FG Annotated Anodyne O=C(O)CCN(CCc1nc2cc(Cl)ncc2[nH]1)Cc1ccccc1 ZINC000587193814 FG Annotated Anodyne Cc1cnc(Cl)c2[nH]c([C@@H](CCN(C)C)NC(=O)OC(C)(C)C)nc12 ZINC000587193836 FG Annotated Anodyne Cc1cnc(Cl)c2[nH]c([C@H](CCN(C)C)NC(=O)OC(C)(C)C)nc12 ZINC000587193839 FG Annotated Anodyne CN(C)CC[C@H](NC(=O)OC(C)(C)C)c1nc2cc(F)c(F)c(F)c2[nH]1 ZINC000587193897 FG Annotated Anodyne CN(C)CC[C@@H](NC(=O)OC(C)(C)C)c1nc2cc(F)c(F)c(F)c2[nH]1 ZINC000587193898 FG Annotated Anodyne O=C(O)CCN(CCc1nc2cc(Cl)cnc2[nH]1)Cc1ccccc1 ZINC000587193984 FG Annotated Anodyne O=C(O)CCN(CCc1nc2ccc(F)c(F)c2[nH]1)Cc1ccccc1 ZINC000587194062 FG Annotated Anodyne COc1cc2nc([C@@H](CCN(C)C)NC(=O)OC(C)(C)C)[nH]c2cc1F ZINC000587194069 FG Annotated Anodyne COc1cccc2nc(CCN(CCC(=O)O)Cc3ccccc3)[nH]c12 ZINC000587194070 FG Annotated Anodyne COc1cc2nc([C@H](CCN(C)C)NC(=O)OC(C)(C)C)[nH]c2cc1F ZINC000587194071 FG Annotated Anodyne COc1cc2nc([C@@H](CCN(C)C)NC(=O)OC(C)(C)C)[nH]c2cc1C ZINC000587194188 FG Annotated Anodyne COc1cc2nc([C@H](CCN(C)C)NC(=O)OC(C)(C)C)[nH]c2cc1C ZINC000587194196 FG Annotated Anodyne Cc1nc(N(C)C)ncc1-c1nc2cc(Br)cc(F)c2[nH]1 ZINC000587194270 FG Annotated Anodyne Cc1nc(N(C)C)ncc1-c1nc2cc(F)cc(Br)c2[nH]1 ZINC000587194308 FG Annotated Anodyne Cc1nc(N(C)C)ncc1-c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587194311 FG Annotated Anodyne CN(C)CC[C@@H](NC(=O)OC(C)(C)C)c1nc2cc(F)cc(F)c2[nH]1 ZINC000587194321 FG Annotated Anodyne CN(C)CC[C@H](NC(=O)OC(C)(C)C)c1nc2cc(F)cc(F)c2[nH]1 ZINC000587194322 FG Annotated Anodyne Cc1nc(N(C)C)ncc1-c1nc2cc(Br)c(F)cc2[nH]1 ZINC000587194365 FG Annotated Anodyne CN(C)c1ccc(-c2nc3c(I)cccc3[nH]2)nc1 ZINC000587194516 FG Annotated Anodyne Cc1nc(N(C)C)ncc1-c1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1 ZINC000587194529 FG Annotated Anodyne CN(C)c1ccc(-c2nc3c4c(ccc3[nH]2)C(=O)c2ccccc2C4=O)nc1 ZINC000587194632 FG Annotated Clean Cc1nc(N(C)C)ncc1-c1nc2ccc(F)c(Br)c2[nH]1 ZINC000587194677 FG Annotated Anodyne Cc1nc(N(C)C)ncc1-c1nc2ccc(Br)c(F)c2[nH]1 ZINC000587194679 FG Annotated Anodyne Cc1nc(N(C)C)ncc1-c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587194835 FG Annotated Anodyne Cc1nc(N(C)C)ncc1-c1nc2cc3nc4ccccc4nc3cc2[nH]1 ZINC000587194985 FG Annotated Bother Cc1nc(N(C)C)ncc1-c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587195002 FG Annotated Anodyne N#Cc1nc2nc(CN(Cc3ccccc3)c3ccccc3)[nH]c2nc1C#N ZINC000587195074 FG Annotated Mild Cc1nc(N(C)C)ncc1-c1nc2cc(C#N)cc(Br)c2[nH]1 ZINC000587195268 FG Annotated Mild C[C@H](c1ccc(N(C)C)cc1)c1nc2ccc(S(=O)(=O)N(C)C)cc2[nH]1 ZINC000587195383 FG Annotated Anodyne C[C@@H](c1ccc(N(C)C)cc1)c1nc2ccc(S(=O)(=O)N(C)C)cc2[nH]1 ZINC000587195384 FG Annotated Anodyne CN(C)c1ccc(-c2nc3cc(I)ccc3[nH]2)nc1 ZINC000587195412 FG Annotated Anodyne CN(C)c1ncccc1-c1nc2c3c(ccc2[nH]1)C(=O)c1ccccc1C3=O ZINC000587195466 FG Annotated Clean CN(C)c1ncccc1-c1nc2c(C(=O)O)cc(Br)cc2[nH]1 ZINC000587195481 FG Annotated Anodyne CN(C)c1ccc(-c2nc3c(C(=O)O)cc(Br)cc3[nH]2)nc1 ZINC000587195532 FG Annotated Anodyne Cc1nc(N(C)C)ncc1-c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587195535 FG Annotated Anodyne CN(C)c1ccc(-c2nc3c([N+](=O)[O-])c(Br)ccc3[nH]2)nc1 ZINC000587195569 FG Annotated Bother CN(C)c1ccc(-c2nc3c([N+](=O)[O-])cc(Br)cc3[nH]2)nc1 ZINC000587195638 FG Annotated Bother CN(C)c1ncccc1-c1nc2c([N+](=O)[O-])cc(Br)cc2[nH]1 ZINC000587195843 FG Annotated Bother C[C@H](c1ccc(N(C)C)cc1)c1nc2cccc(S(=O)(=O)N(C)C)c2[nH]1 ZINC000587196132 FG Annotated Anodyne C[C@@H](c1ccc(N(C)C)cc1)c1nc2cccc(S(=O)(=O)N(C)C)c2[nH]1 ZINC000587196133 FG Annotated Anodyne Cc1ccc(N(C)C(=O)OC(C)(C)C)c(-c2nc3c(O)nc(O)nc3[nH]2)c1 ZINC000587196150 FG Annotated Anodyne CN(C)c1ncccc1-c1nc2c([N+](=O)[O-])c(Br)ccc2[nH]1 ZINC000587196179 FG Annotated Bother Cc1ccc(N(C)C(=O)OC(C)(C)C)c(-c2nc3cnnc(O)c3[nH]2)c1 ZINC000587196187 FG Annotated Anodyne CN(C)c1ncccc1-c1nc2c(I)cccc2[nH]1 ZINC000587196196 FG Annotated Anodyne CN(C)c1ncccc1-c1nc2cc(I)ccc2[nH]1 ZINC000587196497 FG Annotated Anodyne Cc1ccc(N(C)C(=O)OC(C)(C)C)c(-c2nc3c[nH]c(=N)[nH]c-3n2)c1 ZINC000587196514 FG Annotated Anodyne Cc1cc2[nH]c(CN(C[C@@H]3CCCO3)C(=O)OC(C)(C)C)nc2c(C)n1 ZINC000587196578 FG Annotated Anodyne Cc1cc2[nH]c(CN(C[C@H]3CCCO3)C(=O)OC(C)(C)C)nc2c(C)n1 ZINC000587196581 FG Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2cc3cn[nH]c3cc2[nH]1)C[C@H]1CCCO1 ZINC000587196616 FG Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2cc3cn[nH]c3cc2[nH]1)C[C@@H]1CCCO1 ZINC000587196617 FG Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2ccc(C#N)cc2[nH]1)C[C@@H]1CCCO1 ZINC000587196620 FG Annotated Mild CC(C)(C)OC(=O)N(Cc1nc2ccc(C#N)cc2[nH]1)C[C@H]1CCCO1 ZINC000587196622 FG Annotated Mild COc1ccc2nc(CN(C[C@@H]3CCCO3)C(=O)OC(C)(C)C)[nH]c2c1 ZINC000587196753 FG Annotated Anodyne COc1ccc2nc(CN(C[C@H]3CCCO3)C(=O)OC(C)(C)C)[nH]c2c1 ZINC000587196755 FG Annotated Anodyne CCCCOc1cc2nc(CC(=O)N(C)C)[nH]c2cc1Br ZINC000587197068 FG Annotated Anodyne CC(C)[C@H](c1nc2c(S)nc(S)nc2[nH]1)N(C)C(=O)OC(C)(C)C ZINC000587197178 FG Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2cc(F)cnc2[nH]1)C[C@H]1CCCO1 ZINC000587197229 FG Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2cc(F)cnc2[nH]1)C[C@@H]1CCCO1 ZINC000587197232 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@H](C(C)C)N(C)C(=O)OC(C)(C)C)[nH]c2n1 ZINC000587197584 FG Annotated Anodyne CC(C)[C@H](c1nc2ccc(-n3cnnn3)cc2[nH]1)N(C)C(=O)OC(C)(C)C ZINC000587197592 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c([C@@H](C(C)C)N(C)C(=O)OC(C)(C)C)nc12 ZINC000587197757 FG Annotated Anodyne Cc1ccc(N(C)C(=O)OC(C)(C)C)c(-c2nc3c(O)ncnc3[nH]2)c1 ZINC000587198009 FG Annotated Anodyne COC(=O)c1cc2nc([C@@H](C(C)C)N(C)C(=O)OC(C)(C)C)[nH]c2cn1 ZINC000587198081 FG Annotated Anodyne CN(C(=O)c1ccccc1N)c1ccccc1-c1nc2c(N)ccnc2[nH]1 ZINC000587198091 FG Annotated Anodyne CN(C(=O)c1ccccc1N)c1ccccc1-c1nc2ccnc(O)c2[nH]1 ZINC000587198124 FG Annotated Anodyne CC(C)CCOc1cc2nc(CC(=O)N(C)C)[nH]c2cc1Br ZINC000587198148 FG Annotated Anodyne CC(C)[C@H](c1nc2cc3c(cc2[nH]1)OCC(=O)N3)N(C)C(=O)OC(C)(C)C ZINC000587198245 FG Annotated Anodyne COc1cncc2nc(-c3ccccc3N(C)C(=O)c3ccccc3N)[nH]c12 ZINC000587198361 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c([C@H](C(C)C)N(C)C)nc2c1 ZINC000587198538 FG Annotated Anodyne CN(C(=O)c1ccccc1N)c1ccccc1-c1nc2cc(N)c(N)cc2[nH]1 ZINC000587198664 FG Annotated Anodyne Cc1ccc(N(C)C(=O)OC(C)(C)C)c(-c2nc3c(N)ncnc3[nH]2)c1 ZINC000587198834 FG Annotated Anodyne COc1ccc2nc(-c3ccccc3N(C)C(=O)c3ccccc3N)[nH]c2n1 ZINC000587198888 FG Annotated Anodyne COc1nccc2nc(-c3ccccc3N(C)C(=O)c3ccccc3N)[nH]c12 ZINC000587199044 FG Annotated Anodyne COc1cc2nc(-c3ccccc3N(C)C(=O)c3ccccc3N)[nH]c2cn1 ZINC000587199087 FG Annotated Anodyne COc1ccc(NC(C)(C)c2nc3ccc(S(=O)(=O)O)cc3[nH]2)cc1 ZINC000587201038 FG Annotated Anodyne COc1ccc(NC(C)(C)c2nc3cc4c(cc3[nH]2)OCC(=O)N4)cc1 ZINC000587201314 FG Annotated Anodyne CC(C)(C)OC(=O)NC(C)(C)C(C)(C)c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000587201443 FG Annotated Bother COc1ccc(NC(C)(C)c2nc3nc(Br)c[nH]c-3n2)cc1 ZINC000587201476 FG Annotated Anodyne CC(C)(C)OC(=O)NC(C)(C)C(C)(C)c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000587201816 FG Annotated Bother C=C(NC(C)=O)c1nc2cc(OCC(C)C)c(Br)cc2[nH]1 ZINC000587202186 FG Annotated Anodyne C=C(NC(C)=O)c1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000587202223 FG Annotated Anodyne C=C(NC(C)=O)c1nc2cc(C(=O)OC)c(Nc3ccccc3)c(F)c2[nH]1 ZINC000587202229 FG Annotated Anodyne CC(C)(C)OC(=O)NC(=N)c1cccc(-c2nc3c(N)ccnc3[nH]2)c1 ZINC000587202261 FG Annotated Anodyne COc1ccc2nc(-c3cccc(C(=N)NC(=O)OC(C)(C)C)c3)[nH]c2n1 ZINC000587202272 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H](Cc1nc2cncc([N+](=O)[O-])c2[nH]1)C(C)(C)C ZINC000587202544 FG Annotated Bother CC(C)(C)OC(=O)N[C@@H](Cc1nc2cncc([N+](=O)[O-])c2[nH]1)C(C)(C)C ZINC000587202545 FG Annotated Bother C=C(NC(C)=O)c1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587202858 FG Annotated Anodyne C=C(NC(C)=O)c1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000587203297 FG Annotated Anodyne COc1nccc2nc(-c3cccc(C(=N)NC(=O)OC(C)(C)C)c3)[nH]c12 ZINC000587203363 FG Annotated Anodyne CC(C)(C)OC(=O)NC(=N)c1cccc(-c2nc3ccnc(O)c3[nH]2)c1 ZINC000587203386 FG Annotated Anodyne C=C(NC(C)=O)c1nc2ccc(Oc3ccc(C(=O)OC)cc3)cc2[nH]1 ZINC000587203859 FG Annotated Anodyne COc1cncc2nc(-c3cccc(C(=N)NC(=O)OC(C)(C)C)c3)[nH]c12 ZINC000587203953 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H](Cc1nc2cccc(C(N)=O)c2[nH]1)C(C)(C)C ZINC000587204080 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](Cc1nc2cccc(C(N)=O)c2[nH]1)C(C)(C)C ZINC000587204081 FG Annotated Anodyne C=C(NC(C)=O)c1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000587204385 FG Annotated Anodyne CC(C)(C)OC(=O)NC(=N)c1cccc(-c2nc3nc(Cl)c[nH]c-3n2)c1 ZINC000587204514 FG Annotated Anodyne C=C(NC(C)=O)c1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587204546 FG Annotated Anodyne CC(C)(C)OC(=O)NC(=N)c1cccc(-c2nc3cnc(Cl)[nH]c-3n2)c1 ZINC000587204637 FG Annotated Anodyne COc1cc2nc(-c3cccc(C(=N)NC(=O)OC(C)(C)C)c3)[nH]c2cn1 ZINC000587204704 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H](Cc1nc2c(Cl)ncnc2[nH]1)C(C)(C)C ZINC000587204810 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](Cc1nc2c(Cl)ncnc2[nH]1)C(C)(C)C ZINC000587204811 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H](Cc1nc2cc([N+](=O)[O-])cnc2[nH]1)C(C)(C)C ZINC000587205353 FG Annotated Bother CC(C)(C)OC(=O)N[C@@H](Cc1nc2cc([N+](=O)[O-])cnc2[nH]1)C(C)(C)C ZINC000587205354 FG Annotated Bother O=C(O)CCc1nc2cccc3c2c(c1CC(=O)O)-c1ccccc1C3=O ZINC000587205697 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H](Cc1nc2nc(Cl)c[nH]c-2n1)C(C)(C)C ZINC000587205717 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](Cc1nc2nc(Cl)c[nH]c-2n1)C(C)(C)C ZINC000587205719 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](Cc1nc2cnc(Cl)[nH]c-2n1)C(C)(C)C ZINC000587205801 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H](Cc1nc2cnc(Cl)[nH]c-2n1)C(C)(C)C ZINC000587205802 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2ccc(Br)nc2[nH]1)c1ccc(C)cc1 ZINC000587205849 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccc(Br)nc2[nH]1)c1ccc(C)cc1 ZINC000587205851 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc([N+](=O)[O-])c(F)cc2[nH]1)c1ccc(C)cc1 ZINC000587205913 FG Annotated Bother CC(=O)N[C@H](Cc1nc2cc([N+](=O)[O-])c(F)cc2[nH]1)c1ccc(C)cc1 ZINC000587205914 FG Annotated Bother CC(=O)N[C@@H](Cc1nc2cc(Br)cnc2[nH]1)c1ccc(C)cc1 ZINC000587206003 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(Br)cnc2[nH]1)c1ccc(C)cc1 ZINC000587206005 FG Annotated Anodyne COC(=O)C[C@@]1(O)CCc2nc3cccc4c3c(c2C1)-c1ccccc1C4=O ZINC000587206118 FG Annotated Anodyne COC(=O)C[C@]1(O)CCc2nc3cccc4c3c(c2C1)-c1ccccc1C4=O ZINC000587206120 FG Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)CC[C@H](C(=O)O)[C@@H]3C(=O)O ZINC000587206341 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(Cl)nc(C#N)c2[nH]1)c1ccc(C)cc1 ZINC000587206361 FG Annotated Mild CC(=O)N[C@@H](Cc1nc2cc(Cl)nc(C#N)c2[nH]1)c1ccc(C)cc1 ZINC000587206362 FG Annotated Mild CC1(C)OC(=O)C(c2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)C(=O)O1 ZINC000587206811 FG Annotated Anodyne CN=c1nc(Cc2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)[nH]s1 ZINC000587207230 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2ccnc(Br)c2[nH]1)c1ccc(C)cc1 ZINC000587207427 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccnc(Br)c2[nH]1)c1ccc(C)cc1 ZINC000587207428 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cncc(Br)c2[nH]1)c1ccc(C)cc1 ZINC000587207769 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2cncc(Br)c2[nH]1)c1ccc(C)cc1 ZINC000587207770 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2cnc(C(F)(F)F)[nH]c-2n1)c1ccc(C)cc1 ZINC000587207793 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cnc(C(F)(F)F)[nH]c-2n1)c1ccc(C)cc1 ZINC000587207794 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2c(Br)ccnc2[nH]1)c1ccc(C)cc1 ZINC000587207832 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2c(Br)ccnc2[nH]1)c1ccc(C)cc1 ZINC000587207833 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc(F)cc(C(=O)O)c2[nH]1)c1ccc(C)cc1 ZINC000587208117 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(F)cc(C(=O)O)c2[nH]1)c1ccc(C)cc1 ZINC000587208118 FG Annotated Anodyne CC1=C(CCCl)C(=O)N2CCc3c(nc4cccc5c4c3CC5)[C@H]2N1 ZINC000587209026 FG Annotated Reactive CC1=C(CCCl)C(=O)N2CCc3c(nc4cccc5c4c3CC5)[C@@H]2N1 ZINC000587209027 FG Annotated Reactive CCOC(=O)[C@H]1Cc2c(nc3cccc4c3c2-c2ccccc2C4=O)CO1 ZINC000587209654 FG Annotated Anodyne CCOC(=O)[C@@H]1Cc2c(nc3cccc4c3c2-c2ccccc2C4=O)CO1 ZINC000587209663 FG Annotated Anodyne CS(=O)(=O)[C@@H]1CCc2c(nc3cccc4c3c2-c2ccccc2C4=O)C1 ZINC000587209927 FG Annotated Anodyne CS(=O)(=O)[C@H]1CCc2c(nc3cccc4c3c2-c2ccccc2C4=O)C1 ZINC000587209928 FG Annotated Anodyne O=C1Cc2nc3cccc4c3c(c2[C@@H](c2ccccc2)[C@@H]1n1cncn1)CC4 ZINC000587210440 FG Annotated Anodyne O=C1Cc2nc3cccc4c3c(c2[C@@H](c2ccccc2)[C@H]1n1cncn1)CC4 ZINC000587210441 FG Annotated Anodyne O=C1Cc2nc3cccc4c3c(c2[C@H](c2ccccc2)[C@H]1n1cncn1)CC4 ZINC000587210442 FG Annotated Anodyne O=C1Cc2nc3cccc4c3c(c2[C@H](c2ccccc2)[C@@H]1n1cncn1)CC4 ZINC000587210443 FG Annotated Anodyne O=S(=O)(OC1=Cc2nc3cccc4c3c(c2CC1)CC4)C(F)(F)F ZINC000587210844 FG Annotated Unstable COC(=O)C(=NNc1ccccc1OC)c1cc2c3c(cccc3n1)CC2 ZINC000587211019 FG Annotated Mild CCOC(=O)[C@@H]1CC(=O)[C@@H](C(=O)C2CC2)c2nc3cccc4c3c(c21)CC4 ZINC000587211112 FG Annotated Anodyne CCOC(=O)[C@H]1CC(=O)[C@@H](C(=O)C2CC2)c2nc3cccc4c3c(c21)CC4 ZINC000587211115 FG Annotated Anodyne CCOC(=O)[C@@H]1CC(=O)[C@H](C(=O)C2CC2)c2nc3cccc4c3c(c21)CC4 ZINC000587211117 FG Annotated Anodyne CCOC(=O)[C@H]1CC(=O)[C@H](C(=O)C2CC2)c2nc3cccc4c3c(c21)CC4 ZINC000587211118 FG Annotated Anodyne COC(=O)[C@H]1CN(C(=O)OC(C)(C)C)Cc2nc3cccc4c3c(c21)CC4 ZINC000587211544 FG Annotated Anodyne COC(=O)[C@@H]1CN(C(=O)OC(C)(C)C)Cc2nc3cccc4c3c(c21)CC4 ZINC000587211547 FG Annotated Anodyne CC(=O)[C@@H](CN1C(=O)c2ccccc2C1=O)c1cc2c3c(cccc3n1)CC2 ZINC000587212068 FG Annotated Anodyne CC(=O)[C@H](CN1C(=O)c2ccccc2C1=O)c1cc2c3c(cccc3n1)CC2 ZINC000587212070 FG Annotated Anodyne Cn1ncc(I)c1-c1cc2c3c(cccc3n1)CC2 ZINC000587212105 FG Annotated Anodyne O=C(CCN1C(=O)c2ccccc2C1=O)Cc1cc2c3c(cccc3n1)CC2 ZINC000587212389 FG Annotated Anodyne O=C1c2ccccc2C(=O)N1[C@H]1CCc2c(nc3cccc4c3c2CC4)C1 ZINC000587212725 FG Annotated Anodyne O=C1c2ccccc2C(=O)N1[C@@H]1CCc2c(nc3cccc4c3c2CC4)C1 ZINC000587212730 FG Annotated Anodyne O=C1c2ccccc2C(=O)N1[C@H]1CCc2nc3cccc4c3c(c2C1)CC4 ZINC000587212793 FG Annotated Anodyne O=C1c2ccccc2C(=O)N1[C@@H]1CCc2nc3cccc4c3c(c2C1)CC4 ZINC000587212796 FG Annotated Anodyne COC(=O)c1c(CC(=O)O)[nH]c(-c2cc3c4c(cccc4n2)CC3)c1C ZINC000587212852 FG Annotated Anodyne Cn1cc(I)c(-c2cc3c4c(cccc4n2)CC3)n1 ZINC000587212879 FG Annotated Anodyne CC(=O)Nc1ccc(O)c(-c2nc3cccc4c3c(c2CC(=O)O)CC4)c1 ZINC000587213105 FG Annotated Anodyne O=C(O)[C@H]1CC(=O)N(c2cccc(-c3cc4c5c(cccc5n3)CC4)c2)C1 ZINC000587213147 FG Annotated Anodyne O=C(O)[C@@H]1CC(=O)N(c2cccc(-c3cc4c5c(cccc5n3)CC4)c2)C1 ZINC000587213153 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@]1(C(=O)O)CCc2nc3cccc4c3c(c2C1)CC4 ZINC000587213340 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@]1(C(=O)O)CCc2nc3cccc4c3c(c2C1)CC4 ZINC000587213345 FG Annotated Anodyne OCCN1CCN(c2ccc(-c3cc4c5c(cccc5n3)CC4)cc2)CC1 ZINC000587213635 FG Annotated Anodyne COC(=O)[C@@H]1Cc2c(nc3cccc4c3c2CC4)CN1C(=O)OC(C)(C)C ZINC000587213685 FG Annotated Anodyne COC(=O)[C@H]1Cc2c(nc3cccc4c3c2CC4)CN1C(=O)OC(C)(C)C ZINC000587213689 FG Annotated Anodyne COc1cc(OC)c2[nH]c(C[C@H](NC(C)=O)c3ccc(C)cc3)nc2c1 ZINC000587216422 FG Annotated Anodyne COc1cc(OC)c2[nH]c(C[C@@H](NC(C)=O)c3ccc(C)cc3)nc2c1 ZINC000587216424 FG Annotated Anodyne Cc1nc2cccc3c2c(c1CC(=O)c1ccc(S(C)(=O)=O)cc1)CC3 ZINC000587216516 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccc([C@@H](N)N=O)cc2[nH]1)c1ccc(C)cc1 ZINC000587216533 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2ccc([C@@H](N)N=O)cc2[nH]1)c1ccc(C)cc1 ZINC000587216534 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2ccc([C@H](N)N=O)cc2[nH]1)c1ccc(C)cc1 ZINC000587216535 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccc([C@H](N)N=O)cc2[nH]1)c1ccc(C)cc1 ZINC000587216536 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc3c(cc2[nH]1)OCCCO3)c1ccc(C)cc1 ZINC000587216587 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc3c(cc2[nH]1)OCCCO3)c1ccc(C)cc1 ZINC000587216588 FG Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc3c(cc2[nH]1)NC(=O)CC3)c1ccc(C)cc1 ZINC000587216672 FG Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc3c(cc2[nH]1)NC(=O)CC3)c1ccc(C)cc1 ZINC000587216673 FG Annotated Anodyne C=CCNS(=O)(=O)c1cccc(-c2cc3c4c(cccc4n2)CC3)c1 ZINC000587216849 FG Annotated Mild C=CCNS(=O)(=O)c1ccc(-c2cc3c4c(cccc4n2)CC3)cc1 ZINC000587217098 FG Annotated Mild O=C(N[C@@H](c1ccccc1)c1nc2cnc(Cl)[nH]c-2n1)c1ccccc1 ZINC000587217256 FG Annotated Anodyne O=C(N[C@H](c1ccccc1)c1nc2cnc(Cl)[nH]c-2n1)c1ccccc1 ZINC000587217260 FG Annotated Anodyne Cc1nn(CCS(C)(=O)=O)c(C)c1-c1nc2cccc3c2c(c1C)CC3 ZINC000587217535 FG Annotated Anodyne COC(=O)c1cccc2nc(C[C@H](NC(C)=O)c3ccc(C)cc3)[nH]c12 ZINC000587217732 FG Annotated Anodyne COC(=O)c1cccc2nc(C[C@@H](NC(C)=O)c3ccc(C)cc3)[nH]c12 ZINC000587217733 FG Annotated Anodyne O=C(N[C@@H](c1ccccc1)c1nc2nc(Cl)c[nH]c-2n1)c1ccccc1 ZINC000587218183 FG Annotated Anodyne O=C(N[C@H](c1ccccc1)c1nc2nc(Cl)c[nH]c-2n1)c1ccccc1 ZINC000587218185 FG Annotated Anodyne COc1cc2nc([C@@H](NC(=O)c3ccccc3)c3ccccc3)[nH]c2cn1 ZINC000587220406 FG Annotated Anodyne COc1cc2nc([C@H](NC(=O)c3ccccc3)c3ccccc3)[nH]c2cn1 ZINC000587220410 FG Annotated Anodyne Nc1cc2nc([C@@H](NC(=O)c3ccccc3)c3ccccc3)[nH]c2cc1N ZINC000587221270 FG Annotated Anodyne Nc1cc2nc([C@H](NC(=O)c3ccccc3)c3ccccc3)[nH]c2cc1N ZINC000587221271 FG Annotated Anodyne O=C(N[C@@H](c1ccccc1)c1nc2cncc([N+](=O)[O-])c2[nH]1)c1ccccc1 ZINC000587221789 FG Annotated Bother O=C(N[C@H](c1ccccc1)c1nc2cncc([N+](=O)[O-])c2[nH]1)c1ccccc1 ZINC000587221792 FG Annotated Bother CN[C@@H](c1cccnc1)c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587222236 FG Annotated Anodyne CN[C@H](c1cccnc1)c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587222238 FG Annotated Anodyne CCOC(=O)Nc1ccc(C(=O)NCc2nc3c(Cl)ccnc3[nH]2)cc1 ZINC000587223254 FG Annotated Anodyne CC(C)Oc1ccc2nc(CNC(=O)[C@H](C)Oc3ccccc3)[nH]c2c1 ZINC000587223323 FG Annotated Anodyne CC(C)Oc1ccc2nc(CNC(=O)[C@@H](C)Oc3ccccc3)[nH]c2c1 ZINC000587223324 FG Annotated Anodyne C[C@@H](Oc1ccccc1)C(=O)NCc1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000587223715 FG Annotated Anodyne C[C@H](Oc1ccccc1)C(=O)NCc1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000587223716 FG Annotated Anodyne C[C@@H](Oc1ccccc1)C(=O)NCc1nc2ccc(C(C)(C)C)nc2[nH]1 ZINC000587223733 FG Annotated Anodyne C[C@H](Oc1ccccc1)C(=O)NCc1nc2ccc(C(C)(C)C)nc2[nH]1 ZINC000587223734 FG Annotated Anodyne C[C@@H](Oc1ccccc1)C(=O)NCc1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000587223793 FG Annotated Anodyne C[C@H](Oc1ccccc1)C(=O)NCc1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000587223794 FG Annotated Anodyne CN[C@H](c1cccnc1)c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587224155 FG Annotated Clean CN[C@@H](c1cccnc1)c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587224156 FG Annotated Clean CN[C@H](c1cccnc1)c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587224263 FG Annotated Anodyne CN[C@@H](c1cccnc1)c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587224265 FG Annotated Anodyne COc1ccc2nc([C@H](NC(=O)c3ccccc3)c3ccccc3)[nH]c2n1 ZINC000587224294 FG Annotated Anodyne COc1ccc2nc([C@@H](NC(=O)c3ccccc3)c3ccccc3)[nH]c2n1 ZINC000587224297 FG Annotated Anodyne COc1nccc2nc([C@@H](NC(=O)c3ccccc3)c3ccccc3)[nH]c12 ZINC000587224380 FG Annotated Anodyne COc1nccc2nc([C@H](NC(=O)c3ccccc3)c3ccccc3)[nH]c12 ZINC000587224381 FG Annotated Anodyne C[C@@H](Oc1ccccc1)C(=O)NCc1nc2cc(C#N)cc(Cl)c2[nH]1 ZINC000587224433 FG Annotated Mild C[C@H](Oc1ccccc1)C(=O)NCc1nc2cc(C#N)cc(Cl)c2[nH]1 ZINC000587224446 FG Annotated Mild C[C@@H](Oc1ccccc1)C(=O)NCc1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587224478 FG Annotated Anodyne C[C@H](Oc1ccccc1)C(=O)NCc1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587224480 FG Annotated Anodyne COc1cc2nc(CNC(=O)[C@@H](C)Oc3ccccc3)[nH]c2cc1Cl ZINC000587224518 FG Annotated Anodyne COc1cc2nc(CNC(=O)[C@H](C)Oc3ccccc3)[nH]c2cc1Cl ZINC000587224523 FG Annotated Anodyne CCOC(=O)Nc1ccc(C(=O)NCc2nc3ccnc(Cl)c3[nH]2)cc1 ZINC000587224839 FG Annotated Anodyne C[C@@H](Oc1ccccc1)C(=O)NCc1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000587225055 FG Annotated Anodyne C[C@H](Oc1ccccc1)C(=O)NCc1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000587225056 FG Annotated Anodyne CCOC(=O)Nc1ccc(C(=O)NCc2nc3cc(Cl)ncc3[nH]2)cc1 ZINC000587225061 FG Annotated Anodyne C[C@@H](Oc1ccccc1)C(=O)NCc1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000587225104 FG Annotated Anodyne C[C@H](Oc1ccccc1)C(=O)NCc1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000587225105 FG Annotated Anodyne C[C@@H](Oc1ccccc1)C(=O)NCc1nc2cccc(Br)c2[nH]1 ZINC000587225246 FG Annotated Anodyne C[C@H](Oc1ccccc1)C(=O)NCc1nc2cccc(Br)c2[nH]1 ZINC000587225248 FG Annotated Anodyne COc1cncc2nc([C@H](NC(=O)c3ccccc3)c3ccccc3)[nH]c12 ZINC000587225437 FG Annotated Anodyne COc1cncc2nc([C@@H](NC(=O)c3ccccc3)c3ccccc3)[nH]c12 ZINC000587225439 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](c1nc2c(O)nc(S)nc2[nH]1)C1CCCC1 ZINC000587225486 FG Annotated Anodyne CN[C@H](c1cccnc1)c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587225487 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H](c1nc2c(O)nc(S)nc2[nH]1)C1CCCC1 ZINC000587225488 FG Annotated Anodyne CN[C@@H](c1cccnc1)c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587225489 FG Annotated Anodyne O=C(N[C@@H](c1ccccc1)c1nc2cc([N+](=O)[O-])cnc2[nH]1)c1ccccc1 ZINC000587225840 FG Annotated Bother O=C(N[C@H](c1ccccc1)c1nc2cc([N+](=O)[O-])cnc2[nH]1)c1ccccc1 ZINC000587225841 FG Annotated Bother CN[C@H](c1cccnc1)c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587225909 FG Annotated Anodyne CN[C@@H](c1cccnc1)c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587225913 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](c1nc2[nH]c(=N)[nH]c(Cl)c-2n1)C1CCCC1 ZINC000587225955 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H](c1nc2[nH]c(=N)[nH]c(Cl)c-2n1)C1CCCC1 ZINC000587225966 FG Annotated Anodyne CCOC(=O)Nc1ccc(C(=O)NCc2nc3cncc(Cl)c3[nH]2)cc1 ZINC000587226129 FG Annotated Anodyne CCOC(=O)Nc1ccc(C(=O)NCc2nc3ccc(Cl)nc3[nH]2)cc1 ZINC000587226237 FG Annotated Anodyne CCOC(=O)CNc1ccc(-c2nc3nc(C(F)(F)F)ncc3[nH]2)cc1 ZINC000587227366 FG Annotated Anodyne CCCCCCCC(=O)NCCCc1nc2c(S)nc(S)nc2[nH]1 ZINC000587227859 FG Annotated Mild CCCCCCCC(=O)NCCCc1nc2cc(C(=O)OC)ncc2[nH]1 ZINC000587228064 FG Annotated Mild CCCCCCCC(=O)NCCCc1nc2c(C(=O)OC)ccnc2[nH]1 ZINC000587228248 FG Annotated Mild CCOC(=O)Nc1ccc(C(=O)NCc2nc3cc(F)cc(F)c3[nH]2)cc1 ZINC000587228444 FG Annotated Anodyne CCOC(=O)Nc1ccc(C(=O)NCc2nc3ccc(F)c(F)c3[nH]2)cc1 ZINC000587228543 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(CCCNc3cc(C)ccc3OC)nc12 ZINC000587228794 FG Annotated Anodyne CCOC(=O)Nc1ccc(C(=O)NCc2nc3cccc(C)c3[nH]2)cc1 ZINC000587228848 FG Annotated Anodyne CCOC(=O)Nc1ccc(C(=O)NCc2nc3cccc(OC)c3[nH]2)cc1 ZINC000587228888 FG Annotated Anodyne COc1ccc(C)cc1NCCCc1nc2cc3c(cc2[nH]1)OCC(=O)N3 ZINC000587228922 FG Annotated Anodyne COC(=O)c1ccc2nc(CCCNc3cc(C)ccc3OC)[nH]c2n1 ZINC000587228929 FG Annotated Anodyne CCOC(=O)Nc1ccc(C(=O)NCc2nc3c(C)nc(C)cc3[nH]2)cc1 ZINC000587228948 FG Annotated Anodyne COC(=O)c1cc2nc(CCCNc3cc(C)ccc3OC)[nH]c2cn1 ZINC000587229074 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2ccc3ncccc3c2[nH]1 ZINC000587229484 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2ccc3ncccc3c2[nH]1 ZINC000587229485 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2ccc3ncccc3c2[nH]1 ZINC000587229486 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2ccc3ncccc3c2[nH]1 ZINC000587229487 FG Annotated Anodyne COc1ccc(C)cc1NCCCc1nc2c(S)nc(S)nc2[nH]1 ZINC000587229545 FG Annotated Anodyne N#Cc1cccnc1NCc1cccc(-c2nc3cc([N+](=O)[O-])cnc3[nH]2)c1 ZINC000587229630 FG Annotated Mild Oc1nc(S)nc2[nH]c(-c3cccnc3NCc3ccccc3)nc12 ZINC000587229634 FG Annotated Anodyne CCNC(=O)CCc1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587229678 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2ccc3c(c2[nH]1)CCCC3 ZINC000587229817 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2ccc3c(c2[nH]1)CCCC3 ZINC000587229819 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2ccc3c(c2[nH]1)CCCC3 ZINC000587229822 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2ccc3c(c2[nH]1)CCCC3 ZINC000587229824 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000587229916 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000587229919 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000587229920 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000587229921 FG Annotated Anodyne CCNC(=O)CCc1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587230061 FG Annotated Anodyne N#Cc1cccnc1NCc1cccc(-c2nc3cc(N)c(N)cc3[nH]2)c1 ZINC000587230069 FG Annotated Mild CCNC(=O)CCc1nc2cc(OCC(C)C)c(Br)cc2[nH]1 ZINC000587230115 FG Annotated Anodyne O=C(O)c1ccccc1NCCNc1ccccc1-c1nc2ncc[nH]c-2n1 ZINC000587230191 FG Annotated Anodyne O=C(O)c1ccccc1NCCNc1ccccc1-c1nc2cncnc2[nH]1 ZINC000587230302 FG Annotated Anodyne c1ccc(CNc2ncccc2-c2nc3ccc(-n4cnnn4)cc3[nH]2)cc1 ZINC000587230380 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587230518 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587230520 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587230522 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587230523 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000587230560 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000587230561 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000587230562 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000587230563 FG Annotated Anodyne N#Cc1cccnc1NCc1cccc(-c2nc3cncc([N+](=O)[O-])c3[nH]2)c1 ZINC000587230821 FG Annotated Mild CCNC(=O)CCc1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587230878 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000587230883 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000587230885 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000587230888 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000587230889 FG Annotated Anodyne CCNC(=O)CCc1nc2ccc(Oc3ccc(C(=O)OC)cc3)cc2[nH]1 ZINC000587230908 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2ccc(C(C)(C)C)nc2[nH]1 ZINC000587230921 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2ccc(C(C)(C)C)nc2[nH]1 ZINC000587230925 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2ccc(C(C)(C)C)nc2[nH]1 ZINC000587230930 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2ccc(C(C)(C)C)nc2[nH]1 ZINC000587230932 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2ccc(OC(C)C)cc2[nH]1 ZINC000587230963 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2ccc(OC(C)C)cc2[nH]1 ZINC000587230966 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2ccc(OC(C)C)cc2[nH]1 ZINC000587230967 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2ccc(OC(C)C)cc2[nH]1 ZINC000587230968 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000587231097 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000587231099 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000587231100 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000587231102 FG Annotated Anodyne CCNC(=O)CCc1nc2cc(OC(C)C)c(Br)cc2[nH]1 ZINC000587231143 FG Annotated Anodyne CCNC(=O)CCc1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587231251 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2ccc3nc(C)ccc3c2[nH]1 ZINC000587231271 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2ccc3nc(C)ccc3c2[nH]1 ZINC000587231274 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2ccc3nc(C)ccc3c2[nH]1 ZINC000587231276 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2ccc3nc(C)ccc3c2[nH]1 ZINC000587231278 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2cnc3ccccc3c2[nH]1 ZINC000587231345 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2cnc3ccccc3c2[nH]1 ZINC000587231346 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2cnc3ccccc3c2[nH]1 ZINC000587231347 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2cnc3ccccc3c2[nH]1 ZINC000587231348 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2cc(F)c(F)c(F)c2[nH]1 ZINC000587231512 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2cc(F)c(F)c(F)c2[nH]1 ZINC000587231527 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2cc(F)c(F)c(F)c2[nH]1 ZINC000587231528 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2cc(F)c(F)c(F)c2[nH]1 ZINC000587231530 FG Annotated Anodyne O=C(O)c1ccccc1NCCNc1ccccc1-c1nc2cnncc2[nH]1 ZINC000587231640 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000587231830 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000587231833 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000587231836 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000587231837 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2cc(C#N)cc(Cl)c2[nH]1 ZINC000587232053 FG Annotated Mild COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2cc(C#N)cc(Cl)c2[nH]1 ZINC000587232054 FG Annotated Mild COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2cc(C#N)cc(Cl)c2[nH]1 ZINC000587232055 FG Annotated Mild COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2cc(C#N)cc(Cl)c2[nH]1 ZINC000587232056 FG Annotated Mild CC(C)(C)OC(=O)NCc1ccc(-c2nc3cncnc3[nH]2)c(C2CC2)n1 ZINC000587232137 FG Annotated Anodyne COC(=O)c1cc2[nH]c(-c3ccc(CNCc4ccco4)cc3)nc2cn1 ZINC000587232212 FG Annotated Anodyne O=C1COc2cc3nc(-c4ccc(CNCc5ccco5)cc4)[nH]c3cc2N1 ZINC000587232216 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2cc(OC)c(Cl)cc2[nH]1 ZINC000587232236 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2cc(OC)c(Cl)cc2[nH]1 ZINC000587232237 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2cc(OC)c(Cl)cc2[nH]1 ZINC000587232238 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2cc(OC)c(Cl)cc2[nH]1 ZINC000587232239 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000587232419 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000587232420 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000587232421 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000587232422 FG Annotated Anodyne Sc1nc(S)c2nc(-c3ccc(CNCc4ccco4)cc3)[nH]c2n1 ZINC000587232448 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2cc(Cl)cc(F)c2[nH]1 ZINC000587232481 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2cc(Cl)cc(F)c2[nH]1 ZINC000587232482 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2cc(Cl)cc(F)c2[nH]1 ZINC000587232483 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2cc(Cl)cc(F)c2[nH]1 ZINC000587232484 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2cc(Cl)c(F)cc2[nH]1 ZINC000587232536 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2cc(Cl)c(F)cc2[nH]1 ZINC000587232537 FG Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2cc(Cl)c(F)cc2[nH]1 ZINC000587232538 FG Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2cc(Cl)c(F)cc2[nH]1 ZINC000587232539 FG Annotated Anodyne CC(C)(C)OC(=O)NCc1ccc(-c2nc3cnncc3[nH]2)c(C2CC2)n1 ZINC000587232659 FG Annotated Anodyne CC(C)(C)OC(=O)NCc1ccc(-c2nc3ncc[nH]c-3n2)c(C2CC2)n1 ZINC000587232665 FG Annotated Anodyne COC(=O)c1ccc2[nH]c(-c3ccc(CNCc4ccco4)cc3)nc2n1 ZINC000587232683 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000587232724 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000587232785 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1c1nc2c(S)nc(S)nc2[nH]1 ZINC000587232958 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1c1nc2c(S)nc(S)nc2[nH]1 ZINC000587233052 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000587233214 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000587233244 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000587233262 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000587233288 FG Annotated Anodyne CNc1cccc(-c2cccc(-c3nc4nc(C#N)c(C#N)nc4[nH]3)c2)c1 ZINC000587233563 FG Annotated Mild CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1c1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000587233640 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1c1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000587233641 FG Annotated Anodyne CC(=O)NC1(c2nc3c(Br)ccnc3[nH]2)CCC(C)CC1 ZINC000587233712 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cccc([N+](=O)[O-])c3[nH]2)CCC(=O)CC1 ZINC000587233746 FG Annotated Bother CC(C)(C)OC(=O)NC1(c2nc3ccc(C(=O)O)cc3[nH]2)CCC(=O)CC1 ZINC000587233777 FG Annotated Anodyne CC(=O)NC1(c2nc3cncc(Br)c3[nH]2)CCC(C)CC1 ZINC000587233809 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cccc(C#N)c3[nH]2)CCC(=O)CC1 ZINC000587233853 FG Annotated Mild CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1c1nc2cc(C#N)c(C#N)cc2[nH]1 ZINC000587233871 FG Annotated Mild COc1cccc2nc(C3(NC(=O)OC(C)(C)C)CCC(=O)CC3)[nH]c12 ZINC000587233899 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc([C@H]3CCC[C@@H]3NC(=O)OC(C)(C)C)[nH]c2c1 ZINC000587233947 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1c1nc2cc3c(cc2[nH]1)OCC(=O)N3 ZINC000587234005 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1c1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000587234010 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1c1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000587234011 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1c1nc2cc(C#N)c(C#N)cc2[nH]1 ZINC000587234075 FG Annotated Mild CC(=O)NC1(c2nc3c(F)cnc(Br)c3[nH]2)CCC(C)CC1 ZINC000587234102 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3ccc([N+](=O)[O-])cc3[nH]2)CCC(=O)CC1 ZINC000587234105 FG Annotated Bother CC(C)(C)OC(=O)NC1(c2nc3ccc(Cl)nc3[nH]2)CCC(=O)CC1 ZINC000587234193 FG Annotated Anodyne CN(C)C(=O)c1ccc2nc([C@H]3CCC[C@H]3NC(=O)OC(C)(C)C)[nH]c2c1 ZINC000587234206 FG Annotated Anodyne CC(=O)NC1(c2nc3cc(Br)cnc3[nH]2)CCC(C)CC1 ZINC000587234282 FG Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1c1nc2cc3c(cc2[nH]1)OCC(=O)N3 ZINC000587234297 FG Annotated Anodyne CC(=O)NC1(c2nc3cc(-n4cccn4)c(F)cc3[nH]2)CCC(C)CC1 ZINC000587234303 FG Annotated Anodyne Cc1cc2[nH]c(C3(NC(=O)OC(C)(C)C)CCC(=O)CC3)nc2c(C)n1 ZINC000587234357 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc4cn[nH]c4cc3[nH]2)CCC(=O)CC1 ZINC000587234360 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(C3(NC(C)=O)CCC(C)CC3)[nH]c2c1 ZINC000587234365 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc4c(cc3[nH]2)OCO4)CCC(=O)CC1 ZINC000587234403 FG Annotated Anodyne CC(=O)NC1(c2nc3ccnc(Br)c3[nH]2)CCC(C)CC1 ZINC000587234520 FG Annotated Anodyne CC(=O)NC1(c2nc3cc(Br)ncc3[nH]2)CCC(C)CC1 ZINC000587234603 FG Annotated Anodyne COc1ccc2nc(C3(NC(=O)OC(C)(C)C)CCC(=O)CC3)[nH]c2c1 ZINC000587234664 FG Annotated Anodyne CNC(=O)[C@H]1C[C@@H]1c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587234682 FG Annotated Anodyne CNC(=O)[C@@H]1C[C@@H]1c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587234683 FG Annotated Anodyne CNC(=O)[C@@H]1C[C@H]1c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587234684 FG Annotated Anodyne CNC(=O)[C@H]1C[C@H]1c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587234685 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc(Cl)ncc3[nH]2)CCC(=O)CC1 ZINC000587234749 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3ccnc(Cl)c3[nH]2)CCC(=O)CC1 ZINC000587234771 FG Annotated Anodyne CC(=O)NC1(c2nc3ccc(Br)nc3[nH]2)CCC(C)CC1 ZINC000587234923 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3ccc(C#N)cc3[nH]2)CCC(=O)CC1 ZINC000587234942 FG Annotated Mild CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000587235235 FG Annotated Bother CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000587235254 FG Annotated Bother CCCCOc1cc2nc([C@@H]3C[C@H]3C(=O)NC)[nH]c2cc1Br ZINC000587235296 FG Annotated Anodyne CCCCOc1cc2nc([C@H]3C[C@@H]3C(=O)NC)[nH]c2cc1Br ZINC000587235297 FG Annotated Anodyne CCCCOc1cc2nc([C@H]3C[C@H]3C(=O)NC)[nH]c2cc1Br ZINC000587235298 FG Annotated Anodyne CCCCOc1cc2nc([C@@H]3C[C@@H]3C(=O)NC)[nH]c2cc1Br ZINC000587235299 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc(Cl)cnc3[nH]2)CCC(=O)CC1 ZINC000587235459 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cncc(Cl)c3[nH]2)CCC(=O)CC1 ZINC000587235742 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@H]3CCCC[C@H]3NC(=O)OC(C)(C)C)[nH]c2n1 ZINC000587235748 FG Annotated Anodyne COC(=O)c1cc2nc([C@@H]3CCCC[C@H]3NC(=O)OC(C)(C)C)[nH]c2cn1 ZINC000587235752 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c([C@@H]3CCCC[C@H]3NC(=O)OC(C)(C)C)nc12 ZINC000587236015 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3c(Cl)ccnc3[nH]2)CCC(=O)CC1 ZINC000587236110 FG Annotated Anodyne CNC(=O)[C@H]1C[C@@H]1c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587236117 FG Annotated Anodyne CNC(=O)[C@@H]1C[C@@H]1c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587236118 FG Annotated Anodyne CNC(=O)[C@@H]1C[C@H]1c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587236119 FG Annotated Anodyne CNC(=O)[C@H]1C[C@H]1c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587236120 FG Annotated Anodyne CNC(=O)[C@@H]1C[C@H]1c1nc2cc(OCC(C)C)c(Br)cc2[nH]1 ZINC000587236315 FG Annotated Anodyne CNC(=O)[C@H]1C[C@@H]1c1nc2cc(OCC(C)C)c(Br)cc2[nH]1 ZINC000587236316 FG Annotated Anodyne CNC(=O)[C@@H]1C[C@@H]1c1nc2cc(OCC(C)C)c(Br)cc2[nH]1 ZINC000587236317 FG Annotated Anodyne CNC(=O)[C@H]1C[C@H]1c1nc2cc(OCC(C)C)c(Br)cc2[nH]1 ZINC000587236318 FG Annotated Anodyne CNC(=O)[C@H]1C[C@@H]1c1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1 ZINC000587236322 FG Annotated Anodyne CNC(=O)[C@@H]1C[C@@H]1c1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1 ZINC000587236323 FG Annotated Anodyne CNC(=O)[C@@H]1C[C@H]1c1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1 ZINC000587236324 FG Annotated Anodyne CNC(=O)[C@H]1C[C@H]1c1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1 ZINC000587236325 FG Annotated Anodyne CNC(=O)[C@@H]1C[C@@H]1c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587236375 FG Annotated Anodyne CNC(=O)[C@@H]1C[C@H]1c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587236376 FG Annotated Anodyne CNC(=O)[C@H]1C[C@H]1c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587236377 FG Annotated Anodyne CNC(=O)[C@H]1C[C@@H]1c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587236378 FG Annotated Anodyne CNC(=O)[C@@H]1C[C@@H]1c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587236388 FG Annotated Anodyne CNC(=O)[C@@H]1C[C@H]1c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587236389 FG Annotated Anodyne CNC(=O)[C@H]1C[C@H]1c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587236390 FG Annotated Anodyne CNC(=O)[C@H]1C[C@@H]1c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587236391 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3c(Cl)ccnc3[nH]2)CCC(O)CC1 ZINC000587236634 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc(Cl)ncc3[nH]2)CCC(O)CC1 ZINC000587236665 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc(Cl)cnc3[nH]2)CCC(O)CC1 ZINC000587236672 FG Annotated Anodyne CC(=O)c1ccc2nc(C3(NC(=O)OC(C)(C)C)CCC(O)CC3)[nH]c2c1 ZINC000587236679 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cccc(C#N)c3[nH]2)CCC(O)CC1 ZINC000587236681 FG Annotated Mild CC(C)(C)OC(=O)NC1(c2nc3cncc(Cl)c3[nH]2)CCC(O)CC1 ZINC000587236689 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc(F)c(F)cc3[nH]2)CCC(O)CC1 ZINC000587236999 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3ccc(Cl)nc3[nH]2)CCC(O)CC1 ZINC000587237008 FG Annotated Anodyne Cc1cc2[nH]c(C3(NC(=O)OC(C)(C)C)CCC(O)CC3)nc2c(C)n1 ZINC000587237030 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3ccc(C#N)cc3[nH]2)CCC(O)CC1 ZINC000587237189 FG Annotated Mild CC(C)(C)OC(=O)NC1(c2nc3ccnc(Cl)c3[nH]2)CCC(O)CC1 ZINC000587237514 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc4cn[nH]c4cc3[nH]2)CCC(O)CC1 ZINC000587237530 FG Annotated Anodyne COc1cccc2nc(C3(NC(=O)OC(C)(C)C)CCC(O)CC3)[nH]c12 ZINC000587237547 FG Annotated Anodyne Cc1ccc(NC2(c3nc4cccc(S(N)(=O)=O)c4[nH]3)CCCC2)cc1 ZINC000587237585 FG Annotated Anodyne COc1ccc2nc(C3(NC(=O)OC(C)(C)C)CCC(O)CC3)[nH]c2c1 ZINC000587237764 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3ccc(F)c(F)c3[nH]2)CCC(O)CC1 ZINC000587237781 FG Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc(F)cc(F)c3[nH]2)CCC(O)CC1 ZINC000587237844 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(CC(=O)Nc3cccc(C)c3C)[nH]c2c1 ZINC000587238572 FG Annotated Anodyne Cc1cccc(NC(=O)Cc2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)c1C ZINC000587238938 FG Annotated Bother Cc1cccc(NC(=O)Cc2nc3ccc(C(=O)N(C)C)cc3[nH]2)c1C ZINC000587238954 FG Annotated Anodyne COC(=O)c1ccc2nc(CC(=O)Nc3cccc(C)c3C)[nH]c2c1OC ZINC000587239211 FG Annotated Anodyne Cc1c(NC(N)=O)cccc1-c1nc2ccc(Br)c(O)c2[nH]1 ZINC000587239616 FG Annotated Anodyne Cc1c(NC(N)=O)cccc1-c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587239689 FG Annotated Anodyne COC(=O)c1cc2[nH]c(CC(=O)Nc3cccc(C)c3C)nc2cc1OC ZINC000587239737 FG Annotated Anodyne Cc1c(NC(N)=O)cccc1-c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587239799 FG Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(-c3cccc(NC(N)=O)c3C)nc2c1 ZINC000587240003 FG Annotated Anodyne Cc1ccccc1CC(=O)Nc1ccc(-c2nc3ncc[nH]c-3n2)c(O)c1 ZINC000587240040 FG Annotated Anodyne Cc1nc2[nH]c(-c3cccc(NC(N)=O)c3C)nc2cc1Br ZINC000587240211 FG Annotated Anodyne Cc1c(NC(N)=O)cccc1-c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587240358 FG Annotated Anodyne Cc1ccccc1CC(=O)Nc1ccc(-c2nc3c(N)ccnc3[nH]2)c(O)c1 ZINC000587240385 FG Annotated Anodyne CCc1ccccc1NC(=O)c1nc2cc(C(=O)OC)c(OC)cc2[nH]1 ZINC000587240584 FG Annotated Anodyne Cc1ccccc1CC(=O)Nc1ccc(-c2nc3cncnc3[nH]2)c(O)c1 ZINC000587240885 FG Annotated Anodyne CCc1ccccc1NC(=O)c1nc2c(OC)c(C(=O)OC)ccc2[nH]1 ZINC000587240959 FG Annotated Anodyne Cc1cc(C)cc(Nc2c(N)cccc2-c2nc3c(O)nc(=N)[nH]c3[nH]2)c1 ZINC000587241236 FG Annotated Anodyne CC(C)(C)C(=O)Nc1cccc(-c2nc3ccc(-n4cnnn4)cc3[nH]2)c1 ZINC000587241447 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3cccc(NC(=O)C(C)(C)C)c3)[nH]c2n1 ZINC000587241485 FG Annotated Anodyne Cc1cc(C)cc(Nc2c(N)cccc2-c2nc3c(O)nc(O)nc3[nH]2)c1 ZINC000587241590 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3cccc(NC(=O)C(C)(C)C)c3)nc12 ZINC000587241798 FG Annotated Anodyne N#Cc1nc2nc(-c3cccc(Nc4ccc(O)cc4)c3)[nH]c2nc1C#N ZINC000587241924 FG Annotated Mild CC(C)(C)CC(=O)Nc1cccc(-c2nc3[nH]c(=N)[nH]c(Cl)c-3n2)c1 ZINC000587242333 FG Annotated Anodyne Oc1ccc(Nc2cccc(-c3nc4c(O)nc(S)nc4[nH]3)c2)cc1 ZINC000587242416 FG Annotated Anodyne N=c1[nH]c2nc(-c3cccc(Nc4ccc(O)cc4)c3)nc-2c(Cl)[nH]1 ZINC000587242540 FG Annotated Anodyne CC(C)(C)CC(=O)Nc1cccc(-c2nc3c(O)nc(S)nc3[nH]2)c1 ZINC000587242778 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(Cc3cccc(NC(C)=O)c3)[nH]c2c1 ZINC000587242830 FG Annotated Anodyne CC(=O)Nc1cccc(Cc2nc3c(F)cnc(Br)c3[nH]2)c1 ZINC000587242932 FG Annotated Anodyne NC(=O)Nc1ccc(-c2nc3c(Br)ncc(F)c3[nH]2)cc1 ZINC000587243930 FG Annotated Anodyne Cc1oncc1C(=O)Nc1ccc(Cc2nc3nc(Cl)c[nH]c-3n2)cc1 ZINC000587243996 FG Annotated Anodyne COC(=O)c1cccc2nc(-c3ccc(NC(=O)C(C)(C)C)nc3)[nH]c12 ZINC000587244454 FG Annotated Anodyne COC(=O)Nc1ccc(-c2nc3c(F)cnc(Br)c3[nH]2)cn1 ZINC000587244680 FG Annotated Anodyne CCCCCOc1cc2nc(COCCN)[nH]c2cc1Br ZINC000587244689 FG Annotated Anodyne COC(=O)c1ccc2nc(/C=C\C(=O)Nc3ccccc3)[nH]c2c1OC ZINC000587244935 FG Annotated Anodyne COC(=O)c1ccc2nc(/C=C/C(=O)Nc3ccccc3)[nH]c2c1OC ZINC000587244936 FG Annotated Anodyne COc1cncc2nc(Cc3ccc(NC(=O)c4cnoc4C)cc3)[nH]c12 ZINC000587245269 FG Annotated Anodyne COc1nccc2nc(Cc3ccc(NC(=O)c4cnoc4C)cc3)[nH]c12 ZINC000587245276 FG Annotated Anodyne CC(C)CCOc1cc2nc(COCCN)[nH]c2cc1Br ZINC000587245832 FG Annotated Anodyne NCCOCCOCCc1nc2ccc(Sc3ccccc3)cc2[nH]1 ZINC000587245859 FG Annotated Anodyne CCCCCOc1cc2nc([C@]3(N)CCOC3)[nH]c2cc1Br ZINC000587245914 FG Annotated Anodyne CCCCCOc1cc2nc([C@@]3(N)CCOC3)[nH]c2cc1Br ZINC000587245915 FG Annotated Anodyne N[C@H]1CC[C@@H]1c1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000587245960 FG Annotated Anodyne COc1ccc(-c2nnc(-c3ccc4nc([C@H]5CC[C@@H]5N)[nH]c4c3)o2)cc1 ZINC000587246082 FG Annotated Anodyne NCc1cccc(-c2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)c1 ZINC000587246098 FG Annotated Clean COC(=O)c1cc2nc([C@H]3CC[C@@H]3N)[nH]c2c(F)c1Nc1ccccc1 ZINC000587246110 FG Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3cc(Br)cnc3[nH]1)C2 ZINC000587246302 FG Annotated Anodyne COc1ccc2c(c1)CC[C@](N)(c1nc3cc(Br)cnc3[nH]1)C2 ZINC000587246303 FG Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3cc4c(cc3[nH]1)OCCCO4)C2 ZINC000587246328 FG Annotated Anodyne COc1ccc2c(c1)CC[C@](N)(c1nc3cc4c(cc3[nH]1)OCCCO4)C2 ZINC000587246331 FG Annotated Anodyne N[C@H]1CC[C@@H]1c1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000587246410 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(-c3cccc(CN)c3)nc2c1 ZINC000587246535 FG Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3cc(C(F)(F)F)ncc3[nH]1)C2 ZINC000587246669 FG Annotated Anodyne COc1ccc2c(c1)CC[C@](N)(c1nc3cc(C(F)(F)F)ncc3[nH]1)C2 ZINC000587246670 FG Annotated Anodyne CC(C)(C)C(=O)Nc1ccc(-c2nc3cc(F)cc(C(=O)O)c3[nH]2)cn1 ZINC000587246716 FG Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c([C@H]3CC[C@@H](N)C3)nc2c1 ZINC000587246839 FG Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3cncc(Br)c3[nH]1)C2 ZINC000587246877 FG Annotated Anodyne COc1ccc2c(c1)CC[C@](N)(c1nc3cncc(Br)c3[nH]1)C2 ZINC000587246878 FG Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3cc(C#N)cc(Cl)c3[nH]1)C2 ZINC000587246915 FG Annotated Mild COc1ccc2c(c1)CC[C@](N)(c1nc3cc(C#N)cc(Cl)c3[nH]1)C2 ZINC000587246916 FG Annotated Mild COc1ccc2c(c1)CC[C@](N)(c1nc3cc([N+](=O)[O-])c(Cl)cc3[nH]1)C2 ZINC000587247022 FG Annotated Bother COc1ccc2c(c1)CC[C@@](N)(c1nc3cc([N+](=O)[O-])c(Cl)cc3[nH]1)C2 ZINC000587247023 FG Annotated Bother CCOC(=O)c1ccc2nc([C@]3(N)CCc4cc(OC)ccc4C3)[nH]c2c1 ZINC000587247027 FG Annotated Anodyne CCOC(=O)c1ccc2nc([C@@]3(N)CCc4cc(OC)ccc4C3)[nH]c2c1 ZINC000587247029 FG Annotated Anodyne N[C@H]1CC[C@@H]1c1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000587247039 FG Annotated Anodyne N[C@@H]1CC[C@H](c2nc3c(Br)cnc(Br)c3[nH]2)C1 ZINC000587247086 FG Annotated Anodyne CC(C)(C)C(=O)Nc1ccc(-c2nc3cnc(C(F)(F)F)[nH]c-3n2)cn1 ZINC000587247135 FG Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3c(Br)ccnc3[nH]1)C2 ZINC000587247266 FG Annotated Anodyne COc1ccc2c(c1)CC[C@](N)(c1nc3c(Br)ccnc3[nH]1)C2 ZINC000587247267 FG Annotated Anodyne CCCCOc1cc2nc([C@]3(N)CCOC3)[nH]c2cc1Br ZINC000587247319 FG Annotated Anodyne CCCCOc1cc2nc([C@@]3(N)CCOC3)[nH]c2cc1Br ZINC000587247322 FG Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3cc(Br)ncc3[nH]1)C2 ZINC000587247331 FG Annotated Anodyne COc1ccc2c(c1)CC[C@](N)(c1nc3cc(Br)ncc3[nH]1)C2 ZINC000587247332 FG Annotated Anodyne CC(C)CCOc1cc2nc([C@]3(N)CCOC3)[nH]c2cc1Br ZINC000587247589 FG Annotated Anodyne CC(C)CCOc1cc2nc([C@@]3(N)CCOC3)[nH]c2cc1Br ZINC000587247590 FG Annotated Anodyne COc1ccc2c(c1)CC[C@](N)(c1nc3c(F)c(F)c(F)c(F)c3[nH]1)C2 ZINC000587247666 FG Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3c(F)c(F)c(F)c(F)c3[nH]1)C2 ZINC000587247667 FG Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3cc(C(F)(F)F)cnc3[nH]1)C2 ZINC000587247722 FG Annotated Anodyne COc1ccc2c(c1)CC[C@](N)(c1nc3cc(C(F)(F)F)cnc3[nH]1)C2 ZINC000587247723 FG Annotated Anodyne CC(C)C(=O)Nc1cc2ccccc2cc1-c1nc2c(O)nc(O)nc2[nH]1 ZINC000587247763 FG Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3cc([N+](=O)[O-])c(C)cc3[nH]1)C2 ZINC000587247804 FG Annotated Bother CC(C)(C)C(=O)Nc1ccc(-c2nc3ccc([C@@H](N)N=O)cc3[nH]2)cn1 ZINC000587247805 FG Annotated Anodyne CC(C)(C)C(=O)Nc1ccc(-c2nc3ccc([C@H](N)N=O)cc3[nH]2)cn1 ZINC000587247806 FG Annotated Anodyne COc1ccc2c(c1)CC[C@](N)(c1nc3cc([N+](=O)[O-])c(C)cc3[nH]1)C2 ZINC000587247809 FG Annotated Bother COc1ccc2c(c1)CC[C@@](N)(c1nc3ccc(Br)nc3[nH]1)C2 ZINC000587247822 FG Annotated Anodyne COc1ccc2c(c1)CC[C@](N)(c1nc3ccc(Br)nc3[nH]1)C2 ZINC000587247823 FG Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3ccnc(Br)c3[nH]1)C2 ZINC000587247843 FG Annotated Anodyne COc1ccc2c(c1)CC[C@](N)(c1nc3ccnc(Br)c3[nH]1)C2 ZINC000587247844 FG Annotated Anodyne Nc1cccc(-c2nc3ccc(Br)c(F)c3[nH]2)c1C(=O)O ZINC000587248064 FG Annotated Anodyne N#Cc1cc(Br)c2[nH]c(-c3c(N)cccc3C(=O)O)nc2c1 ZINC000587248262 FG Annotated Mild Nc1cccc(-c2nc3ccc(F)c(Br)c3[nH]2)c1C(=O)O ZINC000587248354 FG Annotated Anodyne Nc1cccc(-c2nc3c(Br)cnc(Cl)c3[nH]2)c1C(=O)O ZINC000587248391 FG Annotated Anodyne N#Cc1cc(Br)c2[nH]c(-c3cccc(N)c3C(=O)O)nc2c1 ZINC000587248450 FG Annotated Mild Nc1cccc(C(=O)O)c1-c1nc2cc(Br)c(F)cc2[nH]1 ZINC000587248480 FG Annotated Anodyne Nc1cccc(-c2nc3cc(F)cc(Br)c3[nH]2)c1C(=O)O ZINC000587248548 FG Annotated Anodyne Nc1cc(C(=O)O)cc(-c2nc3c(Br)cnc(Cl)c3[nH]2)c1 ZINC000587248721 FG Annotated Anodyne Nc1cccc(C(=O)O)c1-c1nc2cc(Br)cc(F)c2[nH]1 ZINC000587248730 FG Annotated Anodyne Nc1cccc(C(=O)O)c1-c1nc2ccc(Br)c(F)c2[nH]1 ZINC000587248734 FG Annotated Anodyne Nc1cccc(C(=O)O)c1-c1nc2cc(F)cc(Br)c2[nH]1 ZINC000587248737 FG Annotated Anodyne Nc1cc(C(=O)O)cc(-c2nc3ccc(Br)c(F)c3[nH]2)c1 ZINC000587248789 FG Annotated Anodyne Nc1cc(C(=O)O)cc(-c2nc3cc(F)cc(Br)c3[nH]2)c1 ZINC000587248792 FG Annotated Anodyne Nc1cc(C(=O)O)ccc1Cc1nc2cc(Br)cc(F)c2[nH]1 ZINC000587248882 FG Annotated Anodyne Nc1cccc(C(=O)O)c1-c1nc2ccc(F)c(Br)c2[nH]1 ZINC000587248902 FG Annotated Anodyne Nc1cccc(C(=O)O)c1-c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587248941 FG Annotated Anodyne N#Cc1cc(-c2nc3cccc(I)c3[nH]2)ccc1N ZINC000587248955 FG Annotated Mild Nc1cc(C(=O)O)cc(-c2nc3ccc(F)c(Br)c3[nH]2)c1 ZINC000587249044 FG Annotated Anodyne Nc1cccc(O)c1-c1nc2ccc(I)cc2[nH]1 ZINC000587249183 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(-c3c(N)cccc3O)nc2c1 ZINC000587249289 FG Annotated Anodyne N#Cc1cc2nc(Cc3ccc(C(=O)O)cc3N)[nH]c2cc1C(F)(F)F ZINC000587249306 FG Annotated Mild Nc1ccc(-c2ccc3nc(Cc4ccc(C(=O)O)cc4N)[nH]c3c2)cc1N ZINC000587249318 FG Annotated Anodyne Nc1cc(-c2nc3cc(Br)cc(F)c3[nH]2)ccc1CC(=O)O ZINC000587249346 FG Annotated Anodyne N#Cc1cc(Br)c2[nH]c(-c3ccc(CC(=O)O)c(N)c3)nc2c1 ZINC000587249371 FG Annotated Mild Nc1cc(C(=O)O)ccc1Cc1nc2cc(F)cc(Br)c2[nH]1 ZINC000587249385 FG Annotated Anodyne Nc1cc(C(=O)O)ccc1Cc1nc2ccc(F)c(Br)c2[nH]1 ZINC000587249392 FG Annotated Anodyne COc1cc(C)c(N)c(-c2nc3c(F)cnc(Br)c3[nH]2)c1 ZINC000587249534 FG Annotated Anodyne Cc1ccc(CCc2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)cc1N ZINC000587249578 FG Annotated Anodyne N#Cc1cc(Br)c2[nH]c(-c3cc(N)cc(C(=O)O)c3)nc2c1 ZINC000587249674 FG Annotated Mild Nc1cc(-c2nc3ccc(F)c(Br)c3[nH]2)ccc1CC(=O)O ZINC000587249837 FG Annotated Anodyne Nc1cc(C(=O)O)cc(-c2nc3cc(Br)cc(F)c3[nH]2)c1 ZINC000587249934 FG Annotated Anodyne N#Cc1cc(-c2nc3cc(Br)cc(C(=O)O)c3[nH]2)ccc1N ZINC000587250102 FG Annotated Mild N#Cc1cc(-c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)ccc1N ZINC000587250147 FG Annotated Mild Nc1cc(C(=O)O)ccc1Cc1nc2ccc(Br)c(F)c2[nH]1 ZINC000587250205 FG Annotated Anodyne Nc1cc(C(=O)O)ccc1Cc1nc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000587250208 FG Annotated Anodyne Nc1cc(C(=O)O)ccc1Cc1nc2cc(Br)c(F)cc2[nH]1 ZINC000587250214 FG Annotated Anodyne Nc1cc(-c2nc3cccc(OC(F)(F)F)c3[nH]2)ccc1CC(=O)O ZINC000587250241 FG Annotated Anodyne Nc1cccc(O)c1-c1nc2cccc(I)c2[nH]1 ZINC000587250272 FG Annotated Anodyne N#Cc1cc(Br)c2[nH]c(Cc3ccc(C(=O)O)cc3N)nc2c1 ZINC000587250373 FG Annotated Mild N#Cc1cc(-c2nc3ccc(I)cc3[nH]2)ccc1N ZINC000587250393 FG Annotated Mild Nc1cc(-c2nc3ccc(Br)c(F)c3[nH]2)ccc1CC(=O)O ZINC000587250402 FG Annotated Anodyne N#Cc1cc(-c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)ccc1N ZINC000587250413 FG Annotated Mild Nc1cc(-c2nc3cc(F)cc(Br)c3[nH]2)ccc1CC(=O)O ZINC000587250467 FG Annotated Anodyne N#Cc1cc(-c2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)ccc1N ZINC000587250540 FG Annotated Mild Nc1cc(C(=O)O)ccc1Cc1nc2cccc(OC(F)(F)F)c2[nH]1 ZINC000587250728 FG Annotated Anodyne Nc1cccc(O)c1-c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587250793 FG Annotated Clean Cc1ccc(CCc2nc3ccc(CN4CCOCC4)cc3[nH]2)cc1N ZINC000587250950 FG Annotated Anodyne Nc1ccc(/C=C/c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)cc1 ZINC000587251178 FG Annotated Anodyne Nc1ccc(/C=C\c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)cc1 ZINC000587251179 FG Annotated Anodyne Cc1nc2[nH]c(CCC(=O)c3ccc(N)cc3)nc2cc1Br ZINC000587251207 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc(/C=C\c3ccc(N)cc3)[nH]c2c1 ZINC000587251338 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc(/C=C/c3ccc(N)cc3)[nH]c2c1 ZINC000587251339 FG Annotated Anodyne Nc1ccc(C(=O)CCc2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)cc1 ZINC000587251367 FG Annotated Anodyne Nc1ccc(C(=O)CCc2nc3ccc(Br)c(O)c3[nH]2)cc1 ZINC000587251434 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(-c3cc(N)cc4ccccc34)[nH]c12 ZINC000587251459 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(CCC(=O)c3ccc(N)cc3)[nH]c2c1 ZINC000587251588 FG Annotated Anodyne Nc1ccc(C(=O)CCc2nc3c(F)cnc(Br)c3[nH]2)cc1 ZINC000587251596 FG Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(CCC(=O)c3ccc(N)cc3)nc2c1 ZINC000587251729 FG Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc(/C=C/c3ccc(N)cc3)[nH]c2c1 ZINC000587251781 FG Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc(/C=C\c3ccc(N)cc3)[nH]c2c1 ZINC000587251783 FG Annotated Anodyne Nc1ccc(/C=C\c2nc3cc(I)cnc3[nH]2)cc1 ZINC000587251905 FG Annotated Anodyne Nc1ccc(/C=C/c2nc3cc(I)cnc3[nH]2)cc1 ZINC000587251907 FG Annotated Anodyne Cc1c(Br)cnc2[nH]c(CCC(=O)c3ccc(N)cc3)nc12 ZINC000587251927 FG Annotated Anodyne COc1cncc(N)c1-c1nc2c(F)c(F)c(Br)cc2[nH]1 ZINC000587252234 FG Annotated Anodyne Nc1cnc(-c2nc3c(Br)cc(C(F)(F)F)cc3[nH]2)nc1 ZINC000587252292 FG Annotated Anodyne COc1cncc(N)c1-c1nc2ncc(Br)c(Cl)c2[nH]1 ZINC000587252403 FG Annotated Anodyne Nc1cnc(-c2nc3c(Br)cc(OC(F)(F)F)cc3[nH]2)nc1 ZINC000587252632 FG Annotated Anodyne COc1cncc(N)c1-c1nc2c(Cl)ncc(Br)c2[nH]1 ZINC000587252655 FG Annotated Anodyne Nc1cnc(-c2nc3c(Br)ccc(Br)c3[nH]2)nc1 ZINC000587252678 FG Annotated Anodyne Nc1cnc(-c2nc3cc(Br)c(C(F)(F)F)cc3[nH]2)nc1 ZINC000587252691 FG Annotated Anodyne COc1cncc(N)c1-c1nc2cnc(C(F)(F)C(F)(F)F)cc2[nH]1 ZINC000587252774 FG Annotated Anodyne Nc1cnc(-c2nc3c(OC(F)(F)F)cc(Br)cc3[nH]2)nc1 ZINC000587252811 FG Annotated Anodyne CC(C)COc1cc2[nH]c(-c3ncc(N)cn3)nc2cc1Br ZINC000587252815 FG Annotated Anodyne Nc1cnc(-c2nc3c(C(F)(F)F)c(Br)ccc3[nH]2)nc1 ZINC000587252851 FG Annotated Anodyne Nc1cnc(-c2nc3cc(Br)c(Br)cc3[nH]2)nc1 ZINC000587252861 FG Annotated Anodyne Nc1cnc(-c2nc3cc(Br)c(OC(F)(F)F)cc3[nH]2)nc1 ZINC000587252872 FG Annotated Anodyne CC1=C(c2ccc3nc(-c4cc5cc(N)ccc5o4)[nH]c3c2)NNC(=O)C1 ZINC000587252890 FG Annotated Anodyne Nc1cnc(-c2nc3c(C(F)(F)F)cc(Br)cc3[nH]2)nc1 ZINC000587253058 FG Annotated Anodyne N=c1nc(O)c(-c2nc3ccc(-c4nc5ccccc5s4)cc3[nH]2)c[nH]1 ZINC000587253193 FG Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4cc([N+](=O)[O-])c(F)cc4[nH]3)c2)c[nH]1 ZINC000587253602 FG Annotated Bother N=c1ncc(-c2cccc(-c3nc4ccc(Br)nc4[nH]3)c2)c[nH]1 ZINC000587253606 FG Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4ccnc(Br)c4[nH]3)c2)c[nH]1 ZINC000587253733 FG Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4cc(Br)cnc4[nH]3)c2)c[nH]1 ZINC000587253740 FG Annotated Anodyne N=c1nc(O)c(-c2nc3cc(C(F)(F)F)cc(C(F)(F)F)c3[nH]2)c[nH]1 ZINC000587253755 FG Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4cc5c(cc4[nH]3)OCCCO5)c2)c[nH]1 ZINC000587253768 FG Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(-c3cncc(N)c3)nc2c1 ZINC000587253903 FG Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4c(Br)ccnc4[nH]3)c2)c[nH]1 ZINC000587254158 FG Annotated Anodyne N=c1cc(-c2nc3c(F)cnc(Br)c3[nH]2)c2ccccc2[nH]1 ZINC000587254259 FG Annotated Anodyne N=c1cc(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)c2ccccc2[nH]1 ZINC000587254619 FG Annotated Bother CCOC(=O)Cc1ccc2nc(-c3cccc(-c4cnc(=N)[nH]c4)c3)[nH]c2c1 ZINC000587254833 FG Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4cc(Br)ncc4[nH]3)c2)c[nH]1 ZINC000587254835 FG Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4cc(-n5cccn5)c(F)cc4[nH]3)c2)c[nH]1 ZINC000587254870 FG Annotated Anodyne Nc1cncc(-c2nc3c(Br)cnc(Br)c3[nH]2)c1 ZINC000587254939 FG Annotated Anodyne CC1(C)OC(=O)C(c2nc3cc(OC(F)(F)F)c(Cl)cc3[nH]2)=C1N ZINC000587254961 FG Annotated Anodyne NC1CC(Cc2nc3c(Br)ccc(Br)c3[nH]2)C1 ZINC000587254970 FG Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4cncc(Br)c4[nH]3)c2)c[nH]1 ZINC000587255032 FG Annotated Anodyne CN(C)CCOc1ccc2nc(-c3cccc(-c4cnc(=N)[nH]c4)c3)[nH]c2c1 ZINC000587255069 FG Annotated Anodyne NC1CC(Cc2nc3cc(Br)c(Br)cc3[nH]2)C1 ZINC000587255313 FG Annotated Anodyne CC(C)CCOc1cc2nc([C@H](N)C3COC3)[nH]c2cc1Br ZINC000587255539 FG Annotated Anodyne CCCCOc1cc2nc([C@H](N)C3COC3)[nH]c2cc1Br ZINC000587255546 FG Annotated Anodyne CC(C)COc1cc2nc([C@H](N)C3COC3)[nH]c2cc1Br ZINC000587255957 FG Annotated Anodyne Cc1cc(Br)c2[nH]c(CC[C@@H](N)C(=O)OC(C)(C)C)nc2c1 ZINC000587256066 FG Annotated Anodyne CC(C)(C)OC(=O)[C@H](N)CCc1nc2cc(Br)c(F)cc2[nH]1 ZINC000587256138 FG Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(C3CCC(N)CC3)nc2c1 ZINC000587256238 FG Annotated Anodyne CC(C)(C)OC(=O)[C@H](N)CCc1nc2cc(C(F)(F)F)c(F)cc2[nH]1 ZINC000587256389 FG Annotated Anodyne Cc1cc(Br)cc2nc(CC[C@@H](N)C(=O)OC(C)(C)C)[nH]c12 ZINC000587256455 FG Annotated Anodyne CC(C)(C)OC(=O)[C@H](N)CCc1nc2cc(F)cc(Br)c2[nH]1 ZINC000587256483 FG Annotated Anodyne CC(C)(C)OC(=O)[C@H](N)CCc1nc2cccc(OC(F)(F)F)c2[nH]1 ZINC000587256487 FG Annotated Anodyne CC(C)(C)OC(=O)[C@H](N)CCc1nc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000587256718 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(C3CCC(N)CC3)nc2c1 ZINC000587256738 FG Annotated Anodyne NC1CCC(c2nc3c(Br)cnc(Br)c3[nH]2)CC1 ZINC000587256871 FG Annotated Anodyne CC(C)(C)OC(=O)[C@H](N)CCc1nc2ccc(F)c(Br)c2[nH]1 ZINC000587256875 FG Annotated Anodyne Cc1c(Br)ccc2nc(CC[C@@H](N)C(=O)OC(C)(C)C)[nH]c12 ZINC000587256897 FG Annotated Anodyne CC(C)(C)OC(=O)[C@H](N)CCc1nc2ccc(Br)c(F)c2[nH]1 ZINC000587256937 FG Annotated Anodyne CC(C)(C)OC(=O)[C@H](N)CCc1nc2cc(Br)cc(F)c2[nH]1 ZINC000587257013 FG Annotated Anodyne CC(C)(C)OC(=O)[C@H](N)CCc1nc2cc(F)cc(C(F)(F)F)c2[nH]1 ZINC000587257098 FG Annotated Anodyne CC(C)(C)[C@H](N)c1nc2c(I)cnc(Cl)c2[nH]1 ZINC000587257623 FG Annotated Anodyne C=CC[C@@](C)(N)c1nc2cc(C(=O)OCC)cc(Br)c2[nH]1 ZINC000587257799 FG Annotated Mild C=CC[C@@](C)(N)c1nc2c(Br)cnc(Br)c2[nH]1 ZINC000587258113 FG Annotated Mild N[C@@H](Cc1nc2c(S)nc(S)nc2[nH]1)c1cccc2ccccc12 ZINC000587258273 FG Annotated Anodyne N[C@@H](Cc1nc2cc3c(cc2[nH]1)OCC(=O)N3)c1cccc2ccccc12 ZINC000587258349 FG Annotated Anodyne N[C@@H](Cc1nc2ccc(S(=O)(=O)O)cc2[nH]1)c1cccc2ccccc12 ZINC000587258385 FG Annotated Anodyne COC(=O)CC[C@H](N)c1nc2cc(OC(C)C)c(Br)cc2[nH]1 ZINC000587258495 FG Annotated Anodyne CCCOc1cc2nc([C@@H](N)CCC(=O)OC)[nH]c2cc1Br ZINC000587259080 FG Annotated Anodyne COc1ccc(NS(=O)(=O)c2ccc3nc([C@@H](N)C(C)C)[nH]c3c2)cc1 ZINC000587259130 FG Annotated Anodyne N[C@@H](Cc1nc2nc(Br)c[nH]c-2n1)c1cccc2ccccc12 ZINC000587259181 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc(CCCCCCN=[N+]=[N-])[nH]c2c1 ZINC000587259263 FG Annotated Clean COC(=O)CC[C@H](N)c1nc2cc(OC(F)(F)F)c(Cl)cc2[nH]1 ZINC000587259279 FG Annotated Anodyne COc1ccccc1NS(=O)(=O)c1ccc2nc([C@@H](N)C(C)C)[nH]c2c1 ZINC000587259466 FG Annotated Anodyne NC(=O)c1cccc(C[C@H](N)c2nc3cc(C(F)(F)F)c(F)cc3[nH]2)c1 ZINC000587259585 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(CCCCCCN=[N+]=[N-])[nH]c12 ZINC000587259954 FG Annotated Clean COc1cc(-c2nc3cc4c(cc3[nH]2)OCCCO4)c(OC)c([N+](=O)[O-])c1 ZINC000587260724 FG Annotated Bother COc1cc(-c2nc3c(F)cnc(Cl)c3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587260809 FG Annotated Bother COc1cc(-c2nc3cc(OC)c(OC)cc3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587260819 FG Annotated Bother COc1cc(-c2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587260895 FG Annotated Bother COc1cc(-c2nc3cc([N+](=O)[O-])c(C)cc3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587260926 FG Annotated Bother CCOC(=O)c1ccc2nc(-c3cc(OC)cc([N+](=O)[O-])c3OC)[nH]c2c1 ZINC000587260968 FG Annotated Bother COc1cc(-c2nc3cc(OC)cc(OC)c3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587261152 FG Annotated Bother COc1cc(-c2nc3cc(Cl)nc(C#N)c3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587261172 FG Annotated Mild COc1cc(-c2nc3cc4c(cc3[nH]2)NC(=O)CC4)c(OC)c([N+](=O)[O-])c1 ZINC000587261238 FG Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3cccc(OC(F)(F)F)c3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587261294 FG Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3cccc(OC(F)(F)F)c3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587261295 FG Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3cccc(OC(F)(F)F)c3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587261296 FG Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3cccc(OC(F)(F)F)c3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587261297 FG Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3ccc(OC(F)(F)F)cc3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587261330 FG Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3ccc(OC(F)(F)F)cc3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587261331 FG Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3ccc(OC(F)(F)F)cc3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587261332 FG Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3ccc(OC(F)(F)F)cc3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587261333 FG Annotated Bother COc1cc(OC)c2[nH]c(CCOc3cc(C)ccc3[N+](=O)[O-])nc2c1 ZINC000587261407 FG Annotated Bother COc1cc(OCc2nc3cc4c(cc3[nH]2)OCCCO4)ccc1[N+](=O)[O-] ZINC000587261498 FG Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cccnc2[nH]1 ZINC000587261567 FG Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cccnc2[nH]1 ZINC000587261569 FG Annotated Bother COCCNc1ccc(-c2nc3cc(Cl)nc(C#N)c3[nH]2)cc1[N+](=O)[O-] ZINC000587261592 FG Annotated Mild COc1cc(OCc2nc3cc([N+](=O)[O-])c(C)cc3[nH]2)ccc1[N+](=O)[O-] ZINC000587261602 FG Annotated Bother Cc1cc(C#Cc2nc3c(Br)ccnc3[nH]2)ccc1[N+](=O)[O-] ZINC000587261665 FG Annotated Mild COC(=O)c1ccc2nc(CCOc3cc(C)ccc3[N+](=O)[O-])[nH]c2c1 ZINC000587261692 FG Annotated Bother Cc1cc(C#Cc2nc3ccc(Br)nc3[nH]2)ccc1[N+](=O)[O-] ZINC000587261711 FG Annotated Mild Cc1ccc([N+](=O)[O-])c(OCCc2nc3cnc(C(F)(F)F)[nH]c-3n2)c1 ZINC000587261724 FG Annotated Bother O=CC(C=O)c1ccc(-c2nc3cnc4ccccc4c3[nH]2)cc1[N+](=O)[O-] ZINC000587261731 FG Annotated Mild Cc1ccc([N+](=O)[O-])c(OCCc2nc3ccc(C(=O)N(C)C)cc3[nH]2)c1 ZINC000587261758 FG Annotated Bother N#Cc1cc(Cl)c2[nH]c(-c3ccc(C(C=O)C=O)c([N+](=O)[O-])c3)nc2c1 ZINC000587261764 FG Annotated Mild COCCNc1ccc(-c2nc3c(F)cnc(Cl)c3[nH]2)cc1[N+](=O)[O-] ZINC000587261769 FG Annotated Bother Cc1cc(C#Cc2nc3cc(Br)ncc3[nH]2)ccc1[N+](=O)[O-] ZINC000587261820 FG Annotated Mild CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cc(F)cnc2[nH]1 ZINC000587261873 FG Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cc(F)cnc2[nH]1 ZINC000587261874 FG Annotated Bother Cc1cc(C#Cc2nc3cncc(Br)c3[nH]2)ccc1[N+](=O)[O-] ZINC000587261934 FG Annotated Mild COCCNc1ccc(-c2nc3cc(OC)cc(OC)c3[nH]2)cc1[N+](=O)[O-] ZINC000587261975 FG Annotated Bother COCCNc1ccc(-c2nc3cc(F)cc(C(=O)O)c3[nH]2)cc1[N+](=O)[O-] ZINC000587261993 FG Annotated Bother CC(C)Oc1ccc2nc(-c3ccc(C(C=O)C=O)c([N+](=O)[O-])c3)[nH]c2c1 ZINC000587262053 FG Annotated Mild Cc1ccc([N+](=O)[O-])c(OCCc2nc3cc(C(=O)O)c(F)cc3[nH]2)c1 ZINC000587262061 FG Annotated Bother O=CC(C=O)c1ccc(-c2nc3cc(F)c(F)c(F)c3[nH]2)cc1[N+](=O)[O-] ZINC000587262097 FG Annotated Mild O=CC(C=O)c1ccc(-c2nc3ccc4c(c3[nH]2)CCCC4)cc1[N+](=O)[O-] ZINC000587262127 FG Annotated Mild CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cnccc2[nH]1 ZINC000587262176 FG Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cnccc2[nH]1 ZINC000587262177 FG Annotated Bother O=CC(C=O)c1ccc(-c2nc3ccc4ncccc4c3[nH]2)cc1[N+](=O)[O-] ZINC000587262291 FG Annotated Mild CCOC(=O)Cc1ccc2nc(C#Cc3ccc([N+](=O)[O-])c(C)c3)[nH]c2c1 ZINC000587262382 FG Annotated Mild Cc1ccc2c(ccc3nc(-c4ccc(C(C=O)C=O)c([N+](=O)[O-])c4)[nH]c32)n1 ZINC000587262391 FG Annotated Mild Cc1ccc([N+](=O)[O-])c(OCCc2nc3cc4c(cc3[nH]2)OCCO4)c1 ZINC000587262396 FG Annotated Bother Cc1cc(C#Cc2nc3cc(Br)cnc3[nH]2)ccc1[N+](=O)[O-] ZINC000587262424 FG Annotated Mild CC1=C(c2ccc3nc(-c4cccc([N+](=O)[O-])c4C)[nH]c3c2)NNC(=O)C1 ZINC000587262457 FG Annotated Bother COc1cc(OCc2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)ccc1[N+](=O)[O-] ZINC000587262531 FG Annotated Bother CCOC(=O)c1ccc2nc(COc3ccc([N+](=O)[O-])c(OC)c3)[nH]c2c1 ZINC000587262548 FG Annotated Bother O=CC(C=O)c1ccc(-c2nc3cc(Cl)cc(F)c3[nH]2)cc1[N+](=O)[O-] ZINC000587262560 FG Annotated Mild CC(C)(C)c1ccc2nc(-c3ccc(C(C=O)C=O)c([N+](=O)[O-])c3)[nH]c2n1 ZINC000587262578 FG Annotated Mild Cc1cc(C#Cc2nc3ccc(OCCN(C)C)cc3[nH]2)ccc1[N+](=O)[O-] ZINC000587262669 FG Annotated Mild COc1cc(OCc2nc3c(F)cnc(Cl)c3[nH]2)ccc1[N+](=O)[O-] ZINC000587262700 FG Annotated Bother Cc1ccc([N+](=O)[O-])c(OCCc2nc3cc(F)cc(C(=O)O)c3[nH]2)c1 ZINC000587262725 FG Annotated Bother Cc1ccc([N+](=O)[O-])c(OCCc2nc3ccc([C@@H](N)N=O)cc3[nH]2)c1 ZINC000587262738 FG Annotated Bother Cc1ccc([N+](=O)[O-])c(OCCc2nc3ccc([C@H](N)N=O)cc3[nH]2)c1 ZINC000587262744 FG Annotated Bother Cc1c(-c2nc3ccc(CN4CCOCC4)cc3[nH]2)cccc1[N+](=O)[O-] ZINC000587262798 FG Annotated Bother Cc1cc(C#Cc2nc3ccnc(Br)c3[nH]2)ccc1[N+](=O)[O-] ZINC000587262857 FG Annotated Mild COc1cc(OCc2nc3cc(C(F)(F)F)ncc3[nH]2)ccc1[N+](=O)[O-] ZINC000587262932 FG Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3ccc(C(F)(F)F)cc3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587262966 FG Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3ccc(C(F)(F)F)cc3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587262968 FG Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3ccc(C(F)(F)F)cc3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587262971 FG Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3ccc(C(F)(F)F)cc3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587262973 FG Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3cccc(C(F)(F)F)c3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587263068 FG Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3cccc(C(F)(F)F)c3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587263069 FG Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3cccc(C(F)(F)F)c3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587263070 FG Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3cccc(C(F)(F)F)c3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587263071 FG Annotated Bother COc1cc(OC)c2[nH]c(COc3ccc([N+](=O)[O-])c(OC)c3)nc2c1 ZINC000587263164 FG Annotated Bother COc1cc(OCc2nc3cc(C(F)(F)F)cnc3[nH]2)ccc1[N+](=O)[O-] ZINC000587263289 FG Annotated Bother Cc1ccc([N+](=O)[O-])c(OCCc2nc3cc4c(cc3[nH]2)NC(=O)CC4)c1 ZINC000587263317 FG Annotated Bother N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2ccc3c(c2[nH]1)CCCC3 ZINC000587263541 FG Annotated Bother COc1cc(OCc2nc3cc(F)c(F)c(F)c3[nH]2)ccc1[N+](=O)[O-] ZINC000587263578 FG Annotated Bother COc1cc2nc(COc3ccc([N+](=O)[O-])c(OC)c3)[nH]c2cc1OC ZINC000587263632 FG Annotated Bother Cc1ccc2c(ccc3nc(C[C@@H]4C(=O)C[C@H](C)[C@@H]4C[N+](=O)[O-])[nH]c32)n1 ZINC000587263686 FG Annotated Bother Cc1ccc2c(ccc3nc(C[C@@H]4C(=O)C[C@@H](C)[C@H]4C[N+](=O)[O-])[nH]c32)n1 ZINC000587263687 FG Annotated Bother Cc1ccc2c(ccc3nc(C[C@@H]4C(=O)C[C@H](C)[C@H]4C[N+](=O)[O-])[nH]c32)n1 ZINC000587263688 FG Annotated Bother Cc1ccc2c(ccc3nc(C[C@@H]4C(=O)C[C@@H](C)[C@@H]4C[N+](=O)[O-])[nH]c32)n1 ZINC000587263689 FG Annotated Bother Cc1ccc2c(ccc3nc([C@@H](N)Cc4ccc(O)c([N+](=O)[O-])c4)[nH]c32)n1 ZINC000587263758 FG Annotated Bother CC(C)Oc1ccc2nc([C@@H](N)Cc3ccc(O)c([N+](=O)[O-])c3)[nH]c2c1 ZINC000587263772 FG Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3cc(C(F)(F)F)c(F)cc3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587263939 FG Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3cc(C(F)(F)F)c(F)cc3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587263941 FG Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3cc(C(F)(F)F)c(F)cc3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587263942 FG Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3cc(C(F)(F)F)c(F)cc3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587263944 FG Annotated Bother N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000587264086 FG Annotated Bother COc1cc2nc([C@@H](N)Cc3ccc(O)c([N+](=O)[O-])c3)[nH]c2cc1Cl ZINC000587264118 FG Annotated Bother O=[N+]([O-])c1ccc(Cc2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)c([N+](=O)[O-])c1 ZINC000587264231 FG Annotated Bother N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000587264252 FG Annotated Bother O=[N+]([O-])c1ccc(Cc2nc3cc4c(cc3[nH]2)OCCCO4)c([N+](=O)[O-])c1 ZINC000587264277 FG Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3cc(F)cc(C(F)(F)F)c3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587264350 FG Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3cc(F)cc(C(F)(F)F)c3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587264351 FG Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3cc(F)cc(C(F)(F)F)c3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587264352 FG Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3cc(F)cc(C(F)(F)F)c3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587264353 FG Annotated Bother N#Cc1cc(Cl)c2[nH]c(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])nc2c1 ZINC000587264373 FG Annotated Mild C[C@@H]1CC(=O)[C@H](Cc2nc3cc(Cl)c(F)c(F)c3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587264424 FG Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3cc(Cl)c(F)c(F)c3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587264425 FG Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3cc(Cl)c(F)c(F)c3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587264426 FG Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3cc(Cl)c(F)c(F)c3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587264427 FG Annotated Bother COCCOc1ccc(-c2nc3cc(Cl)nc(C#N)c3[nH]2)cc1[N+](=O)[O-] ZINC000587264561 FG Annotated Mild C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2ccc(CO)cc2[nH]1 ZINC000587264605 FG Annotated Bother N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2cc(Cl)c(F)c(F)c2[nH]1 ZINC000587264627 FG Annotated Bother O=[N+]([O-])c1ccc(Cc2nc3cc(C(F)(F)F)cnc3[nH]2)c([N+](=O)[O-])c1 ZINC000587264631 FG Annotated Bother COCCOc1ccc(-c2nc3cccc([N+](=O)[O-])c3[nH]2)cc1[N+](=O)[O-] ZINC000587264643 FG Annotated Bother N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000587264677 FG Annotated Bother O=[N+]([O-])c1ccc(Cc2nc3c(F)cnc(Cl)c3[nH]2)c([N+](=O)[O-])c1 ZINC000587265077 FG Annotated Bother O=[N+]([O-])c1ccccc1-c1ccc(-c2nc3cc(-n4cnnn4)ccc3[nH]2)o1 ZINC000587265101 FG Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cc3c(cc2[nH]1)OCO3 ZINC000587265106 FG Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2ccc(CCO)cc2[nH]1 ZINC000587265114 FG Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cccc(C#N)c2[nH]1 ZINC000587265132 FG Annotated Mild N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2cccc(C(F)(F)F)c2[nH]1 ZINC000587265222 FG Annotated Bother COCCOc1ccc(-c2nc3cc(OC)cc(OC)c3[nH]2)cc1[N+](=O)[O-] ZINC000587265255 FG Annotated Bother CC(C)(C)c1ccc2nc([C@@H](N)Cc3ccc(O)c([N+](=O)[O-])c3)[nH]c2n1 ZINC000587265520 FG Annotated Bother N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2cc(Cl)cc(F)c2[nH]1 ZINC000587265841 FG Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2ccc([N+](=O)[O-])cc2[nH]1 ZINC000587265887 FG Annotated Bother Cc1cc2[nH]c(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])nc2cc1[N+](=O)[O-] ZINC000587265909 FG Annotated Bother N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000587265929 FG Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cccc(C(=O)O)c2[nH]1 ZINC000587265938 FG Annotated Bother N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2cc(Cl)c(F)cc2[nH]1 ZINC000587266036 FG Annotated Bother O=[N+]([O-])c1ccc(Cc2nc3cc(F)c(F)c(F)c3[nH]2)c([N+](=O)[O-])c1 ZINC000587266095 FG Annotated Bother O=[N+]([O-])c1ccc(Cc2nc3cc(C(F)(F)F)ncc3[nH]2)c([N+](=O)[O-])c1 ZINC000587266101 FG Annotated Bother N=c1nc2nc(-c3ccc(-c4ccccc4[N+](=O)[O-])o3)[nH]c2c(Cl)[nH]1 ZINC000587266125 FG Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2ccc(C#N)cc2[nH]1 ZINC000587266220 FG Annotated Mild C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cccc([N+](=O)[O-])c2[nH]1 ZINC000587266227 FG Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cc3cn[nH]c3cc2[nH]1 ZINC000587266257 FG Annotated Bother Cc1cccc2nc([C@@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@@H](C)O)[nH]c12 ZINC000587266323 FG Annotated Bother O=[N+]([O-])c1ccccc1-c1ccc(-c2nc3c(O)nc(S)nc3[nH]2)o1 ZINC000587266325 FG Annotated Bother Cc1cccc2nc([C@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H](C)O)[nH]c12 ZINC000587266327 FG Annotated Bother Cc1cccc2nc([C@@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H](C)O)[nH]c12 ZINC000587266330 FG Annotated Bother Cc1cccc2nc([C@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@@H](C)O)[nH]c12 ZINC000587266331 FG Annotated Bother COCCNc1ccc(-c2nc3cccc([N+](=O)[O-])c3[nH]2)cc1[N+](=O)[O-] ZINC000587266481 FG Annotated Bother N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC000587266514 FG Annotated Bother COC(=O)c1cc(Cl)c2[nH]c([C@@H](C)n3ncc([N+](=O)[O-])c3C)nc2c1 ZINC000587266824 FG Annotated Bother COC(=O)c1cc(Cl)c2[nH]c([C@H](C)n3ncc([N+](=O)[O-])c3C)nc2c1 ZINC000587266825 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2cc(Br)c(F)cc2[nH]1 ZINC000587266829 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2cc(Br)c(F)cc2[nH]1 ZINC000587266831 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2ccc(Br)cc2[nH]1 ZINC000587267271 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2ccc(Br)cc2[nH]1 ZINC000587267273 FG Annotated Bother Cc1ccc2nc([C@@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@@H](C)O)[nH]c2c1 ZINC000587267330 FG Annotated Bother Cc1ccc2nc([C@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H](C)O)[nH]c2c1 ZINC000587267331 FG Annotated Bother Cc1ccc2nc([C@@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@H](C)O)[nH]c2c1 ZINC000587267332 FG Annotated Bother Cc1ccc2nc([C@H](Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[C@@H](C)O)[nH]c2c1 ZINC000587267334 FG Annotated Bother Cc1nn(Cc2ccccc2-c2nc3ccnc(O)c3[nH]2)c(C)c1[N+](=O)[O-] ZINC000587267340 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2ccc(Br)c(O)c2[nH]1 ZINC000587267363 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2ccc(Br)c(O)c2[nH]1 ZINC000587267366 FG Annotated Bother Nc1ncc(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)cc1[N+](=O)[O-] ZINC000587267587 FG Annotated Bother Nc1ncc(-c2nc3cc(F)cc(Br)c3[nH]2)cc1[N+](=O)[O-] ZINC000587267591 FG Annotated Bother Nc1ncc(-c2nc3ccc(Br)c(F)c3[nH]2)cc1[N+](=O)[O-] ZINC000587267598 FG Annotated Bother CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587267630 FG Annotated Bother Nc1ncc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1[N+](=O)[O-] ZINC000587267657 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2cc(Br)cc(F)c2[nH]1 ZINC000587267660 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2cc(Br)cc(F)c2[nH]1 ZINC000587267661 FG Annotated Bother Cc1nc2[nH]c([C@@H](C)n3ncc([N+](=O)[O-])c3C)nc2cc1Br ZINC000587267692 FG Annotated Bother Cc1nc2[nH]c([C@H](C)n3ncc([N+](=O)[O-])c3C)nc2cc1Br ZINC000587267696 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2ccc(F)c(Br)c2[nH]1 ZINC000587267823 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2ccc(F)c(Br)c2[nH]1 ZINC000587267824 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000587267832 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000587267834 FG Annotated Bother Nc1ncc(-c2nc3ccc(F)c(Br)c3[nH]2)cc1[N+](=O)[O-] ZINC000587267837 FG Annotated Bother CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000587267845 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1 ZINC000587267851 FG Annotated Mild Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1 ZINC000587267852 FG Annotated Mild CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587267907 FG Annotated Bother Cc1c(Br)cc2nc(-c3cnc(N)c([N+](=O)[O-])c3)[nH]c2c1C ZINC000587267961 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2cccc(Br)c2[nH]1 ZINC000587267983 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2cccc(Br)c2[nH]1 ZINC000587267984 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2cccc(OC(F)(F)F)c2[nH]1 ZINC000587268018 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2cccc(OC(F)(F)F)c2[nH]1 ZINC000587268019 FG Annotated Bother CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000587268058 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000587268090 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000587268091 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2ccc(Br)c(F)c2[nH]1 ZINC000587268105 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2ccc(Br)c(F)c2[nH]1 ZINC000587268107 FG Annotated Bother Cc1c(Br)cnc2[nH]c([C@@H](C)n3ncc([N+](=O)[O-])c3C)nc12 ZINC000587268139 FG Annotated Bother Cc1c(Br)cnc2[nH]c([C@H](C)n3ncc([N+](=O)[O-])c3C)nc12 ZINC000587268140 FG Annotated Bother CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2cc3c(cc2[nH]1)OC(F)(F)O3 ZINC000587268148 FG Annotated Bother Nc1ncc(-c2nc3cc(Br)c(F)cc3[nH]2)cc1[N+](=O)[O-] ZINC000587268149 FG Annotated Bother Nc1ncc(-c2nc3cc(Br)c(F)c(F)c3[nH]2)cc1[N+](=O)[O-] ZINC000587268179 FG Annotated Bother Nc1ncc(-c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)cc1[N+](=O)[O-] ZINC000587268209 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2cc(F)cc(Br)c2[nH]1 ZINC000587268228 FG Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2cc(F)cc(Br)c2[nH]1 ZINC000587268229 FG Annotated Bother CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000587268341 FG Annotated Bother Nc1ncc(-c2nc3cc(Br)cc(F)c3[nH]2)cc1[N+](=O)[O-] ZINC000587268354 FG Annotated Bother N#Cc1cc(Br)c2[nH]c(CNc3ncccc3[N+](=O)[O-])nc2c1 ZINC000587268407 FG Annotated Mild CCOC(=O)c1ccc2nc(Cc3c([N+](=O)[O-])cnn3C(C)C)[nH]c2c1 ZINC000587268451 FG Annotated Bother CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587268453 FG Annotated Bother Cc1oc(-c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)cc1[N+](=O)[O-] ZINC000587268510 FG Annotated Bother O=[N+]([O-])c1cccnc1NCc1nc2cc(F)cc(Br)c2[nH]1 ZINC000587268582 FG Annotated Bother O=[N+]([O-])c1cccnc1NCc1nc2cc(Br)c(F)cc2[nH]1 ZINC000587268590 FG Annotated Bother O=[N+]([O-])c1cccnc1NCc1nc2cccc(OC(F)(F)F)c2[nH]1 ZINC000587268636 FG Annotated Bother O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3cc([N+](=O)[O-])cnc3[nH]2)c1 ZINC000587268658 FG Annotated Bother O=[N+]([O-])c1cccnc1NCc1nc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000587268678 FG Annotated Bother O=Cc1cc([N+](=O)[O-])ccc1OCc1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587268718 FG Annotated Bother O=[N+]([O-])c1cccnc1NCc1nc2ccc(F)c(Br)c2[nH]1 ZINC000587268725 FG Annotated Bother O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3ccc(CCO)cc3[nH]2)c1 ZINC000587268734 FG Annotated Bother O=Cc1cc([N+](=O)[O-])ccc1OCc1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000587268781 FG Annotated Bother Cc1cnc(Cl)c2[nH]c(-c3cn(-c4cccc([N+](=O)[O-])c4)nn3)nc12 ZINC000587268858 FG Annotated Bother Cc1oc(-c2nc3ncc(I)cc3[nH]2)cc1[N+](=O)[O-] ZINC000587268860 FG Annotated Bother O=[N+]([O-])c1cccc(-n2cc(-c3nc4ccc5ncccc5c4[nH]3)nn2)c1 ZINC000587268866 FG Annotated Bother N[C@@H](N=O)c1ccc2nc(-c3cc([N+](=O)[O-])ccc3N3CCCC3)[nH]c2c1 ZINC000587269033 FG Annotated Bother N[C@H](N=O)c1ccc2nc(-c3cc([N+](=O)[O-])ccc3N3CCCC3)[nH]c2c1 ZINC000587269034 FG Annotated Bother O=[N+]([O-])c1cccnc1NCc1nc2cc(Br)cc(F)c2[nH]1 ZINC000587269103 FG Annotated Bother N#Cc1cc2nc(CNc3ncccc3[N+](=O)[O-])[nH]c2cc1C(F)(F)F ZINC000587269120 FG Annotated Mild CSc1ccc2nc(-c3cn(-c4cccc([N+](=O)[O-])c4)nn3)[nH]c2c1 ZINC000587269153 FG Annotated Bother N#Cc1cc(Cl)c2[nH]c(-c3cn(-c4cccc([N+](=O)[O-])c4)nn3)nc2c1 ZINC000587269214 FG Annotated Mild O=C(c1ccc([N+](=O)[O-])cc1)N1CCC(c2nc3cc(F)cnc3[nH]2)CC1 ZINC000587269248 FG Annotated Bother O=Cc1cc([N+](=O)[O-])ccc1OCc1nc2cc(F)c(F)c(F)c2[nH]1 ZINC000587269364 FG Annotated Bother CN(C)CCOc1ccc2nc(CCc3cccc([N+](=O)[O-])c3)[nH]c2c1 ZINC000587269445 FG Annotated Bother N[C@@H](CCc1nc2cccc(Cl)c2[nH]1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000587269515 FG Annotated Bother Cc1ccnc2[nH]c(C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)nc12 ZINC000587269577 FG Annotated Bother O=[N+]([O-])c1cccnc1NCc1nc2ccc(Br)c(F)c2[nH]1 ZINC000587269580 FG Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000587269594 FG Annotated Bother COc1cc2nc(-c3cn(-c4cccc([N+](=O)[O-])c4)nn3)[nH]c2cc1C ZINC000587269664 FG Annotated Bother O=[N+]([O-])c1cccc(-n2cc(-c3nc4cnc5ccccc5c4[nH]3)nn2)c1 ZINC000587269746 FG Annotated Bother O=[N+]([O-])c1cccc(CCc2nc3ccc(CN4CCOCC4)cc3[nH]2)c1 ZINC000587269806 FG Annotated Bother O=Cc1cc([N+](=O)[O-])ccc1OCc1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000587269825 FG Annotated Bother N=c1[nH]c2nc(-c3cncc(-c4cccc([N+](=O)[O-])c4)c3)nc-2c(Cl)[nH]1 ZINC000587269865 FG Annotated Bother O=Cc1cc([N+](=O)[O-])ccc1OCc1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587269967 FG Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000587270065 FG Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cc3c(cc2[nH]1)OC(F)(F)O3 ZINC000587270074 FG Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000587270083 FG Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000587270103 FG Annotated Bother Cc1cc2[nH]c(COc3ccc([N+](=O)[O-])cc3C=O)nc2cc1[N+](=O)[O-] ZINC000587270327 FG Annotated Bother O=Cc1cc([N+](=O)[O-])ccc1OCc1nc2c(F)cnc(Cl)c2[nH]1 ZINC000587270350 FG Annotated Bother O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3c(S)nc(S)nc3[nH]2)c1 ZINC000587270386 FG Annotated Bother N#Cc1cc(Cl)c2[nH]c(COc3ccc([N+](=O)[O-])cc3C=O)nc2c1 ZINC000587270415 FG Annotated Mild O=C(O)c1cccc2nc(-c3cc([N+](=O)[O-])ccc3N3CCCC3)[nH]c12 ZINC000587270433 FG Annotated Bother O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3cc4c(cc3[nH]2)OCO4)c1 ZINC000587270453 FG Annotated Bother O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3cncc([N+](=O)[O-])c3[nH]2)c1 ZINC000587270469 FG Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587270513 FG Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000587270544 FG Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cccc(Br)c2[nH]1 ZINC000587270546 FG Annotated Bother CC(C)(C)c1ccc2nc(-c3cn(-c4cccc([N+](=O)[O-])c4)nn3)[nH]c2n1 ZINC000587270586 FG Annotated Bother O=[N+]([O-])c1cccc(-n2cc(-c3nc4cc(F)c(F)c(F)c4[nH]3)nn2)c1 ZINC000587270606 FG Annotated Bother COc1cc2nc(-c3cn(-c4cccc([N+](=O)[O-])c4)nn3)[nH]c2cc1Cl ZINC000587270685 FG Annotated Bother Cc1cncc2nc(C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)[nH]c12 ZINC000587270806 FG Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587270821 FG Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000587270859 FG Annotated Bother O=[N+]([O-])c1cccc(CCc2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)c1 ZINC000587270867 FG Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2ccc(Br)cc2[nH]1 ZINC000587270992 FG Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000587271035 FG Annotated Bother O=[N+]([O-])c1ccc(Oc2cccc(-c3nc4c(O)nc(O)nc4[nH]3)c2)cc1 ZINC000587271263 FG Annotated Bother CC(C)(C(=O)Cl)C(=O)c1c(CO)oc2cc(Br)cnc12 ZINC000587272701 FG Annotated Reactive C[C@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cccc(OC(F)(F)F)c2[nH]1 ZINC000587272703 FG Annotated Bother C[C@@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cccc(OC(F)(F)F)c2[nH]1 ZINC000587272706 FG Annotated Bother O=C(CC1CCOCC1)c1c(CO)oc2cc(Br)cnc12 ZINC000587272773 FG Annotated Anodyne Cc1ncc([N+](=O)[O-])n1Cc1nc2cc3nc4ccccc4nc3cc2[nH]1 ZINC000587272783 FG Annotated Bother O=[N+]([O-])c1ccn(CCCc2nc3cccc(OC(F)(F)F)c3[nH]2)n1 ZINC000587272840 FG Annotated Bother O=[N+]([O-])c1ccn(CCCc2nc3cc(Br)c(F)cc3[nH]2)n1 ZINC000587272913 FG Annotated Bother O=C(Cl)CCCC(=O)c1c(CO)oc2cc(Br)cnc12 ZINC000587272927 FG Annotated Reactive O=[N+]([O-])c1ccn(CCCc2nc3ccc(Br)cc3[nH]2)n1 ZINC000587272944 FG Annotated Bother O=[N+]([O-])c1ccn(CCCc2nc3cc(C(F)(F)F)c(F)cc3[nH]2)n1 ZINC000587272954 FG Annotated Bother C[C@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1 ZINC000587272955 FG Annotated Mild C[C@@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1 ZINC000587272958 FG Annotated Mild O=[N+]([O-])c1ccn(CCCc2nc3ccc(F)c(Br)c3[nH]2)n1 ZINC000587272970 FG Annotated Bother O=[N+]([O-])c1ccn(CCCc2nc3cc(F)cc(Br)c3[nH]2)n1 ZINC000587272997 FG Annotated Bother C[C@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cc(Br)c(F)cc2[nH]1 ZINC000587273088 FG Annotated Bother C[C@@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cc(Br)c(F)cc2[nH]1 ZINC000587273090 FG Annotated Bother O=C(COc1ccccc1)c1c(CO)oc2cc(Br)cnc12 ZINC000587273117 FG Annotated Anodyne Cc1ncc([N+](=O)[O-])n1Cc1nc2ccc(Oc3ccc(N)cc3)cc2[nH]1 ZINC000587273221 FG Annotated Clean C[C@H](Cn1cc([N+](=O)[O-])cn1)c1nc2ccc(Br)c(F)c2[nH]1 ZINC000587273264 FG Annotated Bother C[C@@H](Cn1cc([N+](=O)[O-])cn1)c1nc2ccc(Br)c(F)c2[nH]1 ZINC000587273268 FG Annotated Bother Cc1cc(Br)c2[nH]c(Cn3c([N+](=O)[O-])cnc3C)nc2c1 ZINC000587273560 FG Annotated Bother O=[N+]([O-])c1ccn(CCCc2nc3cc(F)cc(C(F)(F)F)c3[nH]2)n1 ZINC000587273622 FG Annotated Bother Cn1nc([N+](=O)[O-])cc1-c1nc2cc(Cl)cc(Br)c2[nH]1 ZINC000587273627 FG Annotated Bother Cc1ncc([N+](=O)[O-])n1Cc1nc2c3cccnc3c3ncccc3c2[nH]1 ZINC000587273678 FG Annotated Bother O=[N+]([O-])c1ccn(CCCc2nc3cc(Br)cc(F)c3[nH]2)n1 ZINC000587273840 FG Annotated Bother Cc1cc(Br)cc2nc(CCCn3ccc([N+](=O)[O-])n3)[nH]c12 ZINC000587273892 FG Annotated Bother COC1(C(=O)c2c(CO)oc3cc(Br)cnc23)CCCC1 ZINC000587273997 FG Annotated Anodyne O=C(CCBr)c1c(CO)oc2cc(Br)cnc12 ZINC000587274043 FG Annotated Reactive Cc1ncc([N+](=O)[O-])n1Cc1nc2cc(Cl)cc(Br)c2[nH]1 ZINC000587274095 FG Annotated Bother N#Cc1cc2nc(CCCn3ccc([N+](=O)[O-])n3)[nH]c2cc1C(F)(F)F ZINC000587274096 FG Annotated Mild C[C@H](Cn1cc([N+](=O)[O-])cn1)c1nc2ccc(F)c(Br)c2[nH]1 ZINC000587274158 FG Annotated Bother C[C@@H](Cn1cc([N+](=O)[O-])cn1)c1nc2ccc(F)c(Br)c2[nH]1 ZINC000587274160 FG Annotated Bother Cc1ncc([N+](=O)[O-])n1Cc1nc2cc(Br)cc(Cl)c2[nH]1 ZINC000587274161 FG Annotated Bother Cc1cc(Br)c2[nH]c(CCCn3ccc([N+](=O)[O-])n3)nc2c1 ZINC000587274240 FG Annotated Bother O=[N+]([O-])c1ccn(CCCc2nc3cc4nc5ccccc5nc4cc3[nH]2)n1 ZINC000587274409 FG Annotated Bother O=[N+]([O-])c1ccn(CCCc2nc3c4cccnc4c4ncccc4c3[nH]2)n1 ZINC000587274417 FG Annotated Bother O=[N+]([O-])c1ccn(CCCc2nc3ccc(Br)c(F)c3[nH]2)n1 ZINC000587274440 FG Annotated Bother Cc1cc2nc(Cn3c([N+](=O)[O-])cnc3C)[nH]c2cc1Br ZINC000587274495 FG Annotated Bother Cc1ncc([N+](=O)[O-])n1Cc1nc2ccc(C(=O)c3ccccc3)cc2[nH]1 ZINC000587274507 FG Annotated Bother C[C@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cc(Br)cc(F)c2[nH]1 ZINC000587274616 FG Annotated Bother C[C@@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cc(Br)cc(F)c2[nH]1 ZINC000587274620 FG Annotated Bother C[C@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cc(F)cc(Br)c2[nH]1 ZINC000587274656 FG Annotated Bother C[C@@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cc(F)cc(Br)c2[nH]1 ZINC000587274658 FG Annotated Bother O=[N+]([O-])c1ccn(CCCc2nc3ccc(OC(F)(F)F)cc3[nH]2)n1 ZINC000587274705 FG Annotated Bother C[C@@H](Br)C(=O)c1c(CO)oc2cc(Br)cnc12 ZINC000587274706 FG Annotated Reactive C[C@H](Br)C(=O)c1c(CO)oc2cc(Br)cnc12 ZINC000587274707 FG Annotated Reactive Cn1nc([N+](=O)[O-])cc1-c1nc2cc(Br)cc(Cl)c2[nH]1 ZINC000587274736 FG Annotated Bother Cn1nc([N+](=O)[O-])cc1-c1nc2ccc(Oc3ccc(N)cc3)cc2[nH]1 ZINC000587274750 FG Annotated Clean Cc1c(Br)cc2nc(Cn3c([N+](=O)[O-])cnc3C)[nH]c2c1C ZINC000587274838 FG Annotated Bother C[C@H](Cn1cc([N+](=O)[O-])cn1)c1nc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000587274849 FG Annotated Bother C[C@@H](Cn1cc([N+](=O)[O-])cn1)c1nc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000587274851 FG Annotated Bother Cc1c(Br)ccc2nc(Cn3c([N+](=O)[O-])cnc3C)[nH]c12 ZINC000587274908 FG Annotated Bother Cc1cc(Br)cc2nc(Cn3c([N+](=O)[O-])cnc3C)[nH]c12 ZINC000587274971 FG Annotated Bother Cn1nc([N+](=O)[O-])cc1-c1nc2cc(OC(F)(F)F)c(Cl)cc2[nH]1 ZINC000587275078 FG Annotated Bother Cc1c(Br)ccc2nc(CCCn3ccc([N+](=O)[O-])n3)[nH]c12 ZINC000587275081 FG Annotated Bother Cc1cc2nc(CCCn3ccc([N+](=O)[O-])n3)[nH]c2cc1Br ZINC000587275151 FG Annotated Bother Cc1c(Br)cc2nc(-c3cc([N+](=O)[O-])nn3C)[nH]c2c1C ZINC000587275158 FG Annotated Bother O=[N+]([O-])c1ccn(CCCc2nc3cccc(Br)c3[nH]2)n1 ZINC000587275166 FG Annotated Bother Cc1cc(Br)cc2nc([C@@H](C)n3cc([N+](=O)[O-])cn3)[nH]c12 ZINC000587275251 FG Annotated Bother Cc1cc(Br)cc2nc([C@H](C)n3cc([N+](=O)[O-])cn3)[nH]c12 ZINC000587275252 FG Annotated Bother C[C@@H](c1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587275269 FG Annotated Bother C[C@H](c1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587275270 FG Annotated Bother C[C@H](Cn1cc([N+](=O)[O-])cn1)c1nc2ccc(Br)cc2[nH]1 ZINC000587275353 FG Annotated Bother C[C@@H](Cn1cc([N+](=O)[O-])cn1)c1nc2ccc(Br)cc2[nH]1 ZINC000587275354 FG Annotated Bother C[C@@H](c1nc2ccc(F)c(Br)c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587275361 FG Annotated Bother C[C@H](c1nc2ccc(F)c(Br)c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587275362 FG Annotated Bother C[C@@H](c1nc2cc(Br)c(F)cc2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587275549 FG Annotated Bother C[C@H](c1nc2cc(Br)c(F)cc2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587275551 FG Annotated Bother O=C(/C=C/C(F)(F)F)c1c(CO)oc2cc(Br)cnc12 ZINC000587275580 FG Annotated Mild O=C(c1ccnc(Cl)c1)c1c(CO)oc2cc(Br)cnc12 ZINC000587275807 FG Annotated Anodyne COC1CCC(C(=O)c2c(CO)oc3cc(Br)cnc23)CC1 ZINC000587275812 FG Annotated Anodyne C[C@@H](c1nc2ccc(Br)c(F)c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587275818 FG Annotated Bother C[C@H](c1nc2ccc(Br)c(F)c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587275819 FG Annotated Bother Cc1cc2nc([C@@H](C)n3cc([N+](=O)[O-])cn3)[nH]c2cc1Br ZINC000587275831 FG Annotated Bother Cc1cc2nc([C@H](C)n3cc([N+](=O)[O-])cn3)[nH]c2cc1Br ZINC000587275832 FG Annotated Bother O=C=Nc1ccc(C(=O)c2c(CO)oc3cc(Br)cnc23)cc1 ZINC000587275848 FG Annotated Reactive CC(C)n1nccc1C(=O)c1c(CO)oc2cc(Br)cnc12 ZINC000587275919 FG Annotated Anodyne O=C(c1ccc(Cl)cn1)c1c(CO)oc2cc(Br)cnc12 ZINC000587275927 FG Annotated Anodyne Cc1c(Br)ccc2nc([C@@H](C)n3cc([N+](=O)[O-])cn3)[nH]c12 ZINC000587276053 FG Annotated Bother Cc1c(Br)ccc2nc([C@H](C)n3cc([N+](=O)[O-])cn3)[nH]c12 ZINC000587276054 FG Annotated Bother C[C@@H](c1nc2c3cccnc3c3ncccc3c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587276073 FG Annotated Bother C[C@H](c1nc2c3cccnc3c3ncccc3c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587276074 FG Annotated Bother Cc1nc(C(=O)c2c(CO)oc3cc(Br)cnc23)cs1 ZINC000587276100 FG Annotated Anodyne O=C(c1csc(Cl)n1)c1c(CO)oc2cc(Br)cnc12 ZINC000587276148 FG Annotated Anodyne COc1ccsc1C(=O)c1c(CO)oc2cc(Br)cnc12 ZINC000587276156 FG Annotated Anodyne O=C(c1c(CO)oc2cc(Br)cnc12)[C@@H](Cl)CCl ZINC000587276209 FG Annotated Reactive O=C(c1c(CO)oc2cc(Br)cnc12)[C@H](Cl)CCl ZINC000587276211 FG Annotated Reactive O=C(c1cccc(F)c1)c1c(CO)oc2cc(Br)cnc12 ZINC000587276220 FG Annotated Anodyne O=Cc1ccc(C(=O)c2c(CO)oc3cc(Br)cnc23)cc1 ZINC000587276277 FG Annotated Anodyne CC(C)n1ccc(C(=O)c2c(CO)oc3cc(Br)cnc23)n1 ZINC000587276357 FG Annotated Anodyne O=C(c1cc(Cl)ccn1)c1c(CO)oc2cc(Br)cnc12 ZINC000587276389 FG Annotated Anodyne Cc1cc(Br)c2[nH]c([C@@H](C)n3cc([N+](=O)[O-])cn3)nc2c1 ZINC000587276567 FG Annotated Bother Cc1cc(Br)c2[nH]c([C@H](C)n3cc([N+](=O)[O-])cn3)nc2c1 ZINC000587276568 FG Annotated Bother C[C@H](c1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587276648 FG Annotated Mild C[C@@H](c1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587276649 FG Annotated Mild COc1ccccc1C(=O)c1c(CO)oc2cc(Br)cnc12 ZINC000587276688 FG Annotated Anodyne O=C(c1cccnc1Cl)c1c(CO)oc2cc(Br)cnc12 ZINC000587276696 FG Annotated Anodyne Cc1nc(C)c(C(=O)c2c(CO)oc3cc(Br)cnc23)s1 ZINC000587276741 FG Annotated Anodyne Cc1ncsc1C(=O)c1c(CO)oc2cc(Br)cnc12 ZINC000587276746 FG Annotated Anodyne O=C(c1ccccc1F)c1c(CO)oc2cc(Br)cnc12 ZINC000587276843 FG Annotated Anodyne Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc[nH]c(=N)c3[nH]1)[C@@H]1CC=C[C@@H]21 ZINC000587276867 FG Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc[nH]c(=N)c3[nH]1)[C@H]1CC=C[C@H]21 ZINC000587276868 FG Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc[nH]c(=N)c3[nH]1)[C@@H]1CC=C[C@H]21 ZINC000587276869 FG Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc[nH]c(=N)c3[nH]1)[C@H]1CC=C[C@@H]21 ZINC000587276870 FG Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc(=N)[nH]cc3[nH]1)[C@@H]1CC=C[C@@H]21 ZINC000587276883 FG Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc(=N)[nH]cc3[nH]1)[C@@H]1CC=C[C@H]21 ZINC000587276884 FG Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc(=N)[nH]cc3[nH]1)[C@H]1CC=C[C@H]21 ZINC000587276885 FG Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc(=N)[nH]cc3[nH]1)[C@H]1CC=C[C@@H]21 ZINC000587276886 FG Annotated Clean O=C=Nc1cccc(C(=O)c2c(CO)oc3cc(Br)cnc23)c1 ZINC000587276959 FG Annotated Reactive O=C(c1c(CO)oc2cc(Br)cnc12)[C@@H]1COc2ccccc21 ZINC000587276961 FG Annotated Anodyne O=C(c1c(CO)oc2cc(Br)cnc12)[C@H]1COc2ccccc21 ZINC000587276963 FG Annotated Anodyne O=C(c1c(CO)oc2cc(Br)cnc12)C(F)(F)C(F)F ZINC000587276968 FG Annotated Anodyne O=C(c1ccc(F)cc1)c1c(CO)oc2cc(Br)cnc12 ZINC000587277026 FG Annotated Anodyne N#Cc1cccc(C(=O)c2c(CO)oc3cc(Br)cnc23)c1 ZINC000587277027 FG Annotated Mild N#Cc1ccc(C(=O)c2c(CO)oc3cc(Br)cnc23)cc1 ZINC000587277039 FG Annotated Mild O=C(c1ccc(Cl)nc1)c1c(CO)oc2cc(Br)cnc12 ZINC000587277104 FG Annotated Anodyne C[C@@H](c1nc2cc(F)cc(Br)c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587277138 FG Annotated Bother C[C@H](c1nc2cc(F)cc(Br)c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587277139 FG Annotated Bother C[C@@H](c1nc2cc(Br)cc(F)c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587277192 FG Annotated Bother C[C@H](c1nc2cc(Br)cc(F)c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587277193 FG Annotated Bother Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3c(O)ncnc3[nH]1)[C@@H]1CC=C[C@@H]21 ZINC000587277284 FG Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3c(O)ncnc3[nH]1)[C@H]1CC=C[C@H]21 ZINC000587277285 FG Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3c(O)ncnc3[nH]1)[C@H]1CC=C[C@@H]21 ZINC000587277286 FG Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3c(O)ncnc3[nH]1)[C@@H]1CC=C[C@H]21 ZINC000587277287 FG Annotated Clean C[C@H](c1nc2cc(Br)c(F)c(F)c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587277296 FG Annotated Bother C[C@@H](c1nc2cc(Br)c(F)c(F)c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587277297 FG Annotated Bother Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cnnc(O)c3[nH]1)[C@@H]1CC=C[C@@H]21 ZINC000587277298 FG Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cnnc(O)c3[nH]1)[C@H]1CC=C[C@H]21 ZINC000587277299 FG Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cnnc(O)c3[nH]1)[C@@H]1CC=C[C@H]21 ZINC000587277300 FG Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cnnc(O)c3[nH]1)[C@H]1CC=C[C@@H]21 ZINC000587277301 FG Annotated Clean C[C@@H](c1nc2cc3nc4ccccc4nc3cc2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587277428 FG Annotated Bother C[C@H](c1nc2cc3nc4ccccc4nc3cc2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587277429 FG Annotated Bother C[C@H](c1nc2c(Cl)c(Br)cnc2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587277468 FG Annotated Bother C[C@@H](c1nc2c(Cl)c(Br)cnc2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587277469 FG Annotated Bother C[C@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000587277500 FG Annotated Bother C[C@@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000587277501 FG Annotated Bother C[C@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cccc(Br)c2[nH]1 ZINC000587277538 FG Annotated Bother C[C@@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cccc(Br)c2[nH]1 ZINC000587277539 FG Annotated Bother C[C@H](c1nc2c(Br)cnc(Cl)c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587277596 FG Annotated Bother C[C@@H](c1nc2c(Br)cnc(Cl)c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587277597 FG Annotated Bother N#Cc1ccc2c(C(=O)c3nn4cccnc4c3Br)coc2c1 ZINC000587278492 FG Annotated Mild COc1ccc(S(=O)(=O)CCC(=O)c2coc3cc(C#N)ccc23)cc1 ZINC000587278597 FG Annotated Mild N#Cc1ccc2c(C(=O)CCS(=O)(=O)c3ccc(F)cc3)coc2c1 ZINC000587278917 FG Annotated Mild O=C(c1ccc(N2C(=O)C=CC2=O)cc1)c1coc2cc([N+](=O)[O-])ccc12 ZINC000587279022 FG Annotated Bother Cn1cc(Br)c(C(=O)c2coc3cc([N+](=O)[O-])ccc23)n1 ZINC000587279027 FG Annotated Bother Cc1cc([N+](=O)[O-])nn1CCCC(=O)c1coc2cc([N+](=O)[O-])ccc12 ZINC000587279053 FG Annotated Bother N#Cc1ccc2c(C(=O)c3cc4ncc(Br)cn4n3)coc2c1 ZINC000587279130 FG Annotated Mild O=C(c1coc2cc([N+](=O)[O-])ccc12)C1(Br)CCOCC1 ZINC000587279590 FG Annotated Bother C[C@@H](C(=O)c1coc2cc([N+](=O)[O-])ccc12)N1C(=O)c2ccccc2C1=O ZINC000587279717 FG Annotated Bother C[C@H](C(=O)c1coc2cc([N+](=O)[O-])ccc12)N1C(=O)c2ccccc2C1=O ZINC000587279718 FG Annotated Bother O=C(c1cccc(S(=O)(=O)Cl)c1)c1coc2cc([N+](=O)[O-])ccc12 ZINC000587279775 FG Annotated Unstable O=C(c1coc2cc([N+](=O)[O-])ccc12)[C@@H]1CCCN1C(=O)C(F)(F)F ZINC000587279821 FG Annotated Bother O=C(c1cccc(N2C(=O)C=CC2=O)c1)c1coc2cc([N+](=O)[O-])ccc12 ZINC000587279916 FG Annotated Bother O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1coc2cc([N+](=O)[O-])ccc12 ZINC000587279963 FG Annotated Bother O=C(CCS(=O)(=O)c1ccccc1)c1coc2cc([N+](=O)[O-])ccc12 ZINC000587280473 FG Annotated Bother O=C(c1ccc(S(=O)(=O)N2CCCC2)cc1)c1coc2ccccc12 ZINC000587280898 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](CCl)(c2cnon2)[C@@H]1c1ccc(F)cc1 ZINC000587327473 FG Annotated Reactive O=C1c2ccc(O)cc2O[C@](CCl)(c2cnon2)[C@H]1c1ccc(F)cc1 ZINC000587327478 FG Annotated Reactive O=C1c2ccc(O)cc2O[C@](CCl)(c2cnon2)[C@@H]1c1ccc(F)cc1 ZINC000587327479 FG Annotated Reactive O=C1c2ccc(O)cc2O[C@@](CCl)(c2cnon2)[C@H]1c1ccc(F)cc1 ZINC000587327480 FG Annotated Reactive C[C@@]1(c2c[nH]c(=N)o2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587330554 FG Annotated Anodyne C[C@@]1(c2c[nH]c(=N)o2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587330555 FG Annotated Anodyne C[C@]1(c2c[nH]c(=N)o2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587330556 FG Annotated Anodyne C[C@]1(c2c[nH]c(=N)o2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587330557 FG Annotated Anodyne NC(=O)C1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587332194 FG Annotated Anodyne NC(=O)C1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587332196 FG Annotated Anodyne CN1C=C[C@]2(CC1=O)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587335646 FG Annotated Anodyne CN1C=C[C@@]2(CC1=O)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587335668 FG Annotated Anodyne CN1C=C[C@@]2(CC1=O)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587335674 FG Annotated Anodyne CN1C=C[C@]2(CC1=O)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587335683 FG Annotated Anodyne N#CCN1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587336842 FG Annotated Mild N#CCN1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587336847 FG Annotated Mild CC1=C[C@@]2(CC(=O)N1C)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587336868 FG Annotated Anodyne CC1=C[C@@]2(CC(=O)N1C)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587336874 FG Annotated Anodyne CN(C)C(=O)C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336917 FG Annotated Anodyne C[C@@H]1N(C)C=CC(=O)[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587336923 FG Annotated Mild C[C@@H]1N(C)C=CC(=O)[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587336926 FG Annotated Mild C[C@@H]1N(C)C=CC(=O)[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587336929 FG Annotated Mild CN(C)C(=O)C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336930 FG Annotated Anodyne CN(C)C(=O)C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336932 FG Annotated Anodyne C[C@@H]1N(C)C=CC(=O)[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587336933 FG Annotated Mild CN(C)C(=O)C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336935 FG Annotated Anodyne CN(C)N1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587337277 FG Annotated Anodyne CN(C)N1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587337293 FG Annotated Anodyne CC1=C[C@]2(CC(=O)N1C)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587337489 FG Annotated Anodyne CC1=C[C@]2(CC(=O)N1C)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587337492 FG Annotated Anodyne C[C@]1([C@@]2(F)CCOC2=O)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587337935 FG Annotated Anodyne C[C@]1([C@@]2(F)CCOC2=O)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587337938 FG Annotated Anodyne C[C@]1([C@]2(F)CCOC2=O)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587337947 FG Annotated Anodyne C[C@]1([C@]2(F)CCOC2=O)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587337951 FG Annotated Anodyne CN1C=CC[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)C1=O ZINC000587338927 FG Annotated Anodyne CN1C=CC[C@@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)C1=O ZINC000587338928 FG Annotated Anodyne CN1C=CC[C@@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)C1=O ZINC000587338929 FG Annotated Anodyne CN1C=CC[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)C1=O ZINC000587338930 FG Annotated Anodyne C[C@]1(c2cc[nH]c(=N)n2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587340206 FG Annotated Anodyne C[C@@]1(c2cc[nH]c(=N)n2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587340225 FG Annotated Anodyne C[C@@]1(c2cc[nH]c(=N)n2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587340228 FG Annotated Anodyne C[C@]1(c2cc[nH]c(=N)n2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587340231 FG Annotated Anodyne CC(=O)N[C@H](C)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587340916 FG Annotated Anodyne CC(=O)N[C@H](C)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587340919 FG Annotated Anodyne CC(=O)N[C@H](C)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587340923 FG Annotated Anodyne CC(=O)N[C@H](C)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587340925 FG Annotated Anodyne C[C@]1(c2nccnc2N)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587341422 FG Annotated Anodyne C[C@@]1(c2nccnc2N)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587341427 FG Annotated Anodyne C[C@@]1(c2nccnc2N)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587341430 FG Annotated Anodyne C[C@]1(c2nccnc2N)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587341434 FG Annotated Anodyne C[C@@H]1C(=O)[C@]2(C=CN1C)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587342786 FG Annotated Anodyne C[C@@H]1C(=O)[C@]2(C=CN1C)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587342789 FG Annotated Anodyne C[C@@H]1C(=O)[C@@]2(C=CN1C)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587342790 FG Annotated Anodyne C[C@@H]1C(=O)[C@@]2(C=CN1C)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587342791 FG Annotated Anodyne C[C@]1(CCn2cncn2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587343211 FG Annotated Anodyne C[C@@]1(CCn2cncn2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587343213 FG Annotated Anodyne C[C@@]1(CCn2cncn2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587343215 FG Annotated Anodyne C[C@]1(CCn2cncn2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587343218 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CN3CCC2CC3)[C@@H]1c1ccc(F)cc1 ZINC000587343366 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CN3CCC2CC3)[C@H]1c1ccc(F)cc1 ZINC000587343367 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CN3CCC2CC3)[C@H]1c1ccc(F)cc1 ZINC000587343369 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CN3CCC2CC3)[C@@H]1c1ccc(F)cc1 ZINC000587343371 FG Annotated Anodyne CC[C@@H]1CNC(=O)C[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587343542 FG Annotated Anodyne CC[C@@H]1CNC(=O)C[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587343547 FG Annotated Anodyne CC[C@@H]1CNC(=O)C[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587343548 FG Annotated Anodyne CC[C@@H]1CNC(=O)C[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587343549 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCN3CCC[C@@H]32)[C@H]1c1ccc(F)cc1 ZINC000587343620 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCN3CCC[C@@H]32)[C@@H]1c1ccc(F)cc1 ZINC000587343631 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCN3CCC[C@H]32)[C@H]1c1ccc(F)cc1 ZINC000587343637 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCN3CCC[C@H]32)[C@@H]1c1ccc(F)cc1 ZINC000587343640 FG Annotated Anodyne Cn1ncc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1N ZINC000587343794 FG Annotated Anodyne Cn1ncc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1N ZINC000587343798 FG Annotated Anodyne Cn1ncc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1N ZINC000587343801 FG Annotated Anodyne Cn1ncc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1N ZINC000587343803 FG Annotated Anodyne CC(=O)N1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587343816 FG Annotated Anodyne CC(=O)N1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587343821 FG Annotated Anodyne CC[C@]1(Cn2cncn2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587344642 FG Annotated Anodyne CC[C@@]1(Cn2cncn2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587344645 FG Annotated Anodyne CC[C@@]1(Cn2cncn2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587344646 FG Annotated Anodyne CC[C@]1(Cn2cncn2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587344647 FG Annotated Anodyne CC[C@@]1(c2ncnn2C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587345135 FG Annotated Anodyne CC[C@]1(c2ncnn2C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587345136 FG Annotated Anodyne CC[C@]1(c2ncnn2C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587345138 FG Annotated Anodyne CC[C@@]1(c2ncnn2C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587345140 FG Annotated Anodyne Cc1nonc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587345421 FG Annotated Anodyne Cc1nonc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587345427 FG Annotated Anodyne Cc1nonc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587345429 FG Annotated Anodyne Cc1nonc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587345431 FG Annotated Anodyne C[C@]1(c2ccc(O)nn2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346000 FG Annotated Anodyne C[C@@]1(c2ccc(O)nn2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346002 FG Annotated Anodyne C[C@@]1(c2ccc(O)nn2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346004 FG Annotated Anodyne C[C@]1(c2ccc(O)nn2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346006 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CC=Cn3ncnc32)[C@H]1c1ccc(F)cc1 ZINC000587346086 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CC=Cn3ncnc32)[C@H]1c1ccc(F)cc1 ZINC000587346088 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CC=Cn3ncnc32)[C@@H]1c1ccc(F)cc1 ZINC000587346090 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CC=Cn3ncnc32)[C@@H]1c1ccc(F)cc1 ZINC000587346093 FG Annotated Anodyne CC1(C)C[C@@]2(CC(=O)N1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587346276 FG Annotated Anodyne CC1(C)C[C@]2(CC(=O)N1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587346278 FG Annotated Anodyne CC1(C)C[C@]2(CC(=O)N1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587346280 FG Annotated Anodyne CC1(C)C[C@@]2(CC(=O)N1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587346282 FG Annotated Anodyne CC1=C[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)C(=O)CN1C ZINC000587346643 FG Annotated Anodyne CC1=C[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)C(=O)CN1C ZINC000587346646 FG Annotated Anodyne CC1=C[C@@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)C(=O)CN1C ZINC000587346649 FG Annotated Anodyne CC1=C[C@@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)C(=O)CN1C ZINC000587346653 FG Annotated Anodyne C#CCN1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587347112 FG Annotated Mild C#CCN1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587347115 FG Annotated Mild O=C1c2ccc(O)cc2O[C@]2(CCN3CC[C@H]2C3)[C@H]1c1ccc(F)cc1 ZINC000587347705 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCN3CC[C@H]2C3)[C@H]1c1ccc(F)cc1 ZINC000587347706 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCN3CC[C@H]2C3)[C@@H]1c1ccc(F)cc1 ZINC000587347709 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCN3CC[C@H]2C3)[C@@H]1c1ccc(F)cc1 ZINC000587347710 FG Annotated Anodyne CCN1CC[C@@]2(CC1=O)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587348361 FG Annotated Anodyne CC[C@@]1(C(=O)OC(C)=O)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348364 FG Annotated Reactive CCN1CC[C@@]2(CC1=O)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587348367 FG Annotated Anodyne CCN1CC[C@]2(CC1=O)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587348368 FG Annotated Anodyne CCN1CC[C@]2(CC1=O)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587348369 FG Annotated Anodyne CC[C@]1(C(=O)OC(C)=O)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348372 FG Annotated Reactive CC[C@]1(C(=O)OC(C)=O)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587348375 FG Annotated Reactive CC[C@@]1(C(=O)OC(C)=O)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587348379 FG Annotated Reactive C[C@@H]1OC=CC(=O)[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587348940 FG Annotated Mild C[C@@H]1OC=CC(=O)[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587348958 FG Annotated Mild C[C@@H]1OC=CC(=O)[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587348962 FG Annotated Mild C[C@@H]1OC=CC(=O)[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587348965 FG Annotated Mild CC(=O)OC1CC2(C1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587349319 FG Annotated Anodyne CC(=O)OC1CC2(C1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587349323 FG Annotated Anodyne C[C@]1(c2cc(CO)on2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587349509 FG Annotated Anodyne C[C@@]1(c2cc(CO)on2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587349525 FG Annotated Anodyne C[C@@]1(c2cc(CO)on2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587349531 FG Annotated Anodyne C[C@]1(c2cc(CO)on2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587349535 FG Annotated Anodyne COC(=O)[C@H](C)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587349555 FG Annotated Anodyne COC(=O)[C@H](C)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587349576 FG Annotated Anodyne COC(=O)[C@H](C)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587349587 FG Annotated Anodyne COC(=O)[C@H](C)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587349594 FG Annotated Anodyne CC1=CC(=O)[C@]2(CN1C)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587350244 FG Annotated Mild CC1=CC(=O)[C@]2(CN1C)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587350250 FG Annotated Mild CC1=CC(=O)[C@@]2(CN1C)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587350257 FG Annotated Mild CC1=CC(=O)[C@@]2(CN1C)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587350264 FG Annotated Mild C[C@@H]1OC=C[C@@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)C1=O ZINC000587350985 FG Annotated Anodyne C[C@@H]1OC=C[C@@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)C1=O ZINC000587350988 FG Annotated Anodyne C[C@@H]1OC=C[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)C1=O ZINC000587350993 FG Annotated Anodyne C[C@@H]1OC=C[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)C1=O ZINC000587351002 FG Annotated Anodyne C[C@]1([C@H]2CCCNC2=O)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587352284 FG Annotated Anodyne C[C@]1([C@@H]2CCCNC2=O)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587352285 FG Annotated Anodyne C[C@]1([C@@H]2CCCNC2=O)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587352286 FG Annotated Anodyne C[C@]1([C@H]2CCCNC2=O)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587352287 FG Annotated Anodyne COC(=O)C1CC2(C1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587352424 FG Annotated Anodyne COC(=O)C1CC2(C1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587352426 FG Annotated Anodyne O=C1c2ccc(O)cc2OC2([C@H]3CC[C@H]2CNC3)[C@@H]1c1ccc(F)cc1 ZINC000587353421 FG Annotated Anodyne O=C1c2ccc(O)cc2OC2([C@H]3CC[C@H]2CNC3)[C@H]1c1ccc(F)cc1 ZINC000587353423 FG Annotated Anodyne CCO[C@@H]1C[C@@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)[C@H]1OC ZINC000587354069 FG Annotated Anodyne CCO[C@@H]1C[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)[C@H]1OC ZINC000587354070 FG Annotated Anodyne CCO[C@@H]1C[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[C@H]1OC ZINC000587354072 FG Annotated Anodyne CCO[C@@H]1C[C@@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[C@H]1OC ZINC000587354075 FG Annotated Anodyne COC(=O)[C@]1(C(C)C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587354129 FG Annotated Anodyne COC(=O)[C@@]1(C(C)C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587354130 FG Annotated Anodyne COC(=O)[C@@]1(C(C)C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587354132 FG Annotated Anodyne COC(=O)[C@]1(C(C)C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587354133 FG Annotated Anodyne CC1=CC(=O)[C@@]2(CO1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587354518 FG Annotated Mild CC1=CC(=O)[C@]2(CO1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587354529 FG Annotated Mild CC1=CC(=O)[C@]2(CO1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587354532 FG Annotated Mild CC1=CC(=O)[C@@]2(CO1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587354537 FG Annotated Mild CC1=C[C@@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)C(=O)CO1 ZINC000587355271 FG Annotated Anodyne CC1=C[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)C(=O)CO1 ZINC000587355272 FG Annotated Anodyne CC1=C[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)C(=O)CO1 ZINC000587355275 FG Annotated Anodyne CC1=C[C@@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)C(=O)CO1 ZINC000587355280 FG Annotated Anodyne C[C@@H]1OC(=O)[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)[C@@H]1C ZINC000587356562 FG Annotated Anodyne C[C@@H]1OC(=O)[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[C@H]1C ZINC000587356563 FG Annotated Anodyne C[C@@H]1OC(=O)[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)[C@H]1C ZINC000587356564 FG Annotated Anodyne C[C@@H]1OC(=O)[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[C@@H]1C ZINC000587356565 FG Annotated Anodyne CC1(C)OCC2(CO1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587356841 FG Annotated Anodyne CC1(C)OCC2(CO1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587356844 FG Annotated Anodyne C[C@@H]1C[C@@]2(CC(=O)O1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587356985 FG Annotated Anodyne C[C@@H]1C[C@@]2(CC(=O)O1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587356986 FG Annotated Anodyne C[C@@H]1C[C@]2(CC(=O)O1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587356987 FG Annotated Anodyne C[C@@H]1C[C@]2(CC(=O)O1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587356988 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(C[C@H]3CO[C@@H](C2)O3)[C@@H]1c1ccc(F)cc1 ZINC000587357268 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(C[C@H]3CO[C@@H](C2)O3)[C@@H]1c1ccc(F)cc1 ZINC000587357272 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(C[C@H]3CO[C@@H](C2)O3)[C@H]1c1ccc(F)cc1 ZINC000587357274 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(C[C@H]3CO[C@@H](C2)O3)[C@H]1c1ccc(F)cc1 ZINC000587357277 FG Annotated Anodyne CC1(C)COC(=O)[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587357367 FG Annotated Anodyne CC1(C)COC(=O)[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587357368 FG Annotated Anodyne CC1(C)COC(=O)[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587357369 FG Annotated Anodyne CC1(C)COC(=O)[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587357370 FG Annotated Anodyne CO[C@@H]1COCC[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587358098 FG Annotated Anodyne CO[C@@H]1COCC[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587358100 FG Annotated Anodyne CO[C@@H]1COCC[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587358102 FG Annotated Anodyne CO[C@@H]1COCC[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587358105 FG Annotated Anodyne O=C(O)CCNC(=O)Cc1c(-c2cccs2)nc2cccc3c2c1CC3 ZINC000587358753 FG Annotated Anodyne Cc1[nH]c(=NCCCC(=O)O)sc1-c1cc2c3c(cccc3n1)CC2 ZINC000587359787 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@](C(=O)O)(c2ccco2)[C@H]1c1ccc(F)cc1 ZINC000587359816 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](C(=O)O)(c2ccco2)[C@H]1c1ccc(F)cc1 ZINC000587359817 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](C(=O)O)(c2ccco2)[C@@H]1c1ccc(F)cc1 ZINC000587359819 FG Annotated Anodyne O=C1c2ccc(O)cc2O[C@](C(=O)O)(c2ccco2)[C@@H]1c1ccc(F)cc1 ZINC000587359820 FG Annotated Anodyne C[C@]1([C@@H]2CCOC2=O)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587359877 FG Annotated Anodyne C[C@]1([C@H]2CCOC2=O)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587359879 FG Annotated Anodyne C[C@]1([C@@H]2CCOC2=O)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587359881 FG Annotated Anodyne C[C@]1([C@H]2CCOC2=O)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587359884 FG Annotated Anodyne O=C(N=c1nc(Cc2cc3c4c(cccc4n2)CC3)[nH]s1)c1ccccc1 ZINC000587361689 FG Annotated Anodyne COc1cccc(-c2cc(Cn3[nH]nnc3=N)nc3c2oc2ccccc23)c1 ZINC000587363815 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3cc(Br)cc(Cl)c3O)nc2n1 ZINC000587365064 FG Annotated Anodyne Oc1nc(O)c2cc3c(nc2n1)-c1cc(Br)cc(Cl)c1C3 ZINC000587365340 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3cc(Cl)cc(Br)c3O)nc2n1 ZINC000587365559 FG Annotated Anodyne Cc1nc(Cl)c(Br)cc1-c1ccc2c(O)nc(O)nc2n1 ZINC000587365863 FG Annotated Anodyne Oc1nc(O)c2cc3c(nc2n1)-c1cc(Cl)cc(Br)c1C3 ZINC000587365928 FG Annotated Anodyne Oc1nc(O)c2cc3c(nc2n1)-c1cc(Br)ccc1CCC3 ZINC000587366239 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3c[nH]c4c(Br)cccc34)nc2n1 ZINC000587366318 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3cc(Br)cc4cc[nH]c34)nc2n1 ZINC000587366664 FG Annotated Anodyne COc1cccc(-c2cc([C@@H](O)[C@H](O)CO)nc3c2oc2ccccc23)c1 ZINC000587366703 FG Annotated Anodyne Oc1nc(O)c2ccc(Cc3ccc(Cl)cc3Br)nc2n1 ZINC000587366855 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3ccc4ncc(Br)cc4c3)nc2n1 ZINC000587367097 FG Annotated Anodyne Cc1cc2c(O)nc(O)nc2nc1CCc1ccc(Br)cc1 ZINC000587367105 FG Annotated Anodyne Oc1nc(O)c2cc3c(nc2n1)CC[C@H](c1ccc(Br)cc1)C3 ZINC000587367134 FG Annotated Anodyne Oc1nc(O)c2cc3c(nc2n1)CC[C@@H](c1ccc(Br)cc1)C3 ZINC000587367135 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3ccnc4cc(Br)ccc34)nc2n1 ZINC000587367227 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3c[nH]c4cc(Br)ccc34)nc2n1 ZINC000587367322 FG Annotated Anodyne Oc1nc(O)c2cc3c(nc2n1)-c1ccc(Br)cc1CCC3 ZINC000587367339 FG Annotated Anodyne CCc1nc2nc(O)nc(O)c2cc1Cc1ccc(Br)cc1 ZINC000587367341 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3cc(Br)c(F)cc3F)nc2n1 ZINC000587367976 FG Annotated Anodyne Cc1cc2c(O)nc(O)nc2nc1-c1cc(Br)ccc1F ZINC000587367996 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3ccc(OC(F)F)cc3OC(F)F)nc2n1 ZINC000587368014 FG Annotated Anodyne Cc1cc2c(O)nc(O)nc2nc1CC(=O)c1ccc(C(F)(F)F)cc1 ZINC000587368030 FG Annotated Anodyne Oc1nc(O)c2cc(CC3OCCCO3)c(-c3cccc(Cl)c3)nc2n1 ZINC000587368176 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3ccc(OC[C@H]4CCCCO4)c(F)c3)nc2n1 ZINC000587368213 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3ccc(OC[C@@H]4CCCCO4)c(F)c3)nc2n1 ZINC000587368214 FG Annotated Anodyne Oc1nc(O)c2cc3c(nc2n1)-c1ccc(Cl)c(Cl)c1OCC3 ZINC000587368251 FG Annotated Anodyne Oc1nc(O)c2cc3c(nc2n1)-c1sc(-c2ccccc2F)nc1CC3 ZINC000587368261 FG Annotated Anodyne Nc1c(Cl)cc(-c2ccc3c(O)nc(O)nc3n2)cc1C(F)(F)F ZINC000587368297 FG Annotated Anodyne Cn1c(-c2ccc3c(O)nc(O)nc3n2)nc2cc(C(F)(F)F)ccc21 ZINC000587368298 FG Annotated Anodyne O=C(CCl)Nc1c(-c2ccc3c(O)nc(O)nc3n2)oc2ccccc12 ZINC000587368348 FG Annotated Reactive Cc1c(-c2ccc3c(O)nc(O)nc3n2)cnn1-c1cccc(Cl)c1 ZINC000587368370 FG Annotated Anodyne Cc1cc2c(O)nc(O)nc2nc1-c1ccc(Br)cc1F ZINC000587368446 FG Annotated Anodyne COc1cc(-c2ccc3c(O)nc(O)nc3n2)ccc1SC(F)F ZINC000587368464 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3c(F)cc(Br)cc3F)nc2n1 ZINC000587368516 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3ccc(F)c(Br)c3F)nc2n1 ZINC000587368522 FG Annotated Anodyne CC(C)(CCl)C(=O)Nc1ccc(-c2ccc3c(O)nc(O)nc3n2)cc1 ZINC000587368579 FG Annotated Reactive O=C(CCCCl)Nc1ccccc1-c1ccc2c(O)nc(O)nc2n1 ZINC000587368586 FG Annotated Reactive O=C(O)Cc1cc2c(O)nc(O)nc2nc1-c1ccc(Cl)c(Cl)c1 ZINC000587368588 FG Annotated Anodyne Oc1nc(O)c2cc(CCBr)c(-c3ccc(F)cc3)nc2n1 ZINC000587368758 FG Annotated Reactive Cn1nc(-c2ccccc2)c(-c2ccc3c(O)nc(O)nc3n2)c1Cl ZINC000587368766 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3c(Cl)c(Cl)cc4c3OCCO4)nc2n1 ZINC000587368831 FG Annotated Anodyne Oc1nc(O)c2ccc([C@@H](Br)Cc3ccccc3F)nc2n1 ZINC000587368948 FG Annotated Reactive Oc1nc(O)c2ccc([C@H](Br)Cc3ccccc3F)nc2n1 ZINC000587368950 FG Annotated Reactive Cc1cc2c(O)nc(O)nc2nc1-c1cc(F)cc(Br)c1 ZINC000587368961 FG Annotated Anodyne Cc1cc2c(O)nc(O)nc2nc1-c1ccc(F)c(Br)c1 ZINC000587369025 FG Annotated Anodyne O=C(CCCCl)Nc1ccc(-c2ccc3c(O)nc(O)nc3n2)cc1 ZINC000587369083 FG Annotated Reactive O=C(O)Cc1cc2c(O)nc(O)nc2nc1-c1cc(Cl)ccc1Cl ZINC000587369094 FG Annotated Anodyne Oc1nc(O)c2cc(CC3OCCCO3)c(-c3ccccc3Cl)nc2n1 ZINC000587369263 FG Annotated Anodyne COc1cc(-c2ccc3c(O)nc(O)nc3n2)ccc1OCCCCl ZINC000587369309 FG Annotated Reactive COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c(Br)cn1 ZINC000587370001 FG Annotated Anodyne COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c(Br)cn1 ZINC000587370004 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3cnc(Nc4ccc(F)cc4)s3)nc2n1 ZINC000587370044 FG Annotated Anodyne Oc1nc(O)c2cc3c(nc2n1)-c1sc(-c2ccc(F)cc2)nc1CC3 ZINC000587370180 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)Nc2ccc(Br)cc21 ZINC000587370317 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)Nc2ccc(Br)cc21 ZINC000587370319 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1ccc(N)cc1)O2 ZINC000587370399 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1ccc(N)cc1)O2 ZINC000587370401 FG Annotated Reactive CCn1cc(Br)c([C@H]2CC(=O)c3cc(C)cc(N)c3O2)n1 ZINC000587370573 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc(CCC(N)=O)cc1)O2 ZINC000587370576 FG Annotated Reactive CCn1cc(Br)c([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)n1 ZINC000587370577 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc(CCC(N)=O)cc1)O2 ZINC000587370579 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CNC(=O)[C@H](C)Cl)(c1ccccc1)O2 ZINC000587370593 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CNC(=O)[C@H](C)Cl)(c1ccccc1)O2 ZINC000587370595 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CNC(=O)[C@@H](C)Cl)(c1ccccc1)O2 ZINC000587370596 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CNC(=O)[C@@H](C)Cl)(c1ccccc1)O2 ZINC000587370599 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cnc3cnc(Br)cn13)O2 ZINC000587371293 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cnc3cnc(Br)cn13)O2 ZINC000587371301 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc3c(c1)OCCO3)O2 ZINC000587371459 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc3c(c1)OCCO3)O2 ZINC000587371462 FG Annotated Reactive COC(=O)c1cccc([C@@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587371513 FG Annotated Reactive COC(=O)c1cccc([C@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587371515 FG Annotated Reactive COc1ncc(Br)cc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587371655 FG Annotated Anodyne COc1ncc(Br)cc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587371656 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCNc3nc(Br)ccc31)O2 ZINC000587371877 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCNc3nc(Br)ccc31)O2 ZINC000587371880 FG Annotated Anodyne CC(=O)Nc1cc([C@@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)ccc1O ZINC000587371925 FG Annotated Reactive CC(=O)Nc1cc([C@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)ccc1O ZINC000587371926 FG Annotated Reactive CC(=O)NCc1ccc([C@@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587371943 FG Annotated Reactive CC(=O)NCc1ccc([C@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587371944 FG Annotated Reactive COc1ccc(Br)nc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587371973 FG Annotated Anodyne COc1ccc(Br)nc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587371974 FG Annotated Anodyne COc1cc(Br)cnc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587372169 FG Annotated Anodyne COc1cc(Br)cnc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587372170 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)Nc2c(Br)cccc21 ZINC000587372251 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)Nc2c(Br)cccc21 ZINC000587372254 FG Annotated Anodyne O=C1c2ccc(O)cc2OC2(CCS(=O)CC2)[C@@H]1c1ccc(F)cc1 ZINC000587372289 FG Annotated Anodyne O=C1c2ccc(O)cc2OC2(CCS(=O)CC2)[C@H]1c1ccc(F)cc1 ZINC000587372298 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C=O)(c1ccc(Br)cc1)O2 ZINC000587372301 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](C=O)(c1ccc(Br)cc1)O2 ZINC000587372309 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)Nc2cccc(Br)c21 ZINC000587372324 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)Nc2cccc(Br)c21 ZINC000587372325 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)Nc2cc(Br)ccc21 ZINC000587372338 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)Nc2cc(Br)ccc21 ZINC000587372340 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc3nc(O)[nH]c3c1)O2 ZINC000587372454 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc3nc(O)[nH]c3c1)O2 ZINC000587372459 FG Annotated Reactive COc1c([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccnc1Br ZINC000587372468 FG Annotated Anodyne COc1c([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccnc1Br ZINC000587372469 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1oc(C)nc1C)O2 ZINC000587372524 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1oc(C)nc1C)O2 ZINC000587372526 FG Annotated Reactive CCn1cc(Br)c([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)n1 ZINC000587372579 FG Annotated Anodyne CCn1cc(Br)c([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)n1 ZINC000587372585 FG Annotated Anodyne COc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)nc1Br ZINC000587372661 FG Annotated Anodyne COc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)nc1Br ZINC000587372664 FG Annotated Anodyne COC(=O)[C@@]1([C@@H](Cl)c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587372830 FG Annotated Reactive COC(=O)[C@]1([C@H](Cl)c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587372842 FG Annotated Reactive COC(=O)[C@@]1([C@H](Cl)c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587372845 FG Annotated Reactive COC(=O)[C@]1([C@@H](Cl)c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587372847 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc(N(C)C=O)cc1)O2 ZINC000587373069 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc(N(C)C=O)cc1)O2 ZINC000587373072 FG Annotated Reactive CCOC(=O)[C@@H](Cl)[C@]1(CC(C)C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587373208 FG Annotated Reactive CCOC(=O)[C@H](Cl)[C@@]1(CC(C)C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587373210 FG Annotated Reactive CCOC(=O)[C@@H](Cl)[C@@]1(CC(C)C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587373211 FG Annotated Reactive CCOC(=O)[C@H](Cl)[C@]1(CC(C)C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587373212 FG Annotated Reactive COc1ccc([C@@]2(C(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1Cl ZINC000587373425 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)([C@H](C)NC(=O)OC(C)(C)C)O2 ZINC000587373427 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)([C@H](C)NC(=O)OC(C)(C)C)O2 ZINC000587373428 FG Annotated Reactive COc1ccc([C@]2(C(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1Cl ZINC000587373437 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(C1CCOCC1)O2 ZINC000587373545 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(C1CCOCC1)O2 ZINC000587373552 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc3c(c1)CCN3C=O)O2 ZINC000587373568 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc3c(c1)CCN3C=O)O2 ZINC000587373575 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc3c(c1)NC(=O)CO3)O2 ZINC000587373773 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc3c(c1)NC(=O)CO3)O2 ZINC000587373775 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc(NC(N)=O)cc1)O2 ZINC000587373870 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc(NC(N)=O)cc1)O2 ZINC000587373876 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc3c(c1)oc(=O)n3C)O2 ZINC000587373914 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc3c(c1)oc(=O)n3C)O2 ZINC000587373916 FG Annotated Reactive CCOC(=O)C[C@]1([C@@H](C)Br)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587374162 FG Annotated Reactive CCOC(=O)C[C@@]1([C@H](C)Br)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587374170 FG Annotated Reactive CCOC(=O)C[C@]1([C@H](C)Br)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587374171 FG Annotated Reactive CCOC(=O)C[C@@]1([C@@H](C)Br)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587374172 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c[nH]c3ncc(Br)nc13)O2 ZINC000587374396 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c[nH]c3ncc(Br)nc13)O2 ZINC000587374398 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CO)(c1ccc(Br)cc1)O2 ZINC000587374605 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CO)(c1ccc(Br)cc1)O2 ZINC000587374613 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(Cl)c(Cl)c1)(C(O)O)O2 ZINC000587374787 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(Cl)c(Cl)c1)(C(O)O)O2 ZINC000587374794 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(O)cc(Br)c1O)O2 ZINC000587374959 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(O)cc(Br)c1O)O2 ZINC000587374960 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(Br)c(O)cc1O)O2 ZINC000587374982 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(Br)c(O)cc1O)O2 ZINC000587374984 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC(CBr)(CBr)O2 ZINC000587375470 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](C=O)(Cc1cccc(Br)c1)O2 ZINC000587375483 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](C=O)(Cc1cccc(Br)c1)O2 ZINC000587375484 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(Br)c(C)nn1C)O2 ZINC000587376086 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(Br)c(C)nn1C)O2 ZINC000587376088 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(O)c(O)c(Br)c1)O2 ZINC000587376673 FG Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(O)c(O)c(Br)c1)O2 ZINC000587376685 FG Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@](CNC(=O)CCCl)(c1ccccc1)O2 ZINC000587376867 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CNC(=O)CCCl)(c1ccccc1)O2 ZINC000587376870 FG Annotated Reactive CCn1ncc(Br)c1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587377065 FG Annotated Anodyne CCn1ncc(Br)c1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587377066 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](C(=O)Cc1cccc(Br)c1)O2 ZINC000587377472 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](C(=O)Cc1cccc(Br)c1)O2 ZINC000587377474 FG Annotated Anodyne COc1ccc(Br)c([C@H]2CC(=O)c3cc(C)cc(N)c3O2)n1 ZINC000587378065 FG Annotated Anodyne COc1ccc(Br)c([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)n1 ZINC000587378066 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(O)c(Br)cc1O)O2 ZINC000587378196 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(O)c(Br)cc1O)O2 ZINC000587378198 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C=O)(c1ccccc1Br)O2 ZINC000587378231 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](C=O)(c1ccccc1Br)O2 ZINC000587378234 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CC(=O)Nc1ccc(Cl)cn1)O2 ZINC000587378423 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CC(=O)Nc1ccc(Cl)cn1)O2 ZINC000587378429 FG Annotated Anodyne CCn1ncc(Br)c1[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587378537 FG Annotated Anodyne CCn1ncc(Br)c1[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587378538 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(C(=O)O)=COc2ccc(Cl)cc21 ZINC000587378717 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(C(=O)O)=COc2ccc(Cl)cc21 ZINC000587378727 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(O)ccc(O)c1Br)O2 ZINC000587379012 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(O)ccc(O)c1Br)O2 ZINC000587379013 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C=O)(c1cccc(Br)c1)O2 ZINC000587379166 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](C=O)(c1cccc(Br)c1)O2 ZINC000587379168 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](CCC(=O)O)(c1ccc(Cl)cn1)O2 ZINC000587379200 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CCC(=O)O)(c1ccc(Cl)cn1)O2 ZINC000587379211 FG Annotated Anodyne CC(=O)OC[C@@]1(c2ccc(Cl)cn2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587379264 FG Annotated Anodyne CC(=O)OC[C@]1(c2ccc(Cl)cn2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587379265 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(Cl)nc1N1CCOCC1)O2 ZINC000587379894 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(Cl)nc1N1CCOCC1)O2 ZINC000587379895 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C[C@H](C(=O)O)Oc3ccc(Cl)cc31)O2 ZINC000587380039 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C[C@@H](C(=O)O)Oc3ccc(Cl)cc31)O2 ZINC000587380040 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@@H](C(=O)O)Oc3ccc(Cl)cc31)O2 ZINC000587380041 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@H](C(=O)O)Oc3ccc(Cl)cc31)O2 ZINC000587380042 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C=C(C(=O)O)Oc3ccc(Cl)cc31)O2 ZINC000587380081 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C=C(C(=O)O)Oc3ccc(Cl)cc31)O2 ZINC000587380155 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cn(-c3ccnc(Cl)n3)nc1C)O2 ZINC000587380201 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cn(-c3ccnc(Cl)n3)nc1C)O2 ZINC000587380207 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(CCN(c3ccc(Cl)nn3)CC1)O2 ZINC000587380332 FG Annotated Anodyne CCOC(=O)[C@]1(c2ccc(Cl)nc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587380334 FG Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(Cl)nc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587380335 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(F)c1N1CCOCC1)O2 ZINC000587380927 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(F)c1N1CCOCC1)O2 ZINC000587380930 FG Annotated Anodyne CCOC(=O)C[C@]1(c2ccc(Cl)cn2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587380988 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2ccc(Cl)cn2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587380995 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(F)c(N3CCN(C)CC3)c1)O2 ZINC000587380998 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(F)c(N3CCN(C)CC3)c1)O2 ZINC000587381001 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1c(F)cccc1N1CCOCC1)O2 ZINC000587381319 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1c(F)cccc1N1CCOCC1)O2 ZINC000587381320 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)Nc2ccc(C(F)(F)F)cc21 ZINC000587381556 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)Nc2ccc(C(F)(F)F)cc21 ZINC000587381562 FG Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(OC)c(F)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587381581 FG Annotated Anodyne CCOC(=O)[C@]1(c2ccc(OC)c(F)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587381582 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(OC(F)(F)C(=O)O)cc1)O2 ZINC000587381971 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(OC(F)(F)C(=O)O)cc1)O2 ZINC000587381972 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(F)cccc1N1CCOCC1)O2 ZINC000587382153 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(F)cccc1N1CCOCC1)O2 ZINC000587382154 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(Cn1cc(C(F)(F)F)ccc1=O)O2 ZINC000587382219 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(Cn1cc(C(F)(F)F)ccc1=O)O2 ZINC000587382220 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(Cc1c([N+](=O)[O-])ccc(O)c1F)O2 ZINC000587382485 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](C)(Cc1c([N+](=O)[O-])ccc(O)c1F)O2 ZINC000587382486 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1sc(=N)[nH]c1C(F)(F)F)O2 ZINC000587382528 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1sc(=N)[nH]c1C(F)(F)F)O2 ZINC000587382529 FG Annotated Anodyne CCO/C=C(/C(=O)OCC)[C@]1(C(F)F)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587382653 FG Annotated Anodyne CCO/C=C(\C(=O)OCC)[C@]1(C(F)F)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587382656 FG Annotated Anodyne CCO/C=C(\C(=O)OCC)[C@@]1(C(F)F)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587382657 FG Annotated Anodyne CCO/C=C(/C(=O)OCC)[C@@]1(C(F)F)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587382658 FG Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(C)c(F)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587382767 FG Annotated Anodyne CCOC(=O)[C@]1(c2ccc(C)c(F)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587382769 FG Annotated Anodyne COC(=O)C[C@@]1(C(F)(F)C(F)(F)F)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587382816 FG Annotated Anodyne COC(=O)C[C@]1(C(F)(F)C(F)(F)F)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587382820 FG Annotated Anodyne CCOC(=O)C(F)(F)[C@H]1CC[C@]2(CC(=O)c3cc(C)cc(N)c3O2)C1 ZINC000587382886 FG Annotated Anodyne CCOC(=O)C(F)(F)[C@@H]1CC[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)C1 ZINC000587382898 FG Annotated Anodyne CCOC(=O)C(F)(F)[C@H]1CC[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)C1 ZINC000587382899 FG Annotated Anodyne CCOC(=O)C(F)(F)[C@@H]1CC[C@]2(CC(=O)c3cc(C)cc(N)c3O2)C1 ZINC000587382900 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)Nc2cc(C(F)(F)F)ccc21 ZINC000587382914 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)Nc2cc(C(F)(F)F)ccc21 ZINC000587382917 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)Nc2c(C(F)(F)F)cccc21 ZINC000587382994 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)Nc2c(C(F)(F)F)cccc21 ZINC000587383000 FG Annotated Anodyne COc1ccc([C@]2(CCC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1F ZINC000587383070 FG Annotated Anodyne COc1ccc([C@@]2(CCC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1F ZINC000587383074 FG Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(F)c(F)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587383194 FG Annotated Anodyne CCOC(=O)[C@]1(c2ccc(F)c(F)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587383197 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(F)c(N3CCOCC3)c1)O2 ZINC000587383206 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(F)c(N3CCOCC3)c1)O2 ZINC000587383208 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CC1OCCO1)(c1cccc(F)c1)O2 ZINC000587383275 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CC1OCCO1)(c1cccc(F)c1)O2 ZINC000587383283 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(C)nn(C)c1OCC(F)(F)F)O2 ZINC000587383293 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(C)nn(C)c1OCC(F)(F)F)O2 ZINC000587383294 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CN(C(=O)OC(C)(C)C)CC1(F)F)O2 ZINC000587383381 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CN(C(=O)OC(C)(C)C)CC1(F)F)O2 ZINC000587383518 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(OC(F)(F)C(=O)O)c1)O2 ZINC000587383523 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(OC(F)(F)C(=O)O)c1)O2 ZINC000587383524 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCOc3c([N+](=O)[O-])cc(F)cc31)O2 ZINC000587383759 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCOc3c([N+](=O)[O-])cc(F)cc31)O2 ZINC000587383760 FG Annotated Bother CC(=O)N1CC[C@]2(CC(=O)c3cc(C)cc(N)c3O2)c2ccc(F)cc2C1 ZINC000587383769 FG Annotated Anodyne CC(=O)N1CC[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)c2ccc(F)cc2C1 ZINC000587383770 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1nnn(-c3ccc(F)cc3)c1C)O2 ZINC000587383868 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1nnn(-c3ccc(F)cc3)c1C)O2 ZINC000587383872 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1cccc(F)c1)(c1nccn1C)O2 ZINC000587384022 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cccc(F)c1)(c1nccn1C)O2 ZINC000587384024 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(N3CCNCC3)c(F)c1)O2 ZINC000587384189 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(N3CCNCC3)c(F)c1)O2 ZINC000587384191 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)Nc2cccc(C(F)(F)F)c21 ZINC000587384302 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)Nc2cccc(C(F)(F)F)c21 ZINC000587384303 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(F)cc1)(c1ccn(C)n1)O2 ZINC000587384332 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(F)cc1)(c1ccn(C)n1)O2 ZINC000587384333 FG Annotated Anodyne CCOC(=O)[C@@]1(c2cc(F)ccc2OC)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587384427 FG Annotated Anodyne CCOC(=O)[C@]1(c2cc(F)ccc2OC)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587384428 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(N3CCN(C)CC3)c(F)c1)O2 ZINC000587384623 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N3CCN(C)CC3)c(F)c1)O2 ZINC000587384624 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](Cn1cncn1)(c1ccc(F)cc1F)O2 ZINC000587384635 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](Cn1cncn1)(c1ccc(F)cc1F)O2 ZINC000587384636 FG Annotated Anodyne COC(=O)C1=C[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)c2cc(F)ccc2O1 ZINC000587384708 FG Annotated Anodyne COC(=O)C1=C[C@]2(CC(=O)c3cc(C)cc(N)c3O2)c2cc(F)ccc2O1 ZINC000587384709 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(N3CCOCC3)c(F)c1)O2 ZINC000587384784 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(N3CCOCC3)c(F)c1)O2 ZINC000587384785 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1cccc(F)c1)(c1cnn(C)c1)O2 ZINC000587384844 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(N3CCN(C)CC3)cc1F)O2 ZINC000587384898 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N3CCN(C)CC3)cc1F)O2 ZINC000587384899 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cccc(F)c1)(c1cnn(C)c1)O2 ZINC000587384919 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cn(Cc3ccc(F)cc3)nn1)O2 ZINC000587385011 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cn(Cc3ccc(F)cc3)nn1)O2 ZINC000587385015 FG Annotated Anodyne COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc(CN(C)C)c1O ZINC000587385072 FG Annotated Clean COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc(CN(C)C)c1O ZINC000587385077 FG Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@](Cn1ccnc1)(c1ccc(F)cc1)O2 ZINC000587385100 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](Cn1ccnc1)(c1ccc(F)cc1)O2 ZINC000587385111 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1F)(c1nccn1C)O2 ZINC000587385186 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccccc1F)(c1nccn1C)O2 ZINC000587385188 FG Annotated Anodyne COC(=O)[C@@H](CCC#N)[C@@]1(C(C)(C)C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587385214 FG Annotated Mild COC(=O)[C@H](CCC#N)[C@@]1(C(C)(C)C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587385215 FG Annotated Mild COC(=O)[C@@H](CCC#N)[C@]1(C(C)(C)C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587385216 FG Annotated Mild COC(=O)[C@H](CCC#N)[C@]1(C(C)(C)C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587385217 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](CC#N)(c1cccc3c1OCCO3)O2 ZINC000587385255 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](CC#N)(c1cccc3c1OCCO3)O2 ZINC000587385256 FG Annotated Mild COc1cc(OC)cc([C@]2(CC#N)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587385361 FG Annotated Mild COc1cc(OC)cc([C@@]2(CC#N)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587385364 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cnc(=NCc3ccccc3)[nH]c1)O2 ZINC000587385479 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cnc(=NCc3ccccc3)[nH]c1)O2 ZINC000587385484 FG Annotated Anodyne COc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1NC(C)=O ZINC000587385508 FG Annotated Anodyne COc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1NC(C)=O ZINC000587385515 FG Annotated Anodyne COc1cc(C#N)ccc1OCC[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587385671 FG Annotated Mild COc1cc(C#N)ccc1OCC[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587385672 FG Annotated Mild COc1cc2c(cc1OC)[C@]1(CC(=O)c3cc(C)cc(N)c3O1)[C@@H](N=O)C2 ZINC000587385680 FG Annotated Anodyne COc1cc2c(cc1OC)[C@@]1(CC(=O)c3cc(C)cc(N)c3O1)[C@@H](N=O)C2 ZINC000587385685 FG Annotated Anodyne COc1cc2c(cc1OC)[C@@]1(CC(=O)c3cc(C)cc(N)c3O1)[C@H](N=O)C2 ZINC000587385687 FG Annotated Anodyne COc1cc2c(cc1OC)[C@]1(CC(=O)c3cc(C)cc(N)c3O1)[C@H](N=O)C2 ZINC000587385688 FG Annotated Anodyne CCOC(=O)[C@@]1(c2cc(F)cc(F)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587385741 FG Annotated Anodyne CCOC(=O)[C@]1(c2cc(F)cc(F)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587385744 FG Annotated Anodyne CC(=O)OC[C@]1(c2ccc(F)cc2F)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587385794 FG Annotated Anodyne CC(=O)OC[C@@]1(c2ccc(F)cc2F)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587385796 FG Annotated Anodyne COC(=O)c1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1N(C)C ZINC000587385905 FG Annotated Anodyne COC(=O)c1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1N(C)C ZINC000587385910 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cccc(OCCN(C)C)c1)O2 ZINC000587385913 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cccc(OCCN(C)C)c1)O2 ZINC000587385928 FG Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(N(C)C)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587385939 FG Annotated Anodyne CCOC(=O)[C@]1(c2ccc(N(C)C)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587385940 FG Annotated Anodyne COc1ccc([C@]2(CC#N)CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587386028 FG Annotated Mild COc1ccc([C@@]2(CC#N)CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587386031 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(N3CCOCC3)c(F)c1)O2 ZINC000587386155 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N3CCOCC3)c(F)c1)O2 ZINC000587386156 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(N3CCOCC3)cc1F)O2 ZINC000587386306 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N3CCOCC3)cc1F)O2 ZINC000587386309 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CC(=O)NCc1ccc(F)cc1)O2 ZINC000587386383 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CC(=O)NCc1ccc(F)cc1)O2 ZINC000587386384 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](Cn1ccnc1)(c1cccc(F)c1)O2 ZINC000587386422 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](Cn1ccnc1)(c1cccc(F)c1)O2 ZINC000587386423 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CC(=O)NCCCc1ccccc1)O2 ZINC000587386498 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CC(=O)NCCCc1ccccc1)O2 ZINC000587386499 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(S(C)(=O)=O)c(F)c1)O2 ZINC000587386717 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(S(C)(=O)=O)c(F)c1)O2 ZINC000587386721 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CN(C(=O)OC(C)(C)C)CC[C@H]1F)O2 ZINC000587386735 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CN(C(=O)OC(C)(C)C)CC[C@H]1F)O2 ZINC000587386738 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CN(C(=O)OC(C)(C)C)CC[C@@H]1F)O2 ZINC000587386740 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CN(C(=O)OC(C)(C)C)CC[C@@H]1F)O2 ZINC000587386742 FG Annotated Anodyne COC(=O)c1ccc([C@]2(CC#N)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587386770 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CC(=O)Nc1ccc(N(C)C)cc1)O2 ZINC000587386782 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CC(=O)Nc1ccc(N(C)C)cc1)O2 ZINC000587386783 FG Annotated Anodyne C#CCNC(=O)Nc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587386826 FG Annotated Mild C#CCNC(=O)Nc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587386827 FG Annotated Mild COC(=O)c1ccc([C@@]2(CC#N)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587386878 FG Annotated Mild CCOC(=O)C[C@]1(c2ccc(C#N)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587386901 FG Annotated Mild CCOC(=O)C[C@@]1(c2ccc(C#N)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587386905 FG Annotated Mild COC(=O)C[C@]1(Cc2ccccc2F)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587386971 FG Annotated Anodyne COC(=O)C[C@@]1(Cc2ccccc2F)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587386975 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(I)o1)O2 ZINC000587387020 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(I)o1)O2 ZINC000587387026 FG Annotated Anodyne COc1ccccc1CNC(=O)C[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387117 FG Annotated Anodyne COc1ccccc1CNC(=O)C[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387119 FG Annotated Anodyne CCOC(=O)[C@]1([C@@H](C#N)c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387291 FG Annotated Mild CCOC(=O)[C@@]1([C@H](C#N)c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387292 FG Annotated Mild CCOC(=O)[C@]1([C@H](C#N)c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387293 FG Annotated Mild CCOC(=O)[C@@]1([C@@H](C#N)c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387294 FG Annotated Mild CCOC(=O)C[C@]1(c2cccc(C#N)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387390 FG Annotated Mild CCOC(=O)C[C@@]1(c2cccc(C#N)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387392 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCN(C(=O)OC(C)(C)C)C[C@H]1F)O2 ZINC000587387421 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCN(C(=O)OC(C)(C)C)C[C@H]1F)O2 ZINC000587387423 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCN(C(=O)OC(C)(C)C)C[C@@H]1F)O2 ZINC000587387424 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCN(C(=O)OC(C)(C)C)C[C@@H]1F)O2 ZINC000587387427 FG Annotated Anodyne CCOC(=O)[C@H](C#N)[C@]1(c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387613 FG Annotated Mild CCOC(=O)[C@@H](C#N)[C@@]1(c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387615 FG Annotated Mild CCOC(=O)[C@@H](C#N)[C@]1(c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387617 FG Annotated Mild CCOC(=O)[C@H](C#N)[C@@]1(c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387618 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](CCCN(C)N=O)(c1cccnc1)O2 ZINC000587387638 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCCN(C)N=O)(c1cccnc1)O2 ZINC000587387643 FG Annotated Anodyne CNC(=O)COc1c(C)cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1C ZINC000587387663 FG Annotated Anodyne CNC(=O)COc1c(C)cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1C ZINC000587387664 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(I)c[nH]1)O2 ZINC000587387769 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(I)c[nH]1)O2 ZINC000587387770 FG Annotated Anodyne CCC[C@@]1(/C(=C/N(C)C)C(=O)OCC)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387858 FG Annotated Anodyne CCC[C@]1(/C(=C/N(C)C)C(=O)OCC)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387860 FG Annotated Anodyne CCC[C@@]1(/C(=C\N(C)C)C(=O)OCC)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387863 FG Annotated Anodyne CCC[C@]1(/C(=C\N(C)C)C(=O)OCC)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587387864 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C/N(C)C)([C@@H](C)Oc1cccnc1)O2 ZINC000587387920 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C/N(C)C)([C@@H](C)Oc1cccnc1)O2 ZINC000587387923 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C/N(C)C)([C@H](C)Oc1cccnc1)O2 ZINC000587387925 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C/N(C)C)([C@H](C)Oc1cccnc1)O2 ZINC000587387926 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C/N(C)C)(c1ccc3c(c1)OCO3)O2 ZINC000587388057 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C/N(C)C)(c1ccc3c(c1)OCO3)O2 ZINC000587388058 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(OCCN(C)C)cc1)O2 ZINC000587388103 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(OCCN(C)C)cc1)O2 ZINC000587388104 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(O)nc1/C=C/N(C)C)O2 ZINC000587388109 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(O)nc1/C=C/N(C)C)O2 ZINC000587388110 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CC(=O)NCCc1ccccc1)O2 ZINC000587388158 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CC(=O)NCCc1ccccc1)O2 ZINC000587388159 FG Annotated Anodyne COc1ccccc1[C@@]1(CNC(C)C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587388188 FG Annotated Anodyne COc1ccccc1[C@]1(CNC(C)C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587388189 FG Annotated Anodyne Cc1ccc(CNC(=O)C[C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587388200 FG Annotated Anodyne Cc1ccc(CNC(=O)C[C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587388201 FG Annotated Anodyne CC(=O)NCCc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587388255 FG Annotated Anodyne CC(=O)NCCc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587388256 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(N(CC(=O)O)N=O)cc1)O2 ZINC000587388293 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(N(CC(=O)O)N=O)cc1)O2 ZINC000587388294 FG Annotated Anodyne CC(=O)Nc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1[N+](=O)[O-] ZINC000587388376 FG Annotated Bother CC(=O)Nc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1[N+](=O)[O-] ZINC000587388379 FG Annotated Bother COc1ccc2c(c1[N+](=O)[O-])[C@]1(CC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587388382 FG Annotated Bother COc1ccc2c(c1[N+](=O)[O-])[C@@]1(CC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587388383 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(N)cc1)([C@@H](C)CC(=O)O)O2 ZINC000587388399 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(N)cc1)([C@H](C)CC(=O)O)O2 ZINC000587388400 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(N)cc1)([C@H](C)CC(=O)O)O2 ZINC000587388403 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(N)cc1)([C@@H](C)CC(=O)O)O2 ZINC000587388405 FG Annotated Anodyne CCOC(=O)c1c(N)oc(C)c1[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587388430 FG Annotated Anodyne CCOC(=O)c1c(N)oc(C)c1[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587388435 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1coc3ccc([N+](=O)[O-])cc3c1=O)O2 ZINC000587388479 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1coc3ccc([N+](=O)[O-])cc3c1=O)O2 ZINC000587388480 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)CC1(CCN(c3ccc([N+](=O)[O-])cc3)CC1)O2 ZINC000587388491 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c([N+](=O)[O-])c(C(C)(C)C)nn1C)O2 ZINC000587388633 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c([N+](=O)[O-])c(C(C)(C)C)nn1C)O2 ZINC000587388634 FG Annotated Bother COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc([N+](=O)[O-])c1OC ZINC000587388667 FG Annotated Bother COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc([N+](=O)[O-])c1OC ZINC000587388668 FG Annotated Bother COc1ccc(C[C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c([N+](=O)[O-])c1 ZINC000587388855 FG Annotated Bother COc1ccc(C[C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c([N+](=O)[O-])c1 ZINC000587388859 FG Annotated Bother COc1cc([N+](=O)[O-])c([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587388980 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(C)n(CC(N)=O)c3ccccc13)O2 ZINC000587388982 FG Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(C)n(CC(N)=O)c3ccccc13)O2 ZINC000587388983 FG Annotated Clean COc1cc([N+](=O)[O-])c([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587388984 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C\N(C)C)(c1ccc([N+](=O)[O-])cc1)O2 ZINC000587388987 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C/N(C)C)(c1ccc([N+](=O)[O-])cc1)O2 ZINC000587388988 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C/N(C)C)(c1ccc([N+](=O)[O-])cc1)O2 ZINC000587388989 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C\N(C)C)(c1ccc([N+](=O)[O-])cc1)O2 ZINC000587388990 FG Annotated Bother COc1cccc(NC(=O)C[C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587389020 FG Annotated Anodyne COc1cccc(NC(=O)C[C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587389024 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cn(CCC(N)=O)c3ccccc13)O2 ZINC000587389035 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cn(CCC(N)=O)c3ccccc13)O2 ZINC000587389036 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CCCOc1ccccc1C(N)=O)O2 ZINC000587389226 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CCCOc1ccccc1C(N)=O)O2 ZINC000587389233 FG Annotated Anodyne COc1cc(NC(C)=O)ccc1[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587389271 FG Annotated Anodyne COc1cc(NC(C)=O)ccc1[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587389272 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)O2 ZINC000587389294 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)O2 ZINC000587389295 FG Annotated Bother CC(=O)Nc1ccc2c(c1)[C@]1(CCO2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587389354 FG Annotated Anodyne CC(=O)Nc1ccc2c(c1)[C@@]1(CCO2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587389362 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1nnn(Cc3ccccc3)c1C)O2 ZINC000587389363 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c[nH]ccc1=NC(=O)C(C)(C)C)O2 ZINC000587389365 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cn(CC(=O)O)c3ccccc13)O2 ZINC000587389367 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1nnn(Cc3ccccc3)c1C)O2 ZINC000587389368 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cn(CC(=O)O)c3ccccc13)O2 ZINC000587389370 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c[nH]ccc1=NC(=O)C(C)(C)C)O2 ZINC000587389371 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1nc(-c3ccc([N+](=O)[O-])cc3)no1)O2 ZINC000587389449 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1nc(-c3ccc([N+](=O)[O-])cc3)no1)O2 ZINC000587389452 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCC[C@H]1n1ccc([N+](=O)[O-])n1)O2 ZINC000587389478 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)O2 ZINC000587389487 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCC[C@H]1n1ccc([N+](=O)[O-])n1)O2 ZINC000587389488 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)O2 ZINC000587389490 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cc3c(cc1[N+](=O)[O-])OCO3)O2 ZINC000587389511 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cc3c(cc1[N+](=O)[O-])OCO3)O2 ZINC000587389512 FG Annotated Bother CCn1cc([C@@]2(/C=C/N(C)C)CC(=O)c3cc(C)cc(N)c3O2)c(C)n1 ZINC000587389706 FG Annotated Anodyne CCn1cc([C@]2(/C=C\N(C)C)CC(=O)c3cc(C)cc(N)c3O2)c(C)n1 ZINC000587389707 FG Annotated Anodyne CCn1cc([C@]2(/C=C/N(C)C)CC(=O)c3cc(C)cc(N)c3O2)c(C)n1 ZINC000587389708 FG Annotated Anodyne CCn1cc([C@@]2(/C=C\N(C)C)CC(=O)c3cc(C)cc(N)c3O2)c(C)n1 ZINC000587389709 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc3c([N+](=O)[O-])ccc(O)c3n1)O2 ZINC000587389791 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc3c([N+](=O)[O-])ccc(O)c3n1)O2 ZINC000587389799 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(Cn3ccc([N+](=O)[O-])n3)o1)O2 ZINC000587389966 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(Cn3ccc([N+](=O)[O-])n3)o1)O2 ZINC000587389969 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CC(=O)Nc1ccc([N+](=O)[O-])cc1)O2 ZINC000587390490 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CC(=O)Nc1ccc([N+](=O)[O-])cc1)O2 ZINC000587390492 FG Annotated Bother COc1cc([N+](=O)[O-])c(OC)cc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587390552 FG Annotated Bother COc1cc([N+](=O)[O-])c(OC)cc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587390555 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CC(=O)Nc1ccc3c(c1)OCO3)O2 ZINC000587390631 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CC(=O)Nc1ccc3c(c1)OCO3)O2 ZINC000587390632 FG Annotated Anodyne COC(=O)[C@@]1(c2cn(C)c3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587390691 FG Annotated Anodyne COC(=O)[C@]1(c2cn(C)c3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587390692 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(C)nn(CC(=O)OC(C)C)c1C)O2 ZINC000587390733 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(C)nn(CC(=O)OC(C)C)c1C)O2 ZINC000587390734 FG Annotated Anodyne CCn1ncc([C@@]2(/C=C/N(C)C)CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587390877 FG Annotated Anodyne CCn1ncc([C@]2(/C=C\N(C)C)CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587390879 FG Annotated Anodyne CCn1ncc([C@]2(/C=C/N(C)C)CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587390881 FG Annotated Anodyne CCn1ncc([C@@]2(/C=C\N(C)C)CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587390883 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc([N+](=O)[O-])cc3c1OCOC3)O2 ZINC000587390916 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc([N+](=O)[O-])cc3c1OCOC3)O2 ZINC000587390918 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(Cn3cc([N+](=O)[O-])cn3)o1)O2 ZINC000587390920 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(Cn3cc([N+](=O)[O-])cn3)o1)O2 ZINC000587390922 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)N(CCN=[N+]=[N-])c2ccccc21 ZINC000587390923 FG Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)N(CCN=[N+]=[N-])c2ccccc21 ZINC000587390924 FG Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C/N(C)C)(c1cccc([N+](=O)[O-])c1)O2 ZINC000587390972 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C\N(C)C)(c1cccc([N+](=O)[O-])c1)O2 ZINC000587390973 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C/N(C)C)(c1cccc([N+](=O)[O-])c1)O2 ZINC000587390974 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C\N(C)C)(c1cccc([N+](=O)[O-])c1)O2 ZINC000587390975 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c[nH]ccc1=NC(=O)OC(C)(C)C)O2 ZINC000587390988 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c[nH]ccc1=NC(=O)OC(C)(C)C)O2 ZINC000587390989 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCc3nn(-c4ccccc4)nc31)O2 ZINC000587391184 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCc3nn(-c4ccccc4)nc31)O2 ZINC000587391189 FG Annotated Anodyne COC(=O)Cn1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c2ccccc21 ZINC000587391204 FG Annotated Anodyne COC(=O)Cn1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c2ccccc21 ZINC000587391207 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(C(=O)O)n(C)c3ccccc13)O2 ZINC000587391222 FG Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(C(=O)O)n(C)c3ccccc13)O2 ZINC000587391224 FG Annotated Clean COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c([N+](=O)[O-])cc1OC ZINC000587391337 FG Annotated Bother COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c([N+](=O)[O-])cc1OC ZINC000587391338 FG Annotated Bother COc1ccc(NC(=O)C[C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587391495 FG Annotated Anodyne COc1ccc(NC(=O)C[C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587391497 FG Annotated Anodyne CCO[C@@H](C)c1ccc([C@]2(CN)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587391552 FG Annotated Anodyne CCO[C@@H](C)c1ccc([C@@]2(CN)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587391555 FG Annotated Anodyne CCO[C@H](C)c1ccc([C@]2(CN)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587391558 FG Annotated Anodyne CCO[C@H](C)c1ccc([C@@]2(CN)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587391562 FG Annotated Anodyne COc1cc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc([N+](=O)[O-])c1O ZINC000587391692 FG Annotated Bother COc1cc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc([N+](=O)[O-])c1O ZINC000587391693 FG Annotated Bother COc1ccc(OC)c([N+](=O)[O-])c1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587391713 FG Annotated Bother COc1ccc(OC)c([N+](=O)[O-])c1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587391714 FG Annotated Bother CCOc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc([N+](=O)[O-])c1O ZINC000587391755 FG Annotated Bother CCOc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc([N+](=O)[O-])c1O ZINC000587391756 FG Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cn(CC(=O)O)c3ccccc13)O2 ZINC000587391957 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cn(CC(=O)O)c3ccccc13)O2 ZINC000587391959 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CC(=O)N(C(=O)OC(C)(C)C)C1(C)C)O2 ZINC000587391982 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CC(=O)N(C(=O)OC(C)(C)C)C1(C)C)O2 ZINC000587391995 FG Annotated Anodyne COc1ccnc(-n2cccc2[C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1C#N ZINC000587392017 FG Annotated Mild COc1ccnc(-n2cccc2[C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1C#N ZINC000587392026 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@@H](N=O)C(=O)Nc1ccccc1)O2 ZINC000587392180 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cn(CCC#N)nc1-c1ccncc1)O2 ZINC000587392251 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cn(CCC#N)nc1-c1ccncc1)O2 ZINC000587392253 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@H](N=O)C(=O)Nc1ccccc1)O2 ZINC000587392322 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@H](N=O)C(=O)Nc1ccccc1)O2 ZINC000587392324 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@@H](N=O)C(=O)Nc1ccccc1)O2 ZINC000587392327 FG Annotated Anodyne CCOC(=O)c1nn(C(C)(C)C)cc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587392354 FG Annotated Anodyne CCOC(=O)c1nn(C(C)(C)C)cc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587392359 FG Annotated Anodyne COc1ccccc1NC(=O)C[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587392374 FG Annotated Anodyne COc1ccccc1NC(=O)C[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587392377 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CC#N)([C@@H]1CCN1C(=O)OC(C)(C)C)O2 ZINC000587392454 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](CC#N)([C@@H]1CCN1C(=O)OC(C)(C)C)O2 ZINC000587392456 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](CC#N)([C@H]1CCN1C(=O)OC(C)(C)C)O2 ZINC000587392457 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](CC#N)([C@H]1CCN1C(=O)OC(C)(C)C)O2 ZINC000587392458 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCN(C(=O)OC(C)(C)C)C[C@@H]1C#N)O2 ZINC000587392524 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCN(C(=O)OC(C)(C)C)C[C@@H]1C#N)O2 ZINC000587392525 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCN(C(=O)OC(C)(C)C)C[C@H]1C#N)O2 ZINC000587392526 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCN(C(=O)OC(C)(C)C)C[C@H]1C#N)O2 ZINC000587392528 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N3C[C@H](C)O[C@H](C)C3)nc1)O2 ZINC000587392539 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N3C[C@H](C)O[C@@H](C)C3)nc1)O2 ZINC000587392540 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(N3C[C@H](C)O[C@H](C)C3)nc1)O2 ZINC000587392541 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N3C[C@@H](C)O[C@H](C)C3)nc1)O2 ZINC000587392542 FG Annotated Anodyne Cc1ccc([C@]2(CCn3cncn3)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587392710 FG Annotated Anodyne Cc1ccc([C@@]2(CCn3cncn3)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587392711 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CN(Cc3ccccc3)C(=O)C13CC3)O2 ZINC000587393003 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CN(Cc3ccccc3)C(=O)C13CC3)O2 ZINC000587393006 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCN(Cc3ccccn3)C[C@@H]1C)O2 ZINC000587393025 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCN(Cc3ccccn3)C[C@H]1C)O2 ZINC000587393028 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCN(Cc3ccccn3)C[C@H]1C)O2 ZINC000587393030 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCN(Cc3ccccn3)C[C@@H]1C)O2 ZINC000587393032 FG Annotated Anodyne CC1=C[C@]2(CC(=O)c3cc(C)cc(N)c3O2)CC(=O)N1Cc1cccnc1 ZINC000587393058 FG Annotated Anodyne CC1=C[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)CC(=O)N1Cc1cccnc1 ZINC000587393062 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CC#N)(C1CN(C(=O)OC(C)(C)C)C1)O2 ZINC000587393065 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](CC#N)(C1CN(C(=O)OC(C)(C)C)C1)O2 ZINC000587393068 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(N3CCC(O)CC3)cc1)O2 ZINC000587393118 FG Annotated Anodyne CC1=C[C@]2(CC(=O)c3cc(C)cc(N)c3O2)CC(=O)N1Cc1ccco1 ZINC000587393120 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N3CCC(O)CC3)cc1)O2 ZINC000587393121 FG Annotated Anodyne CC1=C[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)CC(=O)N1Cc1ccco1 ZINC000587393125 FG Annotated Anodyne C=CN1CC[C@H]([C@]2(c3ccccc3)CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587393174 FG Annotated Anodyne C=CN1CC[C@H]([C@@]2(c3ccccc3)CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587393175 FG Annotated Anodyne C=CN1CC[C@@H]([C@]2(c3ccccc3)CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587393177 FG Annotated Anodyne C=CN1CC[C@@H]([C@@]2(c3ccccc3)CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587393179 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCc3c1cnn3-c1ccccn1)O2 ZINC000587393227 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCc3c1cnn3-c1ccccn1)O2 ZINC000587393230 FG Annotated Anodyne COc1nc(N2CCCC2)ccc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587393444 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(OC3CCOCC3)nc1)O2 ZINC000587393780 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(OC3CCOCC3)nc1)O2 ZINC000587393781 FG Annotated Anodyne CCOC(=O)CC[C@@]1(c2ccccn2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587393814 FG Annotated Anodyne CCOC(=O)CC[C@]1(c2ccccn2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587393815 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(C)nn3c(=O)c4ccccc4[nH]c13)O2 ZINC000587393870 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(C)nn3c(=O)c4ccccc4[nH]c13)O2 ZINC000587393871 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2ccccc2C(=O)c2cnccc21 ZINC000587393933 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2ccccc2C(=O)c2cnccc21 ZINC000587393934 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(C(C)(C)O)nn3ccccc13)O2 ZINC000587394328 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(C(C)(C)O)nn3ccccc13)O2 ZINC000587394329 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2ccccc2C(=O)c2ccncc21 ZINC000587394415 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2ccccc2C(=O)c2ccncc21 ZINC000587394416 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C(=O)c1ccccn1)(c1ccccn1)O2 ZINC000587394458 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C(=O)c1ccccn1)(c1ccccn1)O2 ZINC000587394459 FG Annotated Anodyne COc1ccc2[nH]c(=O)c([C@H]3CC(=O)c4cc(C)cc(N)c4O3)cc2c1 ZINC000587394541 FG Annotated Anodyne COc1ccc2[nH]c(=O)c([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)cc2c1 ZINC000587394542 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(C#Cc3cncnc3)cc1)O2 ZINC000587394543 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(C#Cc3cncnc3)cc1)O2 ZINC000587394544 FG Annotated Mild COc1nc(N2CCCC2)ccc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587394752 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(N3CCC(CO)CC3)cc1)O2 ZINC000587394758 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N3CCC(CO)CC3)cc1)O2 ZINC000587394759 FG Annotated Anodyne CCOC(=O)c1nocc1[C@@]1(C2CC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587394872 FG Annotated Anodyne CCOC(=O)c1nocc1[C@]1(C2CC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587394873 FG Annotated Anodyne CC(=O)N1CC[C@]2(CC(=O)c3cc(C)cc(N)c3O2)c2ccccc2C1 ZINC000587394907 FG Annotated Anodyne CC(=O)N1CC[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)c2ccccc2C1 ZINC000587394909 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(CCN(Cc3ccc(C#N)cc3)CC1)O2 ZINC000587395174 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc3cc(C)c(C)cc3n3nnnc13)O2 ZINC000587395278 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc3cc(C)c(C)cc3n3nnnc13)O2 ZINC000587395279 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@H]1CN(Cc3ccccc3)CCO1)O2 ZINC000587395537 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@H]1CN(Cc3ccccc3)CCO1)O2 ZINC000587395538 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@@H]1CN(Cc3ccccc3)CCO1)O2 ZINC000587395539 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@@H]1CN(Cc3ccccc3)CCO1)O2 ZINC000587395540 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(O)c3nc(O)ccc13)O2 ZINC000587395607 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(O)c3nc(O)ccc13)O2 ZINC000587395608 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc3cc4c(cc3nc1O)OCO4)O2 ZINC000587395609 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc3cc4c(cc3nc1O)OCO4)O2 ZINC000587395610 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c[nH]nc1-c1ccc3c(c1)OCO3)O2 ZINC000587395673 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c[nH]nc1-c1ccc3c(c1)OCO3)O2 ZINC000587395674 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCC(=O)N(Cc3ccccc3)CC1)O2 ZINC000587395765 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCC(=O)N(Cc3ccccc3)CC1)O2 ZINC000587395766 FG Annotated Anodyne CCOC(=O)[C@H](c1cccnc1)[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587395820 FG Annotated Anodyne CCOC(=O)[C@H](c1cccnc1)[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587395821 FG Annotated Anodyne CCOC(=O)[C@@H](c1cccnc1)[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587395822 FG Annotated Anodyne CCOC(=O)[C@@H](c1cccnc1)[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587395823 FG Annotated Anodyne COC(=O)[C@@]1(c2c[nH]c3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587396023 FG Annotated Anodyne COC(=O)[C@]1(c2c[nH]c3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587396024 FG Annotated Anodyne CCOC(=O)CC[C@@]1(c2cccnc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587396309 FG Annotated Anodyne CCOC(=O)CC[C@]1(c2cccnc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587396310 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)c2cccnc2-c2ncccc21 ZINC000587396323 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)c2cccnc2-c2ncccc21 ZINC000587396324 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(OCc3ncon3)cc1)O2 ZINC000587396335 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(OCc3ncon3)cc1)O2 ZINC000587396336 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](C1CCN(Cc3cccnc3)CC1)O2 ZINC000587396475 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](C1CCN(Cc3cccnc3)CC1)O2 ZINC000587396476 FG Annotated Anodyne CCOC(=O)[C@@]1(c2c[nH]c3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587396543 FG Annotated Anodyne CCOC(=O)[C@]1(c2c[nH]c3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587396544 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCN(Cc3ccccc3)C(=O)C1)O2 ZINC000587396567 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCN(Cc3ccccc3)C(=O)C1)O2 ZINC000587396568 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CC(=O)N(C(=O)OC(C)(C)C)C[C@@H]1C)O2 ZINC000587396582 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CC(=O)N(C(=O)OC(C)(C)C)C[C@H]1C)O2 ZINC000587396584 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CC(=O)N(C(=O)OC(C)(C)C)C[C@H]1C)O2 ZINC000587396586 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CC(=O)N(C(=O)OC(C)(C)C)C[C@@H]1C)O2 ZINC000587396588 FG Annotated Anodyne C=CN1CCCC[C@H]([C@]2(C3CC3)CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587396591 FG Annotated Anodyne C=CN1CCCC[C@@H]([C@@]2(C3CC3)CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587396593 FG Annotated Anodyne C=CN1CCCC[C@@H]([C@]2(C3CC3)CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587396595 FG Annotated Anodyne C=CN1CCCC[C@H]([C@@]2(C3CC3)CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587396597 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1[nH]c3cc(O)nc(O)c3c1C)O2 ZINC000587396600 FG Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1[nH]c3cc(O)nc(O)c3c1C)O2 ZINC000587396602 FG Annotated Clean Cc1cc(N)c2c(c1)C(=O)CC1(CCN(c3ccc4c(c3)OCO4)CC1)O2 ZINC000587396792 FG Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(N3CCC(O)CC3)cc1)O2 ZINC000587396818 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(N3CCC(O)CC3)cc1)O2 ZINC000587396821 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C(=O)O)(c1c(C)[nH]c3ccccc13)O2 ZINC000587397137 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C(=O)O)(c1c(C)[nH]c3ccccc13)O2 ZINC000587397138 FG Annotated Anodyne COc1nc(N2CCCC2)ccc1[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587397362 FG Annotated Anodyne COc1nc(N2CCCC2)ccc1[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587397363 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)O2 ZINC000587397378 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@H]3CN(C(=O)OC(C)(C)C)C[C@@H]31)O2 ZINC000587397379 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]31)O2 ZINC000587397380 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]31)O2 ZINC000587397381 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)O2 ZINC000587397382 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](Cc1c[nH]c3ccccc13)(C(=O)O)O2 ZINC000587397458 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](Cc1c[nH]c3ccccc13)(C(=O)O)O2 ZINC000587397460 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CN1CCOCC1)(c1ccccc1C)O2 ZINC000587397500 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CN1CCOCC1)(c1ccccc1C)O2 ZINC000587397501 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(C=O)c3c(c1)CCCN3C)O2 ZINC000587397512 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(C=O)c3c(c1)CCCN3C)O2 ZINC000587397513 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)O2 ZINC000587397514 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)O2 ZINC000587397515 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)O2 ZINC000587397516 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)O2 ZINC000587397517 FG Annotated Anodyne CC(=O)c1c(C)[nH]c([C@]2(CC#N)CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587397606 FG Annotated Mild CC(=O)c1c(C)[nH]c([C@@]2(CC#N)CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587397622 FG Annotated Mild CCOC(=O)[C@H](Cc1ccccc1)[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587397691 FG Annotated Anodyne CCOC(=O)[C@@H](Cc1ccccc1)[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587397699 FG Annotated Anodyne CCOC(=O)[C@@H](Cc1ccccc1)[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587397702 FG Annotated Anodyne CCOC(=O)[C@H](Cc1ccccc1)[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587397705 FG Annotated Anodyne CCOc1cccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1OCC(=O)O ZINC000587397734 FG Annotated Anodyne CCOc1cccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1OCC(=O)O ZINC000587397746 FG Annotated Anodyne COC(=O)c1cc(OC)cc(OC)c1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587397751 FG Annotated Anodyne COC(=O)c1cc(OC)cc(OC)c1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587397753 FG Annotated Anodyne COC(=O)[C@@H]1CCc2ccccc2[C@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587397832 FG Annotated Anodyne COC(=O)[C@H]1CCc2ccccc2[C@@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587397837 FG Annotated Anodyne COC(=O)[C@H]1CCc2ccccc2[C@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587397838 FG Annotated Anodyne COC(=O)[C@@H]1CCc2ccccc2[C@@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587397841 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C[C@H]3C[C@H]1CN3C(=O)OC(C)(C)C)O2 ZINC000587397923 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@H]3C[C@H]1CN3C(=O)OC(C)(C)C)O2 ZINC000587397925 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(N3CCN(C)CC3)c1)O2 ZINC000587397928 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(N3CCN(C)CC3)c1)O2 ZINC000587397930 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1c(C)[nH]c(C(=O)CC#N)c1C)O2 ZINC000587397978 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1c(C)[nH]c(C(=O)CC#N)c1C)O2 ZINC000587397980 FG Annotated Mild COC(=O)[C@@]1(c2c(C)[nH]c3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398018 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(N3CCN(C)CC3)cc1)O2 ZINC000587398019 FG Annotated Anodyne COC(=O)[C@]1(c2c(C)[nH]c3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398020 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N3CCN(C)CC3)cc1)O2 ZINC000587398021 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(N3CCOC3=O)cc1)O2 ZINC000587398049 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(O[C@@H](C)C(=O)O)cc1)O2 ZINC000587398054 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(O[C@H](C)C(=O)O)cc1)O2 ZINC000587398055 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(N3CCOC3=O)cc1)O2 ZINC000587398056 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(O[C@H](C)C(=O)O)cc1)O2 ZINC000587398057 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(O[C@@H](C)C(=O)O)cc1)O2 ZINC000587398059 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](COc1ccc(C(=O)O)cc1)(C1CC1)O2 ZINC000587398066 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](COc1ccc(C(=O)O)cc1)(C1CC1)O2 ZINC000587398068 FG Annotated Anodyne CCN1CCN(c2ccccc2[C@@H]2CC(=O)c3cc(C)cc(N)c3O2)CC1 ZINC000587398083 FG Annotated Anodyne CCN1CCN(c2ccccc2[C@H]2CC(=O)c3cc(C)cc(N)c3O2)CC1 ZINC000587398084 FG Annotated Anodyne COC(=O)[C@H](C)Oc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587398103 FG Annotated Anodyne COC(=O)[C@@H](C)Oc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587398104 FG Annotated Anodyne COC(=O)[C@H](C)Oc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587398105 FG Annotated Anodyne COC(=O)[C@@H](C)Oc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587398106 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CC3(CCNCC3)Oc3ccccc31)O2 ZINC000587398119 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CC3(CCNCC3)Oc3ccccc31)O2 ZINC000587398120 FG Annotated Anodyne COc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1COC(C)=O ZINC000587398155 FG Annotated Anodyne COc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1COC(C)=O ZINC000587398156 FG Annotated Anodyne CCOC(=O)[C@]1(CCc2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398169 FG Annotated Anodyne CCOC(=O)[C@@]1(CCc2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398171 FG Annotated Anodyne COC(=O)[C@@H](C)[C@]1(c2cccc(OC)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398234 FG Annotated Anodyne COC(=O)[C@@H](C)[C@@]1(c2cccc(OC)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398237 FG Annotated Anodyne COC(=O)[C@H](C)[C@@]1(c2cccc(OC)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398238 FG Annotated Anodyne COC(=O)[C@H](C)[C@]1(c2cccc(OC)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398239 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(O2)[C@H]2C[C@H]1CN(C(=O)OC(C)(C)C)C2 ZINC000587398359 FG Annotated Anodyne COc1cc(N2CCOCC2)ccc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398369 FG Annotated Anodyne COc1cc(N2CCOCC2)ccc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398370 FG Annotated Anodyne CCOC(=O)COc1ccccc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398430 FG Annotated Anodyne CCOC(=O)COc1ccccc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398437 FG Annotated Anodyne CCOC(=O)COc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587398445 FG Annotated Anodyne CCOC(=O)COc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587398446 FG Annotated Anodyne CCOC(=O)COc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587398511 FG Annotated Anodyne CCOC(=O)COc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587398512 FG Annotated Anodyne COCCOc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587398672 FG Annotated Anodyne COCCOc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587398674 FG Annotated Anodyne COC(=O)[C@H]1CC[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)c2ccccc21 ZINC000587398735 FG Annotated Anodyne COC(=O)[C@H]1CC[C@]2(CC(=O)c3cc(C)cc(N)c3O2)c2ccccc21 ZINC000587398736 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)c2ccccc21 ZINC000587398737 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@]2(CC(=O)c3cc(C)cc(N)c3O2)c2ccccc21 ZINC000587398738 FG Annotated Anodyne COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OCCC(=O)O ZINC000587398830 FG Annotated Anodyne COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OCCC(=O)O ZINC000587398831 FG Annotated Anodyne CCOC(=O)COc1ccccc1[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398835 FG Annotated Anodyne CCOC(=O)COc1ccccc1[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398837 FG Annotated Anodyne COC(=O)COc1c(C)cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1C ZINC000587398848 FG Annotated Anodyne COC(=O)COc1c(C)cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1C ZINC000587398850 FG Annotated Anodyne CC[C@@]1(c2ccc(OCC(=O)O)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398927 FG Annotated Anodyne CC[C@]1(c2ccc(OCC(=O)O)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398929 FG Annotated Anodyne COc1cc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc(OC)c1OC ZINC000587399150 FG Annotated Anodyne COc1cc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc(OC)c1OC ZINC000587399151 FG Annotated Anodyne COc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1CC(=O)O ZINC000587399152 FG Annotated Anodyne COc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1CC(=O)O ZINC000587399159 FG Annotated Anodyne CCOC(=O)COc1cccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587399266 FG Annotated Anodyne CCOC(=O)COc1cccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587399267 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(OCCC(=O)O)cc1)O2 ZINC000587399318 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(OCCC(=O)O)cc1)O2 ZINC000587399320 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccccc1N1CCN(C)CC1)O2 ZINC000587399642 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccccc1N1CCN(C)CC1)O2 ZINC000587399643 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(C[C@@H]3C[C@H](C1)N3C(=O)OC(C)(C)C)O2 ZINC000587399654 FG Annotated Anodyne COC(=O)COc1ccccc1[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399724 FG Annotated Anodyne COC(=O)COc1ccccc1[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399732 FG Annotated Anodyne COCCOCCOc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587399845 FG Annotated Anodyne COCCOCCOc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587399849 FG Annotated Anodyne CCOC(=O)[C@@]1(c2cccc(OC)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399858 FG Annotated Anodyne CCOC(=O)[C@]1(c2cccc(OC)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399861 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(N3CCOCC3)cc1C)O2 ZINC000587400060 FG Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N3CCOCC3)cc1C)O2 ZINC000587400061 FG Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@H]([C@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)O2 ZINC000587400066 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H]([C@@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)O2 ZINC000587400067 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](C1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]13)O2 ZINC000587400068 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H]([C@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)O2 ZINC000587400069 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H]([C@@H]1[C@H]3CN(C(=O)OC(C)(C)C)C[C@H]31)O2 ZINC000587400070 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](C1[C@@H]3CN(C(=O)OC(C)(C)C)C[C@@H]13)O2 ZINC000587400071 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(N3CCN(C)CC3)cc1)O2 ZINC000587400074 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(N3CCN(C)CC3)cc1)O2 ZINC000587400075 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccccc1N1CCOC1=O)O2 ZINC000587400092 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccccc1N1CCOC1=O)O2 ZINC000587400093 FG Annotated Anodyne COCCOc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587400138 FG Annotated Anodyne COCCOc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587400141 FG Annotated Anodyne COc1cc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1OC(C)=O ZINC000587400265 FG Annotated Anodyne COc1cc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1OC(C)=O ZINC000587400268 FG Annotated Anodyne CCOC(=O)C[C@]1(c2ccccc2OC)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400270 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2ccccc2OC)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400272 FG Annotated Anodyne CCOC(=O)C[C@]1(c2cccc(OC)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400327 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2cccc(OC)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400329 FG Annotated Anodyne COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1O[C@@H](C)C(=O)O ZINC000587400373 FG Annotated Anodyne COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1O[C@H](C)C(=O)O ZINC000587400376 FG Annotated Anodyne COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1O[C@@H](C)C(=O)O ZINC000587400377 FG Annotated Anodyne COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1O[C@H](C)C(=O)O ZINC000587400378 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(CC3(CN(C(=O)OC(C)(C)C)C3)C1)O2 ZINC000587400450 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](C1(CN3CCOCC3)CCCCC1)O2 ZINC000587400455 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](C1(CN3CCOCC3)CCCCC1)O2 ZINC000587400456 FG Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(OCC)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400511 FG Annotated Anodyne CCOC(=O)[C@]1(c2ccc(OCC)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400512 FG Annotated Anodyne CCOC(=O)C(=O)C[C@]1(C2CCCCC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400532 FG Annotated Anodyne CCOC(=O)C(=O)C[C@@]1(C2CCCCC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400538 FG Annotated Anodyne CCOc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1C(=O)OC ZINC000587400573 FG Annotated Anodyne CCOc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1C(=O)OC ZINC000587400574 FG Annotated Anodyne CC(=O)N1CCc2cc([C@]3(C)CC(=O)c4cc(C)cc(N)c4O3)ccc21 ZINC000587400609 FG Annotated Anodyne CC(=O)N1CCc2cc([C@@]3(C)CC(=O)c4cc(C)cc(N)c4O3)ccc21 ZINC000587400616 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cccc(N3CCOC3=O)c1)O2 ZINC000587400620 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cccc(N3CCOC3=O)c1)O2 ZINC000587400623 FG Annotated Anodyne COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc(OC)c1OC(C)=O ZINC000587400646 FG Annotated Anodyne COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc(OC)c1OC(C)=O ZINC000587400647 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cccc(O[C@@H](C)C(=O)O)c1)O2 ZINC000587400796 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cccc(O[C@H](C)C(=O)O)c1)O2 ZINC000587400797 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cccc(O[C@H](C)C(=O)O)c1)O2 ZINC000587400798 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cccc(O[C@@H](C)C(=O)O)c1)O2 ZINC000587400799 FG Annotated Anodyne COC(=O)[C@@]12C[C@H]3C[C@@H](C1)[C@]1(CC(=O)c4cc(C)cc(N)c4O1)[C@H](C3)C2 ZINC000587400876 FG Annotated Anodyne COC(=O)[C@@]12C[C@H]3C[C@@H](C1)[C@@]1(CC(=O)c4cc(C)cc(N)c4O1)[C@H](C3)C2 ZINC000587400877 FG Annotated Anodyne CCOc1ccc([C@@]2(C=O)CC(=O)c3cc(C)cc(N)c3O2)cc1OCC ZINC000587400957 FG Annotated Mild CCOc1ccc([C@]2(C=O)CC(=O)c3cc(C)cc(N)c3O2)cc1OCC ZINC000587400958 FG Annotated Mild CCOC(=O)[C@@H]1Cc2ccccc2[C@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587400959 FG Annotated Anodyne CCOC(=O)[C@H]1Cc2ccccc2[C@@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587400960 FG Annotated Anodyne CCOC(=O)[C@H]1Cc2ccccc2[C@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587400962 FG Annotated Anodyne CCOC(=O)[C@@H]1Cc2ccccc2[C@@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587400965 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(CC3(CCN3C(=O)OC(C)(C)C)C1)O2 ZINC000587401052 FG Annotated Anodyne COc1cc(OC)c([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587401148 FG Annotated Anodyne COc1cc(OC)c([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587401150 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C[C@H]3C[C@H]1N(C(=O)OC(C)(C)C)C3)O2 ZINC000587401163 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@H]3C[C@H]1N(C(=O)OC(C)(C)C)C3)O2 ZINC000587401165 FG Annotated Anodyne COc1cccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1O[C@@H](C)C(=O)O ZINC000587401167 FG Annotated Anodyne COc1cccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1O[C@H](C)C(=O)O ZINC000587401169 FG Annotated Anodyne COc1cccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1O[C@@H](C)C(=O)O ZINC000587401171 FG Annotated Anodyne COc1cccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1O[C@H](C)C(=O)O ZINC000587401173 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)[C@H]2CC[C@H]1N(C(=O)OC(C)(C)C)C2 ZINC000587401177 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)[C@H]2CC[C@H]1N(C(=O)OC(C)(C)C)C2 ZINC000587401178 FG Annotated Anodyne COc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c(OC)c1OC ZINC000587401334 FG Annotated Anodyne COc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c(OC)c1OC ZINC000587401335 FG Annotated Anodyne COc1cc(OC)c([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c(OC)c1 ZINC000587401392 FG Annotated Anodyne COc1cc(OC)c([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c(OC)c1 ZINC000587401393 FG Annotated Anodyne COC(=O)C[C@]1(c2ccccc2OC)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587401446 FG Annotated Anodyne COC(=O)C[C@@]1(c2ccccc2OC)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587401448 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(CN3CCOCC3)c1)O2 ZINC000587401619 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(CN3CCOCC3)c1)O2 ZINC000587401620 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCC13CN(C(=O)OC(C)(C)C)C3)O2 ZINC000587401654 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCC13CN(C(=O)OC(C)(C)C)C3)O2 ZINC000587401655 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc3c(c1)CCC(=O)N3C)O2 ZINC000587401660 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc3c(c1)CCC(=O)N3C)O2 ZINC000587401661 FG Annotated Anodyne CCN1CCN(c2ccc([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)cc2)CC1 ZINC000587401664 FG Annotated Anodyne CCN1CCN(c2ccc([C@H]3CC(=O)c4cc(C)cc(N)c4O3)cc2)CC1 ZINC000587401665 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(C)nc(N3CCCCC3)n1)O2 ZINC000587401698 FG Annotated Anodyne CCOC(=O)C[C@]1(c2cccc(O)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587401701 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2cccc(O)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587401702 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(C)nc(N3CCCCC3)n1)O2 ZINC000587401708 FG Annotated Anodyne COc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1OC(C)=O ZINC000587401848 FG Annotated Anodyne COc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1OC(C)=O ZINC000587401849 FG Annotated Anodyne COC(=O)/C=C/c1ccc(O)c([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587401856 FG Annotated Anodyne COC(=O)/C=C/c1ccc(O)c([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587401857 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)N(CC(C)C)c2ccccc21 ZINC000587402067 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)N(CC(C)C)c2ccccc21 ZINC000587402068 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cccc(N3CCOCC3)c1)O2 ZINC000587402130 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cccc(N3CCOCC3)c1)O2 ZINC000587402131 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(C=O)cc3c1N(C)CCC3)O2 ZINC000587402147 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(C=O)cc3c1N(C)CCC3)O2 ZINC000587402149 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CCc1ccc(OCC(=O)O)cc1)O2 ZINC000587402291 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CCc1ccc(OCC(=O)O)cc1)O2 ZINC000587402296 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C[C@@H]3CC[C@H]1N3C(=O)OC(C)(C)C)O2 ZINC000587402363 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C[C@H]3CC[C@H]1N3C(=O)OC(C)(C)C)O2 ZINC000587402364 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@@H]3CC[C@H]1N3C(=O)OC(C)(C)C)O2 ZINC000587402365 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@H]3CC[C@H]1N3C(=O)OC(C)(C)C)O2 ZINC000587402366 FG Annotated Anodyne COc1ccc2c(c1)[C@H](CC(=O)O)C[C@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587402425 FG Annotated Anodyne COc1ccc2c(c1)[C@@H](CC(=O)O)C[C@@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587402430 FG Annotated Anodyne COc1ccc2c(c1)[C@@H](CC(=O)O)C[C@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587402431 FG Annotated Anodyne COc1ccc2c(c1)[C@H](CC(=O)O)C[C@@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587402434 FG Annotated Anodyne COC(=O)COc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587402455 FG Annotated Anodyne COC(=O)COc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587402457 FG Annotated Anodyne CC(=O)Oc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OC(C)=O ZINC000587402478 FG Annotated Anodyne CC(=O)Oc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OC(C)=O ZINC000587402479 FG Annotated Anodyne COC1=C(OC)[C@]2(CC(=O)c3cc(C)cc(N)c3O2)c2ccccc2C1=O ZINC000587402573 FG Annotated Mild COC1=C(OC)[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)c2ccccc2C1=O ZINC000587402574 FG Annotated Mild CC(=O)OC12CC3C[C@@H](C1)C1(CC(=O)c4cc(C)cc(N)c4O1)[C@@H](C3)C2 ZINC000587402752 FG Annotated Anodyne COc1ccc([C@]2(CCC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587402791 FG Annotated Anodyne COc1ccc([C@@]2(CCC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587402793 FG Annotated Anodyne COC(=O)C[C@]1(c2cccc(OC)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587402850 FG Annotated Anodyne COC(=O)C[C@@]1(c2cccc(OC)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587402851 FG Annotated Anodyne COC(=O)[C@@H](C)[C@]1(c2ccc(OC)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587403120 FG Annotated Anodyne COC(=O)[C@@H](C)[C@@]1(c2ccc(OC)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587403121 FG Annotated Anodyne COC(=O)[C@H](C)[C@@]1(c2ccc(OC)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587403122 FG Annotated Anodyne COC(=O)[C@H](C)[C@]1(c2ccc(OC)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587403123 FG Annotated Anodyne CCOC(=O)C[C@]1(c2ccc(OC)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587403185 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2ccc(OC)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587403186 FG Annotated Anodyne COC(=O)C[C@]1(c2ccc(OC)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587403434 FG Annotated Anodyne COC(=O)C[C@@]1(c2ccc(OC)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587403436 FG Annotated Anodyne COc1ccc([C@@]2(COC(C)=O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587403745 FG Annotated Anodyne COc1ccc([C@]2(COC(C)=O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587403747 FG Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(OC)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587403863 FG Annotated Anodyne CCOC(=O)[C@]1(c2ccc(OC)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587403864 FG Annotated Anodyne Cc1ccc(S(=O)(=O)C[C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587406305 FG Annotated Anodyne Cc1ccc(S(=O)(=O)C[C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587406309 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(/C=C/C(=O)O)=COc2ccccc21 ZINC000587406568 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(/C=C/C(=O)O)=COc2ccccc21 ZINC000587406573 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(/C=C\C(=O)O)=COc2ccccc21 ZINC000587406575 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(/C=C\C(=O)O)=COc2ccccc21 ZINC000587406576 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C=C(C(=O)O)Oc3c(C)cccc31)O2 ZINC000587406749 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C=C(C(=O)O)Oc3c(C)cccc31)O2 ZINC000587406750 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C=C(C(=O)O)Oc3c(C)cc(C)cc31)O2 ZINC000587406938 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C=C(C(=O)O)Oc3c(C)cc(C)cc31)O2 ZINC000587406939 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](Cc1cc3ccccc3o1)(C(=O)O)O2 ZINC000587407268 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](Cc1cc3ccccc3o1)(C(=O)O)O2 ZINC000587407269 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CSC#N)(c1ccc(O)c(O)c1)O2 ZINC000587407482 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CSC#N)(c1ccc(O)c(O)c1)O2 ZINC000587407501 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccccc1OCC1OCCO1)O2 ZINC000587407636 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccccc1OCC1OCCO1)O2 ZINC000587407639 FG Annotated Anodyne CCS(=O)(=O)Nc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587407685 FG Annotated Anodyne CCS(=O)(=O)Nc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587407686 FG Annotated Anodyne Cc1ccc2c(c1)OC(C(=O)O)=C[C@@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587407792 FG Annotated Anodyne Cc1ccc2c(c1)OC(C(=O)O)=C[C@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587407794 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C(=O)O)(c1ccc3c(c1)CCCC3)O2 ZINC000587408147 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C(=O)O)(c1ccc3c(c1)CCCC3)O2 ZINC000587408148 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)[C@@H](C(=O)C(=O)O)[C@H]2CC[C@@]1(C)C2(C)C ZINC000587408201 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)[C@H](C(=O)C(=O)O)[C@H]2CC[C@@]1(C)C2(C)C ZINC000587408203 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)[C@@H](C(=O)C(=O)O)[C@H]2CC[C@@]1(C)C2(C)C ZINC000587408205 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)[C@H](C(=O)C(=O)O)[C@H]2CC[C@@]1(C)C2(C)C ZINC000587408206 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C=C(C(=O)O)Oc3ccc(C)cc31)O2 ZINC000587408309 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C=C(C(=O)O)Oc3ccc(C)cc31)O2 ZINC000587408310 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(S(=O)(=O)Cl)cc1)O2 ZINC000587408657 FG Annotated Unstable Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(S(=O)(=O)Cl)cc1)O2 ZINC000587408668 FG Annotated Unstable Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(C(=O)O)=COc2ccc(C)cc21 ZINC000587408751 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(C(=O)O)=COc2ccc(C)cc21 ZINC000587408752 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCS(=O)(=O)c3ccccc31)O2 ZINC000587408777 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCS(=O)(=O)c3ccccc31)O2 ZINC000587408782 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CSCC(=O)O)(c1ccccc1)O2 ZINC000587408916 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CSCC(=O)O)(c1ccccc1)O2 ZINC000587408922 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(CS(C)(=O)=O)cc1)O2 ZINC000587408929 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(CS(C)(=O)=O)cc1)O2 ZINC000587409031 FG Annotated Anodyne CCOC(=O)C1=C[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)c2ccccc2O1 ZINC000587409317 FG Annotated Anodyne CCOC(=O)C1=C[C@]2(CC(=O)c3cc(C)cc(N)c3O2)c2ccccc2O1 ZINC000587409319 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(O)ccc3c(C)cc(=O)oc13)O2 ZINC000587409661 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(O)ccc3c(C)cc(=O)oc13)O2 ZINC000587409664 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1cc(C(=O)O)cs1)O2 ZINC000587409691 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1cc(C(=O)O)cs1)O2 ZINC000587409697 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cccc(S(=O)(=O)Cl)c1)O2 ZINC000587409707 FG Annotated Unstable Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cccc(S(=O)(=O)Cl)c1)O2 ZINC000587409709 FG Annotated Unstable COCCOc1cc2c(cc1[C@@H]1CC(=O)c3cc(C)cc(N)c3O1)OCO2 ZINC000587409808 FG Annotated Anodyne COCCOc1cc2c(cc1[C@H]1CC(=O)c3cc(C)cc(N)c3O1)OCO2 ZINC000587409809 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCS(=O)(=O)c3ccc(C)cc31)O2 ZINC000587410050 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCS(=O)(=O)c3ccc(C)cc31)O2 ZINC000587410054 FG Annotated Anodyne CCc1ccc2c(c1)[C@@]1(C=C(C(=O)O)O2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587410138 FG Annotated Anodyne CCc1ccc2c(c1)[C@]1(C=C(C(=O)O)O2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587410141 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@H](C)Oc1ccc3c(c1)OCO3)O2 ZINC000587410169 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@@H](C)Oc1ccc3c(c1)OCO3)O2 ZINC000587410171 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@@H](C)Oc1ccc3c(c1)OCO3)O2 ZINC000587410173 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@H](C)Oc1ccc3c(c1)OCO3)O2 ZINC000587410174 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(S(=O)(=O)C(C)C)c1)O2 ZINC000587410238 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(S(=O)(=O)C(C)C)c1)O2 ZINC000587410253 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(S(=O)(=O)Cl)cc1)O2 ZINC000587410333 FG Annotated Unstable Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(S(=O)(=O)Cl)cc1)O2 ZINC000587410334 FG Annotated Unstable CCCS(=O)(=O)c1cccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587410384 FG Annotated Anodyne CCCS(=O)(=O)c1cccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587410385 FG Annotated Anodyne COc1ccc2occ([C@H]3CC(=O)c4cc(C)cc(N)c4O3)c(=O)c2c1 ZINC000587410618 FG Annotated Anodyne COc1ccc2occ([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)c(=O)c2c1 ZINC000587410619 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(S(C)(=O)=O)cc1Cl)O2 ZINC000587410674 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(S(C)(=O)=O)cc1Cl)O2 ZINC000587410675 FG Annotated Anodyne CCS(=O)(=O)c1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587411069 FG Annotated Anodyne CCS(=O)(=O)c1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587411074 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(Cl)cccc1S(C)(=O)=O)O2 ZINC000587411157 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(Cl)cccc1S(C)(=O)=O)O2 ZINC000587411158 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](C(=O)c1ccccc1Br)[C@@H](C2)C3=O ZINC000587411217 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](C(=O)c1ccccc1Br)[C@@H](C2)C3=O ZINC000587411219 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(Cl)cc1S(C)(=O)=O)O2 ZINC000587411273 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(Cl)cc1S(C)(=O)=O)O2 ZINC000587411275 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cc(CN3CCOCC3)cs1)O2 ZINC000587411292 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cc(CN3CCOCC3)cs1)O2 ZINC000587411294 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCc3nc(S)c(C#N)cc31)O2 ZINC000587411295 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCc3nc(S)c(C#N)cc31)O2 ZINC000587411308 FG Annotated Mild COc1cc(OC)c2c(c1)OCC[C@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587411472 FG Annotated Anodyne COc1cc(OC)c2c(c1)OCC[C@@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587411473 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(N3CCOCC3)s1)O2 ZINC000587411733 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(N3CCOCC3)s1)O2 ZINC000587411734 FG Annotated Anodyne COc1cc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1OC[C@@H]1CO1 ZINC000587411768 FG Annotated Anodyne COc1cc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1OC[C@@H]1CO1 ZINC000587411769 FG Annotated Anodyne COc1cc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1OC[C@H]1CO1 ZINC000587411770 FG Annotated Anodyne COc1cc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1OC[C@H]1CO1 ZINC000587411772 FG Annotated Anodyne COc1cc2c(cc1[C@@H]1CC(=O)c3cc(C)cc(N)c3O1)OCCCO2 ZINC000587411778 FG Annotated Anodyne COc1cc2c(cc1[C@H]1CC(=O)c3cc(C)cc(N)c3O1)OCCCO2 ZINC000587411779 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCOC[C@H]1OCc1ccccc1)O2 ZINC000587411859 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCOC[C@@H]1OCc1ccccc1)O2 ZINC000587411860 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCOC[C@@H]1OCc1ccccc1)O2 ZINC000587411861 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCOC[C@H]1OCc1ccccc1)O2 ZINC000587411862 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CBr)(c1ccc(N)cc1)[C@@H](C2)C3=O ZINC000587411915 FG Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(N)cc1)[C@@H](C2)C3=O ZINC000587411920 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(Sc3nncn3C)o1)O2 ZINC000587412244 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(Sc3nncn3C)o1)O2 ZINC000587412252 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(N3CCSCC3)nc1)O2 ZINC000587412351 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N3CCSCC3)nc1)O2 ZINC000587412356 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C1/SCC(=O)N1C)(C(C)(C)C)O2 ZINC000587412416 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C1/SCC(=O)N1C)(C(C)(C)C)O2 ZINC000587412417 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(CN3CCOCC3)s1)O2 ZINC000587412503 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(CN3CCOCC3)s1)O2 ZINC000587412514 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc(CC(=O)O)s1)O2 ZINC000587412533 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc(CC(=O)O)s1)O2 ZINC000587412541 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(N3CCC(O)CC3)s1)O2 ZINC000587412564 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N3CCC(O)CC3)s1)O2 ZINC000587412568 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](/C(C#N)=C/N(C)C)(c1cccs1)O2 ZINC000587412692 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](/C(C#N)=C\N(C)C)(c1cccs1)O2 ZINC000587412698 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](/C(C#N)=C\N(C)C)(c1cccs1)O2 ZINC000587412699 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](/C(C#N)=C/N(C)C)(c1cccs1)O2 ZINC000587412700 FG Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1cnc(O)c(Br)c1)[C@@H](C2)C3=O ZINC000587412883 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnc(O)c(Br)c1)[C@@H](C2)C3=O ZINC000587412885 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CBr)(C1CCOCC1)[C@@H](C2)C3=O ZINC000587412986 FG Annotated Reactive COc1cc2c3c(c1)O[C@](CBr)(C1CCOCC1)[C@@H](C2)C3=O ZINC000587412988 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C1/SCC(=O)N1C)(c1ccco1)O2 ZINC000587413223 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C1/SCC(=O)N1C)(c1ccco1)O2 ZINC000587413224 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CBr)(c1cccnc1)[C@@H](C2)C3=O ZINC000587413362 FG Annotated Reactive COc1cc2c3c(c1)O[C@](CBr)(c1cccnc1)[C@@H](C2)C3=O ZINC000587413364 FG Annotated Reactive CC(=O)N(c1nc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cs1)C1CC1 ZINC000587413431 FG Annotated Anodyne CC(=O)N(c1nc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cs1)C1CC1 ZINC000587413432 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1nccs1)O2 ZINC000587413882 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1nccs1)O2 ZINC000587413883 FG Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](C(=O)OC(C)(C)C)(C1=COCCC1)O2 ZINC000587413947 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C(=O)OC(C)(C)C)(C1=COCCC1)O2 ZINC000587413948 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(N(C)C)c3nsnc13)O2 ZINC000587414068 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N(C)C)c3nsnc13)O2 ZINC000587414071 FG Annotated Anodyne CCn1ncc(Br)c1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587414178 FG Annotated Anodyne CCn1ncc(Br)c1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587414182 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CBr)(C(C)(C)OC)[C@@H](C2)C3=O ZINC000587414459 FG Annotated Reactive COc1cc2c3c(c1)O[C@](CBr)(C(C)(C)OC)[C@@H](C2)C3=O ZINC000587414470 FG Annotated Reactive COc1cc2c3c(c1)O[C@](C=O)(c1ccccc1Br)[C@@H](C2)C3=O ZINC000587414560 FG Annotated Mild COc1cc2c3c(c1)O[C@@](C=O)(c1ccccc1Br)[C@@H](C2)C3=O ZINC000587414570 FG Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(CN3CCSCC3)o1)O2 ZINC000587414955 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(CN3CCSCC3)o1)O2 ZINC000587414957 FG Annotated Anodyne COC(=O)c1oc2c(c1C)[C@]1(CCC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587414970 FG Annotated Anodyne COC(=O)c1oc2c(c1C)[C@@]1(CCC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587414971 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2cc(C(=O)O)ccc2OC1(C)C ZINC000587414990 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2cc(C(=O)O)ccc2OC1(C)C ZINC000587414991 FG Annotated Anodyne COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc2sc(=O)oc12 ZINC000587415193 FG Annotated Anodyne COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc2sc(=O)oc12 ZINC000587415201 FG Annotated Anodyne CCOC(=O)C[C@]1(c2sc(C)nc2C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587415365 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2sc(C)nc2C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587415366 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1c(N)sc3c1CCN(C)C3)O2 ZINC000587415556 FG Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1c(N)sc3c1CCN(C)C3)O2 ZINC000587415559 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](C(=O)c1cccc(Br)c1)[C@@H](C2)C3=O ZINC000587416414 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](C(=O)c1cccc(Br)c1)[C@@H](C2)C3=O ZINC000587416415 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C=O)(c1cccc(Br)c1)[C@@H](C2)C3=O ZINC000587416449 FG Annotated Mild COc1cc2c3c(c1)O[C@@](C=O)(c1cccc(Br)c1)[C@@H](C2)C3=O ZINC000587416450 FG Annotated Mild COc1cc2c3c(c1)O[C@](CCl)(c1cc(C(=O)O)oc1C)[C@@H](C2)C3=O ZINC000587416750 FG Annotated Reactive COc1cc2c3c(c1)O[C@@](CCl)(c1cc(C(=O)O)oc1C)[C@@H](C2)C3=O ZINC000587416751 FG Annotated Reactive COc1cc2c3c(c1)O[C@@](C)([C@@H](Cl)C(=O)Nc1ccccc1)[C@@H](C2)C3=O ZINC000587417040 FG Annotated Reactive COc1cc2c3c(c1)O[C@@](C)([C@H](Cl)C(=O)Nc1ccccc1)[C@@H](C2)C3=O ZINC000587417042 FG Annotated Reactive COc1cc2c3c(c1)O[C@](C)([C@@H](Cl)C(=O)Nc1ccccc1)[C@@H](C2)C3=O ZINC000587417044 FG Annotated Reactive COc1cc2c3c(c1)O[C@](C)([C@H](Cl)C(=O)Nc1ccccc1)[C@@H](C2)C3=O ZINC000587417046 FG Annotated Reactive COC1=C(Br)[C@@]2(CC1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587417121 FG Annotated Anodyne COC1=C(Br)[C@]2(CC1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587417122 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)Nc4c1ccc(Cl)c4C)[C@@H](C2)C3=O ZINC000587417242 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)Nc4c1ccc(Cl)c4C)[C@@H](C2)C3=O ZINC000587417245 FG Annotated Anodyne COC(=O)c1cccc([C@@]2(CCl)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1 ZINC000587417392 FG Annotated Reactive COC(=O)c1cccc([C@]2(CCl)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1 ZINC000587417396 FG Annotated Reactive COc1cc2c3c(c1)O[C@@H](C(=O)c1ccc(Br)cc1)[C@@H](C2)C3=O ZINC000587417493 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](C(=O)c1ccc(Br)cc1)[C@@H](C2)C3=O ZINC000587417496 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnn(-c4cccc(Cl)c4)n1)[C@@H](C2)C3=O ZINC000587417638 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnn(-c4cccc(Cl)c4)n1)[C@@H](C2)C3=O ZINC000587417639 FG Annotated Anodyne CCOC(=O)[C@H](Cl)[C@@]1(CC(C)C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587417704 FG Annotated Reactive CCOC(=O)[C@@H](Cl)[C@]1(CC(C)C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587417705 FG Annotated Reactive CCOC(=O)[C@H](Cl)[C@]1(CC(C)C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587417706 FG Annotated Reactive CCOC(=O)[C@@H](Cl)[C@@]1(CC(C)C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587417707 FG Annotated Reactive COC(=O)[C@]1([C@H](Cl)c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587417710 FG Annotated Reactive COC(=O)[C@@]1([C@@H](Cl)c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587417711 FG Annotated Reactive COC(=O)[C@@]1([C@H](Cl)c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587417712 FG Annotated Reactive COC(=O)[C@]1([C@@H](Cl)c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587417713 FG Annotated Reactive CCn1cc(Br)c([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)n1 ZINC000587417876 FG Annotated Anodyne CCn1cc(Br)c([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)n1 ZINC000587417878 FG Annotated Anodyne COC(=O)[C@]1(c2ccc(Cl)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587417999 FG Annotated Anodyne COC(=O)[C@@]1(c2ccc(Cl)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587418007 FG Annotated Anodyne CCOC(=O)[C@]1(CCC(F)(F)F)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587418093 FG Annotated Anodyne CCOC(=O)[C@@]1(CCC(F)(F)F)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587418094 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4c(C)nn(C)c4nc1Cl)[C@@H](C2)C3=O ZINC000587418187 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4c(C)nn(C)c4nc1Cl)[C@@H](C2)C3=O ZINC000587418192 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(Cl)cc1-n1cncn1)[C@@H](C2)C3=O ZINC000587418426 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(Cl)cc1-n1cncn1)[C@@H](C2)C3=O ZINC000587418427 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@H]1CCC[C@]2(C1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587418743 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@H]1CCC[C@@]2(C1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587418752 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@@H]1CCC[C@]2(C1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587418757 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@@H]1CCC[C@@]2(C1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587418759 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(Cl)nc(C)nc1N(C)C)[C@@H](C2)C3=O ZINC000587418763 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(Cl)nc(C)nc1N(C)C)[C@@H](C2)C3=O ZINC000587418764 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCl)(c1ccc4nc(O)oc4c1)[C@@H](C2)C3=O ZINC000587418780 FG Annotated Reactive COc1cc2c3c(c1)O[C@](CCl)(c1ccc4nc(O)oc4c1)[C@@H](C2)C3=O ZINC000587418797 FG Annotated Reactive COc1cc2c3c(c1)O[C@@](C)(c1cnc4[nH]cnc(Cl)c1-4)[C@@H](C2)C3=O ZINC000587418941 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cnc4[nH]cnc(Cl)c1-4)[C@@H](C2)C3=O ZINC000587418942 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1nc4c(cc1Cl)OCCO4)[C@@H](C2)C3=O ZINC000587419323 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1nc4c(cc1Cl)OCCO4)[C@@H](C2)C3=O ZINC000587419337 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CC(=O)Oc4ccc(Cl)cc41)[C@@H](C2)C3=O ZINC000587419417 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC(=O)Oc4ccc(Cl)cc41)[C@@H](C2)C3=O ZINC000587419426 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cnn(CC(C)C)c1)(C(F)F)[C@@H](C2)C3=O ZINC000587419478 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cnn(CC(C)C)c1)(C(F)F)[C@@H](C2)C3=O ZINC000587419488 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4ncnc(Cl)c4n1C)[C@@H](C2)C3=O ZINC000587419542 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4ncnc(Cl)c4n1C)[C@@H](C2)C3=O ZINC000587419556 FG Annotated Anodyne CCn1ncc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C(F)(F)F ZINC000587419565 FG Annotated Anodyne CCn1ncc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C(F)(F)F ZINC000587419567 FG Annotated Anodyne CCn1cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(C(F)(F)F)n1 ZINC000587419590 FG Annotated Anodyne CCn1cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(C(F)(F)F)n1 ZINC000587419591 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCl)(c1ccc(N(C)C=O)cc1)[C@@H](C2)C3=O ZINC000587419699 FG Annotated Reactive COc1cc2c3c(c1)O[C@](CCl)(c1ccc(N(C)C=O)cc1)[C@@H](C2)C3=O ZINC000587419700 FG Annotated Reactive COc1cc2c3c(c1)O[C@](CCl)(c1ccc(NC(N)=O)cc1)[C@@H](C2)C3=O ZINC000587419779 FG Annotated Reactive COc1cc2c3c(c1)O[C@@](CCl)(c1ccc(NC(N)=O)cc1)[C@@H](C2)C3=O ZINC000587419780 FG Annotated Reactive COc1cc2c3c(c1)O[C@H](c1cc(C(F)(F)F)cnc1N)[C@@H](C2)C3=O ZINC000587420341 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(C(F)(F)F)cnc1N)[C@@H](C2)C3=O ZINC000587420343 FG Annotated Anodyne CCn1nc(C(F)(F)F)cc1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587420345 FG Annotated Anodyne CCn1nc(C(F)(F)F)cc1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587420347 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)Nc4c(C)ccc(Cl)c41)[C@@H](C2)C3=O ZINC000587420545 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)Nc4c(C)ccc(Cl)c41)[C@@H](C2)C3=O ZINC000587420549 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C=O)(c1ccc(Br)cc1)[C@@H](C2)C3=O ZINC000587420578 FG Annotated Mild COc1cc2c3c(c1)O[C@@](C=O)(c1ccc(Br)cc1)[C@@H](C2)C3=O ZINC000587420580 FG Annotated Mild COc1cc2c3c(c1)O[C@]1(CCOc4cc(O)c(Cl)cc41)[C@@H](C2)C3=O ZINC000587420774 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCOc4cc(O)c(Cl)cc41)[C@@H](C2)C3=O ZINC000587420776 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CO)(c1ccc(C(F)(F)F)cc1)[C@@H](C2)C3=O ZINC000587420843 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cnc4ccc(Cl)nn14)[C@@H](C2)C3=O ZINC000587420846 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CO)(c1ccc(C(F)(F)F)cc1)[C@@H](C2)C3=O ZINC000587420847 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cnc4ccc(Cl)nn14)[C@@H](C2)C3=O ZINC000587420852 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](Cc1c(Cl)ncnc1Cl)[C@@H](C2)C3=O ZINC000587420906 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](Cc1c(Cl)ncnc1Cl)[C@@H](C2)C3=O ZINC000587420911 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1sc(=N)[nH]c1C(F)(F)F)[C@@H](C2)C3=O ZINC000587420991 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1sc(=N)[nH]c1C(F)(F)F)[C@@H](C2)C3=O ZINC000587420996 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(C(F)(F)F)nn(C)c1C)[C@@H](C2)C3=O ZINC000587421000 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C(F)(F)F)nn(C)c1C)[C@@H](C2)C3=O ZINC000587421002 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnn(-c4ccc(Cl)cc4)n1)[C@@H](C2)C3=O ZINC000587421135 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnn(-c4ccc(Cl)cc4)n1)[C@@H](C2)C3=O ZINC000587421138 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)Nc4c(Cl)ccc(C)c41)[C@@H](C2)C3=O ZINC000587421269 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)Nc4c(Cl)ccc(C)c41)[C@@H](C2)C3=O ZINC000587421273 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CCC(=O)O)(c1ccc(Cl)cn1)[C@@H](C2)C3=O ZINC000587421321 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCC(=O)O)(c1ccc(Cl)cn1)[C@@H](C2)C3=O ZINC000587421327 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cnc(Cl)nc1Cl)[C@@H](C2)C3=O ZINC000587421469 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cnc(Cl)nc1Cl)[C@@H](C2)C3=O ZINC000587421474 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1c(Cl)ncnc1Cl)[C@@H](C2)C3=O ZINC000587421619 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1c(Cl)ncnc1Cl)[C@@H](C2)C3=O ZINC000587421621 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(F)c(F)c(O)c(F)c1F)[C@@H](C2)C3=O ZINC000587421730 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(F)c(F)c(O)c(F)c1F)[C@@H](C2)C3=O ZINC000587421734 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)Nc4c(Cl)cc(C)cc41)[C@@H](C2)C3=O ZINC000587422032 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)Nc4c(Cl)cc(C)cc41)[C@@H](C2)C3=O ZINC000587422034 FG Annotated Anodyne COC(=O)c1cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cnc1Cl ZINC000587422159 FG Annotated Anodyne COC(=O)c1cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cnc1Cl ZINC000587422160 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(Cl)cnc(OC)c1OC)[C@@H](C2)C3=O ZINC000587422389 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(Cl)cnc(OC)c1OC)[C@@H](C2)C3=O ZINC000587422390 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)Nc4c(C)cc(Cl)cc41)[C@@H](C2)C3=O ZINC000587422563 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)Nc4c(C)cc(Cl)cc41)[C@@H](C2)C3=O ZINC000587422565 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CCl)(c1c[nH]c4ccncc14)[C@@H](C2)C3=O ZINC000587422706 FG Annotated Reactive COc1cc2c3c(c1)O[C@@](CCl)(c1c[nH]c4ccncc14)[C@@H](C2)C3=O ZINC000587422709 FG Annotated Reactive COc1cc2c3c(c1)O[C@H](c1cc(Cl)cc([N+](=O)[O-])c1O)[C@@H](C2)C3=O ZINC000587422714 FG Annotated Bother COc1cc2c3c(c1)O[C@@H](c1cc(Cl)cc([N+](=O)[O-])c1O)[C@@H](C2)C3=O ZINC000587422718 FG Annotated Bother COc1cc2c3c(c1)O[C@](CCl)(c1ccc4c(c1)OCCO4)[C@@H](C2)C3=O ZINC000587422760 FG Annotated Reactive COc1cc2c3c(c1)O[C@@](CCl)(c1ccc4c(c1)OCCO4)[C@@H](C2)C3=O ZINC000587422765 FG Annotated Reactive COc1cc2c3c(c1)OC1(CCN(CCC(F)(F)F)CC1)[C@@H](C2)C3=O ZINC000587422813 FG Annotated Anodyne CCOC(=O)C(F)(F)[C@@H]1CC[C@]2(C1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587422981 FG Annotated Anodyne CCOC(=O)C(F)(F)[C@@H]1CC[C@@]2(C1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587422984 FG Annotated Anodyne CCOC(=O)C(F)(F)[C@H]1CC[C@@]2(C1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587422985 FG Annotated Anodyne CCOC(=O)C(F)(F)[C@H]1CC[C@]2(C1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587422987 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](Cc1c(Cl)nc(C)nc1Cl)[C@@H](C2)C3=O ZINC000587423077 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](Cc1c(Cl)nc(C)nc1Cl)[C@@H](C2)C3=O ZINC000587423079 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](Cc1ccc(Cl)cc1)(C(=O)O)[C@@H](C2)C3=O ZINC000587423081 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](Cc1ccc(Cl)cc1)(C(=O)O)[C@@H](C2)C3=O ZINC000587423083 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(Cl)cc4[nH]c(=N)oc14)[C@@H](C2)C3=O ZINC000587423101 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(Cl)cc4[nH]c(=N)oc14)[C@@H](C2)C3=O ZINC000587423102 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(Cn1ccc(C(F)(F)F)n1)[C@@H](C2)C3=O ZINC000587423107 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(Cn1ccc(C(F)(F)F)n1)[C@@H](C2)C3=O ZINC000587423114 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C(=O)O)(c1ccc(OC)c(Cl)c1)[C@@H](C2)C3=O ZINC000587423156 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C(=O)O)(c1ccc(OC)c(Cl)c1)[C@@H](C2)C3=O ZINC000587423158 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(C(F)(F)F)nn1C)[C@@H](C2)C3=O ZINC000587423221 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(C(F)(F)F)nn1C)[C@@H](C2)C3=O ZINC000587423224 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](/C=C\N(C)C)(c1cccnc1Cl)[C@@H](C2)C3=O ZINC000587423298 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](/C=C/N(C)C)(c1cccnc1Cl)[C@@H](C2)C3=O ZINC000587423299 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](/C=C/N(C)C)(c1cccnc1Cl)[C@@H](C2)C3=O ZINC000587423300 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](/C=C\N(C)C)(c1cccnc1Cl)[C@@H](C2)C3=O ZINC000587423301 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(F)c1N1CCOCC1)[C@@H](C2)C3=O ZINC000587423470 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(F)c1N1CCOCC1)[C@@H](C2)C3=O ZINC000587423471 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cn(-c4ccc(Cl)cc4)nn1)[C@@H](C2)C3=O ZINC000587423497 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cn(-c4ccc(Cl)cc4)nn1)[C@@H](C2)C3=O ZINC000587423499 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CCl)(c1c[nH]c4ncccc14)[C@@H](C2)C3=O ZINC000587423616 FG Annotated Reactive COc1cc2c3c(c1)O[C@@](CCl)(c1c[nH]c4ncccc14)[C@@H](C2)C3=O ZINC000587423617 FG Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1c(O)ccc([N+](=O)[O-])c1Cl)[C@@H](C2)C3=O ZINC000587423732 FG Annotated Bother COc1cc2c3c(c1)O[C@H](c1c(O)ccc([N+](=O)[O-])c1Cl)[C@@H](C2)C3=O ZINC000587423735 FG Annotated Bother COc1cc2c3c(c1)O[C@](CCl)(c1nc4ccccc4[nH]1)[C@@H](C2)C3=O ZINC000587423861 FG Annotated Reactive COc1cc2c3c(c1)O[C@@](CCl)(c1nc4ccccc4[nH]1)[C@@H](C2)C3=O ZINC000587423863 FG Annotated Reactive COc1ccc([C@]2([C@H](F)C#N)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587423878 FG Annotated Mild COc1ccc([C@@]2([C@@H](F)C#N)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587423880 FG Annotated Mild COc1ccc([C@]2([C@@H](F)C#N)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587423882 FG Annotated Mild COc1ccc([C@@]2([C@H](F)C#N)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587423886 FG Annotated Mild COc1cc2c3c(c1)O[C@@](CCl)(c1ccc4nc(O)[nH]c4c1)[C@@H](C2)C3=O ZINC000587424131 FG Annotated Reactive COc1cc2c3c(c1)O[C@](CCl)(c1ccc4nc(O)[nH]c4c1)[C@@H](C2)C3=O ZINC000587424135 FG Annotated Reactive COc1cc2c3c(c1)O[C@](C)(c1cc(Cl)cnc1C(=O)O)[C@@H](C2)C3=O ZINC000587424408 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(Cl)cnc1C(=O)O)[C@@H](C2)C3=O ZINC000587424411 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(Cl)cnc4c1OCCO4)[C@@H](C2)C3=O ZINC000587424415 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(Cl)cnc4c1OCCO4)[C@@H](C2)C3=O ZINC000587424417 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1c(F)ccc(F)c1C(=O)O)[C@@H](C2)C3=O ZINC000587424421 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1c(F)ccc(F)c1C(=O)O)[C@@H](C2)C3=O ZINC000587424424 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(C(F)(F)F)n(C)n1)[C@@H](C2)C3=O ZINC000587424441 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(C(F)(F)F)n(C)n1)[C@@H](C2)C3=O ZINC000587424444 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(F)ccc(C#N)c1N(C)C)[C@@H](C2)C3=O ZINC000587424529 FG Annotated Mild COc1cc2c3c(c1)O[C@@H](c1c(F)ccc(C#N)c1N(C)C)[C@@H](C2)C3=O ZINC000587424532 FG Annotated Mild COc1cc2c3c(c1)O[C@@H](c1ccc(F)c(N4CCOCC4)c1)[C@@H](C2)C3=O ZINC000587424699 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(F)c(N4CCOCC4)c1)[C@@H](C2)C3=O ZINC000587424700 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CCC(=O)O)(c1cc(F)ccc1F)[C@@H](C2)C3=O ZINC000587424791 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCC(=O)O)(c1cc(F)ccc1F)[C@@H](C2)C3=O ZINC000587424792 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(F)cccc1N1CCOCC1)[C@@H](C2)C3=O ZINC000587424805 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(F)cccc1N1CCOCC1)[C@@H](C2)C3=O ZINC000587424806 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc([N+](=O)[O-])c(C#N)cc1F)[C@@H](C2)C3=O ZINC000587425011 FG Annotated Mild COc1cc2c3c(c1)O[C@@H](c1cc([N+](=O)[O-])c(C#N)cc1F)[C@@H](C2)C3=O ZINC000587425012 FG Annotated Mild CCOC(=O)C[C@]1(c2ccccc2F)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587425235 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2ccccc2F)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587425236 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)Nc1ccccc1F)[C@@H](C2)C3=O ZINC000587425341 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)Nc1ccccc1F)[C@@H](C2)C3=O ZINC000587425343 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(Cc1c([N+](=O)[O-])ccc(O)c1F)[C@@H](C2)C3=O ZINC000587425355 FG Annotated Bother COc1cc2c3c(c1)O[C@](C)(Cc1c([N+](=O)[O-])ccc(O)c1F)[C@@H](C2)C3=O ZINC000587425359 FG Annotated Bother COc1cc2c3c(c1)O[C@@H](c1ccnc(Br)c1F)[C@@H](C2)C3=O ZINC000587425555 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccnc(Br)c1F)[C@@H](C2)C3=O ZINC000587425558 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CCC(=O)O)(c1ccc(F)cc1F)[C@@H](C2)C3=O ZINC000587425646 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCC(=O)O)(c1ccc(F)cc1F)[C@@H](C2)C3=O ZINC000587425648 FG Annotated Anodyne CCOC(=O)[C@]1(c2ccccc2F)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587425670 FG Annotated Anodyne CCOC(=O)[C@@]1(c2ccccc2F)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587425671 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(N4CCOCC4)cc1F)[C@@H](C2)C3=O ZINC000587425807 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N4CCOCC4)cc1F)[C@@H](C2)C3=O ZINC000587425808 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ncc(Br)cc1F)[C@@H](C2)C3=O ZINC000587425919 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ncc(Br)cc1F)[C@@H](C2)C3=O ZINC000587425920 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(F)cc([N+](=O)[O-])c1OC)[C@@H](C2)C3=O ZINC000587425923 FG Annotated Bother COc1cc2c3c(c1)O[C@@](C)(c1cc(F)cc([N+](=O)[O-])c1OC)[C@@H](C2)C3=O ZINC000587425924 FG Annotated Bother COc1cc2c3c(c1)O[C@@](CCC(=O)O)(c1ccc(F)c(F)c1)[C@@H](C2)C3=O ZINC000587425941 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CCC(=O)O)(c1ccc(F)c(F)c1)[C@@H](C2)C3=O ZINC000587425942 FG Annotated Anodyne COC(=O)C[C@]1(c2ccccc2F)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587425983 FG Annotated Anodyne COC(=O)C[C@@]1(c2ccccc2F)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587425984 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](COC(C)=O)(c1ccc(F)cc1F)[C@@H](C2)C3=O ZINC000587426095 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](COC(C)=O)(c1ccc(F)cc1F)[C@@H](C2)C3=O ZINC000587426096 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](Cn1ccnc1)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587426197 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](Cn1ccnc1)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587426198 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccc(F)c1)(c1nccn1C)[C@@H](C2)C3=O ZINC000587426199 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccc(F)c1)(c1nccn1C)[C@@H](C2)C3=O ZINC000587426200 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2ccc(F)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587426226 FG Annotated Anodyne CCOC(=O)C[C@]1(c2ccc(F)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587426227 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1nc(Br)ccc1F)[C@@H](C2)C3=O ZINC000587426477 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1nc(Br)ccc1F)[C@@H](C2)C3=O ZINC000587426478 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](COC(C)=O)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587426488 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](COC(C)=O)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587426489 FG Annotated Anodyne CCOC(=O)[C@]1(c2cc(F)cc(F)c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587426496 FG Annotated Anodyne CCOC(=O)[C@@]1(c2cc(F)cc(F)c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587426497 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)Nc4c1ccc(Cl)c4F)[C@@H](C2)C3=O ZINC000587426522 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)Nc4c1ccc(Cl)c4F)[C@@H](C2)C3=O ZINC000587426526 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)Nc4c(F)cc(Cl)cc41)[C@@H](C2)C3=O ZINC000587426611 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)Nc4c(F)cc(Cl)cc41)[C@@H](C2)C3=O ZINC000587426613 FG Annotated Anodyne CCOC(=O)[C@]1(c2ccc(C)c(F)c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587426729 FG Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(C)c(F)c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587426735 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)Nc4cc(F)cc(Cl)c41)[C@@H](C2)C3=O ZINC000587426793 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)Nc4cc(F)cc(Cl)c41)[C@@H](C2)C3=O ZINC000587426796 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CN)(c1ccc([C@@H](C)OC)cc1)[C@@H](C2)C3=O ZINC000587426927 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CN)(c1ccc([C@@H](C)OC)cc1)[C@@H](C2)C3=O ZINC000587426928 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CN)(c1ccc([C@H](C)OC)cc1)[C@@H](C2)C3=O ZINC000587426929 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CN)(c1ccc([C@H](C)OC)cc1)[C@@H](C2)C3=O ZINC000587426930 FG Annotated Anodyne C=CCOC(=O)NC1CCC2(CC1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587426933 FG Annotated Mild COc1cc2c3c(c1)O[C@](CC1OCCO1)(c1cccc(F)c1)[C@@H](C2)C3=O ZINC000587426960 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CC1OCCO1)(c1cccc(F)c1)[C@@H](C2)C3=O ZINC000587426961 FG Annotated Anodyne CCCOc1ccccc1[C@]1(CN)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587426966 FG Annotated Anodyne CCCOc1ccccc1[C@@]1(CN)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587426971 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCOc4ccc(NC(C)=O)cc41)[C@@H](C2)C3=O ZINC000587426977 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCOc4ccc(NC(C)=O)cc41)[C@@H](C2)C3=O ZINC000587426979 FG Annotated Anodyne COc1ccc(NC(=O)C[C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587426980 FG Annotated Anodyne COc1ccc(NC(=O)C[C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587426983 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(Br)cnc1F)[C@@H](C2)C3=O ZINC000587427060 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(Br)cnc1F)[C@@H](C2)C3=O ZINC000587427061 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccc(F)c1)(c1cnn(C)c1)[C@@H](C2)C3=O ZINC000587427105 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccc(F)c1)(c1cnn(C)c1)[C@@H](C2)C3=O ZINC000587427106 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC(C)(C)CC(=O)/C1=C/N(C)C)[C@@H](C2)C3=O ZINC000587427158 FG Annotated Mild COc1cc2c3c(c1)O[C@]1(CC(C)(C)CC(=O)/C1=C/N(C)C)[C@@H](C2)C3=O ZINC000587427162 FG Annotated Mild COc1cc2c3c(c1)O[C@@]1(CC(C)(C)CC(=O)/C1=C\N(C)C)[C@@H](C2)C3=O ZINC000587427164 FG Annotated Mild COc1cc2c3c(c1)O[C@]1(CC(C)(C)CC(=O)/C1=C\N(C)C)[C@@H](C2)C3=O ZINC000587427168 FG Annotated Mild COc1cc2c3c(c1)O[C@@](C)(CC(=O)N[C@H](C)c1ccccc1)[C@@H](C2)C3=O ZINC000587427187 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)N[C@H](C)c1ccccc1)[C@@H](C2)C3=O ZINC000587427190 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)N[C@@H](C)c1ccccc1)[C@@H](C2)C3=O ZINC000587427192 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)N[C@@H](C)c1ccccc1)[C@@H](C2)C3=O ZINC000587427193 FG Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(F)c(F)c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587427221 FG Annotated Anodyne CCOC(=O)[C@]1(c2ccc(F)c(F)c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587427223 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N4CCOCC4)c(F)c1)[C@@H](C2)C3=O ZINC000587427241 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(N4CCOCC4)c(F)c1)[C@@H](C2)C3=O ZINC000587427244 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCCN(C)N=O)(c1cccnc1)[C@@H](C2)C3=O ZINC000587427306 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CCCN(C)N=O)(c1cccnc1)[C@@H](C2)C3=O ZINC000587427307 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(N4CCCC4)nc1F)[C@@H](C2)C3=O ZINC000587427413 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N4CCCC4)nc1F)[C@@H](C2)C3=O ZINC000587427414 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)Nc4cc(F)c(Cl)cc41)[C@@H](C2)C3=O ZINC000587427458 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)Nc4cc(F)c(Cl)cc41)[C@@H](C2)C3=O ZINC000587427462 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(N4CCCC4)nc1F)[C@@H](C2)C3=O ZINC000587427551 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(N4CCCC4)nc1F)[C@@H](C2)C3=O ZINC000587427554 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)Nc1ccccc1OC)[C@@H](C2)C3=O ZINC000587427564 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)Nc1ccccc1OC)[C@@H](C2)C3=O ZINC000587427566 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(OC)c(NC(C)=O)c1)[C@@H](C2)C3=O ZINC000587427591 FG Annotated Anodyne COC(=O)C[C@]1(c2ccc(F)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587427599 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(OC)c(NC(C)=O)c1)[C@@H](C2)C3=O ZINC000587427600 FG Annotated Anodyne COC(=O)C[C@@]1(c2ccc(F)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587427602 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(F)cc1)(c1ncccn1)[C@@H](C2)C3=O ZINC000587427609 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(F)cc1)(c1ncccn1)[C@@H](C2)C3=O ZINC000587427614 FG Annotated Anodyne COc1cc(OC)cc([C@@]2(CC#N)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1 ZINC000587427678 FG Annotated Mild COc1cc(OC)cc([C@]2(CC#N)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1 ZINC000587427681 FG Annotated Mild COc1cc2c3c(c1)O[C@H](c1ccc(OC)c(CN(C)C)c1)[C@@H](C2)C3=O ZINC000587427686 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC)c(CN(C)C)c1)[C@@H](C2)C3=O ZINC000587427687 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)N(C)c1ccccc1)[C@@H](C2)C3=O ZINC000587427707 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)N(C)c1ccccc1)[C@@H](C2)C3=O ZINC000587427710 FG Annotated Anodyne COc1ccc([C@]2(/C=C/N(C)C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587427801 FG Annotated Anodyne COc1ccc([C@]2(/C=C\N(C)C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587427803 FG Annotated Anodyne COc1ccc([C@@]2(/C=C/N(C)C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587427805 FG Annotated Anodyne COc1ccc([C@@]2(/C=C\N(C)C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587427807 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cccc(N(C)C(C)=O)c1)[C@@H](C2)C3=O ZINC000587427809 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cccc(N(C)C(C)=O)c1)[C@@H](C2)C3=O ZINC000587427811 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccccc1OCCN(C)C)[C@@H](C2)C3=O ZINC000587427825 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccccc1OCCN(C)C)[C@@H](C2)C3=O ZINC000587427828 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(OC)ccc1OCC#N)[C@@H](C2)C3=O ZINC000587427857 FG Annotated Mild COc1cc2c3c(c1)O[C@@H](c1cc(OC)ccc1OCC#N)[C@@H](C2)C3=O ZINC000587427858 FG Annotated Mild COC(=O)C[C@@]1(Cc2ccccc2F)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587427876 FG Annotated Anodyne COC(=O)C[C@]1(Cc2ccccc2F)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587427878 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(Br)c(F)n1)[C@@H](C2)C3=O ZINC000587427894 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(Br)c(F)n1)[C@@H](C2)C3=O ZINC000587427895 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(Br)ccnc1F)[C@@H](C2)C3=O ZINC000587427972 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(Br)ccnc1F)[C@@H](C2)C3=O ZINC000587427974 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2cccc(F)c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587427987 FG Annotated Anodyne CCOC(=O)C[C@]1(c2cccc(F)c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587427989 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCOc4c([N+](=O)[O-])cc(F)cc41)[C@@H](C2)C3=O ZINC000587428038 FG Annotated Bother COc1cc2c3c(c1)O[C@]1(CCOc4c([N+](=O)[O-])cc(F)cc41)[C@@H](C2)C3=O ZINC000587428047 FG Annotated Bother COC(=O)N(C[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3)c1ccccc1 ZINC000587428243 FG Annotated Anodyne COC(=O)N(C[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3)c1ccccc1 ZINC000587428245 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1F)(c1nccn1C)[C@@H](C2)C3=O ZINC000587428266 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccccc1F)(c1nccn1C)[C@@H](C2)C3=O ZINC000587428268 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H]([C@@]1(c4cccc(F)c4)CCOC1)[C@@H](C2)C3=O ZINC000587428322 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H]([C@@]1(c4cccc(F)c4)CCOC1)[C@@H](C2)C3=O ZINC000587428323 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H]([C@]1(c4cccc(F)c4)CCOC1)[C@@H](C2)C3=O ZINC000587428326 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H]([C@]1(c4cccc(F)c4)CCOC1)[C@@H](C2)C3=O ZINC000587428327 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N(C)C)c(C#N)c1F)[C@@H](C2)C3=O ZINC000587428409 FG Annotated Mild COc1cc2c3c(c1)O[C@H](c1ccc(N(C)C)c(C#N)c1F)[C@@H](C2)C3=O ZINC000587428413 FG Annotated Mild COC(=O)c1ccc([C@]2(CC#N)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587428472 FG Annotated Mild COC(=O)c1ccc([C@@]2(CC#N)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587428475 FG Annotated Mild COc1cc2c3c(c1)O[C@](Cn1ccnc1)(c1cccc(F)c1)[C@@H](C2)C3=O ZINC000587428520 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](Cn1ccnc1)(c1cccc(F)c1)[C@@H](C2)C3=O ZINC000587428522 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccccc1OC(=O)N(C)C)[C@@H](C2)C3=O ZINC000587428542 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccccc1OC(=O)N(C)C)[C@@H](C2)C3=O ZINC000587428543 FG Annotated Anodyne COC(=O)[C@H](CCC#N)[C@@]1(C(C)(C)C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587428574 FG Annotated Mild COC(=O)[C@@H](CCC#N)[C@]1(C(C)(C)C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587428575 FG Annotated Mild COC(=O)[C@@H](CCC#N)[C@@]1(C(C)(C)C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587428576 FG Annotated Mild COC(=O)[C@H](CCC#N)[C@]1(C(C)(C)C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587428577 FG Annotated Mild COc1cc2c3c(c1)O[C@@](CC#N)(c1cccc4c1OCCO4)[C@@H](C2)C3=O ZINC000587428578 FG Annotated Mild COc1cc2c3c(c1)O[C@](CC#N)(c1cccc4c1OCCO4)[C@@H](C2)C3=O ZINC000587428579 FG Annotated Mild COc1cc2c3c(c1)O[C@](C)(CCN(C)C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587428626 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CCN(C)C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587428627 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(F)nc(N4CCCC4)c1)[C@@H](C2)C3=O ZINC000587428660 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(F)nc(N4CCCC4)c1)[C@@H](C2)C3=O ZINC000587428661 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CCC(=O)O)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587428823 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCC(=O)O)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587428824 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](C(C)(C)N(C)C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587428878 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](C(C)(C)N(C)C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587428879 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CNC(C)C)(c1ccccc1OC)[C@@H](C2)C3=O ZINC000587428908 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CNC(C)C)(c1ccccc1OC)[C@@H](C2)C3=O ZINC000587428909 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1coc4ccc(F)cc4c1=O)[C@@H](C2)C3=O ZINC000587428944 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1coc4ccc(F)cc4c1=O)[C@@H](C2)C3=O ZINC000587428945 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(S(=O)(=O)F)cc1)[C@@H](C2)C3=O ZINC000587429062 FG Annotated Unstable COc1cc2c3c(c1)O[C@@](C)(c1ccc(S(=O)(=O)F)cc1)[C@@H](C2)C3=O ZINC000587429063 FG Annotated Unstable COc1cc2c3c(c1)O[C@](C)(CC(=O)Nc1cccc(F)c1)[C@@H](C2)C3=O ZINC000587429072 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)Nc1cccc(F)c1)[C@@H](C2)C3=O ZINC000587429073 FG Annotated Anodyne COC(=O)CC[C@@]1(c2ccc(F)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587429090 FG Annotated Anodyne COC(=O)CC[C@]1(c2ccc(F)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587429095 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OCC#N)c(OC)c1)[C@@H](C2)C3=O ZINC000587429197 FG Annotated Mild COc1cc2c3c(c1)O[C@@H](c1ccc(OCC#N)c(OC)c1)[C@@H](C2)C3=O ZINC000587429198 FG Annotated Mild COc1cc2c3c(c1)O[C@@]1(CCc4ccc(OC)c([N+](=O)[O-])c41)[C@@H](C2)C3=O ZINC000587429230 FG Annotated Bother COc1cc2c3c(c1)O[C@]1(CCc4ccc(OC)c([N+](=O)[O-])c41)[C@@H](C2)C3=O ZINC000587429234 FG Annotated Bother COc1cc2c3c(c1)O[C@@]1(CCCC[C@H]1n1ccc([N+](=O)[O-])n1)[C@@H](C2)C3=O ZINC000587429277 FG Annotated Bother COc1cc2c3c(c1)O[C@@]1(CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)[C@@H](C2)C3=O ZINC000587429280 FG Annotated Bother COc1cc2c3c(c1)O[C@]1(CCCC[C@H]1n1ccc([N+](=O)[O-])n1)[C@@H](C2)C3=O ZINC000587429282 FG Annotated Bother COc1cc2c3c(c1)O[C@]1(CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)[C@@H](C2)C3=O ZINC000587429284 FG Annotated Bother COc1cc2c3c(c1)O[C@@](C)(c1cc(F)nc(N4CCCC4)c1)[C@@H](C2)C3=O ZINC000587429352 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(F)nc(N4CCCC4)c1)[C@@H](C2)C3=O ZINC000587429354 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1nc4cc(OC)ccc4n1C)[C@@H](C2)C3=O ZINC000587429375 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1nc4cc(OC)ccc4n1C)[C@@H](C2)C3=O ZINC000587429378 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(Br)ncc1F)[C@@H](C2)C3=O ZINC000587429381 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(Br)ncc1F)[C@@H](C2)C3=O ZINC000587429382 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1coc4cc(F)ccc4c1=O)[C@@H](C2)C3=O ZINC000587429434 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1coc4cc(F)ccc4c1=O)[C@@H](C2)C3=O ZINC000587429435 FG Annotated Anodyne CCOC(=O)[C@]1(c2ccc(F)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587429471 FG Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(F)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587429472 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(F)cc1)(c1ccn(C)n1)[C@@H](C2)C3=O ZINC000587429503 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(F)cc1)(c1ccn(C)n1)[C@@H](C2)C3=O ZINC000587429504 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CCC(=O)O)(c1cc(F)cc(F)c1)[C@@H](C2)C3=O ZINC000587429520 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCC(=O)O)(c1cc(F)cc(F)c1)[C@@H](C2)C3=O ZINC000587429521 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CCC(=O)O)(c1cccc(F)c1)[C@@H](C2)C3=O ZINC000587429522 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCC(=O)O)(c1cccc(F)c1)[C@@H](C2)C3=O ZINC000587429523 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnn(C(=O)OC(C)(C)C)c1)[C@@H](C2)C3=O ZINC000587429649 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnn(C(=O)OC(C)(C)C)c1)[C@@H](C2)C3=O ZINC000587429666 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)Nc1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587429683 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)Nc1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587429687 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4cc(OC)ccc4C[C@@H]1N=O)[C@@H](C2)C3=O ZINC000587429714 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4cc(OC)ccc4C[C@@H]1N=O)[C@@H](C2)C3=O ZINC000587429719 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4cc(OC)ccc4C[C@H]1N=O)[C@@H](C2)C3=O ZINC000587429726 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4cc(OC)ccc4C[C@H]1N=O)[C@@H](C2)C3=O ZINC000587429732 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(F)cc1)(c1ncc[nH]1)[C@@H](C2)C3=O ZINC000587429763 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(F)cc1)(c1ncc[nH]1)[C@@H](C2)C3=O ZINC000587429765 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)Nc4c(Cl)ccc(F)c41)[C@@H](C2)C3=O ZINC000587429795 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)Nc4c(Cl)ccc(F)c41)[C@@H](C2)C3=O ZINC000587429799 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)NCc1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587429815 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)NCc1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587429823 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccn1-c1ccc(OC)nc1)[C@@H](C2)C3=O ZINC000587429838 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccn1-c1ccc(OC)nc1)[C@@H](C2)C3=O ZINC000587429847 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccnn1-c1ccccc1OC)[C@@H](C2)C3=O ZINC000587429852 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccnn1-c1ccccc1OC)[C@@H](C2)C3=O ZINC000587429853 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccc(F)c1)(C1CCNCC1)[C@@H](C2)C3=O ZINC000587429959 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccc(F)c1)(C1CCNCC1)[C@@H](C2)C3=O ZINC000587429961 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccn1-c1nc(C)cc(C)n1)[C@@H](C2)C3=O ZINC000587429967 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccn1-c1nc(C)cc(C)n1)[C@@H](C2)C3=O ZINC000587429978 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(F)cc1)(C1CCNCC1)[C@@H](C2)C3=O ZINC000587430046 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(F)cc1)(C1CCNCC1)[C@@H](C2)C3=O ZINC000587430047 FG Annotated Anodyne COc1cccc([C@@]2(/C=C/N(C)C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1 ZINC000587430081 FG Annotated Anodyne COc1cccc([C@]2(/C=C/N(C)C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1 ZINC000587430082 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(F)cc1)(c1cnccn1)[C@@H](C2)C3=O ZINC000587430089 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(F)cc1)(c1cnccn1)[C@@H](C2)C3=O ZINC000587430092 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CNC(=O)OC(C)(C)C)(C1CC1)[C@@H](C2)C3=O ZINC000587430118 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CNC(=O)OC(C)(C)C)(C1CC1)[C@@H](C2)C3=O ZINC000587430122 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCC(=O)Nc4ccc(F)cc41)[C@@H](C2)C3=O ZINC000587430151 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCC(=O)Nc4ccc(F)cc41)[C@@H](C2)C3=O ZINC000587430153 FG Annotated Anodyne COc1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(OCC#N)c1 ZINC000587430171 FG Annotated Mild COc1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(OCC#N)c1 ZINC000587430172 FG Annotated Mild COc1cc2c3c(c1)O[C@@]1(CCN(Cc4ccccc4)C[C@@H]1F)[C@@H](C2)C3=O ZINC000587430177 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCN(Cc4ccccc4)C[C@H]1F)[C@@H](C2)C3=O ZINC000587430179 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCN(Cc4ccccc4)C[C@@H]1F)[C@@H](C2)C3=O ZINC000587430181 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCN(Cc4ccccc4)C[C@H]1F)[C@@H](C2)C3=O ZINC000587430182 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CC#N)(c1ccc(OC)c(OC)c1)[C@@H](C2)C3=O ZINC000587430185 FG Annotated Mild COc1cc2c3c(c1)O[C@](CC#N)(c1ccc(OC)c(OC)c1)[C@@H](C2)C3=O ZINC000587430188 FG Annotated Mild COc1cc2c3c(c1)O[C@H](c1c(F)cncc1Br)[C@@H](C2)C3=O ZINC000587430209 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(F)cncc1Br)[C@@H](C2)C3=O ZINC000587430211 FG Annotated Anodyne COc1cc2c3c(c1)OC1(CCN(c4cccc(F)n4)CC1)[C@@H](C2)C3=O ZINC000587430213 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(C(=O)O)n(C)c4ccccc14)[C@@H](C2)C3=O ZINC000587430335 FG Annotated Clean COc1cc2c3c(c1)O[C@@H](c1c(C(=O)O)n(C)c4ccccc14)[C@@H](C2)C3=O ZINC000587430336 FG Annotated Clean COc1cc2c3c(c1)O[C@](C)(c1cn(CCN)c4ccccc14)[C@@H](C2)C3=O ZINC000587430349 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cn(CCN)c4ccccc14)[C@@H](C2)C3=O ZINC000587430351 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(C)nn(-c4ccccn4)c1C)[C@@H](C2)C3=O ZINC000587430377 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C)nn(-c4ccccn4)c1C)[C@@H](C2)C3=O ZINC000587430378 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C)nn(-c4ccccc4)c1O)[C@@H](C2)C3=O ZINC000587430443 FG Annotated Clean COc1cc2c3c(c1)O[C@H](c1c(C)nn(-c4ccccc4)c1O)[C@@H](C2)C3=O ZINC000587430444 FG Annotated Clean COc1cc2c3c(c1)O[C@@](C)(c1cccc(OCCN(C)C)c1)[C@@H](C2)C3=O ZINC000587430531 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cccc(OCCN(C)C)c1)[C@@H](C2)C3=O ZINC000587430533 FG Annotated Anodyne CCOC(=O)[C@H](C)n1cccc1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587430646 FG Annotated Anodyne CCOC(=O)[C@H](C)n1cccc1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587430647 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C)nn(-c4ccccc4)c1N)[C@@H](C2)C3=O ZINC000587430755 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(C)nn(-c4ccccc4)c1N)[C@@H](C2)C3=O ZINC000587430756 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CC#N)(c1cccc([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587430779 FG Annotated Mild COc1cc2c3c(c1)O[C@@](CC#N)(c1cccc([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587430781 FG Annotated Mild COc1cc2c3c(c1)O[C@H](c1cn(C)nc1-c1ccc(C#N)cc1)[C@@H](C2)C3=O ZINC000587430801 FG Annotated Mild COc1cc2c3c(c1)O[C@@H](c1cn(C)nc1-c1ccc(C#N)cc1)[C@@H](C2)C3=O ZINC000587430803 FG Annotated Mild COc1cc2c3c(c1)O[C@@H](c1c([N+](=O)[O-])c(C(C)(C)C)nn1C)[C@@H](C2)C3=O ZINC000587430819 FG Annotated Bother COc1cc2c3c(c1)O[C@H](c1c([N+](=O)[O-])c(C(C)(C)C)nn1C)[C@@H](C2)C3=O ZINC000587430826 FG Annotated Bother COc1cc2c3c(c1)O[C@H](c1cc(OC)c(OC)c([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587430848 FG Annotated Bother COc1cc2c3c(c1)O[C@@H](c1cc(OC)c(OC)c([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587430851 FG Annotated Bother COc1cc2c3c(c1)O[C@]1(CC(C)(C)Oc4ccc(N)cc41)[C@@H](C2)C3=O ZINC000587430857 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC(C)(C)Oc4ccc(N)cc41)[C@@H](C2)C3=O ZINC000587430860 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](/C=C(\C)N(C)C)(c1ccccn1)[C@@H](C2)C3=O ZINC000587430902 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](/C=C(\C)N(C)C)(c1ccccn1)[C@@H](C2)C3=O ZINC000587430923 FG Annotated Anodyne COc1ccc(/C(=C\N(C)C)[C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587430925 FG Annotated Anodyne COc1ccc(/C(=C\N(C)C)[C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587430933 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](CCOc1ccc(C#N)cc1OC)[C@@H](C2)C3=O ZINC000587430941 FG Annotated Mild COc1cc2c3c(c1)O[C@H](CCOc1ccc(C#N)cc1OC)[C@@H](C2)C3=O ZINC000587430947 FG Annotated Mild CNc1ccc([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1[N+](=O)[O-] ZINC000587430974 FG Annotated Bother COc1cc2c3c(c1)O[C@@H](c1ccc(C(=O)NC(C)C)cc1)[C@@H](C2)C3=O ZINC000587430975 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(C(=O)NC(C)C)cc1)[C@@H](C2)C3=O ZINC000587430976 FG Annotated Anodyne CNc1ccc([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1[N+](=O)[O-] ZINC000587430989 FG Annotated Bother COC(=O)c1cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)ccc1N(C)C ZINC000587431065 FG Annotated Anodyne COC(=O)c1cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)ccc1N(C)C ZINC000587431067 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(OC)c1OCC#N)[C@@H](C2)C3=O ZINC000587431086 FG Annotated Mild COc1cc2c3c(c1)O[C@@H](c1cccc(OC)c1OCC#N)[C@@H](C2)C3=O ZINC000587431087 FG Annotated Mild CCOc1cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc([N+](=O)[O-])c1O ZINC000587431194 FG Annotated Bother CCOc1cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc([N+](=O)[O-])c1O ZINC000587431197 FG Annotated Bother COc1cc2c3c(c1)O[C@H](c1cc([N+](=O)[O-])ccc1N(C)C)[C@@H](C2)C3=O ZINC000587431301 FG Annotated Bother COc1cc2c3c(c1)O[C@](C)(CC(=O)NCc1ccc(C)cc1)[C@@H](C2)C3=O ZINC000587431306 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)NCc1ccc(C)cc1)[C@@H](C2)C3=O ZINC000587431312 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc([N+](=O)[O-])ccc1N(C)C)[C@@H](C2)C3=O ZINC000587431313 FG Annotated Bother COc1cc2c3c(c1)O[C@@]1(CCOc4ccc([N+](=O)[O-])cc41)[C@@H](C2)C3=O ZINC000587431449 FG Annotated Bother COc1cc2c3c(c1)O[C@]1(CCOc4ccc([N+](=O)[O-])cc41)[C@@H](C2)C3=O ZINC000587431452 FG Annotated Bother COc1cc2c3c(c1)O[C@@](c1ccccn1)(c1ccccc1N)[C@@H](C2)C3=O ZINC000587431462 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccn1)(c1ccccc1N)[C@@H](C2)C3=O ZINC000587431466 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccncc1)(c1ccc(N)cc1)[C@@H](C2)C3=O ZINC000587431547 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccncc1)(c1ccc(N)cc1)[C@@H](C2)C3=O ZINC000587431548 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](Cc1nccn1C)(c1ccccc1)[C@@H](C2)C3=O ZINC000587431587 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](Cc1nccn1C)(c1ccccc1)[C@@H](C2)C3=O ZINC000587431590 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CC#N)(c1ccc(-n4cccn4)cc1)[C@@H](C2)C3=O ZINC000587431604 FG Annotated Mild COc1cc2c3c(c1)O[C@](CC#N)(c1ccc(-n4cccn4)cc1)[C@@H](C2)C3=O ZINC000587431606 FG Annotated Mild COc1cc2c3c(c1)O[C@@](c1ccc(C)cc1)(c1nccn1C)[C@@H](C2)C3=O ZINC000587431691 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(C)cc1)(c1nccn1C)[C@@H](C2)C3=O ZINC000587431693 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(Cn4cc(C)cn4)o1)[C@@H](C2)C3=O ZINC000587431743 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(Cn4cc(C)cn4)o1)[C@@H](C2)C3=O ZINC000587431744 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(NC(C)=O)c([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587431803 FG Annotated Bother COc1cc2c3c(c1)O[C@H](c1ccc(NC(C)=O)c([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587431804 FG Annotated Bother COc1cc2c3c(c1)OC1(CC(C)(NC(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587431872 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)NC1CCCCCC1)[C@@H](C2)C3=O ZINC000587431878 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)NC1CCCCCC1)[C@@H](C2)C3=O ZINC000587431879 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c([N+](=O)[O-])cccc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587431884 FG Annotated Bother COc1cc2c3c(c1)O[C@@H](c1c([N+](=O)[O-])cccc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587431886 FG Annotated Bother COc1cc2c3c(c1)O[C@@H](c1cn(CC(=O)O)c4ccccc14)[C@@H](C2)C3=O ZINC000587431893 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cn(CC(=O)O)c4ccccc14)[C@@H](C2)C3=O ZINC000587431898 FG Annotated Anodyne COc1cc2c3c(c1)OC1(CC(CNC(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587431978 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnn(-c4cc(C)cc(C)c4)n1)[C@@H](C2)C3=O ZINC000587432117 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnn(-c4cc(C)cc(C)c4)n1)[C@@H](C2)C3=O ZINC000587432118 FG Annotated Anodyne COc1ccc(-n2ccnc2[C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587432246 FG Annotated Anodyne COc1ccc(-n2ccnc2[C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587432247 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587432262 FG Annotated Bother COc1cc2c3c(c1)O[C@@](C)(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587432267 FG Annotated Bother COc1cc2c3c(c1)O[C@]1(CC[C@H](NC(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587432290 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC[C@@H](NC(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587432294 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC[C@H](NC(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587432296 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CC[C@@H](NC(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587432298 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCOc4cc([N+](=O)[O-])ccc41)[C@@H](C2)C3=O ZINC000587432311 FG Annotated Bother COc1cc2c3c(c1)O[C@]1(CCOc4cc([N+](=O)[O-])ccc41)[C@@H](C2)C3=O ZINC000587432313 FG Annotated Bother COc1cc2c3c(c1)O[C@@H](c1c(OC)ccc(OC)c1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587432317 FG Annotated Bother COc1cc2c3c(c1)O[C@H](c1c(OC)ccc(OC)c1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587432318 FG Annotated Bother COc1cc2c3c(c1)O[C@H](c1ccc(N(C)C)cc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587432411 FG Annotated Bother COc1cc2c3c(c1)O[C@@H](c1ccc(N(C)C)cc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587432413 FG Annotated Bother COc1cc2c3c(c1)O[C@](C)(c1ccc(NC(C)=O)cc1OC)[C@@H](C2)C3=O ZINC000587432468 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(NC(C)=O)cc1OC)[C@@H](C2)C3=O ZINC000587432469 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(C(C)C)nn(C)c1N(C)C)[C@@H](C2)C3=O ZINC000587432510 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C(C)C)nn(C)c1N(C)C)[C@@H](C2)C3=O ZINC000587432517 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(OC)c([N+](=O)[O-])cc1OC)[C@@H](C2)C3=O ZINC000587432710 FG Annotated Bother COc1cc2c3c(c1)O[C@H](c1cc(OC)c([N+](=O)[O-])cc1OC)[C@@H](C2)C3=O ZINC000587432711 FG Annotated Bother COc1cc2c3c(c1)O[C@@](C)(c1cccc(OC)c1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587432746 FG Annotated Bother COc1cc2c3c(c1)O[C@](C)(c1cccc(OC)c1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587432753 FG Annotated Bother COc1cc2c3c(c1)O[C@](C)(c1cnn(-c4ccccn4)c1C)[C@@H](C2)C3=O ZINC000587432769 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cnn(-c4ccccn4)c1C)[C@@H](C2)C3=O ZINC000587432775 FG Annotated Anodyne CCOC(=O)c1c(N)oc(C)c1[C@]1(C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587432822 FG Annotated Anodyne CCOC(=O)c1c(N)oc(C)c1[C@@]1(C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587432827 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnc(=NCc4ccccc4)[nH]c1)[C@@H](C2)C3=O ZINC000587432867 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnc(=NCc4ccccc4)[nH]c1)[C@@H](C2)C3=O ZINC000587432878 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(OC)ccc1-n1cccn1)[C@@H](C2)C3=O ZINC000587433000 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(OC)ccc1-n1cccn1)[C@@H](C2)C3=O ZINC000587433001 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N(C)C)c([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587433088 FG Annotated Bother COc1cc2c3c(c1)O[C@H](c1ccc(N(C)C)c([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587433089 FG Annotated Bother CCc1cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(O)c([N+](=O)[O-])c1 ZINC000587433114 FG Annotated Bother CCc1cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(O)c([N+](=O)[O-])c1 ZINC000587433115 FG Annotated Bother COc1cc2c3c(c1)O[C@](C)(Cc1ccc(OC)cc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587433130 FG Annotated Bother COc1cc2c3c(c1)O[C@@](C)(Cc1ccc(OC)cc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587433131 FG Annotated Bother COc1cc2c3c(c1)O[C@@H](c1cnn(-c4ccccc4OC)c1)[C@@H](C2)C3=O ZINC000587433139 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnn(-c4ccccc4OC)c1)[C@@H](C2)C3=O ZINC000587433140 FG Annotated Anodyne COc1ccc(-n2cc([C@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)cn2)cc1 ZINC000587433197 FG Annotated Anodyne COc1ccc(-n2cc([C@@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)cn2)cc1 ZINC000587433198 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCCC[C@H]1Cn1cncn1)[C@@H](C2)C3=O ZINC000587433554 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCCC[C@@H]1Cn1cncn1)[C@@H](C2)C3=O ZINC000587433558 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCCC[C@@H]1Cn1cncn1)[C@@H](C2)C3=O ZINC000587433560 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCCC[C@H]1Cn1cncn1)[C@@H](C2)C3=O ZINC000587433561 FG Annotated Anodyne CCc1nn(CC)c2c1[C@]1(CCC2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587433599 FG Annotated Anodyne CCc1nn(CC)c2c1[C@@]1(CCC2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587433601 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4c1cnn4-c1ccccn1)[C@@H](C2)C3=O ZINC000587433619 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4c1cnn4-c1ccccn1)[C@@H](C2)C3=O ZINC000587433620 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCC[C@H]1NC(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587433747 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCC[C@@H]1NC(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587433748 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCC[C@H]1NC(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587433749 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCC[C@@H]1NC(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587433750 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccncc1)(c1cccc(N)c1)[C@@H](C2)C3=O ZINC000587433765 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccncc1)(c1cccc(N)c1)[C@@H](C2)C3=O ZINC000587433766 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(N)cc1)([C@H](C)CC(=O)O)[C@@H](C2)C3=O ZINC000587433818 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(N)cc1)([C@H](C)CC(=O)O)[C@@H](C2)C3=O ZINC000587433819 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(N)cc1)([C@@H](C)CC(=O)O)[C@@H](C2)C3=O ZINC000587433820 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(N)cc1)([C@@H](C)CC(=O)O)[C@@H](C2)C3=O ZINC000587433821 FG Annotated Anodyne CCO[C@@H](C)c1ccc([C@]2(CN)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587433970 FG Annotated Anodyne CCO[C@H](C)c1ccc([C@@]2(CN)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587433971 FG Annotated Anodyne CCO[C@@H](C)c1ccc([C@@]2(CN)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587433972 FG Annotated Anodyne CCO[C@H](C)c1ccc([C@]2(CN)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587433973 FG Annotated Anodyne CCOc1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1[N+](=O)[O-] ZINC000587434062 FG Annotated Bother CCOc1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1[N+](=O)[O-] ZINC000587434063 FG Annotated Bother COc1cc2c3c(c1)O[C@@]1(C=COc4ccc([N+](=O)[O-])cc41)[C@@H](C2)C3=O ZINC000587434221 FG Annotated Bother COc1cc2c3c(c1)O[C@]1(C=COc4ccc([N+](=O)[O-])cc41)[C@@H](C2)C3=O ZINC000587434227 FG Annotated Bother COc1cc2c3c(c1)O[C@@](C)(COc1ccccc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587434248 FG Annotated Bother COc1cc2c3c(c1)O[C@](C)(COc1ccccc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587434250 FG Annotated Bother COc1cc2c3c(c1)O[C@@H](c1cc(OC)c(OC)cc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587434434 FG Annotated Bother COc1cc2c3c(c1)O[C@H](c1cc(OC)c(OC)cc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587434435 FG Annotated Bother COc1cc2c3c(c1)O[C@@H](c1ccccc1-c1cnc(=N)[nH]c1)[C@@H](C2)C3=O ZINC000587434442 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccccc1-c1cnc(=N)[nH]c1)[C@@H](C2)C3=O ZINC000587434443 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc([N+](=O)[O-])c([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587434494 FG Annotated Bother COc1cc2c3c(c1)O[C@@H](c1ccc([N+](=O)[O-])c([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587434495 FG Annotated Bother COc1cc2c3c(c1)O[C@@]1(CCCc4nn(-c5ccccc5)nc41)[C@@H](C2)C3=O ZINC000587434522 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4nn(-c5ccccc5)nc41)[C@@H](C2)C3=O ZINC000587434523 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H]([C@]1(C)CCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587434524 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H]([C@]1(C)CCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587434525 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H]([C@@]1(C)CCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587434526 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H]([C@@]1(C)CCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587434527 FG Annotated Anodyne COc1cc2c3c(c1)OC1(CCN(C(=O)OCC(C)C)CC1)[C@@H](C2)C3=O ZINC000587434571 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)([C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587434572 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)([C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587434573 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)([C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587434574 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)([C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587434575 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCN(Cc4ccccn4)C[C@H]1C)[C@@H](C2)C3=O ZINC000587434587 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCN(Cc4ccccn4)C[C@H]1C)[C@@H](C2)C3=O ZINC000587434588 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCN(Cc4ccccn4)C[C@@H]1C)[C@@H](C2)C3=O ZINC000587434589 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCN(Cc4ccccn4)C[C@@H]1C)[C@@H](C2)C3=O ZINC000587434590 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(C)cc4[nH]c(=N)oc14)[C@@H](C2)C3=O ZINC000587434645 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(C)cc4[nH]c(=N)oc14)[C@@H](C2)C3=O ZINC000587434646 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc([N+](=O)[O-])c(C#N)c1)[C@@H](C2)C3=O ZINC000587434658 FG Annotated Mild COc1cc2c3c(c1)O[C@@](C)(c1ccc([N+](=O)[O-])c(C#N)c1)[C@@H](C2)C3=O ZINC000587434659 FG Annotated Mild CCOc1ccc([N+](=O)[O-])cc1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587434660 FG Annotated Bother CCOc1ccc([N+](=O)[O-])cc1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587434661 FG Annotated Bother COc1cc2c3c(c1)O[C@@](C)(c1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587434666 FG Annotated Bother COc1cc2c3c(c1)O[C@](C)(c1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587434667 FG Annotated Bother COc1cc2c3c(c1)O[C@@H](c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587434702 FG Annotated Bother COc1cc2c3c(c1)O[C@H](c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587434703 FG Annotated Bother COc1cc2c3c(c1)O[C@](CC#N)(c1ccc([N+](=O)[O-])cc1)[C@@H](C2)C3=O ZINC000587434712 FG Annotated Mild COc1cc2c3c(c1)O[C@@](CC#N)(c1ccc([N+](=O)[O-])cc1)[C@@H](C2)C3=O ZINC000587434713 FG Annotated Mild COc1cc2c3c(c1)O[C@H](c1ccc(OC4CCOCC4)nc1)[C@@H](C2)C3=O ZINC000587434747 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC4CCOCC4)nc1)[C@@H](C2)C3=O ZINC000587434748 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C2)C3=O ZINC000587434776 FG Annotated Bother COc1cc2c3c(c1)O[C@](C)(c1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C2)C3=O ZINC000587434777 FG Annotated Bother COc1cc2c3c(c1)O[C@]1(CCN(C(C)=O)Cc4ccccc41)[C@@H](C2)C3=O ZINC000587434835 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCN(C(C)=O)Cc4ccccc41)[C@@H](C2)C3=O ZINC000587434836 FG Annotated Anodyne COc1ccc(N2CCC3(CC2)Oc2cc(OC)cc4c2C(=O)[C@H]3C4)cc1 ZINC000587435167 FG Annotated Clean COc1cc2c3c(c1)O[C@](C(=O)c1ccccn1)(c1ccccn1)[C@@H](C2)C3=O ZINC000587435177 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C(=O)c1ccccn1)(c1ccccn1)[C@@H](C2)C3=O ZINC000587435182 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](Cc1cnccn1)(c1ccccc1)[C@@H](C2)C3=O ZINC000587435243 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](Cc1cnccn1)(c1ccccc1)[C@@H](C2)C3=O ZINC000587435248 FG Annotated Anodyne COc1ccc(N2CC[C@]3(C2)Oc2cc(OC)cc4c2C(=O)[C@H]3C4)cc1 ZINC000587435307 FG Annotated Clean COc1ccc(N2CC[C@@]3(C2)Oc2cc(OC)cc4c2C(=O)[C@H]3C4)cc1 ZINC000587435309 FG Annotated Clean COc1cc2c3c(c1)O[C@]1(c4ccccc4C(=O)c4ccncc41)[C@@H](C2)C3=O ZINC000587435323 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccccc4C(=O)c4ccncc41)[C@@H](C2)C3=O ZINC000587435327 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(C)cc1)(c1ncccn1)[C@@H](C2)C3=O ZINC000587435333 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(C)cc1)(c1ncccn1)[C@@H](C2)C3=O ZINC000587435335 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1([C@H]4CC[C@H]1N(Cc1ccccc1)C4)[C@@H](C2)C3=O ZINC000587435437 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1([C@H]4CC[C@H]1N(Cc1ccccc1)C4)[C@@H](C2)C3=O ZINC000587435438 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C[C@H]4C[C@H]1N(C(=O)OC(C)(C)C)C4)[C@@H](C2)C3=O ZINC000587435750 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@H]4C[C@H]1N(C(=O)OC(C)(C)C)C4)[C@@H](C2)C3=O ZINC000587435751 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1([C@H]4CC[C@H]1N(C(=O)OC(C)(C)C)C4)[C@@H](C2)C3=O ZINC000587435789 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1([C@H]4CC[C@H]1N(C(=O)OC(C)(C)C)C4)[C@@H](C2)C3=O ZINC000587435792 FG Annotated Anodyne COc1cc2c3c(c1)OC1(C[C@@H]4C[C@H](C1)N4C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587435801 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)N(CC(C)C)c4ccccc41)[C@@H](C2)C3=O ZINC000587435852 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)N(CC(C)C)c4ccccc41)[C@@H](C2)C3=O ZINC000587435853 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(O)c4nc(O)ccc14)[C@@H](C2)C3=O ZINC000587435916 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(O)c4nc(O)ccc14)[C@@H](C2)C3=O ZINC000587435917 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccccc4C(=O)c4cnccc41)[C@@H](C2)C3=O ZINC000587435937 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4ccccc4C(=O)c4cnccc41)[C@@H](C2)C3=O ZINC000587435938 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccnc(-c4cc(C=O)ccn4)c1)[C@@H](C2)C3=O ZINC000587436053 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccnc(-c4cc(C=O)ccn4)c1)[C@@H](C2)C3=O ZINC000587436054 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC(C)(C)Cc4nc(O)ccc41)[C@@H](C2)C3=O ZINC000587436077 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CC(C)(C)Cc4nc(O)ccc41)[C@@H](C2)C3=O ZINC000587436083 FG Annotated Anodyne CCOC(=O)CC[C@@]1(c2cccnc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587436187 FG Annotated Anodyne CCOC(=O)CC[C@]1(c2cccnc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587436188 FG Annotated Anodyne CCOC(=O)CC[C@@]1(c2ccccn2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587436249 FG Annotated Anodyne CCOC(=O)CC[C@]1(c2ccccn2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587436250 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C[C@H]4C[C@H]1CN4C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587436305 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@H]4C[C@H]1CN4C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587436395 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H]([C@@H]1CCCN1C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587436413 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H]([C@H]1CCCN1C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587436414 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H]([C@H]1CCCN1C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587436415 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H]([C@@H]1CCCN1C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587436416 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@H]4CC[C@H]1N4C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587436449 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C[C@H]4CC[C@H]1N4C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587436450 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccncc1)(C1CCOCC1)[C@@H](C2)C3=O ZINC000587436494 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccncc1)(C1CCOCC1)[C@@H](C2)C3=O ZINC000587436495 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4ccc(OC)cc4nc1O)[C@@H](C2)C3=O ZINC000587436531 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4ccc(OC)cc4nc1O)[C@@H](C2)C3=O ZINC000587436532 FG Annotated Anodyne COC(=O)c1cccc2c([C@@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)c[nH]c12 ZINC000587436747 FG Annotated Anodyne COC(=O)c1cccc2c([C@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)c[nH]c12 ZINC000587436748 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccnc1)(C1CCOCC1)[C@@H](C2)C3=O ZINC000587436767 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccnc1)(C1CCOCC1)[C@@H](C2)C3=O ZINC000587436768 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCn4c(O)nc5cccc1c54)[C@@H](C2)C3=O ZINC000587436782 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCn4c(O)nc5cccc1c54)[C@@H](C2)C3=O ZINC000587436784 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(C(C)(C)O)nn4ccccc14)[C@@H](C2)C3=O ZINC000587436797 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C(C)(C)O)nn4ccccc14)[C@@H](C2)C3=O ZINC000587436799 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccnc1)(c1cnccc1C)[C@@H](C2)C3=O ZINC000587436842 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccnc1)(c1cnccc1C)[C@@H](C2)C3=O ZINC000587436843 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(C#Cc4cncnc4)cc1)[C@@H](C2)C3=O ZINC000587437045 FG Annotated Mild COc1cc2c3c(c1)O[C@H](c1ccc(C#Cc4cncnc4)cc1)[C@@H](C2)C3=O ZINC000587437047 FG Annotated Mild COc1cc2c3c(c1)O[C@@](Cc1ccncn1)(c1ccccc1)[C@@H](C2)C3=O ZINC000587437108 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](Cc1ccncn1)(c1ccccc1)[C@@H](C2)C3=O ZINC000587437110 FG Annotated Anodyne COC(=O)c1cccc2[nH]cc([C@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)c12 ZINC000587437151 FG Annotated Anodyne COC(=O)c1cccc2[nH]cc([C@@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)c12 ZINC000587437152 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OCc4ncon4)cc1)[C@@H](C2)C3=O ZINC000587437167 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OCc4ncon4)cc1)[C@@H](C2)C3=O ZINC000587437168 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)([C@@H](C#N)c1nc4ccccc4[nH]1)[C@@H](C2)C3=O ZINC000587437169 FG Annotated Mild COc1cc2c3c(c1)O[C@@](C)([C@H](C#N)c1nc4ccccc4[nH]1)[C@@H](C2)C3=O ZINC000587437170 FG Annotated Mild COc1cc2c3c(c1)O[C@](C)([C@H](C#N)c1nc4ccccc4[nH]1)[C@@H](C2)C3=O ZINC000587437171 FG Annotated Mild COc1cc2c3c(c1)O[C@](C)([C@@H](C#N)c1nc4ccccc4[nH]1)[C@@H](C2)C3=O ZINC000587437172 FG Annotated Mild COc1cc2c3c(c1)O[C@@](C)(Cc1nc(-c4ccccc4)no1)[C@@H](C2)C3=O ZINC000587437177 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(Cc1nc(-c4ccccc4)no1)[C@@H](C2)C3=O ZINC000587437178 FG Annotated Anodyne CCOC(=O)c1c(C)[nH]c([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C ZINC000587437191 FG Annotated Anodyne CCOC(=O)c1c(C)[nH]c([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C ZINC000587437192 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](Cc1ccccn1)(c1cccnc1)[C@@H](C2)C3=O ZINC000587437248 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](Cc1ccccn1)(c1cccnc1)[C@@H](C2)C3=O ZINC000587437249 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](CC1CN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587437468 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](CC1CN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587437471 FG Annotated Anodyne COc1cc2c3c(c1)OC1(CCN(C(=O)CC(C)(C)C)CC1)[C@@H](C2)C3=O ZINC000587437473 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C=C(C)N(Cc4ccco4)C(=O)C1)[C@@H](C2)C3=O ZINC000587437499 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C=C(C)N(Cc4ccco4)C(=O)C1)[C@@H](C2)C3=O ZINC000587437501 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCC(=O)N4CCc5cccc1c54)[C@@H](C2)C3=O ZINC000587437563 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCC(=O)N4CCc5cccc1c54)[C@@H](C2)C3=O ZINC000587437565 FG Annotated Anodyne COc1cc2c3c(c1)OC1(CCN(C(=O)OC(C)(C)C)CC1)[C@@H](C2)C3=O ZINC000587437620 FG Annotated Anodyne COC(=O)c1[nH]c2ccccc2c1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587437633 FG Annotated Anodyne COC(=O)c1[nH]c2ccccc2c1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587437634 FG Annotated Anodyne CCOC(=O)c1[nH]c(C)c([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C ZINC000587437645 FG Annotated Anodyne CCOC(=O)c1[nH]c(C)c([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C ZINC000587437646 FG Annotated Anodyne CCc1c(C(=O)O)[nH]c(C)c1[C@@]1(C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587437746 FG Annotated Anodyne CCc1c(C(=O)O)[nH]c(C)c1[C@]1(C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587437748 FG Annotated Anodyne COC(=O)c1ccc2c([C@@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)c[nH]c2c1 ZINC000587437778 FG Annotated Anodyne COC(=O)c1ccc2c([C@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)c[nH]c2c1 ZINC000587437780 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@@H](C)N(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587437800 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C[C@@H](C)N(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587437803 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C[C@H](C)N(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587437806 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@H](C)N(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587437810 FG Annotated Anodyne C#CCOc1ccc(OC)cc1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587437860 FG Annotated Mild C#CCOc1ccc(OC)cc1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587437862 FG Annotated Mild C#CCOc1cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)ccc1OC ZINC000587437944 FG Annotated Mild C#CCOc1cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)ccc1OC ZINC000587437945 FG Annotated Mild COc1cc2c3c(c1)O[C@H]([C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587437987 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H]([C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587437988 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H]([C@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587437989 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H]([C@@H]1CCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587437990 FG Annotated Anodyne CCOC(=O)COc1ccccc1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587438071 FG Annotated Anodyne CCOC(=O)COc1ccccc1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587438075 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C(=O)O)(c1c(C)[nH]c4ccccc14)[C@@H](C2)C3=O ZINC000587438120 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C(=O)O)(c1c(C)[nH]c4ccccc14)[C@@H](C2)C3=O ZINC000587438125 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4[nH]c(C(=O)O)c(C)c41)[C@@H](C2)C3=O ZINC000587438154 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4[nH]c(C(=O)O)c(C)c41)[C@@H](C2)C3=O ZINC000587438161 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1nnn(-c4ccccc4)c1C)[C@@H](C2)C3=O ZINC000587438182 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1nnn(-c4ccccc4)c1C)[C@@H](C2)C3=O ZINC000587438185 FG Annotated Anodyne COC(=O)c1ccc2[nH]cc([C@@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)c2c1 ZINC000587438311 FG Annotated Anodyne COC(=O)c1ccc2[nH]cc([C@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)c2c1 ZINC000587438312 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(O)[nH]c4ccc(OC)cc14)[C@@H](C2)C3=O ZINC000587438323 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(O)[nH]c4ccc(OC)cc14)[C@@H](C2)C3=O ZINC000587438324 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCN(Cc4ccccc4)C(=O)C1)[C@@H](C2)C3=O ZINC000587438352 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCN(Cc4ccccc4)C(=O)C1)[C@@H](C2)C3=O ZINC000587438354 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H]([C@H]1[C@@H](C(=O)OC(C)(C)C)C1(C)C)[C@@H](C2)C3=O ZINC000587438404 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H]([C@@H]1[C@H](C(=O)OC(C)(C)C)C1(C)C)[C@@H](C2)C3=O ZINC000587438405 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H]([C@@H]1[C@@H](C(=O)OC(C)(C)C)C1(C)C)[C@@H](C2)C3=O ZINC000587438407 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H]([C@H]1[C@H](C(=O)OC(C)(C)C)C1(C)C)[C@@H](C2)C3=O ZINC000587438409 FG Annotated Anodyne CCOC(=O)c1c(C)[nH]c([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C ZINC000587438421 FG Annotated Anodyne CCOC(=O)c1c(C)[nH]c([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C ZINC000587438425 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(C1CN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587438441 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(C1CN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587438443 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4[nH]c(C)c(C(=O)O)c41)[C@@H](C2)C3=O ZINC000587438638 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4[nH]c(C)c(C(=O)O)c41)[C@@H](C2)C3=O ZINC000587438640 FG Annotated Anodyne COc1cc2c3c(c1)OC1(CCN(Cc4ccc(C#N)cc4)CC1)[C@@H](C2)C3=O ZINC000587438674 FG Annotated Mild CCOC(=O)c1[nH]c(C)c([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C ZINC000587438717 FG Annotated Anodyne CCOC(=O)c1[nH]c(C)c([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C ZINC000587438721 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccccc1O[C@@H](C)C(=O)O)[C@@H](C2)C3=O ZINC000587438756 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccccc1O[C@H](C)C(=O)O)[C@@H](C2)C3=O ZINC000587438759 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccccc1O[C@@H](C)C(=O)O)[C@@H](C2)C3=O ZINC000587438762 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccccc1O[C@H](C)C(=O)O)[C@@H](C2)C3=O ZINC000587438763 FG Annotated Anodyne COc1cc2c3c(c1)OC1(CCN(c4ccc(C#N)cc4)CC1)[C@@H](C2)C3=O ZINC000587438972 FG Annotated Mild COc1cc2c3c(c1)O[C@@](C)(c1c(C)[nH]c(C(=O)CC#N)c1C)[C@@H](C2)C3=O ZINC000587439022 FG Annotated Mild COc1cc2c3c(c1)O[C@](C)(c1c(C)[nH]c(C(=O)CC#N)c1C)[C@@H](C2)C3=O ZINC000587439023 FG Annotated Mild COc1cc2c3c(c1)O[C@](CC#N)(c1[nH]c(C)c(C(C)=O)c1C)[C@@H](C2)C3=O ZINC000587439025 FG Annotated Mild COc1cc2c3c(c1)O[C@@](CC#N)(c1[nH]c(C)c(C(C)=O)c1C)[C@@H](C2)C3=O ZINC000587439027 FG Annotated Mild CCOC(=O)COc1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587439151 FG Annotated Anodyne CCOC(=O)COc1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587439152 FG Annotated Anodyne CCc1noc(C2CCC3(CC2)Oc2cc(OC)cc4c2C(=O)[C@H]3C4)n1 ZINC000587439419 FG Annotated Anodyne CC[C@H]1CCCCN1C(=O)C[C@@]1(C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587439463 FG Annotated Anodyne CC[C@@H]1CCCCN1C(=O)C[C@@]1(C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587439465 FG Annotated Anodyne CC[C@@H]1CCCCN1C(=O)C[C@]1(C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587439466 FG Annotated Anodyne CC[C@H]1CCCCN1C(=O)C[C@]1(C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587439467 FG Annotated Anodyne CCOC(=O)Cc1ccc([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587439497 FG Annotated Anodyne CCOC(=O)Cc1ccc([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587439498 FG Annotated Anodyne C#CCOc1c(OC)cccc1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587439511 FG Annotated Mild C#CCOc1c(OC)cccc1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587439513 FG Annotated Mild CCOc1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1C(=O)O ZINC000587439541 FG Annotated Anodyne CCOc1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1C(=O)O ZINC000587439553 FG Annotated Anodyne COC(=O)c1[nH]c(C)c([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C ZINC000587439588 FG Annotated Anodyne COC(=O)c1[nH]c(C)c([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C ZINC000587439594 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(C)c(OCCO)c(C)c1)[C@@H](C2)C3=O ZINC000587439638 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(C)c(OCCO)c(C)c1)[C@@H](C2)C3=O ZINC000587439639 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](Cc1ccccc1)([C@@H]1CCCNC1)[C@@H](C2)C3=O ZINC000587439681 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](Cc1ccccc1)([C@@H]1CCCNC1)[C@@H](C2)C3=O ZINC000587439682 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](Cc1ccccc1)([C@H]1CCCNC1)[C@@H](C2)C3=O ZINC000587439683 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](Cc1ccccc1)([C@H]1CCCNC1)[C@@H](C2)C3=O ZINC000587439685 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cn(Cc4ccc(C)cc4)nn1)[C@@H](C2)C3=O ZINC000587439709 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cn(Cc4ccc(C)cc4)nn1)[C@@H](C2)C3=O ZINC000587439711 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCN(C(=O)OC(C)(C)C)C[C@@H]1C)[C@@H](C2)C3=O ZINC000587439887 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCN(C(=O)OC(C)(C)C)C[C@H]1C)[C@@H](C2)C3=O ZINC000587439888 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCN(C(=O)OC(C)(C)C)C[C@@H]1C)[C@@H](C2)C3=O ZINC000587439889 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCN(C(=O)OC(C)(C)C)C[C@H]1C)[C@@H](C2)C3=O ZINC000587439890 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1[nH]c(C)c(CCC(=O)O)c1C)[C@@H](C2)C3=O ZINC000587440009 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1[nH]c(C)c(CCC(=O)O)c1C)[C@@H](C2)C3=O ZINC000587440014 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cccc(O[C@H](C)C(=O)O)c1)[C@@H](C2)C3=O ZINC000587440150 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cccc(O[C@H](C)C(=O)O)c1)[C@@H](C2)C3=O ZINC000587440151 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cccc(O[C@@H](C)C(=O)O)c1)[C@@H](C2)C3=O ZINC000587440152 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cccc(O[C@@H](C)C(=O)O)c1)[C@@H](C2)C3=O ZINC000587440153 FG Annotated Anodyne CCOC(=O)[C@@H](c1ccccc1)[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587440264 FG Annotated Anodyne CCOC(=O)[C@@H](c1ccccc1)[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587440265 FG Annotated Anodyne CCOC(=O)[C@H](c1ccccc1)[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587440266 FG Annotated Anodyne CCOC(=O)[C@H](c1ccccc1)[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587440267 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(OCCC(=O)O)cc1)[C@@H](C2)C3=O ZINC000587440280 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(OCCC(=O)O)cc1)[C@@H](C2)C3=O ZINC000587440281 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H]([C@H]1CCCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587440358 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H]([C@H]1CCCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587440359 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H]([C@@H]1CCCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587440361 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H]([C@@H]1CCCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587440363 FG Annotated Anodyne COc1cccc(N2CCC3(CC2)Oc2cc(OC)cc4c2C(=O)[C@H]3C4)c1 ZINC000587440411 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CN(C(=O)OC(C)(C)C)CC[C@@H]1C)[C@@H](C2)C3=O ZINC000587440457 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CN(C(=O)OC(C)(C)C)CC[C@H]1C)[C@@H](C2)C3=O ZINC000587440458 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CN(C(=O)OC(C)(C)C)CC[C@@H]1C)[C@@H](C2)C3=O ZINC000587440459 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CN(C(=O)OC(C)(C)C)CC[C@H]1C)[C@@H](C2)C3=O ZINC000587440460 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCc4c1ccc(OC)c4OC)[C@@H](C2)C3=O ZINC000587440529 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCc4c1ccc(OC)c4OC)[C@@H](C2)C3=O ZINC000587440532 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(O)c(OC)c(OC)c1)[C@@H](C2)C3=O ZINC000587440606 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(O)c(OC)c(OC)c1)[C@@H](C2)C3=O ZINC000587440633 FG Annotated Anodyne COC(=O)[C@H]1CCc2ccccc2[C@@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587440647 FG Annotated Anodyne COCCOc1ccc([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587440652 FG Annotated Anodyne COc1cc2c3c(c1)OC1(CC(OC(=O)c4ccccc4)C1)[C@@H](C2)C3=O ZINC000587440653 FG Annotated Anodyne COC(=O)[C@@H]1CCc2ccccc2[C@@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587440656 FG Annotated Anodyne COCCOc1ccc([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587440660 FG Annotated Anodyne COC(=O)[C@@H]1CCc2ccccc2[C@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587440661 FG Annotated Anodyne COC(=O)[C@H]1CCc2ccccc2[C@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587440665 FG Annotated Anodyne CCO[C@@H]1C[C@@]2(Oc3cc(OC)cc4c3C(=O)[C@H]2C4)[C@H]1Oc1ccccc1 ZINC000587440684 FG Annotated Anodyne CCO[C@@H]1C[C@]2(Oc3cc(OC)cc4c3C(=O)[C@H]2C4)[C@@H]1Oc1ccccc1 ZINC000587440690 FG Annotated Anodyne CCO[C@@H]1C[C@]2(Oc3cc(OC)cc4c3C(=O)[C@H]2C4)[C@H]1Oc1ccccc1 ZINC000587440693 FG Annotated Anodyne CCO[C@@H]1C[C@@]2(Oc3cc(OC)cc4c3C(=O)[C@H]2C4)[C@@H]1Oc1ccccc1 ZINC000587440697 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](COC(C)=O)(c1ccc(C)cc1)[C@@H](C2)C3=O ZINC000587440707 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](COC(C)=O)(c1ccc(C)cc1)[C@@H](C2)C3=O ZINC000587440710 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(O[C@H](C)C(=O)O)cc1)[C@@H](C2)C3=O ZINC000587440834 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(O[C@H](C)C(=O)O)cc1)[C@@H](C2)C3=O ZINC000587440837 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(O[C@@H](C)C(=O)O)cc1)[C@@H](C2)C3=O ZINC000587440840 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(O[C@@H](C)C(=O)O)cc1)[C@@H](C2)C3=O ZINC000587440841 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N4CCC(O)CC4)cc1)[C@@H](C2)C3=O ZINC000587440978 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(N4CCC(O)CC4)cc1)[C@@H](C2)C3=O ZINC000587440979 FG Annotated Anodyne COCCOc1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1OC ZINC000587441055 FG Annotated Anodyne COCCOc1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1OC ZINC000587441058 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OCCC(=O)O)cc1)[C@@H](C2)C3=O ZINC000587441071 FG Annotated Anodyne COC(=O)c1ccc(CC[C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587441092 FG Annotated Anodyne COC(=O)c1ccc(CC[C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587441095 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OCCC(=O)O)cc1)[C@@H](C2)C3=O ZINC000587441096 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCN(C(=O)c4ccccc4)C1)[C@@H](C2)C3=O ZINC000587441100 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCN(C(=O)c4ccccc4)C1)[C@@H](C2)C3=O ZINC000587441104 FG Annotated Anodyne CCOC(=O)[C@H]1Cc2ccccc2[C@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587441220 FG Annotated Anodyne CCOC(=O)[C@@H]1Cc2ccccc2[C@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587441223 FG Annotated Anodyne CCOC(=O)[C@@H]1Cc2ccccc2[C@@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587441226 FG Annotated Anodyne CCOC(=O)[C@H]1Cc2ccccc2[C@@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587441230 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(N4CCOCC4)cc1)[C@@H](C2)C3=O ZINC000587441265 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N4CCOCC4)cc1)[C@@H](C2)C3=O ZINC000587441269 FG Annotated Anodyne COC(=O)[C@H](C)[C@]1(c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441282 FG Annotated Anodyne CCOC(=O)C[C@@]1(Cc2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441291 FG Annotated Anodyne COC(=O)[C@@H](C)[C@@]1(c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441292 FG Annotated Anodyne CCOC(=O)C[C@]1(Cc2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441293 FG Annotated Anodyne COC(=O)[C@H](C)[C@@]1(c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441294 FG Annotated Anodyne COC(=O)[C@@H](C)[C@]1(c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441296 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)Nc4ccc5ccccc5c41)[C@@H](C2)C3=O ZINC000587441366 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)Nc4ccc5ccccc5c41)[C@@H](C2)C3=O ZINC000587441396 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OC)c(OC)c1OC)[C@@H](C2)C3=O ZINC000587441421 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC)c(OC)c1OC)[C@@H](C2)C3=O ZINC000587441423 FG Annotated Anodyne COC(=O)[C@@H](C)Oc1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587441429 FG Annotated Anodyne COC(=O)[C@H](C)Oc1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587441432 FG Annotated Anodyne COC(=O)[C@H](C)Oc1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587441434 FG Annotated Anodyne COC(=O)[C@@H](C)Oc1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587441436 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OC(C)C)c(CO)c1)[C@@H](C2)C3=O ZINC000587441467 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(N4CCCC4)nc1OC)[C@@H](C2)C3=O ZINC000587441519 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N4CCCC4)nc1OC)[C@@H](C2)C3=O ZINC000587441522 FG Annotated Anodyne COc1cc2c3c(c1)OC1([C@H]4C[C@H]1CN(Cc1ccccc1)C4)[C@@H](C2)C3=O ZINC000587441528 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441590 FG Annotated Anodyne CCOC(=O)C[C@]1(c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441593 FG Annotated Anodyne COc1ccc([C@]2(CCC(=O)O)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587441619 FG Annotated Anodyne COc1ccc([C@@]2(CCC(=O)O)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587441620 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(C)cc(OC)c(OC)c1O)[C@@H](C2)C3=O ZINC000587441627 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C)cc(OC)c(OC)c1O)[C@@H](C2)C3=O ZINC000587441631 FG Annotated Anodyne COC(=O)/C=C/c1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587441636 FG Annotated Anodyne COC(=O)/C=C/c1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587441639 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(OC)c(OC)c(OC)c1)[C@@H](C2)C3=O ZINC000587441650 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(OC)c(OC)c(OC)c1)[C@@H](C2)C3=O ZINC000587441653 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OC(C)=O)c(OC)c1)[C@@H](C2)C3=O ZINC000587441736 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC(C)=O)c(OC)c1)[C@@H](C2)C3=O ZINC000587441743 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCc4cc(OC)c(OC)cc41)[C@@H](C2)C3=O ZINC000587441751 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCc4cc(OC)c(OC)cc41)[C@@H](C2)C3=O ZINC000587441753 FG Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(C)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441792 FG Annotated Anodyne CCOC(=O)[C@]1(c2ccc(C)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441793 FG Annotated Anodyne CC[C@@]1(c2ccc(OCC(=O)O)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441804 FG Annotated Anodyne CC[C@]1(c2ccc(OCC(=O)O)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441808 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(N4CCOCC4)cc1)[C@@H](C2)C3=O ZINC000587441809 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(N4CCOCC4)cc1)[C@@H](C2)C3=O ZINC000587441813 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(OC)c1OC(C)=O)[C@@H](C2)C3=O ZINC000587441837 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(OC)c1OC(C)=O)[C@@H](C2)C3=O ZINC000587441838 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccccc1N1CCOC1=O)[C@@H](C2)C3=O ZINC000587441841 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccccc1N1CCOC1=O)[C@@H](C2)C3=O ZINC000587441842 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC(C)C)c(CO)c1)[C@@H](C2)C3=O ZINC000587441868 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(O[C@@H](C)C(=O)O)c1)[C@@H](C2)C3=O ZINC000587441947 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(O[C@H](C)C(=O)O)c1)[C@@H](C2)C3=O ZINC000587441948 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(O[C@@H](C)C(=O)O)c1)[C@@H](C2)C3=O ZINC000587441949 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(O[C@H](C)C(=O)O)c1)[C@@H](C2)C3=O ZINC000587441950 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(O[C@@H](C)C(=O)O)cc1)[C@@H](C2)C3=O ZINC000587441965 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(O[C@H](C)C(=O)O)cc1)[C@@H](C2)C3=O ZINC000587441966 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(O[C@@H](C)C(=O)O)cc1)[C@@H](C2)C3=O ZINC000587441967 FG Annotated Anodyne CCOc1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1C(=O)OC ZINC000587441984 FG Annotated Anodyne CCOc1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1C(=O)OC ZINC000587441985 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(Cc1ccc(OC)c(OC)c1)[C@@H](C2)C3=O ZINC000587442110 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(Cc1ccc(OC)c(OC)c1)[C@@H](C2)C3=O ZINC000587442113 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(OC)cc(OC)cc1OC)[C@@H](C2)C3=O ZINC000587442121 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(OC)cc(OC)cc1OC)[C@@H](C2)C3=O ZINC000587442123 FG Annotated Anodyne COC(=O)C1C[C@@H]2CCC[C@H](C1)C21Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587442191 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(N4CCCC4=O)cc1)[C@@H](C2)C3=O ZINC000587442193 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(N4CCCC4=O)cc1)[C@@H](C2)C3=O ZINC000587442197 FG Annotated Anodyne CCOC(=O)[C@@]1(c2ccccc2C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587442199 FG Annotated Anodyne CCOC(=O)[C@]1(c2ccccc2C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587442201 FG Annotated Anodyne COC(=O)/C=C/c1ccc(O)c([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1 ZINC000587442256 FG Annotated Anodyne COC(=O)/C=C/c1ccc(O)c([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1 ZINC000587442259 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587442278 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCN(C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587442282 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(OC)c(OC)c(OC)c1)[C@@H](C2)C3=O ZINC000587442341 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(OC)c(OC)c(OC)c1)[C@@H](C2)C3=O ZINC000587442343 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc4c(c1)CCC(=O)N4C)[C@@H](C2)C3=O ZINC000587442390 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc4c(c1)CCC(=O)N4C)[C@@H](C2)C3=O ZINC000587442391 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(O[C@H](C)C(=O)O)cc1)[C@@H](C2)C3=O ZINC000587442398 FG Annotated Anodyne COc1cc2c3c(c1)OC1(CC4(CCN4C(=O)OC(C)(C)C)C1)[C@@H](C2)C3=O ZINC000587442399 FG Annotated Anodyne CCCOc1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1CO ZINC000587442569 FG Annotated Anodyne CCCOc1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1CO ZINC000587442570 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCc4c(OC)ccc(OC)c41)[C@@H](C2)C3=O ZINC000587442699 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCc4c(OC)ccc(OC)c41)[C@@H](C2)C3=O ZINC000587442702 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OC)c(OC(C)=O)c1)[C@@H](C2)C3=O ZINC000587442748 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC)c(OC(C)=O)c1)[C@@H](C2)C3=O ZINC000587442749 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(OC)c(O)c(OC)c1)[C@@H](C2)C3=O ZINC000587442765 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(OC)c(O)c(OC)c1)[C@@H](C2)C3=O ZINC000587442767 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(OC(C)=O)ccc1OC)[C@@H](C2)C3=O ZINC000587442768 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(OC(C)=O)ccc1OC)[C@@H](C2)C3=O ZINC000587442770 FG Annotated Anodyne CCOC(=O)[C@H](Cc1ccccc1)[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587443076 FG Annotated Anodyne CCOC(=O)[C@@H](Cc1ccccc1)[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587443079 FG Annotated Anodyne CCOC(=O)[C@H](Cc1ccccc1)[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587443081 FG Annotated Anodyne CCOC(=O)[C@@H](Cc1ccccc1)[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587443083 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(CN4CCOCC4)c1)[C@@H](C2)C3=O ZINC000587443175 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(CN4CCOCC4)c1)[C@@H](C2)C3=O ZINC000587443178 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(N4CCOCC4)c1)[C@@H](C2)C3=O ZINC000587443181 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(N4CCOCC4)c1)[C@@H](C2)C3=O ZINC000587443182 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(OC)c(O)cc1OC)[C@@H](C2)C3=O ZINC000587443252 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(OC)c(O)cc1OC)[C@@H](C2)C3=O ZINC000587443253 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccccc1N1CCOCC1)[C@@H](C2)C3=O ZINC000587443254 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccccc1N1CCOCC1)[C@@H](C2)C3=O ZINC000587443257 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(OC)c(C=O)cc1OC)[C@@H](C2)C3=O ZINC000587443290 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(OC)c(C=O)cc1OC)[C@@H](C2)C3=O ZINC000587443291 FG Annotated Anodyne COC1=C[C@]2(Oc3cc(OC)cc4c3C(=O)[C@H]2C4)C(=O)C=C1C(C)(C)C ZINC000587443421 FG Annotated Mild COC1=C[C@@]2(Oc3cc(OC)cc4c3C(=O)[C@H]2C4)C(=O)C=C1C(C)(C)C ZINC000587443424 FG Annotated Mild COC(=O)CC[C@@]1(c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587443791 FG Annotated Anodyne COC(=O)CC[C@]1(c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587443793 FG Annotated Anodyne COC(=O)[C@@]12C[C@H]3C[C@@H](C1)[C@]1(Oc4cc(OC)cc5c4C(=O)[C@H]1C5)[C@H](C3)C2 ZINC000587443819 FG Annotated Anodyne COC(=O)[C@@]12C[C@H]3C[C@@H](C1)[C@@]1(Oc4cc(OC)cc5c4C(=O)[C@H]1C5)[C@H](C3)C2 ZINC000587443824 FG Annotated Anodyne COc1cc2c3c(c1)OC1([C@H]4C[C@H]1CN(C(=O)OC(C)(C)C)C4)[C@@H](C2)C3=O ZINC000587443836 FG Annotated Anodyne COC(=O)c1cccc2c1CC[C@]21Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587443879 FG Annotated Anodyne COC(=O)c1cccc2c1CC[C@@]21Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587443881 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OC)c(COC(C)=O)c1)[C@@H](C2)C3=O ZINC000587443893 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC)c(COC(C)=O)c1)[C@@H](C2)C3=O ZINC000587443897 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(C)nc(N4CCCCC4)n1)[C@@H](C2)C3=O ZINC000587443917 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(C)nc(N4CCCCC4)n1)[C@@H](C2)C3=O ZINC000587443920 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(C=O)cc4c1N(C)CCC4)[C@@H](C2)C3=O ZINC000587443928 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(C=O)cc4c1N(C)CCC4)[C@@H](C2)C3=O ZINC000587443929 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(OCCC(=O)O)c1)[C@@H](C2)C3=O ZINC000587444096 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(OCCC(=O)O)c1)[C@@H](C2)C3=O ZINC000587444097 FG Annotated Anodyne CCOC(=O)c1ccc(O)c([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1 ZINC000587444221 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](C1(CN4CCOCC4)CCCCC1)[C@@H](C2)C3=O ZINC000587444224 FG Annotated Anodyne CCOC(=O)c1ccc(O)c([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1 ZINC000587444226 FG Annotated Anodyne COCOc1ccc(OC)cc1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587444227 FG Annotated Anodyne CCOC(=O)[C@]1(CCc2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587444229 FG Annotated Anodyne CCOC(=O)[C@@]1(CCc2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587444231 FG Annotated Anodyne COCOc1ccc(OC)cc1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587444238 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](C1(CN4CCOCC4)CCCCC1)[C@@H](C2)C3=O ZINC000587444240 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(C=O)c4c(c1)CCCN4C)[C@@H](C2)C3=O ZINC000587444332 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(C=O)c4c(c1)CCCN4C)[C@@H](C2)C3=O ZINC000587444335 FG Annotated Anodyne CCOC(=O)Cc1ccccc1[C@@]1(C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587444490 FG Annotated Anodyne CCOC(=O)Cc1ccccc1[C@]1(C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587444491 FG Annotated Anodyne COC(=O)c1ccc2c(c1)[C@]1(CC2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587444667 FG Annotated Anodyne COC(=O)c1ccc2c(c1)[C@@]1(CC2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587444670 FG Annotated Anodyne COc1cc2c3c(c1)OC1(CC(C(=O)OCc4ccccc4)C1)[C@@H](C2)C3=O ZINC000587444776 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N4CCOCC4)cc1C)[C@@H](C2)C3=O ZINC000587444825 FG Annotated Clean COc1cc2c3c(c1)O[C@H](c1ccc(N4CCOCC4)cc1C)[C@@H](C2)C3=O ZINC000587444826 FG Annotated Clean COc1cc2c3c(c1)O[C@H](C1CCN(c4cccc(C)n4)CC1)[C@@H](C2)C3=O ZINC000587444840 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](C1CCN(c4cccc(C)n4)CC1)[C@@H](C2)C3=O ZINC000587444843 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(OC)c(OC(C)=O)c1)[C@@H](C2)C3=O ZINC000587444844 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(OC)c(OC(C)=O)c1)[C@@H](C2)C3=O ZINC000587444847 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@@H]4CC[C@H]1N4C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587444865 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C[C@@H]4CC[C@H]1N4C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587444866 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc4c(c1)CCN4C(C)=O)[C@@H](C2)C3=O ZINC000587444879 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc4c(c1)CCN4C(C)=O)[C@@H](C2)C3=O ZINC000587444880 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](C1CCN(Cc4cccnc4)CC1)[C@@H](C2)C3=O ZINC000587444883 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](C1CCN(Cc4cccnc4)CC1)[C@@H](C2)C3=O ZINC000587444884 FG Annotated Anodyne COc1cc2c3c(c1)OC1([C@H]4CC5C[C@H]1CC(OC(C)=O)(C5)C4)[C@@H](C2)C3=O ZINC000587444976 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(OC)c(OC)cc1OC)[C@@H](C2)C3=O ZINC000587445257 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(OC)c(OC)cc1OC)[C@@H](C2)C3=O ZINC000587445259 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1c(OC)cc(OC)cc1OC)[C@@H](C2)C3=O ZINC000587445268 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1c(OC)cc(OC)cc1OC)[C@@H](C2)C3=O ZINC000587445269 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cccc(N4CCOCC4)c1)[C@@H](C2)C3=O ZINC000587445364 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cccc(N4CCOCC4)c1)[C@@H](C2)C3=O ZINC000587445365 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(N4CCOC4=O)cc1)[C@@H](C2)C3=O ZINC000587445368 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(N4CCOC4=O)cc1)[C@@H](C2)C3=O ZINC000587445369 FG Annotated Anodyne COC(=O)[C@H]1CC[C@]2(Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c2ccccc21 ZINC000587445490 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@]2(Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c2ccccc21 ZINC000587445492 FG Annotated Anodyne COC(=O)[C@H]1CC[C@@]2(Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c2ccccc21 ZINC000587445494 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@@]2(Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c2ccccc21 ZINC000587445497 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCC14CN(C(=O)OC(C)(C)C)C4)[C@@H](C2)C3=O ZINC000587445598 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCC14CN(C(=O)OC(C)(C)C)C4)[C@@H](C2)C3=O ZINC000587445599 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cccc(N4CCCC4=O)c1)[C@@H](C2)C3=O ZINC000587445745 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cccc(N4CCCC4=O)c1)[C@@H](C2)C3=O ZINC000587445746 FG Annotated Anodyne COc1cc2c3c(c1)OC1(CC4(CN(C(=O)OC(C)(C)C)C4)C1)[C@@H](C2)C3=O ZINC000587445786 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cccc(N4CCOC4=O)c1)[C@@H](C2)C3=O ZINC000587445880 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cccc(N4CCOC4=O)c1)[C@@H](C2)C3=O ZINC000587445883 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@@H]4CN(C(=O)OC(C)(C)C)C[C@@H]41)[C@@H](C2)C3=O ZINC000587445958 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@H]4CN(C(=O)OC(C)(C)C)C[C@H]41)[C@@H](C2)C3=O ZINC000587445961 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@@H]4CN(C(=O)OC(C)(C)C)C[C@H]41)[C@@H](C2)C3=O ZINC000587445962 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@H]4CN(C(=O)OC(C)(C)C)C[C@@H]41)[C@@H](C2)C3=O ZINC000587445966 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C[C@@H]4CN(C(=O)OC(C)(C)C)C[C@@H]41)[C@@H](C2)C3=O ZINC000587445969 FG Annotated Anodyne C=CN1CCCC[C@@H]([C@@]2(C3CC3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)C1=O ZINC000587445985 FG Annotated Anodyne C=CN1CCCC[C@H]([C@@]2(C3CC3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)C1=O ZINC000587445987 FG Annotated Anodyne C=CN1CCCC[C@H]([C@]2(C3CC3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)C1=O ZINC000587445988 FG Annotated Anodyne C=CN1CCCC[C@@H]([C@]2(C3CC3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)C1=O ZINC000587445989 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C[C@H](C)C(=O)O)(c1ccccc1)[C@@H](C2)C3=O ZINC000587446638 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C[C@@H](C)C(=O)O)(c1ccccc1)[C@@H](C2)C3=O ZINC000587446642 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C[C@@H](C)C(=O)O)(c1ccccc1)[C@@H](C2)C3=O ZINC000587446643 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C[C@H](C)C(=O)O)(c1ccccc1)[C@@H](C2)C3=O ZINC000587446644 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC1C(=O)CC(C)(C)CC1=O)[C@@H](C2)C3=O ZINC000587447152 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC1C(=O)CC(C)(C)CC1=O)[C@@H](C2)C3=O ZINC000587447153 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C(=O)O)(c1ccc4c(c1)CCCC4)[C@@H](C2)C3=O ZINC000587447426 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C(=O)O)(c1ccc4c(c1)CCCC4)[C@@H](C2)C3=O ZINC000587447428 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CSc1nc(C)cc(C)n1)[C@@H](C2)C3=O ZINC000587447491 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CSc1nc(C)cc(C)n1)[C@@H](C2)C3=O ZINC000587447493 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(S(=O)(=O)C(C)C)c1)[C@@H](C2)C3=O ZINC000587447770 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(S(=O)(=O)C(C)C)c1)[C@@H](C2)C3=O ZINC000587447774 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4cc(C(=O)O)ccc4OC1(C)C)[C@@H](C2)C3=O ZINC000587447966 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4cc(C(=O)O)ccc4OC1(C)C)[C@@H](C2)C3=O ZINC000587447976 FG Annotated Anodyne CCS(=O)(=O)c1ccc([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587447990 FG Annotated Anodyne CCS(=O)(=O)c1ccc([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587447991 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C[C@@]4(C(=O)O)CC[C@@]1(C)C4(C)C)[C@@H](C2)C3=O ZINC000587448239 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@@]4(C(=O)O)CC[C@@]1(C)C4(C)C)[C@@H](C2)C3=O ZINC000587448240 FG Annotated Anodyne CCCS(=O)(=O)c1cccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1 ZINC000587448647 FG Annotated Anodyne CCCS(=O)(=O)c1cccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1 ZINC000587448651 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2cccs2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587449025 FG Annotated Anodyne CCOC(=O)C[C@]1(c2cccs2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587449026 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1csc(N(C(C)=O)C4CC4)n1)[C@@H](C2)C3=O ZINC000587449033 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1csc(N(C(C)=O)C4CC4)n1)[C@@H](C2)C3=O ZINC000587449035 FG Annotated Anodyne COc1cc2c3c(c1)OC1(CCN(c4nc(C)cs4)CC1)[C@@H](C2)C3=O ZINC000587449081 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccs1)(c1nccn1C)[C@@H](C2)C3=O ZINC000587449092 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccs1)(c1nccn1C)[C@@H](C2)C3=O ZINC000587449095 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnc(Br)s1)[C@@H](C2)C3=O ZINC000587449199 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnc(Br)s1)[C@@H](C2)C3=O ZINC000587449206 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(Cl)s1)([C@@H](C)O)[C@@H](C2)C3=O ZINC000587449220 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4cc(C(=O)O)ccc41)[C@@H](C2)C3=O ZINC000587449225 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4cc(C(=O)O)ccc41)[C@@H](C2)C3=O ZINC000587449226 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(Cl)s1)([C@@H](C)O)[C@@H](C2)C3=O ZINC000587449231 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(Cl)s1)([C@H](C)O)[C@@H](C2)C3=O ZINC000587449233 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(Cl)s1)([C@H](C)O)[C@@H](C2)C3=O ZINC000587449236 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnc(SC)nc1SC)[C@@H](C2)C3=O ZINC000587449238 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCc4cc5c(cc41)OCCO5)[C@@H](C2)C3=O ZINC000587449239 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnc(SC)nc1SC)[C@@H](C2)C3=O ZINC000587449241 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OC(=S)N(C)C)cc1)[C@@H](C2)C3=O ZINC000587449243 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC(=S)N(C)C)cc1)[C@@H](C2)C3=O ZINC000587449244 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCc4cc5c(cc41)OCCO5)[C@@H](C2)C3=O ZINC000587449252 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)Nc4cc(SC)ccc41)[C@@H](C2)C3=O ZINC000587449256 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)Nc4cc(SC)ccc41)[C@@H](C2)C3=O ZINC000587449265 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnc(-c4cnccn4)s1)[C@@H](C2)C3=O ZINC000587449386 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnc(-c4cnccn4)s1)[C@@H](C2)C3=O ZINC000587449395 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](CCc1ccc4c(c1)OCCO4)[C@@H](C2)C3=O ZINC000587449498 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](CCc1ccc4c(c1)OCCO4)[C@@H](C2)C3=O ZINC000587449502 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C=C(C(=O)O)Oc4c(C)cccc41)[C@@H](C2)C3=O ZINC000587449555 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](/C=C1/SCC(=O)N1C)(C(C)(C)C)[C@@H](C2)C3=O ZINC000587449560 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](/C=C1/SCC(=O)N1C)(C(C)(C)C)[C@@H](C2)C3=O ZINC000587449561 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C=C(C(=O)O)Oc4c(C)cccc41)[C@@H](C2)C3=O ZINC000587449567 FG Annotated Anodyne COCCc1nc(C)c([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)s1 ZINC000587449604 FG Annotated Anodyne COCCc1nc(C)c([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)s1 ZINC000587449606 FG Annotated Anodyne C=CCN=c1[nH]c(C)c([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)s1 ZINC000587449749 FG Annotated Mild C=CCN=c1[nH]c(C)c([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)s1 ZINC000587449753 FG Annotated Mild COc1cc2c3c(c1)O[C@]1(CC(C)(C)Cc4[nH]c(=N)sc41)[C@@H](C2)C3=O ZINC000587450078 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC(C)(C)Cc4[nH]c(=N)sc41)[C@@H](C2)C3=O ZINC000587450082 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N(C)C)c4nsnc14)[C@@H](C2)C3=O ZINC000587450168 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(N(C)C)c4nsnc14)[C@@H](C2)C3=O ZINC000587450173 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C(=O)OC(C)(C)C)(C1=COCCC1)[C@@H](C2)C3=O ZINC000587450274 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C(=O)OC(C)(C)C)(C1=COCCC1)[C@@H](C2)C3=O ZINC000587450278 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ncc(Br)s1)[C@@H](C2)C3=O ZINC000587450330 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ncc(Br)s1)[C@@H](C2)C3=O ZINC000587450332 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CC(C)(C)Cc4sc(=N)[nH]c41)[C@@H](C2)C3=O ZINC000587450494 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC(C)(C)Cc4sc(=N)[nH]c41)[C@@H](C2)C3=O ZINC000587450496 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)(C1(C(=O)O)CC1)[C@@H](C2)C3=O ZINC000587450498 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccccc1)(C1(C(=O)O)CC1)[C@@H](C2)C3=O ZINC000587450499 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCl)(c1cc(C(=O)O)cs1)[C@@H](C2)C3=O ZINC000587450535 FG Annotated Reactive COc1cc2c3c(c1)O[C@](CCl)(c1cc(C(=O)O)cs1)[C@@H](C2)C3=O ZINC000587450543 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@](C(=O)OC)([C@@H](C)Br)CC2=O ZINC000587450594 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@](C(=O)OC)([C@H](C)Br)CC2=O ZINC000587450597 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C(=O)OC)([C@@H](C)Br)CC2=O ZINC000587450598 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C(=O)OC)([C@H](C)Br)CC2=O ZINC000587450600 FG Annotated Reactive COc1cc2c3c(c1)O[C@H](c1ccc4c(c1)sc(=O)n4C)[C@@H](C2)C3=O ZINC000587450608 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc4c(c1)sc(=O)n4C)[C@@H](C2)C3=O ZINC000587450610 FG Annotated Anodyne COc1cc2c3c(c1)OC(C1CCOCC1)(C1CCOCC1)[C@@H](C2)C3=O ZINC000587450746 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1coc4ccc(OC)cc4c1=O)[C@@H](C2)C3=O ZINC000587450757 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1coc4ccc(OC)cc4c1=O)[C@@H](C2)C3=O ZINC000587450759 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cccc(NC(N)=S)c1)[C@@H](C2)C3=O ZINC000587450996 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cccc(NC(N)=S)c1)[C@@H](C2)C3=O ZINC000587450997 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnc(-c4ncccn4)s1)[C@@H](C2)C3=O ZINC000587451147 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnc(-c4ncccn4)s1)[C@@H](C2)C3=O ZINC000587451150 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](/C=C(/C)N(C)C)(c1nccs1)[C@@H](C2)C3=O ZINC000587451188 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](/C=C(\C)N(C)C)(c1nccs1)[C@@H](C2)C3=O ZINC000587451198 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](/C=C(\C)N(C)C)(c1nccs1)[C@@H](C2)C3=O ZINC000587451200 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](/C=C(/C)N(C)C)(c1nccs1)[C@@H](C2)C3=O ZINC000587451202 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1nc(-c4cnn(C)c4)cs1)[C@@H](C2)C3=O ZINC000587451360 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1nc(-c4cnn(C)c4)cs1)[C@@H](C2)C3=O ZINC000587451365 FG Annotated Anodyne CCOP(=O)(C[C@@]1(C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3)OCC ZINC000587451530 FG Annotated Anodyne CCOP(=O)(C[C@]1(C)Oc2cc(OC)cc3c2C(=O)[C@H]1C3)OCC ZINC000587451533 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CC(=O)Oc4cc(C)c(C)cc41)[C@@H](C2)C3=O ZINC000587451582 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC(=O)Oc4cc(C)c(C)cc41)[C@@H](C2)C3=O ZINC000587451589 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(C#CC(C)(C)O)s1)[C@@H](C2)C3=O ZINC000587451621 FG Annotated Mild COc1cc2c3c(c1)O[C@H](c1ccc(C#CC(C)(C)O)s1)[C@@H](C2)C3=O ZINC000587451622 FG Annotated Mild COc1cc2c3c(c1)O[C@@H](c1ccc(Sc4nncn4C)o1)[C@@H](C2)C3=O ZINC000587451659 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(Sc4nncn4C)o1)[C@@H](C2)C3=O ZINC000587451660 FG Annotated Anodyne CCc1nc(C)c([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(S)n1 ZINC000587451703 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](/C(Br)=C/N(C)C)CC2=O ZINC000587451706 FG Annotated Anodyne CCc1nc(C)c([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(S)n1 ZINC000587451708 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](/C(Br)=C/N(C)C)CC2=O ZINC000587451713 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4c(C(=O)O)csc41)[C@@H](C2)C3=O ZINC000587451741 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4c(C(=O)O)csc41)[C@@H](C2)C3=O ZINC000587451743 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(S(=O)(=O)Cl)cc1)[C@@H](C2)C3=O ZINC000587451780 FG Annotated Unstable COc1cc2c3c(c1)O[C@H](c1ccc(S(=O)(=O)Cl)cc1)[C@@H](C2)C3=O ZINC000587451787 FG Annotated Unstable COc1cc2c3c(c1)O[C@@]1(CCCC[C@@H]1N1CCSCC1)[C@@H](C2)C3=O ZINC000587451813 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCC[C@@H]1N1CCSCC1)[C@@H](C2)C3=O ZINC000587451817 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCC[C@H]1N1CCSCC1)[C@@H](C2)C3=O ZINC000587451819 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCC[C@H]1N1CCSCC1)[C@@H](C2)C3=O ZINC000587451820 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(CN4CCSCC4)o1)[C@@H](C2)C3=O ZINC000587451859 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(CN4CCSCC4)o1)[C@@H](C2)C3=O ZINC000587451863 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc4c(s1)SCC(=O)N4)[C@@H](C2)C3=O ZINC000587451961 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc4c(s1)SCC(=O)N4)[C@@H](C2)C3=O ZINC000587451965 FG Annotated Anodyne CCN(C(C)=O)c1nc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cs1 ZINC000587451986 FG Annotated Anodyne CCN(C(C)=O)c1nc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cs1 ZINC000587451990 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1sc(N(C)C)nc1Cl)[C@@H](C2)C3=O ZINC000587452008 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1sc(N(C)C)nc1Cl)[C@@H](C2)C3=O ZINC000587452010 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2ccc(C)o2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587452034 FG Annotated Anodyne CCOC(=O)C[C@]1(c2ccc(C)o2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587452035 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N4CCC(O)CC4)s1)[C@@H](C2)C3=O ZINC000587452046 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(N4CCC(O)CC4)s1)[C@@H](C2)C3=O ZINC000587452049 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(CNC(C)=O)s1)[C@@H](C2)C3=O ZINC000587452053 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(CNC(C)=O)s1)[C@@H](C2)C3=O ZINC000587452070 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(Sc4nc[nH]n4)o1)[C@@H](C2)C3=O ZINC000587452177 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(Sc4nc[nH]n4)o1)[C@@H](C2)C3=O ZINC000587452180 FG Annotated Anodyne CCc1ccc2c(c1)[C@@]1(CC(=O)O2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587452253 FG Annotated Anodyne CCc1ccc2c(c1)[C@]1(CC(=O)O2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587452260 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(C#N)c(S)nc1C)[C@@H](C2)C3=O ZINC000587452298 FG Annotated Mild COc1cc2c3c(c1)O[C@@](C)(c1cc(C#N)c(S)nc1C)[C@@H](C2)C3=O ZINC000587452300 FG Annotated Mild COc1cc2c3c(c1)O[C@@]1(CCCc4nc(SC)ncc41)[C@@H](C2)C3=O ZINC000587452304 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4nc(SC)ncc41)[C@@H](C2)C3=O ZINC000587452306 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CBr)(c1nccs1)[C@@H](C2)C3=O ZINC000587452404 FG Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1nccs1)[C@@H](C2)C3=O ZINC000587452405 FG Annotated Reactive COc1cc2c3c(c1)O[C@]1(CC[C@H](C(=O)O)c4ccccc41)[C@@H](C2)C3=O ZINC000587452436 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC[C@@H](C(=O)O)c4ccccc41)[C@@H](C2)C3=O ZINC000587452437 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC[C@H](C(=O)O)c4ccccc41)[C@@H](C2)C3=O ZINC000587452438 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CC[C@@H](C(=O)O)c4ccccc41)[C@@H](C2)C3=O ZINC000587452440 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnc(-c4cnn(C)c4)s1)[C@@H](C2)C3=O ZINC000587452448 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnc(-c4cnn(C)c4)s1)[C@@H](C2)C3=O ZINC000587452450 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1c(N)sc4c1CCOC4)[C@@H](C2)C3=O ZINC000587452516 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1c(N)sc4c1CCOC4)[C@@H](C2)C3=O ZINC000587452518 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(OC[C@H]4CO4)cc1)[C@@H](C2)C3=O ZINC000587452527 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(OC[C@@H]4CO4)cc1)[C@@H](C2)C3=O ZINC000587452529 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(OC[C@@H]4CO4)cc1)[C@@H](C2)C3=O ZINC000587452531 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(OC[C@H]4CO4)cc1)[C@@H](C2)C3=O ZINC000587452532 FG Annotated Anodyne CCCN=c1[nH]c(C)c([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)s1 ZINC000587452637 FG Annotated Anodyne CCCN=c1[nH]c(C)c([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)s1 ZINC000587452638 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1csc(-c4ncccn4)n1)[C@@H](C2)C3=O ZINC000587452683 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1csc(-c4ncccn4)n1)[C@@H](C2)C3=O ZINC000587452684 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCOc4c(OC)cc(C)cc41)[C@@H](C2)C3=O ZINC000587452775 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCOc4c(OC)cc(C)cc41)[C@@H](C2)C3=O ZINC000587452776 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc4[nH]c(=N)sc4c1)[C@@H](C2)C3=O ZINC000587453017 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc4[nH]c(=N)sc4c1)[C@@H](C2)C3=O ZINC000587453023 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1nc4c(s1)CN(C(C)C)CC4)[C@@H](C2)C3=O ZINC000587453083 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1nc4c(s1)CN(C(C)C)CC4)[C@@H](C2)C3=O ZINC000587453085 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(OC)c4oc(=O)sc4c1)[C@@H](C2)C3=O ZINC000587453103 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(OC)c4oc(=O)sc4c1)[C@@H](C2)C3=O ZINC000587453104 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(CN4CCOCC4)s1)[C@@H](C2)C3=O ZINC000587453179 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(CN4CCOCC4)s1)[C@@H](C2)C3=O ZINC000587453180 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(N4CCOCC4)s1)[C@@H](C2)C3=O ZINC000587453209 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(N4CCOCC4)s1)[C@@H](C2)C3=O ZINC000587453210 FG Annotated Anodyne COc1cc2c3c(c1)OC1(CCN(C(=O)c4cccs4)CC1)[C@@H](C2)C3=O ZINC000587453221 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4nc(S)c(C#N)cc41)[C@@H](C2)C3=O ZINC000587453244 FG Annotated Mild COc1cc2c3c(c1)O[C@]1(CCCc4nc(S)c(C#N)cc41)[C@@H](C2)C3=O ZINC000587453246 FG Annotated Mild COc1cc2c3c(c1)OC1([C@H]4CC5C[C@H]1CC(C(=O)O)(C5)C4)[C@@H](C2)C3=O ZINC000587453271 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1([C@H]4C[C@H]5C[C@@H]1C[C@@](C(=O)O)(C5)C4)[C@@H](C2)C3=O ZINC000587453275 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1([C@H]4C[C@H]5C[C@@H]1C[C@@](C(=O)O)(C5)C4)[C@@H](C2)C3=O ZINC000587453277 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C(=O)O)(c1ccc(Cl)s1)[C@@H](C2)C3=O ZINC000587453295 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C(=O)O)(c1ccc(Cl)s1)[C@@H](C2)C3=O ZINC000587453302 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(NC(N)=S)cc1)[C@@H](C2)C3=O ZINC000587453314 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(NC(N)=S)cc1)[C@@H](C2)C3=O ZINC000587453315 FG Annotated Anodyne COc1cc2c3c(c1)OC(c1nccs1)(c1nccs1)[C@@H](C2)C3=O ZINC000587453335 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@H]1C[C@H]1C(=O)O)[C@@H](C2)C3=O ZINC000587453395 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@@H]1C[C@@H]1C(=O)O)[C@@H](C2)C3=O ZINC000587453409 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@H]1C[C@@H]1C(=O)O)[C@@H](C2)C3=O ZINC000587453412 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@@H]1C[C@H]1C(=O)O)[C@@H](C2)C3=O ZINC000587453415 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](/C(C#N)=C\N(C)C)(c1cccs1)[C@@H](C2)C3=O ZINC000587453492 FG Annotated Reactive COc1cc2c3c(c1)O[C@@](/C(C#N)=C/N(C)C)(c1cccs1)[C@@H](C2)C3=O ZINC000587453497 FG Annotated Reactive COc1cc2c3c(c1)O[C@](/C(C#N)=C\N(C)C)(c1cccs1)[C@@H](C2)C3=O ZINC000587453502 FG Annotated Reactive COc1cc2c3c(c1)O[C@](/C(C#N)=C/N(C)C)(c1cccs1)[C@@H](C2)C3=O ZINC000587453506 FG Annotated Reactive COc1cc2c3c(c1)O[C@](CCl)([C@H](C#N)c1nc(C)cs1)[C@@H](C2)C3=O ZINC000587453659 FG Annotated Reactive COc1cc2c3c(c1)O[C@](CCl)([C@@H](C#N)c1nc(C)cs1)[C@@H](C2)C3=O ZINC000587453661 FG Annotated Reactive COc1cc2c3c(c1)O[C@@](CCl)([C@H](C#N)c1nc(C)cs1)[C@@H](C2)C3=O ZINC000587453663 FG Annotated Reactive COc1cc2c3c(c1)O[C@@](CCl)([C@@H](C#N)c1nc(C)cs1)[C@@H](C2)C3=O ZINC000587453665 FG Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1nc(Br)cs1)[C@@H](C2)C3=O ZINC000587453668 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1nc(Br)cs1)[C@@H](C2)C3=O ZINC000587453669 FG Annotated Anodyne CCOc1nc2sccn2c1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587453680 FG Annotated Anodyne CCOc1nc2sccn2c1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587453694 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1sc(NC(C)=O)nc1C)[C@@H](C2)C3=O ZINC000587453708 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1sc(NC(C)=O)nc1C)[C@@H](C2)C3=O ZINC000587453709 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1csc(Br)n1)[C@@H](C2)C3=O ZINC000587453787 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1csc(Br)n1)[C@@H](C2)C3=O ZINC000587453788 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](CSCC(=O)O)(c1ccccc1)[C@@H](C2)C3=O ZINC000587453844 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](CSCC(=O)O)(c1ccccc1)[C@@H](C2)C3=O ZINC000587453845 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(COC(C)=O)cs1)[C@@H](C2)C3=O ZINC000587453861 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(COC(C)=O)cs1)[C@@H](C2)C3=O ZINC000587453862 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4c(cc1OC)OCCCO4)[C@@H](C2)C3=O ZINC000587454021 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cccc4sc(=N)[nH]c14)[C@@H](C2)C3=O ZINC000587454022 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4c(cc1OC)OCCCO4)[C@@H](C2)C3=O ZINC000587454023 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cccc4sc(=N)[nH]c14)[C@@H](C2)C3=O ZINC000587454024 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(N4CCSCC4)nc1)[C@@H](C2)C3=O ZINC000587454077 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N4CCSCC4)nc1)[C@@H](C2)C3=O ZINC000587454079 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(OC(=S)N(C)C)c1)[C@@H](C2)C3=O ZINC000587454157 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(OC(=S)N(C)C)c1)[C@@H](C2)C3=O ZINC000587454159 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(O)ccc4c(C)cc(=O)oc14)[C@@H](C2)C3=O ZINC000587454207 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(O)ccc4c(C)cc(=O)oc14)[C@@H](C2)C3=O ZINC000587454210 FG Annotated Anodyne CCSc1ccc2c(c1)NC(=O)[C@@]21Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587454249 FG Annotated Anodyne CCSc1ccc2c(c1)NC(=O)[C@]21Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587454258 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C=C(C(=O)O)Oc4cc(C)ccc41)[C@@H](C2)C3=O ZINC000587454339 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C=C(C(=O)O)Oc4cc(C)ccc41)[C@@H](C2)C3=O ZINC000587454341 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4c1sc(N)c4C#N)[C@@H](C2)C3=O ZINC000587454507 FG Annotated Mild COc1cc2c3c(c1)O[C@]1(CCCc4c1sc(N)c4C#N)[C@@H](C2)C3=O ZINC000587454508 FG Annotated Mild COc1cc2c3c(c1)O[C@@]1(C(C(=O)O)=COc4ccc(C)cc41)[C@@H](C2)C3=O ZINC000587454538 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(C(=O)O)=COc4ccc(C)cc41)[C@@H](C2)C3=O ZINC000587454540 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCOc4cc(OC)cc(OC)c41)[C@@H](C2)C3=O ZINC000587454603 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCOc4cc(OC)cc(OC)c41)[C@@H](C2)C3=O ZINC000587454606 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnc(-c4ccncn4)s1)[C@@H](C2)C3=O ZINC000587454703 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnc(-c4ccncn4)s1)[C@@H](C2)C3=O ZINC000587454704 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C=C(C(=O)O)Oc4ccc(C)cc41)[C@@H](C2)C3=O ZINC000587454919 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C=C(C(=O)O)Oc4ccc(C)cc41)[C@@H](C2)C3=O ZINC000587454920 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cccc(OC[C@H]4CO4)c1)[C@@H](C2)C3=O ZINC000587455075 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cccc(OC[C@@H]4CO4)c1)[C@@H](C2)C3=O ZINC000587455076 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cccc(OC[C@@H]4CO4)c1)[C@@H](C2)C3=O ZINC000587455077 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cccc(OC[C@H]4CO4)c1)[C@@H](C2)C3=O ZINC000587455078 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](Cc1cc4ccccc4o1)(C(=O)O)[C@@H](C2)C3=O ZINC000587455153 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](Cc1cc4ccccc4o1)(C(=O)O)[C@@H](C2)C3=O ZINC000587455154 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CBr)(C(=O)OCC)CC2=O ZINC000587455335 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@](CBr)(C(=O)OCC)CC2=O ZINC000587455336 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@](CBr)([C@H]1CCOC1)CC2=O ZINC000587455365 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CBr)([C@@H]1CCOC1)CC2=O ZINC000587455366 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CBr)([C@H]1CCOC1)CC2=O ZINC000587455367 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@](CBr)([C@@H]1CCOC1)CC2=O ZINC000587455368 FG Annotated Reactive COC(=O)c1coc2c1[C@@]1(CCC2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587455443 FG Annotated Anodyne COC(=O)c1coc2c1[C@]1(CCC2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587455444 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4oc(C)c(C(=O)O)c41)[C@@H](C2)C3=O ZINC000587455715 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4oc(C)c(C(=O)O)c41)[C@@H](C2)C3=O ZINC000587455718 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccco1)([C@H](O)c1ccco1)[C@@H](C2)C3=O ZINC000587455747 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccco1)([C@@H](O)c1ccco1)[C@@H](C2)C3=O ZINC000587455750 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccco1)([C@@H](O)c1ccco1)[C@@H](C2)C3=O ZINC000587455751 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccco1)([C@H](O)c1ccco1)[C@@H](C2)C3=O ZINC000587455752 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(CCC(=O)O)oc1C)[C@@H](C2)C3=O ZINC000587455945 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(CCC(=O)O)oc1C)[C@@H](C2)C3=O ZINC000587455946 FG Annotated Anodyne COc1cc2c3c(c1)O[C@](C(=O)c1ccco1)(c1ccco1)[C@@H](C2)C3=O ZINC000587456175 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@](C(=O)c1ccco1)(c1ccco1)[C@@H](C2)C3=O ZINC000587456176 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@H](CCc1cccc(C4OCCO4)c1)[C@@H](C2)C3=O ZINC000587456181 FG Annotated Anodyne COc1cc2c3c(c1)O[C@H](CCc1cccc(C4OCCO4)c1)[C@@H](C2)C3=O ZINC000587456182 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCOC[C@@H]1OCc1ccccc1)[C@@H](C2)C3=O ZINC000587456210 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCOC[C@H]1OCc1ccccc1)[C@@H](C2)C3=O ZINC000587456211 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCOC[C@@H]1OCc1ccccc1)[C@@H](C2)C3=O ZINC000587456212 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCOC[C@H]1OCc1ccccc1)[C@@H](C2)C3=O ZINC000587456213 FG Annotated Anodyne COC(=O)c1oc2c(c1C)[C@@]1(CCC2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587456412 FG Annotated Anodyne COC(=O)c1oc2c(c1C)[C@]1(CCC2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587456415 FG Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4oc(C(=O)O)c(C)c41)[C@@H](C2)C3=O ZINC000587456671 FG Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4oc(C(=O)O)c(C)c41)[C@@H](C2)C3=O ZINC000587456672 FG Annotated Anodyne CCOC(=O)c1cc([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)oc1C ZINC000587457024 FG Annotated Anodyne CCOC(=O)c1cc([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)oc1C ZINC000587457028 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCOC[C@H]1Br)CC2=O ZINC000587458048 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@]1(CCOC[C@@H]1Br)CC2=O ZINC000587458062 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@]1(CCOC[C@@H]1Br)CC2=O ZINC000587458064 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@]1(CCOC[C@H]1Br)CC2=O ZINC000587458066 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@](c1cccc(Cl)c1)(C(O)O)CC2=O ZINC000587459485 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccc(Cl)c1)(C(O)O)CC2=O ZINC000587459488 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccc(Cl)cc1)(C(O)O)CC2=O ZINC000587460042 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccc(Cl)cc1)(C(O)O)CC2=O ZINC000587460043 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N1CCOCC1)(CCl)CC2=O ZINC000587460651 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@](/C=C\N1CCOCC1)(CCl)CC2=O ZINC000587460653 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@](/C=C/N1CCOCC1)(CCl)CC2=O ZINC000587460655 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@](/C=C\N1CCOCC1)(CCl)CC2=O ZINC000587460657 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@H](c1c(Cl)nc(OC)n1C)CC2=O ZINC000587460820 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(Cl)nc(OC)n1C)CC2=O ZINC000587460825 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(Cl)n[nH]c1C(=O)O)CC2=O ZINC000587461331 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(Cl)n[nH]c1C(=O)O)CC2=O ZINC000587461333 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)([C@H](NC(=O)CCl)C(C)C)CC2=O ZINC000587461905 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@](C)([C@@H](NC(=O)CCl)C(C)C)CC2=O ZINC000587461914 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C)([C@@H](NC(=O)CCl)C(C)C)CC2=O ZINC000587461915 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C)([C@H](NC(=O)CCl)C(C)C)CC2=O ZINC000587461916 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@](Cn1cncn1)(C1(Cl)CC1)CC2=O ZINC000587462024 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](Cn1cncn1)(C1(Cl)CC1)CC2=O ZINC000587462031 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCl)(c1cc(C(N)=O)co1)CC2=O ZINC000587462163 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CCl)(c1cc(C(N)=O)co1)CC2=O ZINC000587462174 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@]1(CC=Cn3c1nc(Cl)cc3=O)CC2=O ZINC000587463390 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC=Cn3c1nc(Cl)cc3=O)CC2=O ZINC000587463391 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(F)F)([C@@H](Cl)C(=O)OC)CC2=O ZINC000587464443 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@](C(F)F)([C@H](Cl)C(=O)OC)CC2=O ZINC000587464444 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C(F)F)([C@H](Cl)C(=O)OC)CC2=O ZINC000587464445 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C(F)F)([C@@H](Cl)C(=O)OC)CC2=O ZINC000587464446 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@@H](c1c(C(F)F)nn(C)c1O)CC2=O ZINC000587465758 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(C(F)F)nn(C)c1O)CC2=O ZINC000587465767 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(C(C)(OC)OC)CC2=O ZINC000587466581 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(C(C)(OC)OC)CC2=O ZINC000587466582 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)O)(c1cc(F)ccc1OC)CC2=O ZINC000587466751 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)O)(c1cc(F)ccc1OC)CC2=O ZINC000587466757 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(O)c(C(N)=O)c1)CC2=O ZINC000587467489 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(O)c(C(N)=O)c1)CC2=O ZINC000587467492 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccc(C#N)cc1)([C@@H](C)O)CC2=O ZINC000587467550 FG Annotated Mild CCCc1c(O)ccc2c1O[C@@](c1ccc(C#N)cc1)([C@@H](C)O)CC2=O ZINC000587467554 FG Annotated Mild CCCc1c(O)ccc2c1O[C@@](c1ccc(C#N)cc1)([C@H](C)O)CC2=O ZINC000587467555 FG Annotated Mild CCCc1c(O)ccc2c1O[C@](c1ccc(C#N)cc1)([C@H](C)O)CC2=O ZINC000587467557 FG Annotated Mild CCCc1c(O)ccc2c1OC1(CC2=O)[C@H]2CC3C[C@H]1CC(C(N)=O)(C3)C2 ZINC000587467684 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)CC(C)(C)Cc2nc(=N)[nH]cc21 ZINC000587468111 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)CC(C)(C)Cc2nc(=N)[nH]cc21 ZINC000587468112 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccccc1OCC(=O)NC)CC2=O ZINC000587468230 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccccc1OCC(=O)NC)CC2=O ZINC000587468234 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(O[C@H](C)C(N)=O)cc1)CC2=O ZINC000587468287 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(O[C@@H](C)C(N)=O)cc1)CC2=O ZINC000587468288 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(O[C@H](C)C(N)=O)cc1)CC2=O ZINC000587468289 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(O[C@@H](C)C(N)=O)cc1)CC2=O ZINC000587468290 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1nc(OC)ccc1[N+](=O)[O-])CC2=O ZINC000587468684 FG Annotated Bother CCCc1c(O)ccc2c1O[C@@](C)(Cn1nc([N+](=O)[O-])cc1C)CC2=O ZINC000587468685 FG Annotated Bother CCCc1c(O)ccc2c1O[C@@H](c1nc(OC)ccc1[N+](=O)[O-])CC2=O ZINC000587468687 FG Annotated Bother CCCc1c(O)ccc2c1O[C@](C)(Cn1nc([N+](=O)[O-])cc1C)CC2=O ZINC000587468704 FG Annotated Bother CCCc1c(O)ccc2c1O[C@@H](c1cccn1CC(=O)OCC)CC2=O ZINC000587468981 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccn1CC(=O)OCC)CC2=O ZINC000587468985 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CC(=O)Nc1nccc(C)n1)CC2=O ZINC000587469022 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)Nc1nccc(C)n1)CC2=O ZINC000587469023 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(OCC(N)=O)cc1)CC2=O ZINC000587469498 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(OCC(N)=O)cc1)CC2=O ZINC000587469499 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CC(=O)NCc1ccco1)CC2=O ZINC000587469500 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)NCc1ccco1)CC2=O ZINC000587469501 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C(=C/N(C)C)C(=O)OC)(C1CC1)CC2=O ZINC000587469585 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C(=C/N(C)C)C(=O)OC)(C1CC1)CC2=O ZINC000587469591 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C(=C\N(C)C)C(=O)OC)(C1CC1)CC2=O ZINC000587469593 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C(=C\N(C)C)C(=O)OC)(C1CC1)CC2=O ZINC000587469594 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccc(O[C@H](C)C(N)=O)c1)CC2=O ZINC000587469643 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccc(O[C@@H](C)C(N)=O)c1)CC2=O ZINC000587469645 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccc(O[C@H](C)C(N)=O)c1)CC2=O ZINC000587469646 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccc(O[C@@H](C)C(N)=O)c1)CC2=O ZINC000587469648 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2c(F)ccc(F)c21 ZINC000587469679 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2c(F)ccc(F)c21 ZINC000587469689 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1cnccn1)CC2=O ZINC000587469918 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1cnccn1)CC2=O ZINC000587469919 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccccc1OCCC(N)=O)CC2=O ZINC000587470019 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccccc1OCCC(N)=O)CC2=O ZINC000587470021 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2c([N+](=O)[O-])cccc21 ZINC000587470213 FG Annotated Bother CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2c([N+](=O)[O-])cccc21 ZINC000587470214 FG Annotated Bother CCCc1c(O)ccc2c1O[C@](C)(/C(=C/N(C)C)C(=O)OCC)CC2=O ZINC000587470385 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(/C(=C/N(C)C)C(=O)OCC)CC2=O ZINC000587470387 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(/C(=C\N(C)C)C(=O)OCC)CC2=O ZINC000587470389 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(/C(=C\N(C)C)C(=O)OCC)CC2=O ZINC000587470391 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccncc1)(c1nccn1C)CC2=O ZINC000587470551 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccncc1)(c1nccn1C)CC2=O ZINC000587470552 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cc(C(=O)OC)n(C)c1)CC2=O ZINC000587470573 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cc(C(=O)OC)n(C)c1)CC2=O ZINC000587470574 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)N(C)c2cc(F)ccc21 ZINC000587470764 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)N(C)c2cc(F)ccc21 ZINC000587470765 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2cc(F)c(F)cc21 ZINC000587470770 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2cc(F)c(F)cc21 ZINC000587470771 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1nccn1C)(C1CCOCC1)CC2=O ZINC000587470825 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1nccn1C)(C1CCOCC1)CC2=O ZINC000587470826 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cccnc1)(c1nccn1C)CC2=O ZINC000587470899 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccnc1)(c1nccn1C)CC2=O ZINC000587470902 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C(\C)N(C)C)(c1cnccn1)CC2=O ZINC000587470928 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C(\C)N(C)C)(c1cnccn1)CC2=O ZINC000587470930 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CC(=O)Nc1cccnc1)CC2=O ZINC000587471005 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)Nc1cccnc1)CC2=O ZINC000587471013 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(OCC(=O)NC)cc1)CC2=O ZINC000587471076 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(OCC(=O)NC)cc1)CC2=O ZINC000587471078 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccc(OCC(=O)NC)c1)CC2=O ZINC000587471631 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccc(OCC(=O)NC)c1)CC2=O ZINC000587471632 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(C(=O)OC)c(C)n1C)CC2=O ZINC000587471799 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(C(=O)OC)c(C)n1C)CC2=O ZINC000587471800 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OCC)(c1cccnc1F)CC2=O ZINC000587472010 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OCC)(c1cccnc1F)CC2=O ZINC000587472011 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(C)n(-n3cnnc3)c1C)CC2=O ZINC000587472062 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(C)n(-n3cnnc3)c1C)CC2=O ZINC000587472064 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccccc1OCC(N)=O)CC2=O ZINC000587472202 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccccc1OCC(N)=O)CC2=O ZINC000587472203 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2ccc([N+](=O)[O-])cc21 ZINC000587472271 FG Annotated Bother CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2ccc([N+](=O)[O-])cc21 ZINC000587472272 FG Annotated Bother CCCc1c(O)ccc2c1O[C@H](c1cc([N+](=O)[O-])c(O)cc1O)CC2=O ZINC000587472335 FG Annotated Bother CCCc1c(O)ccc2c1O[C@@H](c1cc([N+](=O)[O-])c(O)cc1O)CC2=O ZINC000587472336 FG Annotated Bother CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)N(C)c2ccc(F)cc21 ZINC000587472420 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)N(C)c2ccc(F)cc21 ZINC000587472421 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(O)c(O)cc1[N+](=O)[O-])CC2=O ZINC000587472517 FG Annotated Clean CCCc1c(O)ccc2c1O[C@@H](c1cc(O)c(O)cc1[N+](=O)[O-])CC2=O ZINC000587472518 FG Annotated Clean CCCc1c(O)ccc2c1O[C@@](CO)(c1cccc([N+](=O)[O-])c1)CC2=O ZINC000587472578 FG Annotated Bother CCCc1c(O)ccc2c1O[C@](CO)(c1cccc([N+](=O)[O-])c1)CC2=O ZINC000587472579 FG Annotated Bother CCCc1c(O)ccc2c1O[C@@](CO)(c1ccc([N+](=O)[O-])cc1)CC2=O ZINC000587472586 FG Annotated Bother CCCc1c(O)ccc2c1O[C@](CO)(c1ccc([N+](=O)[O-])cc1)CC2=O ZINC000587472587 FG Annotated Bother CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2cc(F)cc(F)c21 ZINC000587472801 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2cc(F)cc(F)c21 ZINC000587472802 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2c1ccc(F)c2F ZINC000587473143 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2c1ccc(F)c2F ZINC000587473144 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(N)=COc2cc(OC)ccc21 ZINC000587473218 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(N)=COc2cc(OC)ccc21 ZINC000587473220 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(C=O)cc([N+](=O)[O-])c1O)CC2=O ZINC000587473335 FG Annotated Bother CCCc1c(O)ccc2c1O[C@@H](c1cc(C=O)cc([N+](=O)[O-])c1O)CC2=O ZINC000587473336 FG Annotated Bother CCCc1c(O)ccc2c1O[C@@H](c1cc(C(=O)OC)ccc1N)CC2=O ZINC000587473432 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(C(=O)OC)ccc1N)CC2=O ZINC000587473433 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(Cn1nc(C)c([N+](=O)[O-])c1C)CC2=O ZINC000587473512 FG Annotated Bother CCCc1c(O)ccc2c1O[C@@](C)(Cn1nc(C)c([N+](=O)[O-])c1C)CC2=O ZINC000587473513 FG Annotated Bother CCCc1c(O)ccc2c1O[C@@]1(CC2=O)CC(C)(C)Cc2nc[nH]c(=N)c21 ZINC000587473518 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)CC(C)(C)Cc2nc[nH]c(=N)c21 ZINC000587473519 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccnc(N3CCOCC3)c1)CC2=O ZINC000587473864 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccnc(N3CCOCC3)c1)CC2=O ZINC000587473865 FG Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCN(C3CCN(C)CC3)CC1)CC2=O ZINC000587473965 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccnc1N1CCOCC1)CC2=O ZINC000587473968 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccnc1N1CCOCC1)CC2=O ZINC000587473969 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C\N(C)C)(c1cnn(CC)c1)CC2=O ZINC000587474120 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1cnn(CC)c1)CC2=O ZINC000587474121 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C\N(C)C)(c1cnn(CC)c1)CC2=O ZINC000587474122 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1cnn(CC)c1)CC2=O ZINC000587474123 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1c(C)nn(CC(=O)O)c1C)CC2=O ZINC000587474138 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1c(C)nn(CC(=O)O)c1C)CC2=O ZINC000587474139 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(CN3CCOCC3)o1)CC2=O ZINC000587474140 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(CN3CCOCC3)o1)CC2=O ZINC000587474142 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)O)(c1cnn(C(C)(C)C)c1)CC2=O ZINC000587474167 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)O)(c1cnn(C(C)(C)C)c1)CC2=O ZINC000587474173 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cnc(N3CCCC3)nc1)CC2=O ZINC000587474347 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cnc(N3CCCC3)nc1)CC2=O ZINC000587474350 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cnc(-c3cnn(C)c3)nc1)CC2=O ZINC000587474359 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cnc(-c3cnn(C)c3)nc1)CC2=O ZINC000587474473 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccc(N3CCOCC3)n1)CC2=O ZINC000587474614 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccc(N3CCOCC3)n1)CC2=O ZINC000587474615 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C\N(C)C)(c1cnn(C)c1)CC2=O ZINC000587474706 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C\N(C)C)(c1cnn(C)c1)CC2=O ZINC000587474707 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1cnn(C)c1)CC2=O ZINC000587474708 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1cnn(C)c1)CC2=O ZINC000587474709 FG Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCC(N3CCOCC3)CC1)CC2=O ZINC000587474731 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(N3CCOCC3)nc1)CC2=O ZINC000587474774 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(N3CCOCC3)nc1)CC2=O ZINC000587474776 FG Annotated Anodyne C=CCOC(=O)N1CCC2(CC1)CC(=O)c1ccc(O)c(CCC)c1O2 ZINC000587474798 FG Annotated Mild CCCc1c(O)ccc2c1O[C@@](/C=C\N(C)C)(c1ccnn1C)CC2=O ZINC000587474855 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1ccnn1C)CC2=O ZINC000587474856 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1ccnn1C)CC2=O ZINC000587474858 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C\N(C)C)(c1ccnn1C)CC2=O ZINC000587474860 FG Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCN(c3ncccn3)CC1)CC2=O ZINC000587474905 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(-n3cnnn3)cc1)CC2=O ZINC000587474928 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(-n3cnnn3)cc1)CC2=O ZINC000587474929 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C\N(C)C)(c1ccn(CC)n1)CC2=O ZINC000587475298 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C\N(C)C)(c1ccn(CC)n1)CC2=O ZINC000587475299 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1ccn(CC)n1)CC2=O ZINC000587475300 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1ccn(CC)n1)CC2=O ZINC000587475301 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C\N(C)C)(c1ccnn1CC)CC2=O ZINC000587475434 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C\N(C)C)(c1ccnn1CC)CC2=O ZINC000587475435 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1ccnn1CC)CC2=O ZINC000587475437 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1ccnn1CC)CC2=O ZINC000587475439 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(N3CCN(C)CC3)o1)CC2=O ZINC000587475543 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(N3CCN(C)CC3)o1)CC2=O ZINC000587475544 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccccc1[C@H](O)C(=O)O)CC2=O ZINC000587475846 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccccc1[C@@H](O)C(=O)O)CC2=O ZINC000587475850 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccccc1[C@H](O)C(=O)O)CC2=O ZINC000587475852 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccccc1[C@@H](O)C(=O)O)CC2=O ZINC000587475854 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccccc1N1CCNCC1)CC2=O ZINC000587476050 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccccc1N1CCNCC1)CC2=O ZINC000587476051 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C\N(C)C)(c1cnn(C)c1C)CC2=O ZINC000587476176 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1cnn(C)c1C)CC2=O ZINC000587476181 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C\N(C)C)(c1cnn(C)c1C)CC2=O ZINC000587476182 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1cnn(C)c1C)CC2=O ZINC000587476183 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC#N)(c1c(C)nn(C)c1C)CC2=O ZINC000587476188 FG Annotated Mild CCCc1c(O)ccc2c1O[C@@](CC#N)(c1c(C)nn(C)c1C)CC2=O ZINC000587476189 FG Annotated Mild CCCc1c(O)ccc2c1O[C@@H](c1ccc(N3CCOCC3)o1)CC2=O ZINC000587476404 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(N3CCOCC3)o1)CC2=O ZINC000587476406 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c[nH]nc1-c1cnn(C)c1)CC2=O ZINC000587476516 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c[nH]nc1-c1cnn(C)c1)CC2=O ZINC000587476521 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C\N(C)C)(c1cn(C)nc1C)CC2=O ZINC000587477124 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1cn(C)nc1C)CC2=O ZINC000587477125 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](Cc1ccc(O)cc1)(C(=O)O)CC2=O ZINC000587477348 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](Cc1ccc(O)cc1)(C(=O)O)CC2=O ZINC000587477351 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCN(Cc3ccccc3)C1=O)CC2=O ZINC000587477395 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCN(Cc3ccccc3)C1=O)CC2=O ZINC000587477400 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)O)(c1ccccc1OC)CC2=O ZINC000587477625 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)O)(c1ccccc1OC)CC2=O ZINC000587477628 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C\N(C)C)(c1cn(C)nc1C)CC2=O ZINC000587477758 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1cn(C)nc1C)CC2=O ZINC000587477759 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C\N(C)C)(c1ccn(C)n1)CC2=O ZINC000587477790 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1ccn(C)n1)CC2=O ZINC000587477792 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1ccn(C)n1)CC2=O ZINC000587477793 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C\N(C)C)(c1ccn(C)n1)CC2=O ZINC000587477794 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cnn(-c3cnccn3)c1)CC2=O ZINC000587477926 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cnn(-c3cnccn3)c1)CC2=O ZINC000587477927 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2ccc(OC)cc21 ZINC000587478318 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2ccc(OC)cc21 ZINC000587478323 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccnn1-c1ncccn1)CC2=O ZINC000587478367 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccnn1-c1ncccn1)CC2=O ZINC000587478371 FG Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCN(C(=O)C3CCC3)CC1)CC2=O ZINC000587478374 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2c(C)cc(OC)cc21 ZINC000587478498 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2c(C)cc(OC)cc21 ZINC000587478538 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2cccc(OC)c21 ZINC000587478595 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2cccc(OC)c21 ZINC000587478614 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCNc3nc(OC)ccc31)CC2=O ZINC000587478621 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCNc3nc(OC)ccc31)CC2=O ZINC000587478639 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCOC)(CC(=O)OCC)CC2=O ZINC000587478686 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCOC)(CC(=O)OCC)CC2=O ZINC000587478689 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(C[C@H](C(C)=O)C(=O)OCC)CC2=O ZINC000587478800 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(C[C@@H](C(C)=O)C(=O)OCC)CC2=O ZINC000587478813 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(C[C@H](C(C)=O)C(=O)OCC)CC2=O ZINC000587478815 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(C[C@@H](C(C)=O)C(=O)OCC)CC2=O ZINC000587478817 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](Cc1ccccc1OC)(C(=O)O)CC2=O ZINC000587478896 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](Cc1ccccc1OC)(C(=O)O)CC2=O ZINC000587478898 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cn(C)nc1-c1cnn(C)c1)CC2=O ZINC000587478928 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cn(C)nc1-c1cnn(C)c1)CC2=O ZINC000587478931 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(OC)c(OC)nc1OC)CC2=O ZINC000587479088 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(OC)c(OC)nc1OC)CC2=O ZINC000587479090 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2c(OC)cccc21 ZINC000587479482 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2c(OC)cccc21 ZINC000587479483 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cccc(-n3cnnn3)c1)CC2=O ZINC000587479820 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cccc(-n3cnnn3)c1)CC2=O ZINC000587479825 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccc(O)c(OC)c1)([C@@H](C)O)CC2=O ZINC000587480232 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccc(O)c(OC)c1)([C@H](C)O)CC2=O ZINC000587480233 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccc(O)c(OC)c1)([C@H](C)O)CC2=O ZINC000587480234 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccc(O)c(OC)c1)([C@@H](C)O)CC2=O ZINC000587480237 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@H](CC(C)=O)C(=O)OCC)CC2=O ZINC000587480441 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@@H](CC(C)=O)C(=O)OCC)CC2=O ZINC000587480443 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)([C@H](CC(C)=O)C(=O)OCC)CC2=O ZINC000587480444 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)([C@@H](CC(C)=O)C(=O)OCC)CC2=O ZINC000587480446 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)[C@@H]2[C@H]3C[C@H]4[C@H]2C(=O)[C@@H]2[C@H]4[C@H]3[C@H]21 ZINC000587480462 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)[C@@H]2[C@H]3C[C@H]4[C@H]2C(=O)[C@@H]2[C@H]4[C@H]3[C@H]21 ZINC000587480470 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cnc3nc(C)nn3c1C)CC2=O ZINC000587481524 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cnc3nc(C)nn3c1C)CC2=O ZINC000587481526 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)CC(=O)c2ccccc21 ZINC000587481575 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)CC(=O)c2ccccc21 ZINC000587481578 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)O)(c1c[nH]c3ncccc13)CC2=O ZINC000587481770 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)O)(c1c[nH]c3ncccc13)CC2=O ZINC000587481773 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2c(OC)ccc(C)c21 ZINC000587481850 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2c(OC)ccc(C)c21 ZINC000587481851 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cn(Cc3cccnc3)nn1)CC2=O ZINC000587481960 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cn(Cc3cccnc3)nn1)CC2=O ZINC000587481978 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)C(=O)OCC)(C(C)C)CC2=O ZINC000587482526 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)C(=O)OCC)(C(C)C)CC2=O ZINC000587482529 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)N(C)c2ccc(C)cc21 ZINC000587482671 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)N(C)c2ccc(C)cc21 ZINC000587482680 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)C(=O)OC)(C(C)(C)C)CC2=O ZINC000587482684 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)C(=O)OC)(C(C)(C)C)CC2=O ZINC000587482686 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](Cc1cccc(OC)c1)(C(=O)O)CC2=O ZINC000587483109 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](Cc1cccc(OC)c1)(C(=O)O)CC2=O ZINC000587483111 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCC[C@H]1C(=O)C(=O)OCC)CC2=O ZINC000587483247 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCC[C@@H]1C(=O)C(=O)OCC)CC2=O ZINC000587483252 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCC[C@@H]1C(=O)C(=O)OCC)CC2=O ZINC000587483256 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCC[C@H]1C(=O)C(=O)OCC)CC2=O ZINC000587483264 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1c(C(=O)OC)noc1C)CC2=O ZINC000587483299 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1c(C(=O)OC)noc1C)CC2=O ZINC000587483305 FG Annotated Anodyne C#CCN1C(=O)[C@@]2(CC(=O)c3ccc(O)c(CCC)c3O2)c2ccccc21 ZINC000587483761 FG Annotated Mild C#CCN1C(=O)[C@]2(CC(=O)c3ccc(O)c(CCC)c3O2)c2ccccc21 ZINC000587483767 FG Annotated Mild CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2cc(OC)ccc21 ZINC000587483842 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2cc(OC)ccc21 ZINC000587483843 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)O)(c1ccc(OC)cc1)CC2=O ZINC000587484100 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)O)(c1ccc(OC)cc1)CC2=O ZINC000587484102 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(OC)c(O)c(O)c1OC)CC2=O ZINC000587484255 FG Annotated Clean CCCc1c(O)ccc2c1O[C@@H](c1cc(OC)c(O)c(O)c1OC)CC2=O ZINC000587484257 FG Annotated Clean CCCc1c(O)ccc2c1O[C@](C)(c1cc(C(=O)OCC)no1)CC2=O ZINC000587484475 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cc(C(=O)OCC)no1)CC2=O ZINC000587484477 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@H](CCOC)C(=O)OCC)CC2=O ZINC000587484542 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@@H](CCOC)C(=O)OCC)CC2=O ZINC000587484558 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)([C@H](CCOC)C(=O)OCC)CC2=O ZINC000587484560 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)([C@@H](CCOC)C(=O)OCC)CC2=O ZINC000587484561 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC(=O)Oc3cc(O)ccc31)CC2=O ZINC000587484772 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC(=O)Oc3cc(O)ccc31)CC2=O ZINC000587484773 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OC)(c1ccccn1)CC2=O ZINC000587484858 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OC)(c1ccccn1)CC2=O ZINC000587484870 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2cc(N(C)C)ccc21 ZINC000587484969 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2cc(N(C)C)ccc21 ZINC000587484971 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(C(=[N+]=[N-])P(=O)(OC)OC)CC2=O ZINC000587484979 FG Annotated Clean CCCc1c(O)ccc2c1O[C@@](C)(C(=[N+]=[N-])P(=O)(OC)OC)CC2=O ZINC000587484980 FG Annotated Clean CCCc1c(O)ccc2c1O[C@](COC)([C@H](CC)C(=O)OCC)CC2=O ZINC000587485311 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](COC)([C@@H](CC)C(=O)OCC)CC2=O ZINC000587485314 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](COC)([C@H](CC)C(=O)OCC)CC2=O ZINC000587485316 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](COC)([C@@H](CC)C(=O)OCC)CC2=O ZINC000587485319 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCC)(CC(=O)C(=O)OCC)CC2=O ZINC000587485438 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCC)(CC(=O)C(=O)OCC)CC2=O ZINC000587485441 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccc(-c3nn[nH]n3)c1)CC2=O ZINC000587485611 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OCC)(c1ccccn1)CC2=O ZINC000587485614 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OCC)(c1ccccn1)CC2=O ZINC000587485616 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccc(-c3nn[nH]n3)c1)CC2=O ZINC000587485620 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(Cc1ncccc1C(=O)O)CC2=O ZINC000587485789 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(Cc1ncccc1C(=O)O)CC2=O ZINC000587485792 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CS(C)(=O)=O)(C(C)(C)C)CC2=O ZINC000587485882 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CS(C)(=O)=O)(C(C)(C)C)CC2=O ZINC000587485883 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)O)(c1ccc(O)cc1)CC2=O ZINC000587486001 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)O)(c1ccc(O)cc1)CC2=O ZINC000587486017 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cc3ccccc3o1)(C(O)O)CC2=O ZINC000587486155 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cc3ccccc3o1)(C(O)O)CC2=O ZINC000587486165 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)([C@@H]1CCCO1)CC2=O ZINC000587486326 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)([C@@H]1CCCO1)CC2=O ZINC000587486337 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)([C@H]1CCCO1)CC2=O ZINC000587486341 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)([C@H]1CCCO1)CC2=O ZINC000587486346 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OC)(c1cccnc1)CC2=O ZINC000587486502 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OC)(c1cccnc1)CC2=O ZINC000587486506 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)N(C)c2c(C)cccc21 ZINC000587486755 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)N(C)c2c(C)cccc21 ZINC000587486761 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](CN1C(=O)COc3ccccc31)CC2=O ZINC000587486851 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](CN1C(=O)COc3ccccc31)CC2=O ZINC000587486852 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1c(C)cc(C)cc1C)(C(O)O)CC2=O ZINC000587487451 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1c(C)cc(C)cc1C)(C(O)O)CC2=O ZINC000587487456 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](Cn1c(=O)oc3ccccc31)CC2=O ZINC000587487771 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](Cn1c(=O)oc3ccccc31)CC2=O ZINC000587487774 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(OC)nc(OC)c1OC)CC2=O ZINC000587487816 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(OC)nc(OC)c1OC)CC2=O ZINC000587487817 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)N2CCCc3cccc1c32 ZINC000587487929 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)N2CCCc3cccc1c32 ZINC000587487931 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(-c3nn[nH]n3)cc1)CC2=O ZINC000587488160 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(-c3nn[nH]n3)cc1)CC2=O ZINC000587488164 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCC[C@H](S(C)(=O)=O)C1)CC2=O ZINC000587488189 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCC[C@@H](S(C)(=O)=O)C1)CC2=O ZINC000587488212 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCC[C@H](S(C)(=O)=O)C1)CC2=O ZINC000587488217 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCC[C@@H](S(C)(=O)=O)C1)CC2=O ZINC000587488220 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OCC)(c1cccnc1)CC2=O ZINC000587488286 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OCC)(c1cccnc1)CC2=O ZINC000587488289 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)[C@H]2[C@H]3C(=O)[C@@H]4[C@H]5[C@H]3C[C@H]2[C@H]5[C@H]41 ZINC000587488544 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)[C@H]2[C@@H]3[C@@H]4[C@H]5C[C@@H]3[C@@H]1[C@H]5C(=O)[C@H]42 ZINC000587488547 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)[C@@H]2[C@@H]3C(=O)[C@H]4[C@@H]5C[C@@H]([C@@H]2[C@H]53)[C@H]41 ZINC000587488549 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)[C@@H]2[C@H]3C[C@@H]4[C@H]5[C@H]3[C@@H]1[C@@H]5C(=O)[C@@H]42 ZINC000587488552 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cc(C(=O)O)c(O)nc1C)CC2=O ZINC000587488576 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cc(C(=O)O)c(O)nc1C)CC2=O ZINC000587488578 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCC(=O)O)(c1ccccn1)CC2=O ZINC000587488639 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCC(=O)O)(c1ccccn1)CC2=O ZINC000587488640 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OCC)(c1ncccc1C)CC2=O ZINC000587488677 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OCC)(c1ncccc1C)CC2=O ZINC000587488682 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCc3c1ccc(=O)n3C)CC2=O ZINC000587489288 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCc3c1ccc(=O)n3C)CC2=O ZINC000587489291 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cc(C(=O)OC)ccn1)CC2=O ZINC000587489325 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cc(C(=O)OC)ccn1)CC2=O ZINC000587489326 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccccc1S(C)(=O)=O)CC2=O ZINC000587489429 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccccc1S(C)(=O)=O)CC2=O ZINC000587489430 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccc(CC)cc1)(C(O)O)CC2=O ZINC000587489770 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccc(CC)cc1)(C(O)O)CC2=O ZINC000587489775 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)[C@H]2CC[C@@]1(C(=O)O)C2(C)C ZINC000587489783 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)[C@H]2CC[C@@]1(C(=O)O)C2(C)C ZINC000587489786 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCC[C@H]1S(C)(=O)=O)CC2=O ZINC000587489834 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCC[C@@H]1S(C)(=O)=O)CC2=O ZINC000587489836 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCC[C@H]1S(C)(=O)=O)CC2=O ZINC000587489979 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCC[C@@H]1S(C)(=O)=O)CC2=O ZINC000587489981 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OC)(c1ccncc1)CC2=O ZINC000587490043 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OC)(c1ccncc1)CC2=O ZINC000587490044 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)N(C(C)=O)c2ccccc21 ZINC000587490845 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)N(C(C)=O)c2ccccc21 ZINC000587490854 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)[C@@]2(C(=O)O)CC[C@H]1C2(C)C ZINC000587490911 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)[C@@]2(C(=O)O)CC[C@H]1C2(C)C ZINC000587490915 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2ccccc2C(=O)n2ccnc21 ZINC000587490920 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2ccccc2C(=O)n2ccnc21 ZINC000587490922 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CSCC(=O)OCC)CC2=O ZINC000587491162 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CSCC(=O)OCC)CC2=O ZINC000587491165 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1c(C)nc(O)nc1S)CC2=O ZINC000587492217 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1c(C)nc(O)nc1S)CC2=O ZINC000587492219 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cccnc1)(c1ccncn1)CC2=O ZINC000587492824 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccnc1)(c1ccncn1)CC2=O ZINC000587492827 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccs1)(c1c[nH][nH]c1=N)CC2=O ZINC000587492995 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cccs1)(c1c[nH][nH]c1=N)CC2=O ZINC000587492996 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cnc(SC)[nH]c1=NC)CC2=O ZINC000587493651 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cnc(SC)[nH]c1=NC)CC2=O ZINC000587493652 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cnc(N3CCOCC3)s1)CC2=O ZINC000587493871 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cnc(N3CCOCC3)s1)CC2=O ZINC000587493874 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cnc(SC)[nH]c1=N)CC2=O ZINC000587494372 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cnc(SC)[nH]c1=N)CC2=O ZINC000587494373 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)([C@H]1CCOC1)CC2=O ZINC000587494428 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)([C@H]1CCOC1)CC2=O ZINC000587494431 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)([C@@H]1CCOC1)CC2=O ZINC000587494434 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)([C@@H]1CCOC1)CC2=O ZINC000587494437 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCS(=O)(=O)c3ccccc31)CC2=O ZINC000587494750 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCS(=O)(=O)c3ccccc31)CC2=O ZINC000587494752 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1nc[nH]n1)(c1cccs1)CC2=O ZINC000587495340 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1nc[nH]n1)(c1cccs1)CC2=O ZINC000587495341 FG Annotated Anodyne CCOC(=O)C(=O)[C@H](Cl)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587495801 FG Annotated Reactive CCOC(=O)C(=O)[C@@H](Cl)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587495803 FG Annotated Reactive CCOC(=O)C(=O)[C@@H](Cl)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587495805 FG Annotated Reactive CCOC(=O)C(=O)[C@H](Cl)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587495807 FG Annotated Reactive Nc1ncc(Br)nc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587495971 FG Annotated Anodyne Nc1ncc(Br)nc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587495972 FG Annotated Anodyne Cn1cc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1C(N)=O ZINC000587496203 FG Annotated Reactive Cn1cc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1C(N)=O ZINC000587496205 FG Annotated Reactive CC(C)N1N=C[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@@H](Cl)C1=O ZINC000587496266 FG Annotated Reactive CC(C)N1N=C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@H](Cl)C1=O ZINC000587496267 FG Annotated Reactive CC(C)N1N=C[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@H](Cl)C1=O ZINC000587496268 FG Annotated Reactive CC(C)N1N=C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@@H](Cl)C1=O ZINC000587496269 FG Annotated Reactive CCCc1c(O)ccc2c1O[C@]1(CCSC[C@@H]1C(=O)OCC)CC2=O ZINC000587496698 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCSC[C@H]1C(=O)OCC)CC2=O ZINC000587496699 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCSC[C@@H]1C(=O)OCC)CC2=O ZINC000587496700 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCSC[C@H]1C(=O)OCC)CC2=O ZINC000587496701 FG Annotated Anodyne O=C1C[C@](c2ccc(Cl)cc2)(C(O)O)Oc2c1ccc1c2CCCC1 ZINC000587497341 FG Annotated Anodyne O=C1C[C@@](c2ccc(Cl)cc2)(C(O)O)Oc2c1ccc1c2CCCC1 ZINC000587497343 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1csc(N(C)C(C)=O)n1)CC2=O ZINC000587497528 FG Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1csc(N(C)C(C)=O)n1)CC2=O ZINC000587497529 FG Annotated Anodyne O=C1C[C@](Cn2cncn2)(C2(Cl)CC2)Oc2c1ccc1c2CCCC1 ZINC000587497802 FG Annotated Anodyne O=C1C[C@@](Cn2cncn2)(C2(Cl)CC2)Oc2c1ccc1c2CCCC1 ZINC000587497809 FG Annotated Anodyne NC(=O)c1coc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587498854 FG Annotated Reactive NC(=O)c1coc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587498856 FG Annotated Reactive COC(=O)[C@]1([C@@H](C)Br)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587498972 FG Annotated Reactive COC(=O)[C@@]1([C@H](C)Br)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587498973 FG Annotated Reactive COC(=O)[C@]1([C@H](C)Br)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587498974 FG Annotated Reactive COC(=O)[C@@]1([C@@H](C)Br)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587498975 FG Annotated Reactive CCCN1N=C[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@@H](Cl)C1=O ZINC000587499127 FG Annotated Reactive CCCN1N=C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@H](Cl)C1=O ZINC000587499146 FG Annotated Reactive CCCN1N=C[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@H](Cl)C1=O ZINC000587499148 FG Annotated Reactive CCCN1N=C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@@H](Cl)C1=O ZINC000587499149 FG Annotated Reactive O=C1C[C@](/C=C/N2CCOCC2)(CCl)Oc2c1ccc1c2CCCC1 ZINC000587499584 FG Annotated Reactive O=C1C[C@@](/C=C\N2CCOCC2)(CCl)Oc2c1ccc1c2CCCC1 ZINC000587499585 FG Annotated Reactive O=C1C[C@@](/C=C/N2CCOCC2)(CCl)Oc2c1ccc1c2CCCC1 ZINC000587499586 FG Annotated Reactive O=C1C[C@](/C=C\N2CCOCC2)(CCl)Oc2c1ccc1c2CCCC1 ZINC000587499588 FG Annotated Reactive CCOC(=O)[C@@]1(CBr)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587500133 FG Annotated Reactive CCOC(=O)[C@]1(CBr)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587500138 FG Annotated Reactive O=C1C[C@@]2(CCOC[C@@H]2Br)Oc2c1ccc1c2CCCC1 ZINC000587500506 FG Annotated Reactive O=C1C[C@@]2(CCOC[C@H]2Br)Oc2c1ccc1c2CCCC1 ZINC000587500508 FG Annotated Reactive O=C1C[C@]2(CCOC[C@@H]2Br)Oc2c1ccc1c2CCCC1 ZINC000587500509 FG Annotated Reactive O=C1C[C@]2(CCOC[C@H]2Br)Oc2c1ccc1c2CCCC1 ZINC000587500510 FG Annotated Reactive O=C1CC2(CCN(C(=O)C(F)(F)F)CC2)Oc2c1ccc1c2CCCC1 ZINC000587503012 FG Annotated Anodyne O=C1C[C@](c2cccc(Cl)c2)(C(O)O)Oc2c1ccc1c2CCCC1 ZINC000587504441 FG Annotated Anodyne O=C1C[C@@](c2cccc(Cl)c2)(C(O)O)Oc2c1ccc1c2CCCC1 ZINC000587504445 FG Annotated Anodyne CN(CCO)c1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587507088 FG Annotated Anodyne CN(CCO)c1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587507089 FG Annotated Anodyne NC(=O)COc1ccccc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587507093 FG Annotated Anodyne NC(=O)COc1ccccc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587507094 FG Annotated Anodyne O=C1C[C@](c2ccc(F)c(F)c2)(C(O)O)Oc2c1ccc1c2CCCC1 ZINC000587507688 FG Annotated Anodyne O=C1C[C@@](c2ccc(F)c(F)c2)(C(O)O)Oc2c1ccc1c2CCCC1 ZINC000587507727 FG Annotated Anodyne CCOC(=O)C(=O)C[C@]1(C(F)F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508245 FG Annotated Anodyne COC(C)(OC)[C@]1(/C=C/N(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508520 FG Annotated Anodyne COC(C)(OC)[C@@]1(/C=C/N(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508544 FG Annotated Anodyne COC(=O)/C(=C\N(C)C)[C@@]1(C2CC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508735 FG Annotated Anodyne COC(=O)/C(=C/N(C)C)[C@@]1(C2CC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508738 FG Annotated Anodyne COC(=O)/C(=C\N(C)C)[C@]1(C2CC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508741 FG Annotated Anodyne COC(=O)/C(=C/N(C)C)[C@]1(C2CC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508743 FG Annotated Anodyne C[C@]1(c2ccccc2OCC(N)=O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508933 FG Annotated Anodyne C[C@@]1(c2ccccc2OCC(N)=O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508934 FG Annotated Anodyne CCOC(=O)C(=O)C[C@@]1(C(F)F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508957 FG Annotated Anodyne Cc1ccnc(NC(=O)C[C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)n1 ZINC000587509418 FG Annotated Anodyne Cc1ccnc(NC(=O)C[C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)n1 ZINC000587509421 FG Annotated Anodyne O=C1C[C@H](CCCNC(=O)C2CCOCC2)Oc2c1ccc1c2CCCC1 ZINC000587509622 FG Annotated Anodyne O=C1C[C@@H](CCCNC(=O)C2CCOCC2)Oc2c1ccc1c2CCCC1 ZINC000587509626 FG Annotated Anodyne Cc1cc(=NC(=O)C[C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)[nH]o1 ZINC000587509633 FG Annotated Anodyne Cc1cc(=NC(=O)C[C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)[nH]o1 ZINC000587509645 FG Annotated Anodyne COC(=O)[C@@H](Cl)[C@]1(C(F)F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509915 FG Annotated Reactive COC(=O)[C@@H](Cl)[C@@]1(C(F)F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509916 FG Annotated Reactive COC(=O)[C@H](Cl)[C@@]1(C(F)F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509917 FG Annotated Reactive COC(=O)[C@H](Cl)[C@]1(C(F)F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509918 FG Annotated Reactive CNC(=O)COc1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587511202 FG Annotated Anodyne CNC(=O)COc1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587511204 FG Annotated Anodyne CCOC(=O)C[C@]1(c2nccn2C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511262 FG Annotated Anodyne C[C@@]1(CC(=O)Nc2ncccn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511282 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2nccn2C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511284 FG Annotated Anodyne C[C@]1(CC(=O)Nc2ncccn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511300 FG Annotated Anodyne NC(=O)COc1cccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587511413 FG Annotated Anodyne NC(=O)COc1cccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587511415 FG Annotated Anodyne C[C@@]1(c2ccc(O)c(C(N)=O)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511453 FG Annotated Anodyne C[C@]1(c2ccc(O)c(C(N)=O)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511456 FG Annotated Anodyne C[C@]1(c2ccc(OCC(N)=O)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511631 FG Annotated Anodyne C[C@@]1(c2ccc(OCC(N)=O)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511633 FG Annotated Anodyne Cc1cc([N+](=O)[O-])nn1C[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511726 FG Annotated Bother Cc1cc([N+](=O)[O-])nn1C[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511730 FG Annotated Bother O=C1C[C@@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1c([N+](=O)[O-])cccc12 ZINC000587512376 FG Annotated Bother O=C1C[C@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1c([N+](=O)[O-])cccc12 ZINC000587512377 FG Annotated Bother O=C1C[C@](CO)(c2ccc([N+](=O)[O-])cc2)Oc2c1ccc1c2CCCC1 ZINC000587512382 FG Annotated Bother O=C1C[C@@](CO)(c2ccc([N+](=O)[O-])cc2)Oc2c1ccc1c2CCCC1 ZINC000587512385 FG Annotated Bother NC(=O)COc1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587512563 FG Annotated Anodyne NC(=O)COc1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587512564 FG Annotated Anodyne CCOC(=O)CCN1CCC2(CC1)CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587512971 FG Annotated Anodyne CN1CCN(CC(C)(C)[C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)CC1 ZINC000587512975 FG Annotated Anodyne CN1CCN(CC(C)(C)[C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)CC1 ZINC000587512977 FG Annotated Anodyne CCOC(=O)C[C@@]1(CN2CCCC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513090 FG Annotated Anodyne CCOC(=O)C[C@]1(CN2CCCC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513092 FG Annotated Anodyne COC(=O)CCCN1CCC2(CC1)CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587513239 FG Annotated Anodyne O=C1C[C@@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc12 ZINC000587513466 FG Annotated Bother O=C1C[C@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc12 ZINC000587513467 FG Annotated Bother Cn1cc(-c2nn(C)cc2[C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587513533 FG Annotated Anodyne Cn1cc(-c2nn(C)cc2[C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587513534 FG Annotated Anodyne Cc1nn(CC(=O)O)c(C)c1[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513549 FG Annotated Anodyne Cc1nn(CC(=O)O)c(C)c1[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513550 FG Annotated Anodyne COC(=O)C[C@]1(c2ccccn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513681 FG Annotated Anodyne COC(=O)C[C@@]1(c2ccccn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513683 FG Annotated Anodyne CCOC(=O)/C(=C\N(C)C)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513780 FG Annotated Anodyne CCOC(=O)/C(=C/N(C)C)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513783 FG Annotated Anodyne CCOC(=O)/C(=C/N(C)C)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513786 FG Annotated Anodyne CCOC(=O)/C(=C\N(C)C)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513789 FG Annotated Anodyne CNC[C@]1(c2ccc(O)c(O)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514194 FG Annotated Clean CNC[C@@]1(c2ccc(O)c(O)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514196 FG Annotated Clean O=C1C[C@](CO)(c2cccc([N+](=O)[O-])c2)Oc2c1ccc1c2CCCC1 ZINC000587514448 FG Annotated Bother O=C1C[C@@](CO)(c2cccc([N+](=O)[O-])c2)Oc2c1ccc1c2CCCC1 ZINC000587514449 FG Annotated Bother CC(=O)OCCn1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587514473 FG Annotated Anodyne CC(=O)OCCn1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587514474 FG Annotated Anodyne COC(=O)[C@@H](C)[C@]1(c2cnccn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514732 FG Annotated Anodyne COC(=O)[C@@H](C)[C@@]1(c2cnccn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514742 FG Annotated Anodyne COC(=O)[C@H](C)[C@@]1(c2cnccn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514743 FG Annotated Anodyne COC(=O)[C@H](C)[C@]1(c2cnccn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514744 FG Annotated Anodyne CCOC(=O)[C@@]1(c2cccnc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514854 FG Annotated Anodyne CCOC(=O)[C@]1(c2cccnc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514856 FG Annotated Anodyne CCOC(=O)c1nn(C)cc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515031 FG Annotated Anodyne CCOC(=O)c1nn(C)cc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515032 FG Annotated Anodyne CCOC(=O)C[C@]1(c2cncn2C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515055 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2cncn2C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515056 FG Annotated Anodyne CN1CCC(N2CCC3(CC2)CC(=O)c2ccc4c(c2O3)CCCC4)CC1 ZINC000587515874 FG Annotated Anodyne CCOC(=O)[C@@]1(c2ccccn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515954 FG Annotated Anodyne CCOC(=O)[C@]1(c2ccccn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515956 FG Annotated Anodyne COC(=O)C[C@]1(c2ccncc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516093 FG Annotated Anodyne COC(=O)C[C@@]1(c2ccncc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516094 FG Annotated Anodyne Cn1cc([C@]2(CCC(=O)O)CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587516253 FG Annotated Anodyne Cn1cc([C@@]2(CCC(=O)O)CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587516254 FG Annotated Anodyne COC(=O)C[C@]1(c2cccnc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516447 FG Annotated Anodyne CC(C)(C)n1cc([C@]2(C(=O)O)CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587516493 FG Annotated Anodyne CC(C)(C)n1cc([C@@]2(C(=O)O)CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587516494 FG Annotated Anodyne COC(=O)C[C@@]1(c2cccnc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516497 FG Annotated Anodyne CCOC(=O)Cn1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587516541 FG Annotated Anodyne CCOC(=O)Cn1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587516542 FG Annotated Anodyne CN(C)/C=C\[C@@]1(c2ccn(C)n2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516748 FG Annotated Anodyne CN(C)/C=C\[C@]1(c2ccn(C)n2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516749 FG Annotated Anodyne CN(C)/C=C/[C@@]1(c2ccn(C)n2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516750 FG Annotated Anodyne CN(C)/C=C/[C@]1(c2ccn(C)n2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516751 FG Annotated Anodyne CCOC(=O)C[C@]1(c2cnccn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516771 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2cnccn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516772 FG Annotated Anodyne CCOC(=O)C[C@]1(c2ccn(C)n2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516988 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2ccn(C)n2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516989 FG Annotated Anodyne CCOC(=O)N1CC[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@@H](OC)C1 ZINC000587517256 FG Annotated Anodyne CCOC(=O)N1CC[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@H](OC)C1 ZINC000587517257 FG Annotated Anodyne CCOC(=O)N1CC[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@@H](OC)C1 ZINC000587517258 FG Annotated Anodyne CCOC(=O)N1CC[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@H](OC)C1 ZINC000587517259 FG Annotated Anodyne Cn1cc(-c2ncc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cn2)cn1 ZINC000587517356 FG Annotated Anodyne Cn1cc(-c2ncc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cn2)cn1 ZINC000587517357 FG Annotated Anodyne COC(=O)CCn1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587517378 FG Annotated Anodyne COC(=O)CCn1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587517379 FG Annotated Anodyne COCCN1C(=O)C[C@]2(C=C1C)CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587517398 FG Annotated Anodyne COCCN1C(=O)C[C@@]2(C=C1C)CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587517399 FG Annotated Anodyne CCOC(=O)C[C@]1(c2cnn(C)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517404 FG Annotated Anodyne CCOC(=O)C[C@@]1(c2cnn(C)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517405 FG Annotated Anodyne C[C@@]1(c2cccc(-n3cnnn3)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517505 FG Annotated Anodyne C[C@]1(c2cccc(-n3cnnn3)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517506 FG Annotated Anodyne CCOC(=O)[C@@]1(c2cnn(CC)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517515 FG Annotated Anodyne CCOC(=O)[C@]1(c2cnn(CC)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517516 FG Annotated Anodyne CN(C)/C=C\[C@@]1(c2ccnn2C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517552 FG Annotated Anodyne CN(C)/C=C\[C@]1(c2ccnn2C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517553 FG Annotated Anodyne CN(C)/C=C/[C@@]1(c2ccnn2C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517554 FG Annotated Anodyne CN(C)/C=C/[C@]1(c2ccnn2C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517555 FG Annotated Anodyne O=C1C[C@@H](c2cn(Cc3cccnc3)nn2)Oc2c1ccc1c2CCCC1 ZINC000587517610 FG Annotated Anodyne O=C1C[C@H](c2cn(Cc3cccnc3)nn2)Oc2c1ccc1c2CCCC1 ZINC000587517611 FG Annotated Anodyne CN(C)/C=C\[C@]1(c2cnn(C)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517887 FG Annotated Anodyne CN(C)/C=C/[C@]1(c2cnn(C)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517888 FG Annotated Anodyne CN(C)/C=C\[C@@]1(c2cnn(C)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517889 FG Annotated Anodyne CN(C)/C=C/[C@@]1(c2cnn(C)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517890 FG Annotated Anodyne C[C@@]1(c2ccc(-n3cnnn3)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517934 FG Annotated Anodyne C[C@]1(c2ccc(-n3cnnn3)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517935 FG Annotated Anodyne O=C1C[C@@H](CN2C(=O)c3ccccc3C2=O)Oc2c1ccc1c2CCCC1 ZINC000587518013 FG Annotated Anodyne O=C1C[C@H](CN2C(=O)c3ccccc3C2=O)Oc2c1ccc1c2CCCC1 ZINC000587518014 FG Annotated Anodyne CCOC(=O)[C@@H]1CN(CC)CC[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587518039 FG Annotated Anodyne CCOC(=O)[C@H]1CN(CC)CC[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587518040 FG Annotated Anodyne CCOC(=O)[C@@H]1CN(CC)CC[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587518041 FG Annotated Anodyne CCOC(=O)[C@H]1CN(CC)CC[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587518042 FG Annotated Anodyne C#CCN1C(=O)[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587518133 FG Annotated Mild C#CCN1C(=O)[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587518134 FG Annotated Mild CC(=O)N1C(=O)[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587518326 FG Annotated Anodyne CC(=O)N1C(=O)[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587518327 FG Annotated Anodyne CN1CCOc2cc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cnc21 ZINC000587518330 FG Annotated Anodyne CN1CCOc2cc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cnc21 ZINC000587518331 FG Annotated Anodyne O=C1C[C@@H](CN2C(=O)COc3ccccc32)Oc2c1ccc1c2CCCC1 ZINC000587518362 FG Annotated Anodyne O=C1C[C@H](CN2C(=O)COc3ccccc32)Oc2c1ccc1c2CCCC1 ZINC000587518363 FG Annotated Anodyne Cn1c(=O)n(C)c2cc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)ccc21 ZINC000587519300 FG Annotated Anodyne Cn1c(=O)n(C)c2cc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)ccc21 ZINC000587519301 FG Annotated Anodyne CCOC(=O)CC[C@@]1(C(=O)OCC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587520892 FG Annotated Anodyne CCOC(=O)CC[C@]1(C(=O)OCC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587520903 FG Annotated Anodyne O=C(O)c1cc2n(n1)CCC[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587521463 FG Annotated Anodyne O=C(O)c1cc2n(n1)CCC[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587521464 FG Annotated Anodyne CCOC(=O)[C@@H](CC(C)=O)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522056 FG Annotated Anodyne CCOC(=O)[C@H](CC(C)=O)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522080 FG Annotated Anodyne CCOC(=O)[C@@H](CC(C)=O)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522083 FG Annotated Anodyne CCOC(=O)[C@H](CC(C)=O)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522085 FG Annotated Anodyne CCOC(=O)[C@@](C)(OC(C)=O)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522210 FG Annotated Anodyne CCOC(=O)[C@@](C)(OC(C)=O)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522223 FG Annotated Anodyne CCOC(=O)[C@](C)(OC(C)=O)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522225 FG Annotated Anodyne CCOC(=O)[C@](C)(OC(C)=O)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522227 FG Annotated Anodyne CCOC(=O)C[C@@H](C(=O)OCC)[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522238 FG Annotated Anodyne CCOC(=O)C[C@H](C(=O)OCC)[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522245 FG Annotated Anodyne CCOC(=O)C[C@@H](C(=O)OCC)[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522246 FG Annotated Anodyne CCOC(=O)C[C@H](C(=O)OCC)[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522248 FG Annotated Anodyne CCOC(=O)C(=O)[C@@H]1CCC[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587522439 FG Annotated Anodyne CCOC(=O)C(=O)[C@H]1CCC[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587522441 FG Annotated Anodyne CCOC(=O)C(=O)[C@H]1CCC[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587522442 FG Annotated Anodyne CCOC(=O)C(=O)[C@@H]1CCC[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587522443 FG Annotated Anodyne CCOC(=O)CC[C@@]1(CCC(=O)O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522841 FG Annotated Anodyne CCOC(=O)CC[C@]1(CCC(=O)O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522842 FG Annotated Anodyne O=C(O)c1ccc2c(c1)NC(=O)[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522989 FG Annotated Anodyne O=C(O)c1ccc2c(c1)NC(=O)[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522999 FG Annotated Anodyne CCOC(=O)C(C(=O)OCC)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587523039 FG Annotated Anodyne CCOC(=O)C(C(=O)OCC)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587523041 FG Annotated Anodyne CCOC(=O)C(=O)C[C@]1(C(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587523081 FG Annotated Anodyne CCOC(=O)C(=O)C[C@@]1(C(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587523082 FG Annotated Anodyne COC(=O)CC[C@@H](C(=O)OC)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525020 FG Annotated Anodyne COC(=O)CC[C@H](C(=O)OC)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525022 FG Annotated Anodyne COC(=O)CC[C@H](C(=O)OC)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525023 FG Annotated Anodyne COC(=O)CC[C@@H](C(=O)OC)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525025 FG Annotated Anodyne CN(C)c1ccc2c(c1)NC(=O)[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525637 FG Annotated Anodyne CN(C)c1ccc2c(c1)NC(=O)[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525647 FG Annotated Anodyne CCOC(=O)CC1(CC(=O)OCC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525750 FG Annotated Anodyne CCOC(=O)[C@H](C[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3)C(C)=O ZINC000587526213 FG Annotated Anodyne CCOC(=O)[C@@H](C[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3)C(C)=O ZINC000587526214 FG Annotated Anodyne CCOC(=O)[C@H](C[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3)C(C)=O ZINC000587526219 FG Annotated Anodyne CCOC(=O)[C@@H](C[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3)C(C)=O ZINC000587526220 FG Annotated Anodyne COC(=O)C(=O)C[C@]1(C(C)(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587526222 FG Annotated Anodyne COC(=O)C(=O)C[C@@]1(C(C)(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587526224 FG Annotated Anodyne O=C1C[C@@](C(=O)O)(c2c[nH]c3ncccc23)Oc2c1ccc1c2CCCC1 ZINC000587526334 FG Annotated Anodyne O=C1C[C@](C(=O)O)(c2c[nH]c3ncccc23)Oc2c1ccc1c2CCCC1 ZINC000587526350 FG Annotated Anodyne CCOC(=O)[C@@H](C)[C@]1(C(=O)OCC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587526459 FG Annotated Anodyne CCOC(=O)[C@@H](C)[C@@]1(C(=O)OCC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587526460 FG Annotated Anodyne CCOC(=O)[C@H](C)[C@@]1(C(=O)OCC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587526462 FG Annotated Anodyne CCOC(=O)[C@H](C)[C@]1(C(=O)OCC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587526464 FG Annotated Anodyne CCOC(=O)C(=O)C[C@]1(C2CC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587526733 FG Annotated Anodyne CCOC(=O)C(=O)C[C@@]1(C2CC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587526734 FG Annotated Anodyne O=C(O)c1cccc2c1NC(=O)[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587526881 FG Annotated Anodyne O=C(O)c1cccc2c1NC(=O)[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587526883 FG Annotated Anodyne O=C(O)c1ccc2c(c1)[C@@]1(CC(=O)c3ccc4c(c3O1)CCCC4)C(=O)N2 ZINC000587527255 FG Annotated Anodyne O=C(O)c1ccc2c(c1)[C@]1(CC(=O)c3ccc4c(c3O1)CCCC4)C(=O)N2 ZINC000587527258 FG Annotated Anodyne CC1(C)[C@H]2CC[C@@]1(C(=O)O)C(=O)[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587528653 FG Annotated Anodyne CC1(C)[C@H]2CC[C@@]1(C(=O)O)C(=O)[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587528654 FG Annotated Anodyne O=C(O)C(=O)C[C@@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587528844 FG Annotated Anodyne O=C(O)C(=O)C[C@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587528847 FG Annotated Anodyne CCc1ccc([C@@]2(C(O)O)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587528893 FG Annotated Anodyne CCc1ccc([C@]2(C(O)O)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587528896 FG Annotated Anodyne COC(=O)CC1(O)CCC2(CC1)CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587529174 FG Annotated Anodyne C[C@@H]1C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)C[C@@H](C(=O)O)[C@@H]1C(=O)O ZINC000587529248 FG Annotated Anodyne C[C@@H]1C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)C[C@@H](C(=O)O)[C@H]1C(=O)O ZINC000587529249 FG Annotated Anodyne C[C@@H]1C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)C[C@H](C(=O)O)[C@@H]1C(=O)O ZINC000587529250 FG Annotated Anodyne C[C@@H]1C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)C[C@H](C(=O)O)[C@H]1C(=O)O ZINC000587529251 FG Annotated Anodyne O=C1C[C@]2(Oc3c1ccc1c3CCCC1)[C@H]1[C@H]3C[C@@H]4[C@H]1[C@]1(C(=O)O)[C@@H]2[C@H]3[C@@H]41 ZINC000587529877 FG Annotated Anodyne O=C1C[C@]2(Oc3c1ccc1c3CCCC1)[C@H]1[C@H]3C[C@@H]4[C@H]1[C@@]1(C(=O)O)[C@@H]2[C@H]3[C@@H]41 ZINC000587529878 FG Annotated Anodyne O=C1C[C@]2(Oc3c1ccc1c3CCCC1)[C@H]1[C@H]3C[C@@H]4[C@@H]1[C@]1(C(=O)O)[C@@H]2[C@H]3[C@@H]41 ZINC000587529879 FG Annotated Anodyne O=C1C[C@]2(Oc3c1ccc1c3CCCC1)[C@H]1[C@H]3C[C@@H]4[C@@H]1[C@@]1(C(=O)O)[C@@H]2[C@H]3[C@@H]41 ZINC000587529880 FG Annotated Anodyne CC(C)(C)[C@@]1(CS(C)(=O)=O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587529925 FG Annotated Anodyne CC(C)(C)[C@]1(CS(C)(=O)=O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587529931 FG Annotated Anodyne CC1(C)[C@H]2CC[C@@]1(C(=O)O)[C@]1(CC(=O)c3ccc4c(c3O1)CCCC4)C2=O ZINC000587530359 FG Annotated Anodyne CC1(C)[C@H]2CC[C@@]1(C(=O)O)[C@@]1(CC(=O)c3ccc4c(c3O1)CCCC4)C2=O ZINC000587530360 FG Annotated Anodyne CCOC(=O)C[C@@]1([C@@H]2CCCO2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530412 FG Annotated Anodyne CCOC(=O)C[C@]1([C@H]2CCCO2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530414 FG Annotated Anodyne CCOC(=O)C[C@]1([C@@H]2CCCO2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530416 FG Annotated Anodyne CCOC(=O)C[C@@]1([C@H]2CCCO2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530417 FG Annotated Anodyne C[C@@]1(c2ccc(S(N)(=O)=O)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530658 FG Annotated Anodyne C[C@]1(c2ccc(S(N)(=O)=O)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530659 FG Annotated Anodyne O=C1C[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccc(O)cc2O1 ZINC000587530776 FG Annotated Anodyne O=C1C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccc(O)cc2O1 ZINC000587530779 FG Annotated Anodyne CS(=O)(=O)C[C@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530847 FG Annotated Anodyne CS(=O)(=O)C[C@@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530850 FG Annotated Anodyne O=C(O)c1ccccc1[C@]1(C(=O)O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530959 FG Annotated Anodyne O=C(O)c1ccccc1[C@@]1(C(=O)O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530960 FG Annotated Anodyne O=C1C[C@@]2(CS(=O)(=O)Oc3ccccc32)Oc2c1ccc1c2CCCC1 ZINC000587530993 FG Annotated Anodyne O=C1C[C@]2(CS(=O)(=O)Oc3ccccc32)Oc2c1ccc1c2CCCC1 ZINC000587530994 FG Annotated Anodyne C[C@@]1(c2cccc(S(N)(=O)=O)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587531227 FG Annotated Anodyne C[C@]1(c2cccc(S(N)(=O)=O)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587531228 FG Annotated Anodyne Cc1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cnc1S(C)(=O)=O ZINC000587531571 FG Annotated Anodyne Cc1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cnc1S(C)(=O)=O ZINC000587531578 FG Annotated Anodyne CNS(=O)(=O)c1cccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587531674 FG Annotated Anodyne CNS(=O)(=O)c1cccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587531676 FG Annotated Anodyne CN=c1[nH]c(SC)ncc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587532096 FG Annotated Anodyne CN=c1[nH]c(SC)ncc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587532097 FG Annotated Anodyne CSc1ncc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c(=N)[nH]1 ZINC000587532836 FG Annotated Anodyne CSc1ncc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c(=N)[nH]1 ZINC000587532837 FG Annotated Anodyne CS(=O)(=O)c1ccc(O)c([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587532942 FG Annotated Anodyne CS(=O)(=O)c1ccc(O)c([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587532947 FG Annotated Anodyne CNS(=O)(=O)c1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587533440 FG Annotated Anodyne CNS(=O)(=O)c1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587533441 FG Annotated Anodyne O=C1C[C@@](Cc2ccc(O)cc2)(C(=O)O)Oc2c1ccc1c2CCCC1 ZINC000587533643 FG Annotated Anodyne O=C1C[C@](Cc2ccc(O)cc2)(C(=O)O)Oc2c1ccc1c2CCCC1 ZINC000587533644 FG Annotated Anodyne O=C1C[C@@](c2cc3ccccc3o2)(C(O)O)Oc2c1ccc1c2CCCC1 ZINC000587533655 FG Annotated Anodyne O=C1C[C@](c2cc3ccccc3o2)(C(O)O)Oc2c1ccc1c2CCCC1 ZINC000587533659 FG Annotated Anodyne CS(=O)(=O)c1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587533752 FG Annotated Anodyne CS(=O)(=O)c1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587533757 FG Annotated Anodyne COP(=O)(OC)C(=[N+]=[N-])[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587533871 FG Annotated Clean COP(=O)(OC)C(=[N+]=[N-])[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587533874 FG Annotated Clean O=C1C[C@@](Cc2ccc(O)c(O)c2)(C(=O)O)Oc2c1ccc1c2CCCC1 ZINC000587534047 FG Annotated Clean O=C1C[C@](Cc2ccc(O)c(O)c2)(C(=O)O)Oc2c1ccc1c2CCCC1 ZINC000587534050 FG Annotated Clean CC1=C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)C(OCC(=O)O)=CO1 ZINC000587534471 FG Annotated Anodyne CC1=C[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)C(OCC(=O)O)=CO1 ZINC000587534473 FG Annotated Anodyne O=C1C[C@@]2(CS(=O)(=O)c3ccccc32)Oc2c1ccc1c2CCCC1 ZINC000587534494 FG Annotated Anodyne O=C1C[C@]2(CS(=O)(=O)c3ccccc32)Oc2c1ccc1c2CCCC1 ZINC000587534508 FG Annotated Anodyne CCOC(=O)C[C@]1([C@H]2CCOC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587534547 FG Annotated Anodyne CCOC(=O)C[C@@]1([C@@H]2CCOC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587534552 FG Annotated Anodyne CCOC(=O)C[C@]1([C@@H]2CCOC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587534556 FG Annotated Anodyne CCOC(=O)C[C@@]1([C@H]2CCOC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587534557 FG Annotated Anodyne O=C1C[C@@](CO)(c2ccc3c(c2)OCCO3)Oc2c1ccc1c2CCCC1 ZINC000587536193 FG Annotated Anodyne O=C1C[C@](CO)(c2ccc3c(c2)OCCO3)Oc2c1ccc1c2CCCC1 ZINC000587536194 FG Annotated Anodyne O=C1CC2(Oc3c1ccc1c3CCCC1)[C@H]1COC[C@H]2CC(C(=O)O)C1 ZINC000587536858 FG Annotated Anodyne C[C@]1([C@]2(Cl)CCOC2=O)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587541862 FG Annotated Anodyne C[C@]1([C@]2(Cl)CCOC2=O)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587541867 FG Annotated Anodyne C[C@]1([C@@]2(Cl)CCOC2=O)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587541868 FG Annotated Anodyne C[C@]1([C@@]2(Cl)CCOC2=O)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587541869 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(CCl)c1cocn1 ZINC000587542612 FG Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(CCl)c1cocn1 ZINC000587542615 FG Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(CCl)c1cocn1 ZINC000587542617 FG Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(CCl)c1cocn1 ZINC000587542618 FG Annotated Reactive Cn1cc([C@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587542724 FG Annotated Reactive Cn1cc([C@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587542733 FG Annotated Reactive Cn1cc([C@@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587542734 FG Annotated Reactive Cn1cc([C@@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587542735 FG Annotated Reactive Cn1ncc(Cl)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587548690 FG Annotated Anodyne Cn1ncc(Cl)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587548691 FG Annotated Anodyne Cn1ncc(Cl)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587548692 FG Annotated Anodyne Cn1ncc(Cl)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587548693 FG Annotated Anodyne Cn1cc(Cl)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587551561 FG Annotated Anodyne Cn1cc(Cl)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587551562 FG Annotated Anodyne Cn1cc(Cl)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587551563 FG Annotated Anodyne Cn1cc(Cl)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587551564 FG Annotated Anodyne Nc1ncc(Cl)nc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587551951 FG Annotated Anodyne Nc1ncc(Cl)nc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587551952 FG Annotated Anodyne Nc1ncc(Cl)nc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587551953 FG Annotated Anodyne Nc1ncc(Cl)nc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587551954 FG Annotated Anodyne Cn1c(Cl)cnc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587552458 FG Annotated Anodyne Cn1c(Cl)cnc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587552459 FG Annotated Anodyne Cn1c(Cl)cnc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587552460 FG Annotated Anodyne Cn1c(Cl)cnc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587552461 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1cccc(-c2ccc3c(O)nc(O)nc3n2)c1 ZINC000587552586 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccnn1CCF ZINC000587552737 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccnn1CCF ZINC000587552740 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccnn1CCF ZINC000587552741 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccnn1CCF ZINC000587552742 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1ccc2c(c1)Cc1cc3c(O)nc(O)nc3nc1-2 ZINC000587553142 FG Annotated Anodyne Cc1nc2oc3ccccc3c(=O)c2cc1-c1ccc2c(O)nc(O)nc2n1 ZINC000587553252 FG Annotated Bother CCOC(=O)[C@H](F)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587554490 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587554494 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587554497 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587554499 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1ccc(-c2ccc3c(O)nc(O)nc3n2)cc1 ZINC000587554555 FG Annotated Anodyne CC[C@@H](C)c1ccc(NC(=O)Cc2ccc3c(O)nc(O)nc3n2)cc1 ZINC000587554656 FG Annotated Anodyne CC[C@H](C)c1ccc(NC(=O)Cc2ccc3c(O)nc(O)nc3n2)cc1 ZINC000587554657 FG Annotated Anodyne C=C(C)COCCNc1ccc(-c2ccc3c(O)nc(O)nc3n2)cc1 ZINC000587555139 FG Annotated Mild Cc1[nH]c(C(=O)OC(C)(C)C)c(C)c1-c1ccc2c(O)nc(O)nc2n1 ZINC000587555456 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3c(-c4ccccc4)nn4ccccc34)nc2n1 ZINC000587555463 FG Annotated Anodyne CC[C@]1([C@H](F)C(=O)OC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587555744 FG Annotated Anodyne CC[C@]1([C@@H](F)C(=O)OC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587555745 FG Annotated Anodyne CC[C@]1([C@@H](F)C(=O)OC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587555746 FG Annotated Anodyne CC[C@]1([C@H](F)C(=O)OC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587555748 FG Annotated Anodyne O=[N+]([O-])c1cc(-c2ccc3c(O)nc(O)nc3n2)ccc1N1CCCCC1 ZINC000587555764 FG Annotated Bother C=CCn1c2ccccc2n2nc(C)c(-c3ccc4c(O)nc(O)nc4n3)c12 ZINC000587555872 FG Annotated Mild Cn1cc([C@]2(C(F)F)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587556040 FG Annotated Anodyne Cn1cc([C@@]2(C(F)F)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587556043 FG Annotated Anodyne Cn1cc([C@@]2(C(F)F)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587556053 FG Annotated Anodyne Cn1cc([C@]2(C(F)F)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587556057 FG Annotated Anodyne CC(C)(C)OC(=O)Nc1ccccc1-c1ccc2c(O)nc(O)nc2n1 ZINC000587556092 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@@]1(CC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587556133 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@]1(CC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587556144 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@@]1(CC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587556145 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@]1(CC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587556146 FG Annotated Anodyne Cc1cc(C=O)c(C)n1-c1cccc(-c2ccc3c(O)nc(O)nc3n2)c1 ZINC000587556507 FG Annotated Clean CC(C)(C)OC(=O)N1CCCCC[C@@H]1Cc1ccc2c(O)nc(O)nc2n1 ZINC000587556595 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCCCC[C@H]1Cc1ccc2c(O)nc(O)nc2n1 ZINC000587556604 FG Annotated Anodyne CC[C@@H](C(=O)O)n1cc(-c2ccc3c(O)nc(O)nc3n2)c2ccccc21 ZINC000587556644 FG Annotated Anodyne CC[C@H](C(=O)O)n1cc(-c2ccc3c(O)nc(O)nc3n2)c2ccccc21 ZINC000587556648 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3ccc(O)c(CN4CCCCCC4)c3)nc2n1 ZINC000587557972 FG Annotated Clean Cc1cccc(-n2ncc3c2CCc2cc4c(O)nc(O)nc4nc2-3)c1C ZINC000587558944 FG Annotated Anodyne COc1ccc(-c2ccc3c(O)nc(O)nc3n2)cc1CN1CCCCC1 ZINC000587559282 FG Annotated Anodyne Cc1cc2c(O)nc(O)nc2nc1[C@H]1CCCCN1C(=O)OC(C)(C)C ZINC000587559353 FG Annotated Anodyne Cc1cc2c(O)nc(O)nc2nc1[C@@H]1CCCCN1C(=O)OC(C)(C)C ZINC000587559357 FG Annotated Anodyne N=C1c2ccccc2CN1c1cccc(-c2ccc3c(O)nc(O)nc3n2)c1 ZINC000587559557 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3ccc(OCc4ccccc4)cc3O)nc2n1 ZINC000587559719 FG Annotated Anodyne CC(C)(C)c1ccc(-c2nc3nc(O)nc(O)c3cc2CCC(=O)O)cc1 ZINC000587560111 FG Annotated Anodyne Cc1cc(C)c(-c2nc3nc(O)nc(O)c3cc2CCC(=O)O)c(C)c1 ZINC000587560124 FG Annotated Anodyne Oc1ccc2c(c1)-c1nc3nc(O)nc(O)c3cc1C[C@H]2c1ccccc1 ZINC000587560275 FG Annotated Anodyne Oc1ccc2c(c1)-c1nc3nc(O)nc(O)c3cc1C[C@@H]2c1ccccc1 ZINC000587560276 FG Annotated Anodyne Oc1nc(O)c2cc(Cc3ccccc3)c(C3(O)CCCCC3)nc2n1 ZINC000587560435 FG Annotated Anodyne O=C(Oc1cccc2c1Cc1cc3c(O)nc(O)nc3nc1-2)c1ccccc1 ZINC000587560484 FG Annotated Anodyne CC(C)(C)c1ccc([C@@H]2CC(=O)Cc3nc4nc(O)nc(O)c4cc32)cc1 ZINC000587560917 FG Annotated Anodyne CC(C)(C)c1ccc([C@H]2CC(=O)Cc3nc4nc(O)nc(O)c4cc32)cc1 ZINC000587560918 FG Annotated Anodyne O=C(O)c1ccc(-c2ccccc2-c2ccc3c(O)nc(O)nc3n2)cc1 ZINC000587561061 FG Annotated Anodyne O=C(Oc1ccccc1-c1ccc2c(O)nc(O)nc2n1)c1ccccc1 ZINC000587561096 FG Annotated Anodyne CC(C)(C)c1ccc(-c2nc3nc(O)nc(O)c3cc2CC(=O)O)cc1 ZINC000587561445 FG Annotated Anodyne O=C(O)c1cccc(-c2cccc(-c3ccc4c(O)nc(O)nc4n3)c2)c1 ZINC000587561531 FG Annotated Anodyne CC(=O)[C@H](c1ccc2c(O)nc(O)nc2n1)C12CC3CC(CC(C3)C1)C2 ZINC000587561563 FG Annotated Anodyne CC(=O)[C@@H](c1ccc2c(O)nc(O)nc2n1)C12CC3CC(CC(C3)C1)C2 ZINC000587561564 FG Annotated Anodyne CC(C)(C1CCC(=O)CC1)[C@@H]1CCc2nc3nc(O)nc(O)c3cc2C1 ZINC000587561702 FG Annotated Anodyne CC(C)(C1CCC(=O)CC1)[C@H]1CCc2nc3nc(O)nc(O)c3cc2C1 ZINC000587561710 FG Annotated Anodyne CC(C)c1ccc(-c2nc3nc(O)nc(O)c3cc2CCC(=O)O)cc1 ZINC000587561740 FG Annotated Anodyne O=C(O)[C@@H]1CC[C@H](c2cc3c(O)nc(O)nc3nc2-c2ccccc2)C1 ZINC000587561969 FG Annotated Anodyne O=C(O)c1ccccc1-c1cccc(-c2ccc3c(O)nc(O)nc3n2)c1 ZINC000587561997 FG Annotated Anodyne COCC(=O)Cc1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587562642 FG Annotated Anodyne Cc1nc(-c2ccccc2)nc(S)c1-c1ccc2c(O)nc(O)nc2n1 ZINC000587562719 FG Annotated Anodyne COCC(=O)Cc1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587562840 FG Annotated Anodyne CCCCOc1cc2nc(CC(=O)COC)[nH]c2cc1Br ZINC000587562864 FG Annotated Anodyne CCc1cc2c(O)nc(O)nc2nc1-c1ccc2c(c1)nc(S)n2CC ZINC000587562899 FG Annotated Anodyne C#CCOc1ccc(-c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)cc1 ZINC000587562958 FG Annotated Mild O=c1oc2ccc3ccccc3c2cc1-c1ccc2c(O)nc(O)nc2n1 ZINC000587563059 FG Annotated Bother Cc1nc2sc(-c3ccc4c(O)nc(O)nc4n3)c(N)c2c(C)c1C ZINC000587563091 FG Annotated Anodyne COCC(=O)Cc1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587563113 FG Annotated Anodyne Cc1nc(-c2ccc(C)n2C)sc1-c1ccc2c(O)nc(O)nc2n1 ZINC000587563130 FG Annotated Anodyne Cc1nc(Cc2ccccc2)sc1-c1ccc2c(O)nc(O)nc2n1 ZINC000587563153 FG Annotated Anodyne Cc1[nH]c(-c2ccco2)nc(=S)c1-c1ccc2c(O)nc(O)nc2n1 ZINC000587563266 FG Annotated Anodyne CC(C)CCOc1cc2nc(COCC(=O)O)[nH]c2cc1Br ZINC000587563592 FG Annotated Anodyne COCC(=O)Cc1nc2cc(OCC(C)C)c(Br)cc2[nH]1 ZINC000587563630 FG Annotated Anodyne COCC(=O)Cc1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587563694 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3ccc(NC4=NCCCS4)cc3)nc2n1 ZINC000587564042 FG Annotated Anodyne CC[C@@H]1CN=C(Nc2ccc(-c3ccc4c(O)nc(O)nc4n3)cc2)S1 ZINC000587564100 FG Annotated Anodyne CC[C@H]1CN=C(Nc2ccc(-c3ccc4c(O)nc(O)nc4n3)cc2)S1 ZINC000587564102 FG Annotated Anodyne Oc1nc(O)c2ccc(-c3cnc(Nc4ccc(Cl)cn4)s3)nc2n1 ZINC000587564103 FG Annotated Anodyne O=C(O)Cc1cc2c(O)nc(O)nc2nc1-c1cc(Cl)sc1Cl ZINC000587564128 FG Annotated Anodyne COc1cc(C)ccc1OCc1nc2ccc(N3CCN(C)CC3)cc2[nH]1 ZINC000587564236 FG Annotated Anodyne Cc1cccc(OCc2nc3ccc(S(=O)(=O)N(C)C)cc3[nH]2)c1C ZINC000587564261 FG Annotated Anodyne Cc1cc(C)cc(OCc2nc3ccc(S(=O)(=O)N(C)C)cc3[nH]2)c1 ZINC000587564397 FG Annotated Anodyne Oc1nc(O)c2cc3c(nc2n1)-c1cc(Br)sc1CC3 ZINC000587564447 FG Annotated Anodyne COc1cc(C)ccc1OCc1nc2ccc(OCCN(C)C)cc2[nH]1 ZINC000587564468 FG Annotated Anodyne CCC(C)(C)c1ccc(OCc2nc3ccc(C(=O)NN)cc3[nH]2)cc1 ZINC000587564631 FG Annotated Reactive Cc1cccc(OCc2nc3cccc(S(=O)(=O)N(C)C)c3[nH]2)c1C ZINC000587564846 FG Annotated Anodyne Cc1cc(C)cc(OCc2nc3cccc(S(=O)(=O)N(C)C)c3[nH]2)c1 ZINC000587564924 FG Annotated Anodyne Cc1nc(-c2ccc(O)cc2)sc1-c1ccc2c(O)nc(O)nc2n1 ZINC000587564980 FG Annotated Anodyne CCC(C)(C)c1ccc(OCc2nc3cccc(S(N)(=O)=O)c3[nH]2)cc1 ZINC000587565411 FG Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc(COc3ccc(C)cc3)[nH]c2c1 ZINC000587565647 FG Annotated Anodyne COC(=O)c1ccc2nc(COc3cccc(OCC(C)C)c3)[nH]c2n1 ZINC000587565709 FG Annotated Anodyne COC(=O)c1cc2nc(COc3cccc(OCC(C)C)c3)[nH]c2cn1 ZINC000587565728 FG Annotated Anodyne Cc1ccc(OCc2nc3cc(I)cnc3[nH]2)cc1 ZINC000587565744 FG Annotated Anodyne CCC(C)(C)c1ccc(OCc2nc3ccc(S(N)(=O)=O)cc3[nH]2)cc1 ZINC000587565821 FG Annotated Anodyne COC(=O)c1ccnc2[nH]c(COc3cccc(OCC(C)C)c3)nc12 ZINC000587565850 FG Annotated Anodyne CC(C)COc1cccc(OCc2nc3ccc(-n4cnnn4)cc3[nH]2)c1 ZINC000587565891 FG Annotated Anodyne CCOC(=O)CCOCCCOCCc1nc2ccc(Cl)c(C)c2[nH]1 ZINC000587566229 FG Annotated Anodyne CC1=C(c2ccc3nc(CCOCc4ccccc4)[nH]c3c2)NNC(=O)C1 ZINC000587566255 FG Annotated Anodyne O=Cc1ccc(OCCc2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)cc1 ZINC000587566275 FG Annotated Anodyne CCOC(=O)CCOCCCOCCc1nc2cc(Cl)cc(F)c2[nH]1 ZINC000587566281 FG Annotated Anodyne CCOC(=O)CCOCCCOCCc1nc2cc(C)c(Cl)cc2[nH]1 ZINC000587566376 FG Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(CCOc3ccc(C=O)cc3)nc2c1 ZINC000587566378 FG Annotated Anodyne Cc1c(Br)cnc2[nH]c(CCOc3ccc(C=O)cc3)nc12 ZINC000587566452 FG Annotated Anodyne Cc1nc2[nH]c(CCOc3ccc(C=O)cc3)nc2cc1Br ZINC000587566498 FG Annotated Anodyne CCOC(=O)CCOCCCOCCc1nc2cc(Cl)cc(C)c2[nH]1 ZINC000587566507 FG Annotated Anodyne O=Cc1ccc(OCCc2nc3ccc(Br)c(O)c3[nH]2)cc1 ZINC000587566522 FG Annotated Anodyne CCOC(=O)CCOCCCOCCc1nc2cccc(Cl)c2[nH]1 ZINC000587566529 FG Annotated Anodyne O=Cc1ccc(OCCc2nc3cc(-n4cccn4)c(F)cc3[nH]2)cc1 ZINC000587566607 FG Annotated Anodyne O=Cc1ccc(OCCc2nc3c(F)cnc(Br)c3[nH]2)cc1 ZINC000587566639 FG Annotated Anodyne CCOC(=O)CCOCCCOCCc1nc2cc(Cl)c(F)cc2[nH]1 ZINC000587567134 FG Annotated Anodyne O=C(NC[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1)C1CCCC1 ZINC000587567801 FG Annotated Anodyne C[C@]1(c2ncc(F)cn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567803 FG Annotated Anodyne O=C(NC[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1)C1CCCC1 ZINC000587567808 FG Annotated Anodyne O=C(NC[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1)C1CCCC1 ZINC000587567810 FG Annotated Anodyne O=C(NC[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1)C1CCCC1 ZINC000587567811 FG Annotated Anodyne C[C@@]1(c2ncc(F)cn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567822 FG Annotated Anodyne C[C@@]1(c2ncc(F)cn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567823 FG Annotated Anodyne C[C@]1(c2ncc(F)cn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567824 FG Annotated Anodyne CCOC(=O)CCOCCCOCCc1nc2ccc3c(c2[nH]1)CCCC3 ZINC000587568012 FG Annotated Anodyne N#CC[C@]1([C@@H]2CCOC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587568318 FG Annotated Mild N#CC[C@]1([C@H]2CCOC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587568320 FG Annotated Mild N#CC[C@]1([C@H]2CCOC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587568322 FG Annotated Mild N#CC[C@]1([C@@H]2CCOC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587568324 FG Annotated Mild C=CCc1cccc2nc(CCOCCCOCCC(=O)OCC)[nH]c12 ZINC000587568485 FG Annotated Mild Cc1nn(C)c(F)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587568635 FG Annotated Anodyne Cc1nn(C)c(F)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587568637 FG Annotated Anodyne Cc1nn(C)c(F)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587568638 FG Annotated Anodyne Cc1nn(C)c(F)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587568639 FG Annotated Anodyne CCOC(=O)CCOCCCOCCc1nc2cnc3ccccc3c2[nH]1 ZINC000587568894 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(CO)c1ccc(F)cc1 ZINC000587568981 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(CO)c1ccc(F)cc1 ZINC000587568982 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(CO)c1ccc(F)cc1 ZINC000587568983 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(CO)c1ccc(F)cc1 ZINC000587568984 FG Annotated Anodyne O=C(NCCC[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1)C1CC1 ZINC000587569963 FG Annotated Anodyne O=C(NCCC[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1)C1CC1 ZINC000587569964 FG Annotated Anodyne O=C(NCCC[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1)C1CC1 ZINC000587569967 FG Annotated Anodyne O=C(NCCC[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1)C1CC1 ZINC000587569969 FG Annotated Anodyne CCn1ncc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1F ZINC000587570291 FG Annotated Anodyne CCn1ncc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1F ZINC000587570292 FG Annotated Anodyne CCn1ncc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1F ZINC000587570293 FG Annotated Anodyne CCn1ncc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1F ZINC000587570294 FG Annotated Anodyne N#CC[C@]1([C@@H]2CCCOC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587570613 FG Annotated Mild N#CC[C@]1([C@H]2CCCOC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587570614 FG Annotated Mild N#CC[C@]1([C@H]2CCCOC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587570615 FG Annotated Mild N#CC[C@]1([C@@H]2CCCOC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587570616 FG Annotated Mild CCOC(=O)CCOCCCOCCc1nc2ccc3ncccc3c2[nH]1 ZINC000587570742 FG Annotated Anodyne CC(C)(C)OC(=O)NC[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587570935 FG Annotated Anodyne CC(C)(C)OC(=O)NC[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587570947 FG Annotated Anodyne CC(C)(C)OC(=O)NC[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587570951 FG Annotated Anodyne CC(C)(C)OC(=O)NC[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587570953 FG Annotated Anodyne N#CC[C@]1(C2CCOCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587571234 FG Annotated Mild N#CC[C@@]1(C2CCOCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587571235 FG Annotated Mild N#CC[C@@]1(C2CCOCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587571236 FG Annotated Mild N#CC[C@]1(C2CCOCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587571237 FG Annotated Mild Nc1ncc(F)cc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572442 FG Annotated Anodyne Nc1ncc(F)cc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572446 FG Annotated Anodyne Nc1ncc(F)cc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572448 FG Annotated Anodyne Nc1ncc(F)cc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572449 FG Annotated Anodyne CC(C)NC(=O)[C@]1(C(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587573120 FG Annotated Anodyne CC(C)NC(=O)[C@]1(C(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587573125 FG Annotated Anodyne CC(C)NC(=O)[C@@]1(C(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587573126 FG Annotated Anodyne CC(C)NC(=O)[C@@]1(C(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587573127 FG Annotated Anodyne NC[C@]1(c2ccc(F)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587573342 FG Annotated Anodyne NC[C@@]1(c2ccc(F)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587573343 FG Annotated Anodyne NC[C@@]1(c2ccc(F)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587573345 FG Annotated Anodyne NC[C@]1(c2ccc(F)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587573347 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ncccc1[N+](=O)[O-] ZINC000587573350 FG Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ncccc1[N+](=O)[O-] ZINC000587573354 FG Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ncccc1[N+](=O)[O-] ZINC000587573356 FG Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ncccc1[N+](=O)[O-] ZINC000587573357 FG Annotated Bother CC(=O)NC(C)(C)C[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587574568 FG Annotated Anodyne CC(=O)NC(C)(C)C[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587574573 FG Annotated Anodyne CC(=O)NC(C)(C)C[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587574574 FG Annotated Anodyne CC(=O)NC(C)(C)C[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587574575 FG Annotated Anodyne CCN(CC)C(=O)C[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587574739 FG Annotated Anodyne CCN(CC)C(=O)C[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587574740 FG Annotated Anodyne CCN(CC)C(=O)C[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587574741 FG Annotated Anodyne CCN(CC)C(=O)C[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587574742 FG Annotated Anodyne CC[C@]1(c2cncn2C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587574904 FG Annotated Anodyne CC[C@@]1(c2cncn2C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587574905 FG Annotated Anodyne CC[C@@]1(c2cncn2C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587574907 FG Annotated Anodyne CC[C@]1(c2cncn2C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587574908 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccncc1[N+](=O)[O-] ZINC000587575652 FG Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccncc1[N+](=O)[O-] ZINC000587575655 FG Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccncc1[N+](=O)[O-] ZINC000587575656 FG Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccncc1[N+](=O)[O-] ZINC000587575658 FG Annotated Bother NC1=COc2ccccc2[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587575702 FG Annotated Anodyne NC1=COc2ccccc2[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587575703 FG Annotated Anodyne NC1=COc2ccccc2[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587575704 FG Annotated Anodyne NC1=COc2ccccc2[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587575705 FG Annotated Anodyne Cn1ccnc1[C@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587576179 FG Annotated Anodyne Cn1ccnc1[C@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587576181 FG Annotated Anodyne Cn1ccnc1[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587576182 FG Annotated Anodyne Cn1ccnc1[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587576184 FG Annotated Anodyne CC[C@]1(c2nccn2C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587576220 FG Annotated Anodyne CC[C@@]1(c2nccn2C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587576221 FG Annotated Anodyne CC[C@@]1(c2nccn2C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587576222 FG Annotated Anodyne CC[C@]1(c2nccn2C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587576223 FG Annotated Anodyne C[C@]1(c2ccc(N)c(N)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587576704 FG Annotated Anodyne C[C@@]1(c2ccc(N)c(N)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587576706 FG Annotated Anodyne Cc1nc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1C ZINC000587576708 FG Annotated Anodyne C[C@@]1(c2ccc(N)c(N)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587576709 FG Annotated Anodyne C[C@]1(c2ccc(N)c(N)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587576710 FG Annotated Anodyne Cc1nc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1C ZINC000587576712 FG Annotated Anodyne Cc1nc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1C ZINC000587576715 FG Annotated Anodyne Cc1nc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1C ZINC000587576718 FG Annotated Anodyne NC(=O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587577513 FG Annotated Anodyne NC(=O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587577520 FG Annotated Anodyne NC(=O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587577521 FG Annotated Anodyne NC(=O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587577523 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCC[C@@H]2[N+](=O)[O-] ZINC000587577674 FG Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCC[C@H]2[N+](=O)[O-] ZINC000587577675 FG Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCCC[C@H]2[N+](=O)[O-] ZINC000587577677 FG Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCCC[C@@H]2[N+](=O)[O-] ZINC000587577678 FG Annotated Bother Cn1cc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1C=O ZINC000587577828 FG Annotated Anodyne Cn1cc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1C=O ZINC000587577829 FG Annotated Anodyne Cn1cc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1C=O ZINC000587577830 FG Annotated Anodyne Cn1cc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1C=O ZINC000587577831 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc([N+](=O)[O-])cn1 ZINC000587577965 FG Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc([N+](=O)[O-])cn1 ZINC000587577966 FG Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc([N+](=O)[O-])cn1 ZINC000587577967 FG Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc([N+](=O)[O-])cn1 ZINC000587577968 FG Annotated Bother N=c1cc[nH]cc1[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587578100 FG Annotated Anodyne N=c1cc[nH]cc1[C@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587578104 FG Annotated Anodyne N=c1cc[nH]cc1[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587578105 FG Annotated Anodyne N=c1cc[nH]cc1[C@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587578107 FG Annotated Anodyne CCn1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587578671 FG Annotated Anodyne CCn1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587578672 FG Annotated Anodyne CCn1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587578673 FG Annotated Anodyne CCn1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587578674 FG Annotated Anodyne Cc1ccn(C[C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587579277 FG Annotated Anodyne Cc1ccn(C[C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587579278 FG Annotated Anodyne Cc1ccn(C[C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587579279 FG Annotated Anodyne Cc1ccn(C[C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587579280 FG Annotated Anodyne CC[C@]1(c2ccnn2C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587579281 FG Annotated Anodyne CC[C@@]1(c2ccnn2C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587579283 FG Annotated Anodyne CC[C@@]1(c2ccnn2C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587579285 FG Annotated Anodyne CC[C@]1(c2ccnn2C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587579287 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CC[C@@H](C[N+](=O)[O-])C2 ZINC000587579374 FG Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CC[C@@H](C[N+](=O)[O-])C2 ZINC000587579375 FG Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CC[C@H](C[N+](=O)[O-])C2 ZINC000587579376 FG Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CC[C@H](C[N+](=O)[O-])C2 ZINC000587579377 FG Annotated Bother O=CNC[C@@H]1CCCC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587579498 FG Annotated Anodyne O=CNC[C@@H]1CCCC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587579499 FG Annotated Anodyne O=CNC[C@@H]1CCCC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587579500 FG Annotated Anodyne O=CNC[C@@H]1CCCC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587579501 FG Annotated Anodyne CC(=O)NC1CCC2(CC1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587579502 FG Annotated Anodyne CC(=O)NC1CCC2(CC1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587579503 FG Annotated Anodyne Cc1cc(C)n(C[C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587579657 FG Annotated Anodyne Cc1cc(C)n(C[C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587579662 FG Annotated Anodyne Cc1cc(C)n(C[C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587579663 FG Annotated Anodyne Cc1cc(C)n(C[C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587579664 FG Annotated Anodyne Cc1c([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cnn1C ZINC000587579669 FG Annotated Anodyne Cc1c([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cnn1C ZINC000587579670 FG Annotated Anodyne Cc1c([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cnn1C ZINC000587579671 FG Annotated Anodyne Cc1c([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cnn1C ZINC000587579672 FG Annotated Anodyne Cc1nc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n(C)c1C ZINC000587579964 FG Annotated Anodyne Cc1nc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n(C)c1C ZINC000587579966 FG Annotated Anodyne Cc1nc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n(C)c1C ZINC000587579968 FG Annotated Anodyne Cc1nc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n(C)c1C ZINC000587579969 FG Annotated Anodyne Cc1cnn(C[C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587579982 FG Annotated Anodyne Cc1cnn(C[C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587579983 FG Annotated Anodyne Cc1cnn(C[C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587579984 FG Annotated Anodyne Cc1cnn(C[C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587579985 FG Annotated Anodyne CC(C)N1C[C@H](C)[C@@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587580054 FG Annotated Anodyne CC(C)N1C[C@H](C)[C@@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587580055 FG Annotated Anodyne CC(C)N1C[C@H](C)[C@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587580056 FG Annotated Anodyne CC(C)N1C[C@H](C)[C@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587580057 FG Annotated Anodyne Cc1nn(C)cc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587580121 FG Annotated Anodyne Cc1nn(C)cc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587580122 FG Annotated Anodyne Cc1nn(C)cc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587580123 FG Annotated Anodyne Cc1nn(C)cc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587580125 FG Annotated Anodyne Cn1cnc2cc([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cnc21 ZINC000587580136 FG Annotated Anodyne Cn1cnc2cc([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cnc21 ZINC000587580137 FG Annotated Anodyne C[C@H]1CN(C)[C@H](C)C[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587580301 FG Annotated Anodyne C[C@H]1CN(C)[C@H](C)C[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587580303 FG Annotated Anodyne C[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[C@H](C)CN1C ZINC000587580305 FG Annotated Anodyne C[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[C@H](C)CN1C ZINC000587580307 FG Annotated Anodyne Cn1cnc2cc([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cnc21 ZINC000587580322 FG Annotated Anodyne Cn1cnc2cc([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cnc21 ZINC000587580325 FG Annotated Anodyne Cn1cc(C[C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587580525 FG Annotated Anodyne Cn1cc(C[C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587580526 FG Annotated Anodyne Cn1cc(C[C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587580527 FG Annotated Anodyne Cn1cc(C[C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587580528 FG Annotated Anodyne NC(=O)c1cccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587580540 FG Annotated Anodyne NC(=O)c1cccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587580541 FG Annotated Anodyne NC(=O)c1cccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587580542 FG Annotated Anodyne NC(=O)c1cccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587580543 FG Annotated Anodyne C[C@@H]1CN(C2CC2)C[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587580732 FG Annotated Anodyne C[C@@H]1CN(C2CC2)C[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587580733 FG Annotated Anodyne C[C@@H]1CN(C2CC2)C[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587580735 FG Annotated Anodyne C[C@@H]1CN(C2CC2)C[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587580737 FG Annotated Anodyne CN1CCC(C[C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CC1 ZINC000587580851 FG Annotated Anodyne CN1CCC(C[C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CC1 ZINC000587580854 FG Annotated Anodyne CN1CCC(C[C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CC1 ZINC000587580855 FG Annotated Anodyne CN1CCC(C[C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CC1 ZINC000587580858 FG Annotated Anodyne CCN1CCC([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CC1 ZINC000587580869 FG Annotated Anodyne CCN1CCC([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CC1 ZINC000587580871 FG Annotated Anodyne CCN1CCC([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CC1 ZINC000587580874 FG Annotated Anodyne CCN1CCC([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CC1 ZINC000587580875 FG Annotated Anodyne CC(C)(C)n1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)nn1 ZINC000587580924 FG Annotated Anodyne CC(C)(C)n1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)nn1 ZINC000587580925 FG Annotated Anodyne CC(C)(C)n1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)nn1 ZINC000587580926 FG Annotated Anodyne CC(C)(C)n1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)nn1 ZINC000587580927 FG Annotated Anodyne NC(=O)c1ccccc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587580985 FG Annotated Anodyne NC(=O)c1ccccc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587580986 FG Annotated Anodyne NC(=O)c1ccccc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587580988 FG Annotated Anodyne NC(=O)c1ccccc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587580989 FG Annotated Anodyne C[C@H](Cc1ccnn1C)[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587581210 FG Annotated Anodyne C[C@H](Cc1ccnn1C)[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587581211 FG Annotated Anodyne C[C@H](Cc1ccnn1C)[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587581212 FG Annotated Anodyne C[C@H](Cc1ccnn1C)[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587581213 FG Annotated Anodyne CCN1CC[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[C@@H](C)C1 ZINC000587581400 FG Annotated Anodyne CCN1CC[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[C@H](C)C1 ZINC000587581401 FG Annotated Anodyne CCN1CC[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[C@H](C)C1 ZINC000587581403 FG Annotated Anodyne CCN1CC[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[C@@H](C)C1 ZINC000587581404 FG Annotated Anodyne C[C@]1(CCn2cccn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587581490 FG Annotated Anodyne C[C@@]1(CCn2cccn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587581491 FG Annotated Anodyne C[C@@]1(CCn2cccn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587581492 FG Annotated Anodyne C[C@]1(CCn2cccn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587581493 FG Annotated Anodyne CC(C)(n1cncn1)[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587581522 FG Annotated Anodyne CC(C)(n1cncn1)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587581523 FG Annotated Anodyne CC(C)(n1cncn1)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587581524 FG Annotated Anodyne CC(C)(n1cncn1)[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587581525 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC12CCN(C1CC1)CC2 ZINC000587581641 FG Annotated Anodyne CC[C@]1(c2c[nH]ccc2=N)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587581645 FG Annotated Anodyne CC[C@@]1(c2c[nH]ccc2=N)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587581646 FG Annotated Anodyne CC[C@@]1(c2c[nH]ccc2=N)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587581647 FG Annotated Anodyne CC[C@]1(c2c[nH]ccc2=N)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587581648 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC12CCN(C1CC1)CC2 ZINC000587581650 FG Annotated Anodyne Cn1ncc2c1CCC[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587581721 FG Annotated Anodyne Cn1ncc2c1CCC[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587581730 FG Annotated Anodyne Cn1ncc2c1CCC[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587581732 FG Annotated Anodyne Cn1ncc2c1CCC[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587581733 FG Annotated Anodyne COCn1ncc(C)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582058 FG Annotated Anodyne COCn1ncc(C)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582059 FG Annotated Anodyne COCn1ncc(C)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582060 FG Annotated Anodyne COCn1ncc(C)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582061 FG Annotated Anodyne CC(C)[C@@]1(Cn2cncn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582372 FG Annotated Anodyne CC(C)[C@]1(Cn2cncn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582373 FG Annotated Anodyne CC(C)[C@]1(Cn2cncn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582374 FG Annotated Anodyne CC(C)[C@@]1(Cn2cncn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582375 FG Annotated Anodyne CC[C@]1(c2cnn(C)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582444 FG Annotated Anodyne CC[C@@]1(c2cnn(C)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582445 FG Annotated Anodyne CC[C@@]1(c2cnn(C)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582446 FG Annotated Anodyne CC[C@]1(c2cnn(C)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582447 FG Annotated Anodyne Cn1nnc2cc([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)ccc21 ZINC000587582480 FG Annotated Anodyne Cn1nnc2cc([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)ccc21 ZINC000587582481 FG Annotated Anodyne Cn1nnc2cc([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)ccc21 ZINC000587582482 FG Annotated Anodyne Cn1nnc2cc([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)ccc21 ZINC000587582483 FG Annotated Anodyne CN1CCC[C@H]([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C1 ZINC000587582488 FG Annotated Anodyne CN1CCC[C@H]([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C1 ZINC000587582489 FG Annotated Anodyne CN1CCC[C@H]([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C1 ZINC000587582490 FG Annotated Anodyne CN1CCC[C@H]([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C1 ZINC000587582491 FG Annotated Anodyne Cc1ccnn1C[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582580 FG Annotated Anodyne Cc1ccnn1C[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582581 FG Annotated Anodyne Cc1ccnn1C[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582582 FG Annotated Anodyne Cc1ccnn1C[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582583 FG Annotated Anodyne CCN1C(=O)C[C@@]2(C=C1C)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587582698 FG Annotated Anodyne CCN1C(=O)C[C@]2(C=C1C)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587582699 FG Annotated Anodyne CCN1C(=O)C[C@]2(C=C1C)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587582700 FG Annotated Anodyne CCN1C(=O)C[C@@]2(C=C1C)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587582701 FG Annotated Anodyne CCc1nn(C)cc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582796 FG Annotated Anodyne CCc1nn(C)cc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582797 FG Annotated Anodyne CCc1nn(C)cc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582798 FG Annotated Anodyne CCc1nn(C)cc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582799 FG Annotated Anodyne C[C@@H]1C[C@@]2(CN1C1CC1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587582874 FG Annotated Anodyne C[C@@H]1C[C@]2(CN1C1CC1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587582875 FG Annotated Anodyne C[C@@H]1C[C@@]2(CN1C1CC1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587582876 FG Annotated Anodyne C[C@@H]1C[C@]2(CN1C1CC1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587582877 FG Annotated Anodyne C=CN1CC[C@H]([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C1=O ZINC000587582942 FG Annotated Anodyne C=CN1CC[C@H]([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C1=O ZINC000587582943 FG Annotated Anodyne C=CN1CC[C@H]([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C1=O ZINC000587582944 FG Annotated Anodyne C=CN1CC[C@H]([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C1=O ZINC000587582945 FG Annotated Anodyne COc1c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)nn1C ZINC000587582956 FG Annotated Anodyne COc1c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)nn1C ZINC000587582957 FG Annotated Anodyne COc1c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)nn1C ZINC000587582958 FG Annotated Anodyne COc1c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)nn1C ZINC000587582959 FG Annotated Anodyne C=CCN1CCC2(CC1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587583019 FG Annotated Mild C=CCN1CCC2(CC1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587583020 FG Annotated Mild Cc1cc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)nn1C ZINC000587583059 FG Annotated Anodyne Cc1cc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)nn1C ZINC000587583061 FG Annotated Anodyne Cc1cc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)nn1C ZINC000587583063 FG Annotated Anodyne Cc1cc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)nn1C ZINC000587583070 FG Annotated Anodyne Cc1nn(C)c(C)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587583176 FG Annotated Anodyne Cc1nn(C)c(C)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587583177 FG Annotated Anodyne Cc1nn(C)c(C)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587583178 FG Annotated Anodyne Cc1nn(C)c(C)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587583179 FG Annotated Anodyne CC(C)[C@]1(c2ncnn2C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587583211 FG Annotated Anodyne CC(C)[C@@]1(c2ncnn2C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587583216 FG Annotated Anodyne CC(C)[C@@]1(c2ncnn2C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587583217 FG Annotated Anodyne CC(C)[C@]1(c2ncnn2C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587583219 FG Annotated Anodyne CCn1nccc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587583221 FG Annotated Anodyne CCn1nccc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587583224 FG Annotated Anodyne CCn1nccc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587583225 FG Annotated Anodyne CCn1nccc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587583226 FG Annotated Anodyne Cn1cc2c(n1)CCC[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587583247 FG Annotated Anodyne Cn1cc2c(n1)CCC[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587583248 FG Annotated Anodyne Cn1cc2c(n1)CCC[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587583249 FG Annotated Anodyne Cn1cc2c(n1)CCC[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587583250 FG Annotated Anodyne CC[C@]1(c2ccn(C)n2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587583384 FG Annotated Anodyne CC[C@@]1(c2ccn(C)n2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587583385 FG Annotated Anodyne CC[C@@]1(c2ccn(C)n2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587583386 FG Annotated Anodyne CC[C@]1(c2ccn(C)n2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587583387 FG Annotated Anodyne CCn1cc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587584297 FG Annotated Anodyne CCn1cc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587584298 FG Annotated Anodyne CCn1cc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587584299 FG Annotated Anodyne CCn1cc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587584300 FG Annotated Anodyne Cc1cc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n(C)n1 ZINC000587584301 FG Annotated Anodyne Cc1cc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n(C)n1 ZINC000587584303 FG Annotated Anodyne Cc1cc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n(C)n1 ZINC000587584305 FG Annotated Anodyne Cc1cc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n(C)n1 ZINC000587584306 FG Annotated Anodyne CN1CCC([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CC1 ZINC000587584439 FG Annotated Anodyne CN1CCC([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CC1 ZINC000587584440 FG Annotated Anodyne CN1CCC([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CC1 ZINC000587584441 FG Annotated Anodyne CN1CCC([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CC1 ZINC000587584442 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccnc2nccnc12 ZINC000587584857 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1[C@H]1NC=Cn2cccc21 ZINC000587584858 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccnc2nccnc12 ZINC000587584859 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccnc2nccnc12 ZINC000587584861 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccnc2nccnc12 ZINC000587584862 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1[C@@H]1NC=Cn2cccc21 ZINC000587584868 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1[C@@H]1NC=Cn2cccc21 ZINC000587584871 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1[C@H]1NC=Cn2cccc21 ZINC000587584873 FG Annotated Anodyne COCc1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)no1 ZINC000587584933 FG Annotated Anodyne COCc1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)no1 ZINC000587584934 FG Annotated Anodyne COCc1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)no1 ZINC000587584935 FG Annotated Anodyne COCc1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)no1 ZINC000587584936 FG Annotated Anodyne CN1C(=O)[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c2ccccc21 ZINC000587585192 FG Annotated Anodyne CN1C(=O)[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c2ccccc21 ZINC000587585195 FG Annotated Anodyne CN1C(=O)[C@@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c2ccccc21 ZINC000587585199 FG Annotated Anodyne CN1C(=O)[C@@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c2ccccc21 ZINC000587585203 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccc2ncnn12 ZINC000587585314 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccc2ncnn12 ZINC000587585315 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccc2ncnn12 ZINC000587585316 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccc2ncnn12 ZINC000587585317 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnn2cccnc12 ZINC000587585727 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnn2cccnc12 ZINC000587585728 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnn2cccnc12 ZINC000587585729 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnn2cccnc12 ZINC000587585730 FG Annotated Anodyne COCc1ncc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587585931 FG Annotated Anodyne COCc1ncc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587585932 FG Annotated Anodyne COCc1ncc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587585933 FG Annotated Anodyne COCc1ncc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587585934 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCCc1ncncc12 ZINC000587585951 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCCc1ncncc12 ZINC000587585952 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCc1ncncc12 ZINC000587585953 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCCc1ncncc12 ZINC000587585954 FG Annotated Anodyne CN1[C@H]2CC[C@H]1[C@]1(CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587586114 FG Annotated Anodyne CN1[C@H]2CC[C@H]1[C@]1(CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587586116 FG Annotated Anodyne CN1[C@H]2CC[C@H]1[C@@]1(CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587586119 FG Annotated Anodyne CN1[C@H]2CC[C@H]1[C@@]1(CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587586121 FG Annotated Anodyne O=C(O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[nH]1 ZINC000587586445 FG Annotated Anodyne O=C(O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[nH]1 ZINC000587586447 FG Annotated Anodyne O=C(O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[nH]1 ZINC000587586449 FG Annotated Anodyne O=C(O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[nH]1 ZINC000587586450 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2ncnn2c1 ZINC000587586560 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc2ncnn2c1 ZINC000587586561 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc2ncnn2c1 ZINC000587586563 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2ncnn2c1 ZINC000587586564 FG Annotated Anodyne Cc1[nH]c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1C(=O)O ZINC000587587061 FG Annotated Anodyne Cc1[nH]c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1C(=O)O ZINC000587587064 FG Annotated Anodyne Cc1[nH]c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1C(=O)O ZINC000587587066 FG Annotated Anodyne Cc1[nH]c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1C(=O)O ZINC000587587068 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCOc1cccnc12 ZINC000587587254 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCOc1cccnc12 ZINC000587587259 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCOc1cccnc12 ZINC000587587260 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCOc1cccnc12 ZINC000587587261 FG Annotated Anodyne Cc1nc2cccc([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)n2n1 ZINC000587587971 FG Annotated Anodyne Cc1nc2cccc([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)n2n1 ZINC000587587973 FG Annotated Anodyne Cc1nc2cccc([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)n2n1 ZINC000587587975 FG Annotated Anodyne Cc1nc2cccc([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)n2n1 ZINC000587587977 FG Annotated Anodyne Cc1cc([C@@]2(CC#N)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)no1 ZINC000587587984 FG Annotated Mild Cc1cc([C@]2(CC#N)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)no1 ZINC000587587987 FG Annotated Mild Cc1cc([C@]2(CC#N)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)no1 ZINC000587587988 FG Annotated Mild Cc1cc([C@@]2(CC#N)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)no1 ZINC000587587990 FG Annotated Mild O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CC1CCN(CC1)C2 ZINC000587588080 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CC1CCN(CC1)C2 ZINC000587588083 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CC1CCN(CC1)C2 ZINC000587588086 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CC1CCN(CC1)C2 ZINC000587588089 FG Annotated Anodyne COC[C@]1(c2ccccn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587588121 FG Annotated Anodyne COC[C@@]1(c2ccccn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587588123 FG Annotated Anodyne COC[C@@]1(c2ccccn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587588125 FG Annotated Anodyne COC[C@]1(c2ccccn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587588128 FG Annotated Anodyne COC(=O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[nH]1 ZINC000587588147 FG Annotated Anodyne COC(=O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[nH]1 ZINC000587588153 FG Annotated Anodyne COC(=O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[nH]1 ZINC000587588154 FG Annotated Anodyne COC(=O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[nH]1 ZINC000587588155 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cn2cccnc2n1 ZINC000587588235 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cn2cccnc2n1 ZINC000587588236 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cn2cccnc2n1 ZINC000587588237 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cn2cccnc2n1 ZINC000587588238 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnc2ncccn12 ZINC000587588673 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnc2ncccn12 ZINC000587588675 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnc2ncccn12 ZINC000587588676 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnc2ncccn12 ZINC000587588677 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc2c(cn1)OCO2 ZINC000587588907 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc2c(cn1)OCO2 ZINC000587588908 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc2c(cn1)OCO2 ZINC000587588909 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc2c(cn1)OCO2 ZINC000587588910 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnc2[nH]cncc1-2 ZINC000587589453 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnc2[nH]cncc1-2 ZINC000587589454 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnc2[nH]cncc1-2 ZINC000587589455 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnc2[nH]cncc1-2 ZINC000587589456 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCN1CCC[C@H]1C2 ZINC000587589681 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCN1CCC[C@@H]1C2 ZINC000587589682 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCN1CCC[C@H]1C2 ZINC000587589683 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCN1CCC[C@@H]1C2 ZINC000587589684 FG Annotated Anodyne COC(=O)C[C@@H]1CCC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587589865 FG Annotated Anodyne COC(=O)C[C@@H]1CCC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587589866 FG Annotated Anodyne COC(=O)C[C@@H]1CCC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587589868 FG Annotated Anodyne COC(=O)C[C@@H]1CCC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587589869 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnc2cnccn12 ZINC000587589883 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnc2cnccn12 ZINC000587589884 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnc2cnccn12 ZINC000587589885 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnc2cnccn12 ZINC000587589886 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1nc2ccccn2n1 ZINC000587589907 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1nc2ccccn2n1 ZINC000587589908 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1nc2ccccn2n1 ZINC000587589909 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1nc2ccccn2n1 ZINC000587589910 FG Annotated Anodyne O=C1CC=Cn2c([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cnc21 ZINC000587589980 FG Annotated Anodyne O=C1CC=Cn2c([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cnc21 ZINC000587589991 FG Annotated Anodyne O=C1CC=Cn2c([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cnc21 ZINC000587589993 FG Annotated Anodyne O=C1CC=Cn2c([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cnc21 ZINC000587589995 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnc2[nH]ccnc1-2 ZINC000587590171 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnc2[nH]ccnc1-2 ZINC000587590172 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnc2[nH]ccnc1-2 ZINC000587590175 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnc2[nH]ccnc1-2 ZINC000587590177 FG Annotated Anodyne COC(=O)C[C@]1(C2CCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590339 FG Annotated Anodyne COC(=O)C[C@@]1(C2CCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590340 FG Annotated Anodyne COC(=O)C[C@@]1(C2CCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590341 FG Annotated Anodyne COC(=O)C[C@]1(C2CCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590342 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnn2ncccc12 ZINC000587590363 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnn2ncccc12 ZINC000587590364 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnn2ncccc12 ZINC000587590365 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnn2ncccc12 ZINC000587590366 FG Annotated Anodyne O=Cc1cnc2n1C=CC[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590375 FG Annotated Anodyne O=Cc1cnc2n1C=CC[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590376 FG Annotated Anodyne O=Cc1cnc2n1C=CC[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590377 FG Annotated Anodyne O=Cc1cnc2n1C=CC[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590378 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnc2ccnn2c1 ZINC000587590395 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnc2ccnn2c1 ZINC000587590396 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnc2ccnn2c1 ZINC000587590397 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnc2ccnn2c1 ZINC000587590398 FG Annotated Anodyne Cc1noc(C[C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587590411 FG Annotated Anodyne Cc1noc(C[C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587590412 FG Annotated Anodyne Cc1noc(C[C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587590413 FG Annotated Anodyne Cc1noc(C[C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587590414 FG Annotated Anodyne COC(=O)CCCC[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590629 FG Annotated Anodyne COC(=O)CCCC[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590631 FG Annotated Anodyne COC(=O)CCCC[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590632 FG Annotated Anodyne COC(=O)CCCC[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590634 FG Annotated Anodyne CC[C@H](C(=O)OC)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590684 FG Annotated Anodyne CC[C@H](C(=O)OC)[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590687 FG Annotated Anodyne CC[C@H](C(=O)OC)[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590688 FG Annotated Anodyne CC[C@H](C(=O)OC)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590691 FG Annotated Anodyne C[C@]1(c2cn3cccnc3n2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590872 FG Annotated Anodyne C[C@]1(c2cn3cccnc3n2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590873 FG Annotated Anodyne C[C@@]1(c2cn3cccnc3n2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590874 FG Annotated Anodyne C[C@@]1(c2cn3cccnc3n2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590875 FG Annotated Anodyne COC(=O)C1CCC2(CC1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587591011 FG Annotated Anodyne COC(=O)C1CCC2(CC1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587591012 FG Annotated Anodyne COC(=O)c1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c[nH]1 ZINC000587591621 FG Annotated Anodyne COC(=O)c1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c[nH]1 ZINC000587591622 FG Annotated Anodyne COC(=O)c1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c[nH]1 ZINC000587591625 FG Annotated Anodyne COC(=O)c1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c[nH]1 ZINC000587591627 FG Annotated Anodyne COC(=O)C(C)(C)C[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587591713 FG Annotated Anodyne COC(=O)C(C)(C)C[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587591714 FG Annotated Anodyne COC(=O)C(C)(C)C[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587591716 FG Annotated Anodyne COC(=O)C(C)(C)C[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587591718 FG Annotated Anodyne COC(=O)C12CC([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)(C1)C2 ZINC000587591820 FG Annotated Anodyne COC(=O)C12CC([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)(C1)C2 ZINC000587591822 FG Annotated Anodyne COC(=O)C12CC([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)(C1)C2 ZINC000587591825 FG Annotated Anodyne COC(=O)C12CC([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)(C1)C2 ZINC000587591827 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCN1CCCC[C@H]12 ZINC000587591859 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCN1CCCC[C@@H]12 ZINC000587591863 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCN1CCCC[C@@H]12 ZINC000587591866 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCN1CCCC[C@H]12 ZINC000587591869 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCCN1CCC[C@H]12 ZINC000587591907 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCN1CCC[C@@H]12 ZINC000587591910 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCCN1CCC[C@@H]12 ZINC000587591912 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCN1CCC[C@H]12 ZINC000587591915 FG Annotated Anodyne COC(=O)[C@@H]1CCCC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587592181 FG Annotated Anodyne COC(=O)[C@@H]1CCCC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587592182 FG Annotated Anodyne COC(=O)[C@@H]1CCCC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587592183 FG Annotated Anodyne COC(=O)[C@@H]1CCCC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587592184 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587592217 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587592219 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587592220 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587592221 FG Annotated Anodyne O=C(O)c1cc[nH]c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587592376 FG Annotated Anodyne O=C(O)c1cc[nH]c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587592379 FG Annotated Anodyne O=C(O)c1cc[nH]c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587592381 FG Annotated Anodyne O=C(O)c1cc[nH]c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587592383 FG Annotated Anodyne C[C@@]1(c2c[nH]c(C(=O)O)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587592403 FG Annotated Anodyne C[C@]1(c2c[nH]c(C(=O)O)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587592406 FG Annotated Anodyne C[C@]1(c2c[nH]c(C(=O)O)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587592408 FG Annotated Anodyne C[C@@]1(c2c[nH]c(C(=O)O)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587592410 FG Annotated Anodyne CCOC(=O)[C@@]1(C(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587592523 FG Annotated Anodyne CCOC(=O)[C@]1(C(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587592525 FG Annotated Anodyne CCOC(=O)[C@]1(C(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587592526 FG Annotated Anodyne CCOC(=O)[C@@]1(C(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587592527 FG Annotated Anodyne COC(=O)CC1CC2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587592729 FG Annotated Anodyne COC(=O)CC1CC2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587592730 FG Annotated Anodyne COC(=O)C[C@]1(C(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587592799 FG Annotated Anodyne COC(=O)C[C@@]1(C(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587592800 FG Annotated Anodyne COC(=O)C[C@@]1(C(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587592801 FG Annotated Anodyne COC(=O)C[C@]1(C(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587592802 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1[C@H]1N[C@@H]1c1ccccc1 ZINC000587592837 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1[C@H]1N[C@@H]1c1ccccc1 ZINC000587592838 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1[C@H]1N[C@@H]1c1ccccc1 ZINC000587592839 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1[C@H]1N[C@@H]1c1ccccc1 ZINC000587592840 FG Annotated Anodyne C=CCOC(=O)C[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587592988 FG Annotated Mild C=CCOC(=O)C[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587592992 FG Annotated Mild C=CCOC(=O)C[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587592994 FG Annotated Mild C=CCOC(=O)C[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587592995 FG Annotated Mild O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC12[C@H]1CC3C[C@H]2CN(C3)C1 ZINC000587593000 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC12[C@H]1CC3C[C@H]2CN(C3)C1 ZINC000587593003 FG Annotated Anodyne CCOC(=O)C1CC2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587593102 FG Annotated Anodyne CCOC(=O)C1CC2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587593103 FG Annotated Anodyne CCC[C@]1(CC(=O)OC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587593672 FG Annotated Anodyne CCC[C@@]1(CC(=O)OC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587593673 FG Annotated Anodyne CCC[C@@]1(CC(=O)OC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587593674 FG Annotated Anodyne CCC[C@]1(CC(=O)OC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587593675 FG Annotated Anodyne CCOC(=O)C1(C)CC2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587593867 FG Annotated Anodyne CCOC(=O)C1(C)CC2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587593870 FG Annotated Anodyne CCOC(=O)[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594307 FG Annotated Anodyne CCOC(=O)[C@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594308 FG Annotated Anodyne CCOC(=O)[C@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594309 FG Annotated Anodyne CCOC(=O)[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594310 FG Annotated Anodyne CC(=O)N1CCC[C@]2(CC1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587594609 FG Annotated Anodyne CC(=O)N1CCC[C@@]2(CC1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587594612 FG Annotated Anodyne CC(=O)N1CCC[C@@]2(CC1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587594616 FG Annotated Anodyne CC(=O)N1CCC[C@]2(CC1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587594618 FG Annotated Anodyne COC(=O)C1([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CC1 ZINC000587594673 FG Annotated Anodyne COC(=O)C1([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CC1 ZINC000587594675 FG Annotated Anodyne CCCCOC(=O)[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594735 FG Annotated Anodyne CCCCOC(=O)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594736 FG Annotated Anodyne CCCCOC(=O)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594737 FG Annotated Anodyne CCCCOC(=O)[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594738 FG Annotated Anodyne CCOC(=O)C1([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CC1 ZINC000587594767 FG Annotated Anodyne CCOC(=O)C1([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CC1 ZINC000587594768 FG Annotated Anodyne CCOC(=O)C1([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CC1 ZINC000587594769 FG Annotated Anodyne CCOC(=O)C1([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CC1 ZINC000587594770 FG Annotated Anodyne COC(=O)C1([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CC1 ZINC000587594824 FG Annotated Anodyne COC(=O)C1([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CC1 ZINC000587594826 FG Annotated Anodyne COC(=O)[C@@H]1[C@H](C)CC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587594860 FG Annotated Anodyne COC(=O)[C@@H]1[C@H](C)CC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587594863 FG Annotated Anodyne COC(=O)[C@@H]1[C@H](C)CC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587594864 FG Annotated Anodyne COC(=O)[C@@H]1[C@H](C)CC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587594866 FG Annotated Anodyne COC(=O)C1(C)CC2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587595274 FG Annotated Anodyne COC(=O)C1(C)CC2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587595275 FG Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587595576 FG Annotated Anodyne CCOC(=O)[C@@H]1CC[C@@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587595577 FG Annotated Anodyne CCOC(=O)[C@@H]1CC[C@@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587595578 FG Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587595579 FG Annotated Anodyne COC(=O)[C@@]1(CC(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595775 FG Annotated Anodyne COC(=O)[C@]1(CC(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595776 FG Annotated Anodyne COC(=O)[C@]1(CC(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595777 FG Annotated Anodyne COC(=O)[C@@]1(CC(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595778 FG Annotated Anodyne COC(=O)C[C@@H]1CC[C@@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587595779 FG Annotated Anodyne COC(=O)C[C@@H]1CC[C@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587595780 FG Annotated Anodyne COC(=O)C[C@@H]1CC[C@@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587595781 FG Annotated Anodyne COC(=O)C[C@@H]1CC[C@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587595782 FG Annotated Anodyne COC(=O)C(C)(C)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595821 FG Annotated Anodyne COC(=O)C(C)(C)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595823 FG Annotated Anodyne COC(=O)C(C)(C)[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595825 FG Annotated Anodyne COC(=O)C(C)(C)[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595827 FG Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587595997 FG Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587595998 FG Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587596000 FG Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587596001 FG Annotated Anodyne COC(=O)C[C@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596081 FG Annotated Anodyne COC(=O)C[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596082 FG Annotated Anodyne COC(=O)C[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596083 FG Annotated Anodyne COC(=O)C[C@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596084 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587596144 FG Annotated Anodyne COC(=O)[C@H]1CC[C@@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587596145 FG Annotated Anodyne COC(=O)[C@H]1CC[C@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587596146 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587596147 FG Annotated Anodyne COC(=O)[C@H]1CC[C@@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587596148 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587596149 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587596150 FG Annotated Anodyne COC(=O)[C@H]1CC[C@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587596151 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12C(=O)Nc1ccccc12 ZINC000587596225 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12C(=O)Nc1ccccc12 ZINC000587596226 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12C(=O)Nc1ccccc12 ZINC000587596227 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12C(=O)Nc1ccccc12 ZINC000587596228 FG Annotated Anodyne CCCOC(=O)C[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596345 FG Annotated Anodyne CCCOC(=O)C[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596346 FG Annotated Anodyne CCCOC(=O)C[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596347 FG Annotated Anodyne CCCOC(=O)C[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596348 FG Annotated Anodyne CC[C@]1([C@H](C)C(=O)OC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596445 FG Annotated Anodyne CC[C@]1([C@@H](C)C(=O)OC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596447 FG Annotated Anodyne CC[C@]1([C@H](C)C(=O)OC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596449 FG Annotated Anodyne CC[C@]1([C@@H](C)C(=O)OC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596451 FG Annotated Anodyne COC(=O)[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C1(C)C ZINC000587596452 FG Annotated Anodyne COC(=O)[C@@H]1C[C@@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C1(C)C ZINC000587596454 FG Annotated Anodyne COC(=O)[C@@H]1C[C@@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C1(C)C ZINC000587596457 FG Annotated Anodyne COC(=O)[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C1(C)C ZINC000587596459 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1[nH]nc2ncccc12 ZINC000587596756 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1[nH]nc2ncccc12 ZINC000587596757 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1[nH]nc2ncccc12 ZINC000587596758 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1[nH]nc2ncccc12 ZINC000587596759 FG Annotated Anodyne CCOC(=O)[C@H](C)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596915 FG Annotated Anodyne CCOC(=O)[C@H](C)[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596917 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587596954 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587596955 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587596956 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587596957 FG Annotated Anodyne CC(C)OC(=O)C[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597143 FG Annotated Anodyne CC(C)OC(=O)C[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597144 FG Annotated Anodyne CC(C)OC(=O)C[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597145 FG Annotated Anodyne CC(C)OC(=O)C[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597146 FG Annotated Anodyne CCOC(=O)[C@H](C)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597170 FG Annotated Anodyne CCOC(=O)[C@H](C)[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597172 FG Annotated Anodyne CCOC(=O)C[C@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597255 FG Annotated Anodyne CCOC(=O)C[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597256 FG Annotated Anodyne CCOC(=O)C[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597257 FG Annotated Anodyne CCOC(=O)C[C@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597258 FG Annotated Anodyne COC(=O)[C@H](C)C[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597361 FG Annotated Anodyne COC(=O)[C@H](C)C[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597362 FG Annotated Anodyne COC(=O)[C@H](C)C[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597363 FG Annotated Anodyne COC(=O)[C@H](C)C[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597364 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC12C[C@@H]1CCC[C@H](C2)N1 ZINC000587597552 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC12C[C@@H]1CCC[C@H](C2)N1 ZINC000587597557 FG Annotated Anodyne COCCC[C@]1(COC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597576 FG Annotated Anodyne COCCC[C@@]1(COC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597600 FG Annotated Anodyne COCCC[C@@]1(COC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597604 FG Annotated Anodyne COCCC[C@]1(COC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597608 FG Annotated Anodyne CCC[C@]1(C(=O)OCC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597891 FG Annotated Anodyne CCC[C@@]1(C(=O)OCC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597894 FG Annotated Anodyne CCC[C@@]1(C(=O)OCC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597897 FG Annotated Anodyne CCC[C@]1(C(=O)OCC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597903 FG Annotated Anodyne C#C[C@@]1(C(OCC)OCC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587598325 FG Annotated Mild C#C[C@@]1(C(OCC)OCC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587598328 FG Annotated Mild C#C[C@]1(C(OCC)OCC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587598329 FG Annotated Mild C#C[C@]1(C(OCC)OCC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587598330 FG Annotated Mild CCOC(=O)C[C@@]1(CC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587598767 FG Annotated Anodyne CCOC(=O)C[C@]1(CC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587598768 FG Annotated Anodyne CCOC(=O)C[C@]1(CC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587598769 FG Annotated Anodyne CCOC(=O)C[C@@]1(CC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587598770 FG Annotated Anodyne CCOC(=O)CC[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587599117 FG Annotated Anodyne CCOC(=O)CC[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587599118 FG Annotated Anodyne CCOC(=O)CC[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587599119 FG Annotated Anodyne CCOC(=O)CC[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587599120 FG Annotated Anodyne O=C1C[C@@H]2C[C@@]3(C[C@@H]2C1)Oc1ccccc1C(=O)[C@H]3C(=O)c1ccco1 ZINC000587600923 FG Annotated Anodyne O=C1C[C@@H]2C[C@]3(C[C@@H]2C1)Oc1ccccc1C(=O)[C@H]3C(=O)c1ccco1 ZINC000587600925 FG Annotated Anodyne O=C1C[C@@H]2CC3(C[C@H]2C1)Oc1ccccc1C(=O)[C@@H]3C(=O)c1ccco1 ZINC000587600929 FG Annotated Anodyne O=C1C[C@@H]2CC3(C[C@H]2C1)Oc1ccccc1C(=O)[C@H]3C(=O)c1ccco1 ZINC000587600932 FG Annotated Anodyne O=C1C[C@@H]2C[C@]3(C[C@@H]2C1)Oc1ccccc1C(=O)[C@@H]3C(=O)c1ccco1 ZINC000587600934 FG Annotated Anodyne O=C1C[C@@H]2C[C@@]3(C[C@@H]2C1)Oc1ccccc1C(=O)[C@@H]3C(=O)c1ccco1 ZINC000587600937 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12C(=O)Cc1ccccc12 ZINC000587602268 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12C(=O)Cc1ccccc12 ZINC000587602269 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12C(=O)Cc1ccccc12 ZINC000587602270 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12C(=O)Cc1ccccc12 ZINC000587602271 FG Annotated Anodyne O=C(O)CC[C@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587603836 FG Annotated Anodyne O=C(O)CC[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587603837 FG Annotated Anodyne O=C(O)CC[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587603839 FG Annotated Anodyne O=C(O)CC[C@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587603841 FG Annotated Anodyne O=C(O)C[C@@H]1CC[C@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587604270 FG Annotated Anodyne O=C(O)C[C@@H]1CC[C@@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587604271 FG Annotated Anodyne O=C(O)C[C@@H]1CC[C@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587604272 FG Annotated Anodyne O=C(O)C[C@@H]1CC[C@@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587604273 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(C(=O)O)c1ccccc1 ZINC000587604332 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(C(=O)O)c1ccccc1 ZINC000587604333 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(C(=O)O)c1ccccc1 ZINC000587604334 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(C(=O)O)c1ccccc1 ZINC000587604335 FG Annotated Anodyne O=C(O)C[C@@H]1CCC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587604736 FG Annotated Anodyne O=C(O)C[C@@H]1CCC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587604737 FG Annotated Anodyne O=C(O)C[C@@H]1CCC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587604738 FG Annotated Anodyne O=C(O)C[C@@H]1CCC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587604739 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12C[C@H]1CC[C@@H]2CC1=O ZINC000587605066 FG Annotated Anodyne O=C1C[C@H]2CC[C@@H]1C[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587605067 FG Annotated Anodyne O=C1C[C@H]2CC[C@@H]1C[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587605068 FG Annotated Anodyne O=C1C[C@@H]2CC[C@H]1C[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587605069 FG Annotated Anodyne O=C1C[C@@H]2CC[C@H]1C[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587605072 FG Annotated Anodyne O=C1C[C@@H]2CC[C@H]1C[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587605074 FG Annotated Anodyne O=C1C[C@@H]2CC[C@H]1C[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587605076 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12C[C@H]1CC[C@@H]2CC1=O ZINC000587605077 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(C#CCO)cc1 ZINC000587605599 FG Annotated Mild O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(C#CCO)cc1 ZINC000587605600 FG Annotated Mild O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(CC1OCCO1)C1CC1 ZINC000587605797 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(CC1OCCO1)C1CC1 ZINC000587605799 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(CC1OCCO1)C1CC1 ZINC000587605801 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(CC1OCCO1)C1CC1 ZINC000587605802 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(C#CCO)cc1 ZINC000587605901 FG Annotated Mild O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(C#CCO)cc1 ZINC000587605902 FG Annotated Mild CC1(C)O[C@@H]2CC[C@@]3(Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)[C@@H]2O1 ZINC000587606426 FG Annotated Anodyne CC1(C)O[C@@H]2CC[C@]3(Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)[C@@H]2O1 ZINC000587606427 FG Annotated Anodyne CC1(C)O[C@@H]2CC[C@]3(Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)[C@@H]2O1 ZINC000587606428 FG Annotated Anodyne CC1(C)O[C@@H]2CC[C@@]3(Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)[C@@H]2O1 ZINC000587606429 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12C(=O)Oc1ccccc12 ZINC000587606490 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12C(=O)Oc1ccccc12 ZINC000587606491 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12C(=O)Oc1ccccc12 ZINC000587606492 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12C(=O)Oc1ccccc12 ZINC000587606493 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(O)c(CO)c1 ZINC000587606717 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(O)c(CO)c1 ZINC000587606718 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(O)c(CO)c1 ZINC000587606719 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(O)c(CO)c1 ZINC000587606720 FG Annotated Anodyne O=C(c1cccc(O)c1)[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587607007 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1C(=O)c1cccc(O)c1 ZINC000587607008 FG Annotated Anodyne O=C(c1cccc(O)c1)[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587607009 FG Annotated Anodyne O=C(c1cccc(O)c1)[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587607010 FG Annotated Anodyne O=C[C@]1(c2cccc(O)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587607427 FG Annotated Mild O=C[C@@]1(c2cccc(O)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587607428 FG Annotated Mild O=C[C@@]1(c2cccc(O)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587607430 FG Annotated Mild O=C[C@]1(c2cccc(O)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587607431 FG Annotated Mild CC1([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)COCOC1 ZINC000587607566 FG Annotated Anodyne CC1([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)COCOC1 ZINC000587607567 FG Annotated Anodyne CC1([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)COCOC1 ZINC000587607568 FG Annotated Anodyne CC1([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)COCOC1 ZINC000587607569 FG Annotated Anodyne CC1(C)[C@H](C(=O)O)C[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587607923 FG Annotated Anodyne CC1(C)[C@H](C(=O)O)C[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587607924 FG Annotated Anodyne CC1(C)[C@H](C(=O)O)C[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587607925 FG Annotated Anodyne CC1(C)[C@H](C(=O)O)C[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587607928 FG Annotated Anodyne O=C[C@]1(c2ccc(O)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587607987 FG Annotated Mild O=C[C@@]1(c2ccc(O)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587607990 FG Annotated Mild O=C[C@@]1(c2ccc(O)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587607995 FG Annotated Mild O=C[C@]1(c2ccc(O)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587607997 FG Annotated Mild O=C(O)C1CC2(C1)CC1(C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587608830 FG Annotated Anodyne O=C(O)C1CC2(C1)CC1(C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587608831 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(C(=O)O)c1cccs1 ZINC000587609415 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(C(=O)O)c1cccs1 ZINC000587609416 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(C(=O)O)c1cccs1 ZINC000587609417 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(C(=O)O)c1cccs1 ZINC000587609419 FG Annotated Anodyne C[C@]1(c2csc(=N)[nH]2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587609729 FG Annotated Anodyne C[C@@]1(c2csc(=N)[nH]2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587609732 FG Annotated Anodyne C[C@@]1(c2csc(=N)[nH]2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587609733 FG Annotated Anodyne C[C@]1(c2csc(=N)[nH]2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587609735 FG Annotated Anodyne O=C(O)C1CCC2(CC1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587610045 FG Annotated Anodyne O=C(O)C1CCC2(CC1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587610047 FG Annotated Anodyne Cc1sc(=N)[nH]c1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587610410 FG Annotated Anodyne Cc1sc(=N)[nH]c1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587610418 FG Annotated Anodyne Cc1sc(=N)[nH]c1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587610419 FG Annotated Anodyne Cc1sc(=N)[nH]c1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587610421 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(O)c(O)c1O ZINC000587610624 FG Annotated Clean O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(O)c(O)c1O ZINC000587610645 FG Annotated Clean O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(O)c(O)c1O ZINC000587610647 FG Annotated Clean O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(O)c(O)c1O ZINC000587610650 FG Annotated Clean NC[C@@]1(c2cccs2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587611842 FG Annotated Anodyne NC[C@@]1(c2cccs2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587611844 FG Annotated Anodyne NC[C@]1(c2cccs2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587611846 FG Annotated Anodyne NC[C@]1(c2cccs2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587611849 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12Cc1ccccc1OC2=O ZINC000587612115 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12Cc1ccccc1OC2=O ZINC000587612117 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12Cc1ccccc1OC2=O ZINC000587612118 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12Cc1ccccc1OC2=O ZINC000587612119 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCCC1(C2)OCCO1 ZINC000587612142 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCC1(C2)OCCO1 ZINC000587612143 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCCC1(C2)OCCO1 ZINC000587612144 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCCC1(C2)OCCO1 ZINC000587612145 FG Annotated Anodyne Cc1[nH]c(=N)sc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587612229 FG Annotated Anodyne Cc1[nH]c(=N)sc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587612231 FG Annotated Anodyne Cc1[nH]c(=N)sc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587612233 FG Annotated Anodyne Cc1[nH]c(=N)sc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587612234 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCC[C@@H](C(=O)O)C2 ZINC000587612406 FG Annotated Anodyne O=C(O)[C@@H]1CCC[C@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587612407 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCC[C@@H](C(=O)O)C2 ZINC000587612408 FG Annotated Anodyne O=C(O)[C@@H]1CCC[C@@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587612409 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(O)c(O)cc1O ZINC000587612422 FG Annotated Clean O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(O)c(O)cc1O ZINC000587612423 FG Annotated Clean O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(O)c(O)cc1O ZINC000587612424 FG Annotated Clean O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(O)c(O)cc1O ZINC000587612425 FG Annotated Clean O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC12CCC1(CC2)OCCO1 ZINC000587612502 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC12CCC1(CC2)OCCO1 ZINC000587612503 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1c(O)cc(O)cc1O ZINC000587612812 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1c(O)cc(O)cc1O ZINC000587612813 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1c(O)cc(O)cc1O ZINC000587612814 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1c(O)cc(O)cc1O ZINC000587612815 FG Annotated Anodyne NC(=O)c1csc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587613172 FG Annotated Anodyne NC(=O)c1csc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587613173 FG Annotated Anodyne NC(=O)c1csc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587613174 FG Annotated Anodyne NC(=O)c1csc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587613175 FG Annotated Anodyne O=C(c1ccc(O)cc1)[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587613574 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1C(=O)c1ccc(O)cc1 ZINC000587613575 FG Annotated Anodyne O=C(c1ccc(O)cc1)[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587613576 FG Annotated Anodyne O=C(c1ccc(O)cc1)[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587613577 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(O)c(O)c(O)c1 ZINC000587613588 FG Annotated Clean O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(O)c(O)c(O)c1 ZINC000587613589 FG Annotated Clean O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(O)c(O)c(O)c1 ZINC000587613590 FG Annotated Clean O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(O)c(O)c(O)c1 ZINC000587613591 FG Annotated Clean COC[C@]1(C2CCOCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587614008 FG Annotated Anodyne COC[C@@]1(C2CCOCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587614009 FG Annotated Anodyne COC[C@@]1(C2CCOCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587614010 FG Annotated Anodyne COC[C@]1(C2CCOCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587614011 FG Annotated Anodyne COC(=O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)o1 ZINC000587614608 FG Annotated Anodyne COC(=O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)o1 ZINC000587614609 FG Annotated Anodyne NC(=O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)s1 ZINC000587614796 FG Annotated Anodyne NC(=O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)s1 ZINC000587614797 FG Annotated Anodyne NC(=O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)s1 ZINC000587614798 FG Annotated Anodyne NC(=O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)s1 ZINC000587614799 FG Annotated Anodyne COC(=O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)o1 ZINC000587614854 FG Annotated Anodyne COC(=O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)o1 ZINC000587614856 FG Annotated Anodyne COC(=O)c1occc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587614980 FG Annotated Anodyne COC(=O)c1occc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587614981 FG Annotated Anodyne COC(=O)c1occc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587614982 FG Annotated Anodyne COC(=O)c1occc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587614983 FG Annotated Anodyne COC(=O)c1ccoc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587615769 FG Annotated Anodyne COC(=O)c1ccoc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587615770 FG Annotated Anodyne COC(=O)c1ccoc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587615771 FG Annotated Anodyne COC(=O)c1ccoc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587615772 FG Annotated Anodyne COC(=O)c1coc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587615854 FG Annotated Anodyne COC(=O)c1coc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587615855 FG Annotated Anodyne COC(=O)c1coc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587615857 FG Annotated Anodyne COC(=O)c1coc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587615859 FG Annotated Anodyne CC[C@@H]1OC(=O)[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[C@@H]1C ZINC000587616403 FG Annotated Anodyne CC[C@@H]1OC(=O)[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[C@@H]1C ZINC000587616404 FG Annotated Anodyne CC[C@@H]1OC(=O)[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[C@H]1C ZINC000587616405 FG Annotated Anodyne CC[C@@H]1OC(=O)[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[C@H]1C ZINC000587616406 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1CCCC1OCCO1 ZINC000587617057 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1CCCC1OCCO1 ZINC000587617058 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1CCCC1OCCO1 ZINC000587617059 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1CCCC1OCCO1 ZINC000587617060 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(Cc1ccco1)C(=O)O ZINC000587617643 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(Cc1ccco1)C(=O)O ZINC000587617644 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(Cc1ccco1)C(=O)O ZINC000587617645 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(Cc1ccco1)C(=O)O ZINC000587617646 FG Annotated Anodyne O=C(O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)o1 ZINC000587617806 FG Annotated Anodyne O=C(O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)o1 ZINC000587617810 FG Annotated Anodyne O=C(O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)o1 ZINC000587617811 FG Annotated Anodyne O=C(O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)o1 ZINC000587617812 FG Annotated Anodyne O=C(O)c1ccoc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587618627 FG Annotated Anodyne O=C(O)c1ccoc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587618629 FG Annotated Anodyne O=C(O)c1ccoc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587618631 FG Annotated Anodyne O=C(O)c1ccoc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587618633 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cn2c(n1)SCC2 ZINC000587619283 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cn2c(n1)SCC2 ZINC000587619285 FG Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cn2c(n1)SCC2 ZINC000587619287 FG Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cn2c(n1)SCC2 ZINC000587619288 FG Annotated Anodyne COC(=O)Cc1c(CCl)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587620210 FG Annotated Reactive COC(=O)C(F)(F)c1[nH]c2c(c(Br)cc3n[nH]cc32)c1C ZINC000587621346 FG Annotated Anodyne COC(=O)c1[nH]c2c(c(Br)cc3n[nH]cc32)c1CCCl ZINC000587621676 FG Annotated Reactive Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1C(=O)c1cnn(C)c1 ZINC000587622455 FG Annotated Anodyne CCOC(=O)[C@H](C#N)c1[nH]c2c(c(Br)cc3n[nH]cc32)c1C ZINC000587622477 FG Annotated Mild CCOC(=O)[C@@H](C#N)c1[nH]c2c(c(Br)cc3n[nH]cc32)c1C ZINC000587622480 FG Annotated Mild Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1-n1cc([N+](=O)[O-])cn1 ZINC000587622834 FG Annotated Bother Cc1cc(=NC(=O)c2c(C)[nH]c3c2c(Br)cc2n[nH]cc23)[nH]o1 ZINC000587622891 FG Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1C(=O)Nc1ncccn1 ZINC000587623151 FG Annotated Anodyne Cc1nn(C)cc1-c1[nH]c2c(c(Br)cc3n[nH]cc32)c1C#N ZINC000587623322 FG Annotated Mild CC(=O)c1c(-c2cnn(C)c2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587623360 FG Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1-n1ccc([N+](=O)[O-])n1 ZINC000587623641 FG Annotated Bother COC(=O)[C@H](N=O)c1[nH]c2c(c(Br)cc3n[nH]cc32)c1C ZINC000587623678 FG Annotated Anodyne COC(=O)[C@@H](N=O)c1[nH]c2c(c(Br)cc3n[nH]cc32)c1C ZINC000587623679 FG Annotated Anodyne Cc1c(-c2[nH]c3c(c(Br)cc4n[nH]cc43)c2C#N)cnn1C ZINC000587623682 FG Annotated Mild O=C(O)Cc1c(-c2ccccn2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587623832 FG Annotated Anodyne COC(=O)c1c(-c2cnccn2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587623947 FG Annotated Anodyne O=C(O)Cc1c(-c2ccc[nH]2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587624160 FG Annotated Anodyne O=C(O)Cc1c(-c2ccncc2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587624194 FG Annotated Anodyne Cc1[nH]c2cc(C(F)(F)F)cc(C(F)(F)F)c2c1C(=O)NCC(=O)O ZINC000587625512 FG Annotated Anodyne Cc1cc(Cl)cc2c(C(=O)c3ccnn3C)c(-c3ccnn3C)[nH]c12 ZINC000587626817 FG Annotated Anodyne Cc1cc(Cl)cc2c(C(=O)c3cnn(C)c3)c(-c3cnn(C)c3)[nH]c12 ZINC000587627418 FG Annotated Anodyne COC(=O)c1[nH]c2c(C)cc(Cl)cc2c1C(=O)c1c(C)nn(C)c1C ZINC000587627459 FG Annotated Anodyne COC(=O)c1[nH]c2ccc(F)c(Cl)c2c1C(=O)c1c(C)nn(C)c1C ZINC000587631416 FG Annotated Anodyne COC(=O)C(=O)c1c(-c2c(C)nn(C)c2C)[nH]c2cc(Cl)c(F)cc12 ZINC000587631905 FG Annotated Anodyne Cn1nccc1C(=O)c1c(-c2ccnn2C)[nH]c2cc(Cl)c(F)cc12 ZINC000587631923 FG Annotated Anodyne COC(=O)C1CCN(C(=O)c2c(C)[nH]c3cc(Cl)c(F)cc23)CC1 ZINC000587632113 FG Annotated Anodyne COC(=O)C(=O)c1c(-c2c(C)nn(C)c2C)[nH]c2ccc(F)c(Cl)c12 ZINC000587632142 FG Annotated Anodyne Cn1nccc1C(=O)c1c(-c2ccnn2C)[nH]c2ccc(F)c(Cl)c12 ZINC000587632195 FG Annotated Anodyne Cn1cc(C(=O)c2c(-c3cnn(C)c3)[nH]c3ccc(F)c(Cl)c23)cn1 ZINC000587632313 FG Annotated Anodyne Cn1cc(C(=O)c2c(-c3cnn(C)c3)[nH]c3cc(Cl)c(F)cc23)cn1 ZINC000587632401 FG Annotated Anodyne COC(=O)c1[nH]c2cc(Cl)c(F)cc2c1C(=O)c1c(C)nn(C)c1C ZINC000587632533 FG Annotated Anodyne Cc1c(C(=O)c2c(-c3cnn(C)c3C)[nH]c3cccc(F)c23)cnn1C ZINC000587635422 FG Annotated Anodyne Cc1nn(C)cc1C(=O)c1c(-c2cn(C)nc2C)[nH]c2cccc(F)c12 ZINC000587635517 FG Annotated Anodyne CCOC(=O)c1cc(C(=O)OCC)n(-c2c(C)[nH]c3cccc(F)c23)n1 ZINC000587635665 FG Annotated Anodyne Cc1nn(C)cc1C(=O)c1c(-c2cn(C)nc2C)[nH]c2cc(F)ccc12 ZINC000587635761 FG Annotated Anodyne Cc1c(C(=O)c2c(-c3cnn(C)c3C)[nH]c3cc(F)ccc23)cnn1C ZINC000587636051 FG Annotated Anodyne CCOC(=O)c1cc(C(=O)OCC)n(-c2c(C)[nH]c3cc(F)ccc23)n1 ZINC000587636131 FG Annotated Anodyne CCOC(=O)Cc1[nH]c2cccc(F)c2c1N1C(=O)c2ccccc2C1=O ZINC000587636636 FG Annotated Anodyne CCOC(=O)Cc1[nH]c2cc(F)ccc2c1N1C(=O)c2ccccc2C1=O ZINC000587636672 FG Annotated Anodyne CCOC(=O)c1c(CN2C(=O)c3ccccc3C2=O)[nH]c2cccc(F)c12 ZINC000587636684 FG Annotated Anodyne COC(=O)C(=O)c1c(-c2[nH]c(C)c(C(=O)OC)c2C)[nH]c2cc(F)ccc12 ZINC000587636695 FG Annotated Anodyne CC(=O)Cc1[nH]c2cccc(F)c2c1CN1C(=O)c2ccccc2C1=O ZINC000587636767 FG Annotated Anodyne COC(=O)C(=O)c1c(-c2[nH]c(C)c(C(=O)OC)c2C)[nH]c2cccc(F)c12 ZINC000587636770 FG Annotated Anodyne CC(=O)Cc1[nH]c2cc(F)ccc2c1CN1C(=O)c2ccccc2C1=O ZINC000587636781 FG Annotated Anodyne COC(=O)c1[nH]c2cccc(F)c2c1C(=O)c1[nH]c(C)c(C(=O)OC)c1C ZINC000587636818 FG Annotated Anodyne CC(C)(C)c1[nH]c2c(C(=O)O)cccc2c1NC(=O)CBr ZINC000587636914 FG Annotated Reactive CC(=O)c1c(CCN2C(=O)c3ccccc3C2=O)[nH]c2cc(F)ccc12 ZINC000587636962 FG Annotated Anodyne Cc1[nH]c2cccc(F)c2c1C(=O)CCN1C(=O)c2ccccc2C1=O ZINC000587636990 FG Annotated Anodyne CC(=O)c1c(CCN2C(=O)c3ccccc3C2=O)[nH]c2cccc(F)c12 ZINC000587636993 FG Annotated Anodyne CCOC(=O)c1c(CN2C(=O)c3ccccc3C2=O)[nH]c2cc(F)ccc12 ZINC000587637013 FG Annotated Anodyne Cc1[nH]c2cc(F)ccc2c1C(=O)CCN1C(=O)c2ccccc2C1=O ZINC000587637090 FG Annotated Anodyne CCOC(=O)c1[nH]c2c(C(=O)O)cccc2c1C(=O)c1ccc(F)cc1 ZINC000587637133 FG Annotated Anodyne COC(=O)c1[nH]c2cc(F)ccc2c1C(=O)c1[nH]c(C)c(C(=O)OC)c1C ZINC000587637277 FG Annotated Anodyne COc1ccc([N+](=O)[O-])cc1[C@H](O)c1c(C)[nH]c2c(C(=O)O)cccc12 ZINC000587637348 FG Annotated Bother COc1ccc([N+](=O)[O-])cc1[C@@H](O)c1c(C)[nH]c2c(C(=O)O)cccc12 ZINC000587637351 FG Annotated Bother CCOC(=O)c1c(CNC(=O)OC(C)(C)C)[nH]c2c(C(=O)O)cccc12 ZINC000587637409 FG Annotated Anodyne Cc1c(-c2ccccc2OCC(=O)N(C)C)[nH]c2c(C(=O)O)cccc12 ZINC000587637410 FG Annotated Anodyne COC(=O)C(=O)c1c(-c2cc(F)ccc2F)[nH]c2c(C(=O)O)cccc12 ZINC000587637413 FG Annotated Anodyne COC(=O)c1[nH]c2c(C(=O)O)cccc2c1C(=O)c1cc(F)ccc1F ZINC000587637572 FG Annotated Anodyne CCOC(=O)c1[nH]c2c(C(=O)O)cccc2c1C(=O)c1ccc(C#N)cc1 ZINC000587637718 FG Annotated Mild CCOC(=O)c1[nH]c2c(C(=O)O)cccc2c1C(=O)c1ccccc1F ZINC000587637845 FG Annotated Anodyne C[C@H](NC(=O)OC(C)(C)C)c1[nH]c2c(C(=O)O)cccc2c1CCCO ZINC000587637950 FG Annotated Anodyne CN1CCN(c2ccc(-c3[nH]c4c(C(=O)O)cccc4c3C#N)cc2)CC1 ZINC000587638040 FG Annotated Mild O=C(O)CCC(=O)Nc1c(-c2ccccc2)[nH]c2c(C(=O)O)cccc12 ZINC000587638123 FG Annotated Anodyne CCOC(=O)C(=O)c1c(-c2ccc(C#N)cc2)[nH]c2c(C(=O)O)cccc12 ZINC000587638144 FG Annotated Mild COC(=O)c1[nH]c2c(C(=O)O)cccc2c1C(=O)c1c(F)cccc1F ZINC000587638272 FG Annotated Anodyne O=C(O)CCC(=O)Nc1c(-c2ccccc2F)[nH]c2c(C(=O)O)cccc12 ZINC000587638304 FG Annotated Anodyne COC(=O)C(=O)c1c(-c2c(F)cccc2F)[nH]c2c(C(=O)O)cccc12 ZINC000587638311 FG Annotated Anodyne CCOC(=O)CCC(=O)Nc1c(C(C)(C)C)[nH]c2c(C(=O)O)cccc12 ZINC000587638380 FG Annotated Anodyne Cc1c(C(=O)c2c(C(F)(F)F)[nH]c3c(C(=O)O)cccc23)cnn1C ZINC000587638385 FG Annotated Anodyne Cc1nn(C)cc1C(=O)c1c(C(F)(F)F)[nH]c2c(C(=O)O)cccc12 ZINC000587638396 FG Annotated Anodyne CCOC(=O)Cc1[nH]c2c(C(=O)O)cccc2c1NC(=O)OC(C)(C)C ZINC000587638474 FG Annotated Anodyne CCOC(=O)C(=O)Nc1c(-c2ccccc2)[nH]c2c(C(=O)O)cccc12 ZINC000587638580 FG Annotated Anodyne CC(C)(C)OC(=O)N1CC[C@@H](c2[nH]c3c(C(=O)O)cccc3c2C#N)C1 ZINC000587638625 FG Annotated Mild CC(C)(C)OC(=O)N1CC[C@H](c2[nH]c3c(C(=O)O)cccc3c2C#N)C1 ZINC000587638626 FG Annotated Mild Cc1[nH]c2c(C(=O)O)cccc2c1[C@@H]1COCCN1C(=O)OC(C)(C)C ZINC000587638642 FG Annotated Anodyne Cc1[nH]c2c(C(=O)O)cccc2c1[C@H]1COCCN1C(=O)OC(C)(C)C ZINC000587638643 FG Annotated Anodyne Cc1nn(C)cc1C(=O)c1c(C(F)(F)Cl)[nH]c2c(C(=O)O)cccc12 ZINC000587638712 FG Annotated Anodyne O=C(O)c1cccc2c(CN3C(=O)c4ccccc4C3=O)c(CCl)[nH]c12 ZINC000587638819 FG Annotated Reactive Cc1nn(C)cc1-c1[nH]c2c(C(=O)O)cccc2c1C(=O)C(F)(F)F ZINC000587638869 FG Annotated Anodyne CCn1cc(C(=O)c2c(C(F)(F)F)[nH]c3c(C(=O)O)cccc23)cn1 ZINC000587639104 FG Annotated Anodyne Cc1c(-c2[nH]c3c(C(=O)O)cccc3c2C(=O)C(F)(F)F)cnn1C ZINC000587639259 FG Annotated Anodyne CCn1cc(-c2[nH]c3c(C(=O)O)cccc3c2C(=O)C(F)(F)F)cn1 ZINC000587639281 FG Annotated Anodyne CC[C@H](C)c1ccc2[nH]c(C)c(-n3nnc(C(=O)OC)c3C(=O)OC)c2c1 ZINC000587642906 FG Annotated Anodyne CC[C@@H](C)c1ccc2[nH]c(C)c(-n3nnc(C(=O)OC)c3C(=O)OC)c2c1 ZINC000587642907 FG Annotated Anodyne Cc1nn(C)cc1C(=O)c1c(C(F)(F)F)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587644791 FG Annotated Bother Cc1c(C(=O)c2c(C(F)(F)F)[nH]c3cccc([N+](=O)[O-])c23)cnn1C ZINC000587645036 FG Annotated Bother Cc1c(C(=O)c2c(C(F)(F)F)[nH]c3cc([N+](=O)[O-])ccc23)cnn1C ZINC000587645052 FG Annotated Bother Cc1nn(C)cc1C(=O)c1c(C(F)(F)F)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587645192 FG Annotated Bother COC(=O)C(=O)c1c(-c2ccc(OC)cc2F)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587645653 FG Annotated Bother COC(=O)C(=O)c1c(-c2cc(F)ccc2F)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587645954 FG Annotated Bother COC(=O)C(=O)c1c(-c2cc(F)ccc2F)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587646059 FG Annotated Bother COC(=O)c1[nH]c2cccc([N+](=O)[O-])c2c1C(=O)c1c(F)cccc1F ZINC000587646389 FG Annotated Bother CCOC(=O)c1[nH]c2cccc([N+](=O)[O-])c2c1C(=O)c1ccc(C#N)cc1 ZINC000587646523 FG Annotated Mild COC(=O)C(=O)c1c(-c2c(F)cccc2F)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587646550 FG Annotated Bother CCOC(=O)C(=O)c1c(-c2ccc(C#N)cc2)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587647334 FG Annotated Mild CCn1ncc(-c2[nH]c3cc([N+](=O)[O-])ccc3c2N2CCOCC2)c1C ZINC000587647457 FG Annotated Bother CCn1ncc(-c2[nH]c3cccc([N+](=O)[O-])c3c2N2CCOCC2)c1C ZINC000587647743 FG Annotated Bother COc1ccc([N+](=O)[O-])cc1[C@H](O)c1c(C)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587647807 FG Annotated Bother COc1ccc([N+](=O)[O-])cc1[C@@H](O)c1c(C)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587647808 FG Annotated Bother CCn1cc(-c2[nH]c3cccc([N+](=O)[O-])c3c2N2CCOCC2)c(C)n1 ZINC000587647853 FG Annotated Bother CCn1cc(-c2[nH]c3cc([N+](=O)[O-])ccc3c2N2CCOCC2)c(C)n1 ZINC000587647995 FG Annotated Bother COC(=O)C(=O)c1c(-c2ccccc2[N+](=O)[O-])[nH]c2cccc([N+](=O)[O-])c12 ZINC000587648013 FG Annotated Bother CS(=O)(=O)c1ccc2[nH]c(C(F)(F)F)c(C(=O)C(F)(F)F)c2c1 ZINC000587648457 FG Annotated Anodyne CS(=O)(=O)c1ccc2[nH]c(C(F)(F)F)c(C(=O)c3ccccn3)c2c1 ZINC000587648668 FG Annotated Anodyne CN1CCN(c2ccc(-c3[nH]c4cccc([N+](=O)[O-])c4c3C#N)cc2)CC1 ZINC000587649077 FG Annotated Mild CN1CCN(c2ccc(-c3[nH]c4cc([N+](=O)[O-])ccc4c3C#N)cc2)CC1 ZINC000587649101 FG Annotated Mild CS(=O)(=O)c1ccc2[nH]c(C(F)(F)F)c(C(=O)c3ccncc3)c2c1 ZINC000587649211 FG Annotated Anodyne CS(=O)(=O)c1ccc2[nH]c(CCl)c(-n3nnc4ccccc43)c2c1 ZINC000587649215 FG Annotated Reactive CS(=O)(=O)c1ccc2[nH]c(-c3ccc(F)cc3F)c(-n3cncn3)c2c1 ZINC000587649394 FG Annotated Anodyne CC(=O)c1c(C(F)(F)Br)[nH]c2ccc(S(C)(=O)=O)cc12 ZINC000587649624 FG Annotated Anodyne CS(=O)(=O)c1ccc2[nH]c(C(F)(F)F)c(C(=O)c3ccco3)c2c1 ZINC000587649644 FG Annotated Anodyne CC(=O)Oc1c(-c2ccc(Cl)cn2)[nH]c2ccc(S(C)(=O)=O)cc12 ZINC000587649654 FG Annotated Anodyne Cc1[nH]c2ccc(S(C)(=O)=O)cc2c1C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000587649729 FG Annotated Bother COC(=O)c1c(C(F)(F)C(F)(F)F)[nH]c2ccc(S(C)(=O)=O)cc12 ZINC000587649881 FG Annotated Anodyne CS(=O)(=O)c1ccc2[nH]c(Cc3ccc(F)cc3)c(CCC=O)c2c1 ZINC000587650194 FG Annotated Mild CS(=O)(=O)c1ccc2[nH]c(-c3ccc(Br)o3)c(C#N)c2c1 ZINC000587650225 FG Annotated Mild Cc1[nH]c2ccc(S(C)(=O)=O)cc2c1[C@@H](C)NC(=O)OC(C)(C)C ZINC000587650253 FG Annotated Anodyne Cc1[nH]c2ccc(S(C)(=O)=O)cc2c1[C@H](C)NC(=O)OC(C)(C)C ZINC000587650254 FG Annotated Anodyne CCc1c(CNC(=O)OC(C)(C)C)[nH]c2ccc(S(C)(=O)=O)cc12 ZINC000587650396 FG Annotated Anodyne Cc1[nH]c2ccc(S(C)(=O)=O)cc2c1-n1cc(C(F)(F)F)ccc1=O ZINC000587650416 FG Annotated Anodyne CC(=O)c1c(C(F)(F)C(F)(F)F)[nH]c2ccc(S(C)(=O)=O)cc12 ZINC000587650570 FG Annotated Anodyne O=C(c1cc(Br)co1)n1ncc2ccc(Cl)cc2c1=O ZINC000587650610 FG Annotated Anodyne CS(=O)(=O)c1ccc2[nH]c(-c3ccccn3)c(C(=O)c3ccco3)c2c1 ZINC000587650651 FG Annotated Anodyne Cc1[nH]c2ccc(S(C)(=O)=O)cc2c1CN(C)C(=O)OC(C)(C)C ZINC000587650756 FG Annotated Anodyne CC(=O)c1c(C)[nH]c(-c2[nH]c3ccc(S(C)(=O)=O)cc3c2C#N)c1C ZINC000587650789 FG Annotated Mild CCc1c(-c2cc3c(cc2N)OCCO3)[nH]c2ccc(S(C)(=O)=O)cc12 ZINC000587650891 FG Annotated Anodyne O=C(c1ccc(Br)o1)n1ncc2ccc(Cl)cc2c1=O ZINC000587650984 FG Annotated Anodyne Cc1nn([C@H](C)C(=O)n2ncc3ccc(Cl)cc3c2=O)cc1Cl ZINC000587651055 FG Annotated Anodyne Cc1nn([C@@H](C)C(=O)n2ncc3ccc(Cl)cc3c2=O)cc1Cl ZINC000587651056 FG Annotated Anodyne CN(C)C(=O)c1cc(F)c(-n2ncc3ccc(Cl)cc3c2=O)c(F)c1 ZINC000587651058 FG Annotated Anodyne O=C(n1ncc2ccc(Cl)cc2c1=O)C(F)(F)Oc1ccccc1 ZINC000587651083 FG Annotated Anodyne O=C(c1ccc(C(F)(F)F)nc1)n1ncc2ccc(Cl)cc2c1=O ZINC000587651084 FG Annotated Anodyne C[C@@H](Oc1ccc(F)cc1F)C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587651113 FG Annotated Anodyne C[C@H](Oc1ccc(F)cc1F)C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587651118 FG Annotated Anodyne O=C(c1cnccc1C(F)(F)F)n1ncc2ccc(Cl)cc2c1=O ZINC000587651187 FG Annotated Anodyne O=C(c1ccc(OC(F)F)cc1)n1ncc2ccc(Cl)cc2c1=O ZINC000587651251 FG Annotated Anodyne O=C(c1ccc([N+](=O)[O-])cc1Cl)n1ncc2ccc(Cl)cc2c1=O ZINC000587651314 FG Annotated Bother CS(=O)(=O)c1ccc2[nH]c(-c3ccco3)c(C(=O)c3ccccn3)c2c1 ZINC000587651421 FG Annotated Anodyne O=C(c1cncn1-c1ccc(F)cc1)n1ncc2ccc(Cl)cc2c1=O ZINC000587651479 FG Annotated Anodyne O=C(c1cn2cc(Cl)ccc2n1)n1ncc2ccc(Cl)cc2c1=O ZINC000587651554 FG Annotated Anodyne O=C(COc1ccc2c(c1)CCC2)n1ncc2ccc(Cl)cc2c1=O ZINC000587651620 FG Annotated Anodyne Cc1cc(C(F)F)nn1[C@H](C)C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587651632 FG Annotated Anodyne Cc1cc(C(F)F)nn1[C@@H](C)C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587651635 FG Annotated Anodyne O=C(COc1ccc(F)cc1F)n1ncc2ccc(Cl)cc2c1=O ZINC000587651664 FG Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1-c1ncc(Br)nc1Cl ZINC000587651692 FG Annotated Anodyne O=C(Nc1ccc(C(=O)n2ncc3ccc(Cl)cc3c2=O)cc1)C1CC1 ZINC000587651696 FG Annotated Anodyne O=C(c1cccc(OC(F)F)c1)n1ncc2ccc(Cl)cc2c1=O ZINC000587651708 FG Annotated Anodyne CC(=O)c1ccc(O[C@H](C)C(=O)n2ncc3ccc(Cl)cc3c2=O)cc1 ZINC000587651906 FG Annotated Anodyne CC(=O)c1ccc(O[C@@H](C)C(=O)n2ncc3ccc(Cl)cc3c2=O)cc1 ZINC000587651909 FG Annotated Anodyne O=C(c1cc(-c2ccc(O)cc2)on1)n1ncc2ccc(Cl)cc2c1=O ZINC000587651962 FG Annotated Anodyne C[C@H](C(=O)n1ncc2ccc(Cl)cc2c1=O)n1ccc(C(F)(F)F)n1 ZINC000587651965 FG Annotated Anodyne C[C@@H](C(=O)n1ncc2ccc(Cl)cc2c1=O)n1ccc(C(F)(F)F)n1 ZINC000587651966 FG Annotated Anodyne CCOc1ccccc1OCC(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587651984 FG Annotated Anodyne Cc1nn([C@@H](C)C(=O)n2ncc3ccc(Cl)cc3c2=O)c(C)c1Cl ZINC000587651997 FG Annotated Anodyne Cc1nn([C@H](C)C(=O)n2ncc3ccc(Cl)cc3c2=O)c(C)c1Cl ZINC000587651998 FG Annotated Anodyne O=C(c1ccccc1OC(F)F)n1ncc2ccc(Cl)cc2c1=O ZINC000587652048 FG Annotated Anodyne CCOC(=O)c1cnc(Cl)cc1-n1ncc2ccc(Cl)cc2c1=O ZINC000587652051 FG Annotated Anodyne CCOc1ccc(NCC(=O)n2ncc3ccc(Cl)cc3c2=O)cc1 ZINC000587652144 FG Annotated Anodyne CC(C)C(=O)Nc1ccc(C(=O)n2ncc3ccc(Cl)cc3c2=O)cc1 ZINC000587652168 FG Annotated Anodyne O=C(COc1cc(F)ccc1F)n1ncc2ccc(Cl)cc2c1=O ZINC000587652196 FG Annotated Anodyne CC[C@H](C(=O)n1ncc2ccc(Cl)cc2c1=O)n1cc(Cl)cn1 ZINC000587652199 FG Annotated Anodyne CC[C@@H](C(=O)n1ncc2ccc(Cl)cc2c1=O)n1cc(Cl)cn1 ZINC000587652200 FG Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1-c1ccc(S(=O)(=O)C(F)F)cc1 ZINC000587652224 FG Annotated Anodyne CCNc1ccc(C(=O)n2ncc3ccc(Cl)cc3c2=O)cc1[N+](=O)[O-] ZINC000587652227 FG Annotated Bother O=C(c1cc(-c2ccc(F)cc2)[nH]n1)n1ncc2ccc(Cl)cc2c1=O ZINC000587652229 FG Annotated Anodyne Cc1nn(CCC(=O)n2ncc3ccc(Cl)cc3c2=O)c(C)c1Cl ZINC000587652230 FG Annotated Anodyne CCCc1noc(-c2cccnc2-n2ncc3ccc(Cl)cc3c2=O)n1 ZINC000587652336 FG Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1-c1nc(O)cc(-c2ccccc2)n1 ZINC000587652348 FG Annotated Anodyne CCc1cc(-n2ncc3ccc(Cl)cc3c2=O)nc(-c2ccccn2)n1 ZINC000587652371 FG Annotated Anodyne O=C(n1ncc2ccc(Cl)cc2c1=O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 ZINC000587652382 FG Annotated Anodyne COc1cc(C)ccc1OCC(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587652422 FG Annotated Anodyne CCN(CC)Cc1ccc(C(=O)n2ncc3ccc(Cl)cc3c2=O)o1 ZINC000587652525 FG Annotated Anodyne O=C(c1cc(-c2ccccc2)on1)n1ncc2ccc(Cl)cc2c1=O ZINC000587652531 FG Annotated Anodyne Cc1ccc(-c2noc(C(=O)n3ncc4ccc(Cl)cc4c3=O)n2)cc1 ZINC000587652542 FG Annotated Anodyne O=C(c1ccc(-c2cnco2)cc1)n1ncc2ccc(Cl)cc2c1=O ZINC000587652616 FG Annotated Anodyne CCCC(=O)Nc1ccc(C(=O)n2ncc3ccc(Cl)cc3c2=O)cc1 ZINC000587652649 FG Annotated Anodyne O=C([C@H]1CCO[C@@H]1c1ccccc1)n1ncc2ccc(Cl)cc2c1=O ZINC000587652660 FG Annotated Anodyne CCn1cc(-c2ccnc(-n3ncc4ccc(Cl)cc4c3=O)n2)c(C)n1 ZINC000587652729 FG Annotated Anodyne CCOC(=O)c1ccc(-n2ncc3ccc(Cl)cc3c2=O)c([N+](=O)[O-])c1 ZINC000587652747 FG Annotated Bother O=c1c2cc(Cl)ccc2cnn1-c1ncccc1-c1nc(C2CC2)no1 ZINC000587652755 FG Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1-c1ncnc2c1cnn2-c1ccccc1 ZINC000587652794 FG Annotated Anodyne CC(C)(C)OC(=O)c1ccc(-n2ncc3ccc(Cl)cc3c2=O)nc1 ZINC000587652803 FG Annotated Anodyne O=C(c1cc2cc([N+](=O)[O-])ccc2o1)n1ncc2ccc(Cl)cc2c1=O ZINC000587652900 FG Annotated Bother CCc1nc2ccccc2n1CC(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587653115 FG Annotated Anodyne Cc1cc([N+](=O)[O-])ccc1NC(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587653236 FG Annotated Bother CCc1ccc(-c2cnnc(-n3ncc4ccc(Cl)cc4c3=O)n2)cc1 ZINC000587653395 FG Annotated Anodyne C[C@H](Oc1ccccc1[N+](=O)[O-])C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587653444 FG Annotated Bother C[C@@H](Oc1ccccc1[N+](=O)[O-])C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587653447 FG Annotated Bother C[C@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587653641 FG Annotated Bother C[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587653642 FG Annotated Bother O=C(CSc1nc2ccccc2[nH]1)n1ncc2ccc(Cl)cc2c1=O ZINC000587653667 FG Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1C(=S)Nc1ccc2c(c1)OCO2 ZINC000587653701 FG Annotated Anodyne O=C(c1cc(-c2cccs2)on1)n1ncc2ccc(Cl)cc2c1=O ZINC000587653809 FG Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1-c1nc2cc3c(cc2s1)OCO3 ZINC000587653830 FG Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1C(=S)Nc1cccc([N+](=O)[O-])c1 ZINC000587653981 FG Annotated Bother O=c1c2cc(Cl)ccc2cnn1C(=S)Nc1ccccc1[N+](=O)[O-] ZINC000587654085 FG Annotated Bother O=c1c2cc(Cl)ccc2cnn1-c1nc2cc3c(cc2s1)OCCO3 ZINC000587654177 FG Annotated Anodyne Cc1ccc(-c2cc(C(=O)n3ncc4ccc(Cl)cc4c3=O)n[nH]2)cc1 ZINC000587654259 FG Annotated Anodyne CN(C)c1ccc(NC(=S)n2ncc3ccc(Cl)cc3c2=O)cc1 ZINC000587654275 FG Annotated Anodyne O=C(c1cc(-c2cccs2)[nH]n1)n1ncc2ccc(Cl)cc2c1=O ZINC000587654561 FG Annotated Anodyne Cc1cccc2c1[nH]c1nc(-n3ncc4ccc(Cl)cc4c3=O)nnc12 ZINC000587654648 FG Annotated Anodyne O=C(CN1CCCc2ccccc21)n1ncc2ccc(Cl)cc2c1=O ZINC000587655121 FG Annotated Anodyne CC(=O)Nc1cccc(NC(=S)n2ncc3ccc(Cl)cc3c2=O)c1 ZINC000587655194 FG Annotated Anodyne O=C(c1cc(-c2ccccc2)[nH]n1)n1ncc2ccc(Cl)cc2c1=O ZINC000587655202 FG Annotated Anodyne CS(=O)(=O)c1ccc(-n2ncc3ccc(Cl)cc3c2=O)c(Cl)c1 ZINC000587655209 FG Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1C(=S)Nc1ccc([N+](=O)[O-])cc1 ZINC000587655213 FG Annotated Bother O=C(c1cnco1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655660 FG Annotated Anodyne Cc1ocnc1C(=O)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655664 FG Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1-c1ncc(F)cn1 ZINC000587655709 FG Annotated Anodyne O=C([C@@H]1CCOC1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655903 FG Annotated Anodyne O=C([C@H]1CCOC1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655905 FG Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1Cc1cccnn1 ZINC000587655952 FG Annotated Anodyne Cc1nccnc1-n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655955 FG Annotated Anodyne Nc1cnnc(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)c1Cl ZINC000587656125 FG Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1Cc1cnccn1 ZINC000587656138 FG Annotated Anodyne COc1ccnc(-n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)n1 ZINC000587656266 FG Annotated Anodyne Cc1nc(C(=O)n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)co1 ZINC000587656451 FG Annotated Anodyne O=C(c1ccccn1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656543 FG Annotated Anodyne O=C(c1nccs1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656547 FG Annotated Anodyne O=C([C@@H]1CCCO1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656596 FG Annotated Anodyne O=C([C@H]1CCCO1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656599 FG Annotated Anodyne O=C(c1cncs1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656651 FG Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1-c1ccnc(O)c1 ZINC000587656742 FG Annotated Anodyne Cn1cccc1C(=O)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656752 FG Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1Cc1cncnc1 ZINC000587656776 FG Annotated Anodyne CC(C)OCC(=O)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656852 FG Annotated Anodyne N=c1nc(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)cc(Cl)[nH]1 ZINC000587656943 FG Annotated Anodyne O=C(c1n[nH]cc1Cl)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587656945 FG Annotated Anodyne Cc1cncc(-n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)n1 ZINC000587657018 FG Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1Cc1ccnnc1 ZINC000587657036 FG Annotated Anodyne Cc1cc(-n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)ncn1 ZINC000587657048 FG Annotated Anodyne O=C([C@@H]1CCCOC1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587657110 FG Annotated Anodyne O=C([C@H]1CCCOC1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587657111 FG Annotated Anodyne C[C@H]1CCO[C@H]1C(=O)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587657130 FG Annotated Anodyne O=C(c1cocn1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587657155 FG Annotated Anodyne O=C(c1cscn1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587657207 FG Annotated Anodyne Cc1nnc(-n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)s1 ZINC000587657222 FG Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1Cc1ncccn1 ZINC000587657283 FG Annotated Anodyne O=C(C1CCOCC1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587657329 FG Annotated Anodyne O=C(c1ccon1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587657376 FG Annotated Anodyne Cc1n[nH]cc1C(=O)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587657648 FG Annotated Anodyne O=C(c1ccc(F)cn1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587657854 FG Annotated Anodyne Nc1cc(Cl)nnc1-n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587657919 FG Annotated Anodyne COc1ncc(F)c(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)n1 ZINC000587657945 FG Annotated Anodyne Cc1cc(C(=O)n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)n[nH]1 ZINC000587658057 FG Annotated Anodyne O=C(c1ccc[nH]1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587658060 FG Annotated Anodyne O=C(c1ccncc1F)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658138 FG Annotated Anodyne C=CCNC(=S)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587658271 FG Annotated Mild O=C(CCCCCO)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658307 FG Annotated Anodyne Cc1nc[nH]c1C(=O)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587658402 FG Annotated Anodyne CCCNC(=S)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587658406 FG Annotated Anodyne Nc1c(Cl)ncnc1-n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658651 FG Annotated Anodyne O=C(NCC(F)(F)F)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587659141 FG Annotated Anodyne Cc1ncc(C(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)c(C)n1 ZINC000587659847 FG Annotated Anodyne NC(=O)c1ccccc1-n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587659885 FG Annotated Anodyne O=C(Cc1ccccn1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587659901 FG Annotated Anodyne O=C([C@H]1CCCOC1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587659932 FG Annotated Anodyne O=C([C@@H]1CCCOC1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587659933 FG Annotated Anodyne Cc1cnn(CC(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)c1 ZINC000587659956 FG Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1ccc2nccn2n1 ZINC000587659968 FG Annotated Anodyne CCn1ccc(C(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)n1 ZINC000587660052 FG Annotated Anodyne CN1CCC(C(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)CC1 ZINC000587660220 FG Annotated Anodyne O=C(c1nccs1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587660359 FG Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1nc2ccccn2n1 ZINC000587660495 FG Annotated Anodyne NNc1ccc(C(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)cc1 ZINC000587660607 FG Annotated Anodyne O=C(O)c1cccnc1-n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587660631 FG Annotated Anodyne O=C(N=c1cc[nH]cc1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587660653 FG Annotated Anodyne Nc1ccccc1C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587660688 FG Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1C(=S)NC1CCC1 ZINC000587660884 FG Annotated Anodyne COCc1nnc(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)s1 ZINC000587660887 FG Annotated Anodyne O=C(C1CCOCC1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661217 FG Annotated Anodyne C[C@H]1CCO[C@H]1C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661285 FG Annotated Anodyne Cc1n[nH]c(C)c1C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661311 FG Annotated Anodyne O=C(c1ccccc1CO)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661357 FG Annotated Anodyne O=C(Cc1cccnc1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661364 FG Annotated Anodyne Cc1nc(C)c(C(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)o1 ZINC000587661382 FG Annotated Anodyne Cc1ccnn1CC(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661439 FG Annotated Anodyne O=C(CCN1CCCC1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661455 FG Annotated Anodyne O=C(O)c1ccc(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)nc1 ZINC000587661470 FG Annotated Anodyne O=C(CN1CCCCC1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661485 FG Annotated Anodyne C[C@H](C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O)n1cccn1 ZINC000587661568 FG Annotated Anodyne C[C@@H](C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O)n1cccn1 ZINC000587661569 FG Annotated Anodyne Cc1ccn(CC(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)n1 ZINC000587661585 FG Annotated Anodyne O=C(c1cscn1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661651 FG Annotated Anodyne C[C@@H](C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O)N1CCCC1 ZINC000587661871 FG Annotated Anodyne C[C@H](C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O)N1CCCC1 ZINC000587661879 FG Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1ccncc1[N+](=O)[O-] ZINC000587661973 FG Annotated Bother Cn1cccc1CC(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661977 FG Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1cc2c(nn1)CCC2 ZINC000587662028 FG Annotated Anodyne CCOc1cc(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)ncn1 ZINC000587662034 FG Annotated Anodyne COc1cc(C)nc(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)n1 ZINC000587662064 FG Annotated Anodyne O=C(CC1CCNCC1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587662161 FG Annotated Anodyne O=C(c1cncs1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587662194 FG Annotated Anodyne O=C(c1n[nH]c2c1CCC2)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587662197 FG Annotated Anodyne CSCCNC(=S)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587662198 FG Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1ncccc1[N+](=O)[O-] ZINC000587662272 FG Annotated Bother CCn1nccc1C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587662298 FG Annotated Anodyne CCn1cc(C(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)cn1 ZINC000587662300 FG Annotated Anodyne CN(C)c1nccc(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)n1 ZINC000587662309 FG Annotated Anodyne Cc1nnsc1C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587662769 FG Annotated Anodyne O=C(N1CCSCC1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587662836 FG Annotated Anodyne CCN(CC)c1ccc(-c2nn(C(=O)OC)c(=O)c3ccccc23)c(O)c1 ZINC000587664353 FG Annotated Anodyne CCN(CC)c1ccc(-c2nn(C(C)=O)c(=O)c3ccccc23)c(O)c1 ZINC000587667834 FG Annotated Anodyne CCOc1ccc(-c2nn(C(=O)NC)c(=O)c3ccccc23)cc1OCC ZINC000587668511 FG Annotated Anodyne CCOc1ccc(-c2nn(C(=O)OC)c(=O)c3ccccc23)cc1OCC ZINC000587668599 FG Annotated Anodyne CCOc1ccc(-c2nn(C(=N)O)c(=O)c3ccccc23)cc1OCC ZINC000587668846 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H]([C@H](Br)C=O)N1 ZINC000587670367 FG Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H]([C@H](Br)C=O)N1 ZINC000587670446 FG Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@H]([C@@H](Br)C=O)N1 ZINC000587670447 FG Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H]([C@@H](Br)C=O)N1 ZINC000587670449 FG Annotated Reactive CCN(CC)c1ccc(-c2nn(C(=N)S)c(=O)c3ccccc23)c(O)c1 ZINC000587670685 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H]([C@H](Br)C=O)N1 ZINC000587671233 FG Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H]([C@@H](Br)C=O)N1 ZINC000587671234 FG Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@H]([C@H](Br)C=O)N1 ZINC000587671236 FG Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@H]([C@@H](Br)C=O)N1 ZINC000587671237 FG Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(COC(CCl)=CC2=O)N1 ZINC000587682198 FG Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(COC(CCl)=CC2=O)N1 ZINC000587682240 FG Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(COC(CCl)=CC2=O)N1 ZINC000587682243 FG Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(COC(CCl)=CC2=O)N1 ZINC000587682245 FG Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2cnn(C)c2)N1 ZINC000587682820 FG Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2cnn(C)c2)N1 ZINC000587682821 FG Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2cnn(C)c2)N1 ZINC000587682822 FG Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2cnn(C)c2)N1 ZINC000587682823 FG Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C=C(CCl)OCC2=O)N1 ZINC000587683492 FG Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=C(CCl)OCC2=O)N1 ZINC000587683494 FG Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=C(CCl)OCC2=O)N1 ZINC000587683495 FG Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C=C(CCl)OCC2=O)N1 ZINC000587683497 FG Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2cnn(C)c2)N1 ZINC000587684723 FG Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2cnn(C)c2)N1 ZINC000587684725 FG Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2cnn(C)c2)N1 ZINC000587684727 FG Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2cnn(C)c2)N1 ZINC000587684728 FG Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2cnc(O)[nH]2)N1 ZINC000587685242 FG Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2cnc(O)[nH]2)N1 ZINC000587685243 FG Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2cnc(O)[nH]2)N1 ZINC000587685244 FG Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2cnc(O)[nH]2)N1 ZINC000587685245 FG Annotated Reactive COC(=O)C[C@@]1(CCl)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587685888 FG Annotated Reactive COC(=O)C[C@]1(CCl)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587685889 FG Annotated Reactive COC(=O)C[C@@]1(CCl)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587685890 FG Annotated Reactive COC(=O)C[C@]1(CCl)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587685891 FG Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=C(CCl)OCC2=O)N1 ZINC000587686362 FG Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C=C(CCl)OCC2=O)N1 ZINC000587686363 FG Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C=C(CCl)OCC2=O)N1 ZINC000587686364 FG Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=C(CCl)OCC2=O)N1 ZINC000587686365 FG Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2cnc(O)[nH]2)N1 ZINC000587686989 FG Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2cnc(O)[nH]2)N1 ZINC000587686990 FG Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2cnc(O)[nH]2)N1 ZINC000587686991 FG Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2cnc(O)[nH]2)N1 ZINC000587686992 FG Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(COC(CCl)=CC2=O)N1 ZINC000587687292 FG Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(COC(CCl)=CC2=O)N1 ZINC000587687293 FG Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(COC(CCl)=CC2=O)N1 ZINC000587687294 FG Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(COC(CCl)=CC2=O)N1 ZINC000587687295 FG Annotated Reactive CCOC(=O)[C@H](Cl)[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587687732 FG Annotated Reactive CCOC(=O)[C@H](Cl)[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587687733 FG Annotated Reactive CCOC(=O)[C@H](Cl)[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587687734 FG Annotated Reactive CCOC(=O)[C@H](Cl)[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587687735 FG Annotated Reactive C/C(N)=C(\C#N)[C@]1(CCl)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587687752 FG Annotated Reactive C/C(N)=C(/C#N)[C@]1(CCl)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587687753 FG Annotated Reactive C/C(N)=C(/C#N)[C@]1(CCl)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587687754 FG Annotated Reactive C/C(N)=C(\C#N)[C@]1(CCl)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587687755 FG Annotated Reactive COC(=O)[C@H](Cl)[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587688735 FG Annotated Reactive COC(=O)[C@H](Cl)[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587688736 FG Annotated Reactive COC(=O)[C@H](Cl)[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587688737 FG Annotated Reactive COC(=O)[C@H](Cl)[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587688738 FG Annotated Reactive COC(=O)[C@H](Cl)[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587688743 FG Annotated Reactive COC(=O)[C@H](Cl)[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587688744 FG Annotated Reactive COC(=O)[C@H](Cl)[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587688745 FG Annotated Reactive COC(=O)[C@H](Cl)[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587688746 FG Annotated Reactive CCOC(=O)[C@H](Cl)[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587688755 FG Annotated Reactive CCOC(=O)[C@H](Cl)[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587688756 FG Annotated Reactive CCOC(=O)[C@H](Cl)[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587688757 FG Annotated Reactive CCOC(=O)[C@H](Cl)[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587688758 FG Annotated Reactive C/C(N)=C(/C#N)[C@]1(CCl)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587689047 FG Annotated Reactive C/C(N)=C(\C#N)[C@]1(CCl)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587689048 FG Annotated Reactive C/C(N)=C(\C#N)[C@]1(CCl)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587689049 FG Annotated Reactive C/C(N)=C(/C#N)[C@]1(CCl)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587689050 FG Annotated Reactive COC(=O)C[C@@]1(CCl)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587689470 FG Annotated Reactive COC(=O)C[C@]1(CCl)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587689471 FG Annotated Reactive COC(=O)C[C@@]1(CCl)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587689472 FG Annotated Reactive COC(=O)C[C@]1(CCl)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587689473 FG Annotated Reactive CC(=O)OC[C@]1(CCl)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587689558 FG Annotated Reactive CC(=O)OC[C@@]1(CCl)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587689559 FG Annotated Reactive CC(=O)OC[C@]1(CCl)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587689560 FG Annotated Reactive CC(=O)OC[C@@]1(CCl)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587689561 FG Annotated Reactive CC(=O)OC[C@]1(CCl)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587689862 FG Annotated Reactive CC(=O)OC[C@@]1(CCl)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587689863 FG Annotated Reactive CC(=O)OC[C@]1(CCl)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587689864 FG Annotated Reactive CC(=O)OC[C@@]1(CCl)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587689865 FG Annotated Reactive COC(=O)[C@@]1(C(F)(F)F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587705711 FG Annotated Anodyne COC(=O)[C@]1(C(F)(F)F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587705712 FG Annotated Anodyne COC(=O)[C@@]1(C(F)(F)F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587705713 FG Annotated Anodyne COC(=O)[C@]1(C(F)(F)F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587705714 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(Cl)nc[nH]c2=N)N1 ZINC000587707129 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(Cl)nc[nH]c2=N)N1 ZINC000587707130 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(Cl)nc[nH]c2=N)N1 ZINC000587707131 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(Cl)nc[nH]c2=N)N1 ZINC000587707132 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(Cl)nc[nH]c2=N)N1 ZINC000587707296 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(Cl)nc[nH]c2=N)N1 ZINC000587707298 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(Cl)nc[nH]c2=N)N1 ZINC000587707392 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(Cl)nc[nH]c2=N)N1 ZINC000587707393 FG Annotated Anodyne COC(=O)[C@@]1(C(F)(F)F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707474 FG Annotated Anodyne COC(=O)[C@]1(C(F)(F)F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707475 FG Annotated Anodyne COC(=O)[C@@]1(C(F)(F)F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707476 FG Annotated Anodyne COC(=O)[C@]1(C(F)(F)F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707477 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccnn2CCF)N1 ZINC000587716140 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccnn2CCF)N1 ZINC000587716158 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccnn2CCF)N1 ZINC000587716160 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccnn2CCF)N1 ZINC000587716161 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587716890 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2cnn(C)c2)(C(F)F)N1 ZINC000587716892 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2cnn(C)c2)(C(F)F)N1 ZINC000587716900 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2cnn(C)c2)(C(F)F)N1 ZINC000587716904 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587716907 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2cnn(C)c2)(C(F)F)N1 ZINC000587716908 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587716912 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587716916 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2cnn(C)c2)(C(F)F)N1 ZINC000587719371 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2cnn(C)c2)(C(F)F)N1 ZINC000587719373 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2cnn(C)c2)(C(F)F)N1 ZINC000587719374 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2cnn(C)c2)(C(F)F)N1 ZINC000587719375 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587720320 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587720322 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587720323 FG Annotated Anodyne CCOC(=O)[C@H](F)[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587720325 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccnn2CCF)N1 ZINC000587720708 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccnn2CCF)N1 ZINC000587720709 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccnn2CCF)N1 ZINC000587720710 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccnn2CCF)N1 ZINC000587720711 FG Annotated Anodyne CC[C@]1([C@@H](F)C(=O)OC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587723258 FG Annotated Anodyne CC[C@]1([C@@H](F)C(=O)OC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587723259 FG Annotated Anodyne CC[C@]1([C@H](F)C(=O)OC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587723260 FG Annotated Anodyne CC[C@]1([C@H](F)C(=O)OC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587723261 FG Annotated Anodyne CC[C@]1([C@@H](F)C(=O)OC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587723815 FG Annotated Anodyne CC[C@]1([C@@H](F)C(=O)OC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587723816 FG Annotated Anodyne CC[C@]1([C@H](F)C(=O)OC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587723817 FG Annotated Anodyne CC[C@]1([C@H](F)C(=O)OC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587723819 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(F)cnc2N)N1 ZINC000587727366 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(F)cnc2N)N1 ZINC000587727367 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(F)cnc2N)N1 ZINC000587727368 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(F)cnc2N)N1 ZINC000587727369 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ncc(F)cn2)N1 ZINC000587727998 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ncc(F)cn2)N1 ZINC000587728000 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ncc(F)cn2)N1 ZINC000587728002 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ncc(F)cn2)N1 ZINC000587728003 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CO)(c2ccc(F)cc2)N1 ZINC000587729689 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CO)(c2ccc(F)cc2)N1 ZINC000587729691 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CO)(c2ccc(F)cc2)N1 ZINC000587729694 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CO)(c2ccc(F)cc2)N1 ZINC000587729698 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC#N)([C@@H]2CCOC2)N1 ZINC000587730612 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC#N)([C@H]2CCOC2)N1 ZINC000587730613 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC#N)([C@@H]2CCOC2)N1 ZINC000587730614 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC#N)([C@H]2CCOC2)N1 ZINC000587730615 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC#N)([C@@H]2CCOC2)N1 ZINC000587733909 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC#N)([C@H]2CCOC2)N1 ZINC000587733911 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC#N)([C@@H]2CCOC2)N1 ZINC000587733913 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC#N)([C@H]2CCOC2)N1 ZINC000587733915 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CN)(c2ccc(F)cc2)N1 ZINC000587735493 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CN)(c2ccc(F)cc2)N1 ZINC000587735500 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CN)(c2ccc(F)cc2)N1 ZINC000587735501 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CN)(c2ccc(F)cc2)N1 ZINC000587735502 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ncc(F)cn2)N1 ZINC000587735766 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ncc(F)cn2)N1 ZINC000587735767 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ncc(F)cn2)N1 ZINC000587735768 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ncc(F)cn2)N1 ZINC000587735769 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CO)(c2ccc(F)cc2)N1 ZINC000587736892 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CO)(c2ccc(F)cc2)N1 ZINC000587736894 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CO)(c2ccc(F)cc2)N1 ZINC000587736896 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CO)(c2ccc(F)cc2)N1 ZINC000587736900 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(F)cnc2N)N1 ZINC000587737312 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(F)cnc2N)N1 ZINC000587737314 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(F)cnc2N)N1 ZINC000587737316 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(F)cnc2N)N1 ZINC000587737318 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CN)(c2ccc(F)cc2)N1 ZINC000587737441 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CN)(c2ccc(F)cc2)N1 ZINC000587737444 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CN)(c2ccc(F)cc2)N1 ZINC000587737447 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CN)(c2ccc(F)cc2)N1 ZINC000587737450 FG Annotated Anodyne Cc1nn(C)c(F)c1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738449 FG Annotated Anodyne Cc1nn(C)c(F)c1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738456 FG Annotated Anodyne Cc1nn(C)c(F)c1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738458 FG Annotated Anodyne Cc1nn(C)c(F)c1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738460 FG Annotated Anodyne Cc1nn(C)c(F)c1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587738529 FG Annotated Anodyne Cc1nn(C)c(F)c1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587738530 FG Annotated Anodyne Cc1nn(C)c(F)c1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587738531 FG Annotated Anodyne Cc1nn(C)c(F)c1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587738533 FG Annotated Anodyne CCOC(=O)[C@H](N=O)[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738566 FG Annotated Anodyne CCOC(=O)[C@H](N=O)[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738567 FG Annotated Anodyne CCOC(=O)[C@H](N=O)[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738568 FG Annotated Anodyne CCOC(=O)[C@H](N=O)[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738569 FG Annotated Anodyne CC[C@]1([C@@H](N=O)C(=O)OC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738574 FG Annotated Anodyne CC[C@]1([C@@H](N=O)C(=O)OC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738575 FG Annotated Anodyne CC[C@]1([C@H](N=O)C(=O)OC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738576 FG Annotated Anodyne CC[C@]1([C@H](N=O)C(=O)OC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738577 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccnc(N(C)C)n2)N1 ZINC000587739414 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccnc(N(C)C)n2)N1 ZINC000587739420 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccnc(N(C)C)n2)N1 ZINC000587739421 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccnc(N(C)C)n2)N1 ZINC000587739422 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC(=O)/C2=C\N(C)C)N1 ZINC000587739441 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC(=O)/C2=C/N(C)C)N1 ZINC000587739443 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC(=O)/C2=C/N(C)C)N1 ZINC000587739444 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC(=O)/C2=C\N(C)C)N1 ZINC000587739445 FG Annotated Mild CC(=O)NC1CCC2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587739526 FG Annotated Anodyne CC(=O)NC1CCC2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587739527 FG Annotated Anodyne CC(=O)N=C1C=CC2(C=C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587740834 FG Annotated Mild CC(=O)N=C1C=CC2(C=C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587740843 FG Annotated Mild CC(=O)N=C1C=CC2(C=C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587741215 FG Annotated Mild CC(=O)N=C1C=CC2(C=C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587741217 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCC[C@H]2CNC=O)N1 ZINC000587742189 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCC[C@@H]2CNC=O)N1 ZINC000587742193 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCC[C@@H]2CNC=O)N1 ZINC000587742196 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCC[C@H]2CNC=O)N1 ZINC000587742198 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc[nH]c(=N)c2)N1 ZINC000587742495 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc[nH]c(=N)c2)N1 ZINC000587742496 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc[nH]c(=N)c2)N1 ZINC000587742497 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc[nH]c(=N)c2)N1 ZINC000587742498 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC[C@@H](C[N+](=O)[O-])C2)N1 ZINC000587742499 FG Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC[C@H](C[N+](=O)[O-])C2)N1 ZINC000587742500 FG Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC[C@H](C[N+](=O)[O-])C2)N1 ZINC000587742501 FG Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC[C@@H](C[N+](=O)[O-])C2)N1 ZINC000587742502 FG Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(=N)[nH]c2)N1 ZINC000587742563 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(=N)[nH]c2)N1 ZINC000587742564 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(=N)[nH]c2)N1 ZINC000587742565 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(=N)[nH]c2)N1 ZINC000587742566 FG Annotated Anodyne CN=c1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c[nH]1 ZINC000587742626 FG Annotated Anodyne CN=c1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c[nH]1 ZINC000587742630 FG Annotated Anodyne CN=c1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c[nH]1 ZINC000587742633 FG Annotated Anodyne CN=c1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c[nH]1 ZINC000587742635 FG Annotated Anodyne CCOC(=O)[C@H](N=O)[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587742948 FG Annotated Anodyne CCOC(=O)[C@H](N=O)[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587742949 FG Annotated Anodyne CCOC(=O)[C@H](N=O)[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587742950 FG Annotated Anodyne CCOC(=O)[C@H](N=O)[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587742951 FG Annotated Anodyne CC(=O)NC1CCC2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587743036 FG Annotated Anodyne CC(=O)NC1CCC2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587743038 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCC[C@H]2CNC=O)N1 ZINC000587743081 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCC[C@@H]2CNC=O)N1 ZINC000587743082 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCC[C@@H]2CNC=O)N1 ZINC000587743083 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCC[C@H]2CNC=O)N1 ZINC000587743084 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ncccc2N)N1 ZINC000587743314 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ncccc2N)N1 ZINC000587743316 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ncccc2N)N1 ZINC000587743319 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ncccc2N)N1 ZINC000587743321 FG Annotated Anodyne CC[C@]1([C@@H](N=O)C(=O)OC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587743423 FG Annotated Anodyne CC[C@]1([C@@H](N=O)C(=O)OC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587743425 FG Annotated Anodyne CC[C@]1([C@H](N=O)C(=O)OC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587743427 FG Annotated Anodyne CC[C@]1([C@H](N=O)C(=O)OC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587743430 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC(=O)/C2=C/N(C)C)N1 ZINC000587743522 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC(=O)/C2=C\N(C)C)N1 ZINC000587743523 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC(=O)/C2=C\N(C)C)N1 ZINC000587743524 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC(=O)/C2=C/N(C)C)N1 ZINC000587743525 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccnc2N)N1 ZINC000587743609 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccnc2N)N1 ZINC000587743610 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccnc2N)N1 ZINC000587743611 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccnc2N)N1 ZINC000587743612 FG Annotated Anodyne Cc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(N)n1 ZINC000587744045 FG Annotated Anodyne Cc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(N)n1 ZINC000587744050 FG Annotated Anodyne Cc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(N)n1 ZINC000587744053 FG Annotated Anodyne Cc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(N)n1 ZINC000587744055 FG Annotated Anodyne Cc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(N)n1 ZINC000587744215 FG Annotated Anodyne Cc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(N)n1 ZINC000587744218 FG Annotated Anodyne Cc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(N)n1 ZINC000587744220 FG Annotated Anodyne Cc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(N)n1 ZINC000587744222 FG Annotated Anodyne CN=c1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c[nH]1 ZINC000587744658 FG Annotated Anodyne CN=c1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c[nH]1 ZINC000587744659 FG Annotated Anodyne CN=c1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c[nH]1 ZINC000587744661 FG Annotated Anodyne CN=c1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c[nH]1 ZINC000587744662 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccncc2N)N1 ZINC000587746127 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccncc2N)N1 ZINC000587746128 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccncc2N)N1 ZINC000587746129 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccncc2N)N1 ZINC000587746131 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(=N)[nH]c2)N1 ZINC000587746142 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(=N)[nH]c2)N1 ZINC000587746144 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(=N)[nH]c2)N1 ZINC000587746145 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(=N)[nH]c2)N1 ZINC000587746146 FG Annotated Anodyne Cc1cnc(N)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587747842 FG Annotated Anodyne Cc1cnc(N)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587747843 FG Annotated Anodyne Cc1cnc(N)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587747844 FG Annotated Anodyne Cc1cnc(N)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587747845 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc[nH]c(=N)c2)N1 ZINC000587748146 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc[nH]c(=N)c2)N1 ZINC000587748147 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc[nH]c(=N)c2)N1 ZINC000587748148 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc[nH]c(=N)c2)N1 ZINC000587748149 FG Annotated Anodyne Cc1cnc(N)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587748176 FG Annotated Anodyne Cc1cnc(N)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587748177 FG Annotated Anodyne Cc1cnc(N)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587748178 FG Annotated Anodyne Cc1cnc(N)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587748179 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ncccc2N)N1 ZINC000587748370 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ncccc2N)N1 ZINC000587748371 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ncccc2N)N1 ZINC000587748372 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ncccc2N)N1 ZINC000587748373 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccnc2N)N1 ZINC000587748410 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccnc2N)N1 ZINC000587748411 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccnc2N)N1 ZINC000587748412 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccnc2N)N1 ZINC000587748413 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccncc2N)N1 ZINC000587748565 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccncc2N)N1 ZINC000587748567 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccncc2N)N1 ZINC000587748568 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccncc2N)N1 ZINC000587748570 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC[C@@H](C[N+](=O)[O-])C2)N1 ZINC000587748686 FG Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC[C@H](C[N+](=O)[O-])C2)N1 ZINC000587748687 FG Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC[C@H](C[N+](=O)[O-])C2)N1 ZINC000587748688 FG Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC[C@@H](C[N+](=O)[O-])C2)N1 ZINC000587748689 FG Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2c[nH]ccc2=N)N1 ZINC000587748764 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2c[nH]ccc2=N)N1 ZINC000587748766 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2c[nH]ccc2=N)N1 ZINC000587748769 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2c[nH]ccc2=N)N1 ZINC000587748771 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2c[nH]ccc2=N)N1 ZINC000587748982 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2c[nH]ccc2=N)N1 ZINC000587748983 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2c[nH]ccc2=N)N1 ZINC000587748984 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2c[nH]ccc2=N)N1 ZINC000587748985 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(C(N)=O)cc2)N1 ZINC000587749300 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(C(N)=O)cc2)N1 ZINC000587749301 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(C(N)=O)cc2)N1 ZINC000587749302 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(C(N)=O)cc2)N1 ZINC000587749303 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(C(N)=O)c2)N1 ZINC000587749330 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(C(N)=O)c2)N1 ZINC000587749332 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(C(N)=O)c2)N1 ZINC000587749333 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(C(N)=O)c2)N1 ZINC000587749334 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccccc2C(N)=O)N1 ZINC000587749637 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccccc2C(N)=O)N1 ZINC000587749639 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccccc2C(N)=O)N1 ZINC000587749641 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccccc2C(N)=O)N1 ZINC000587749642 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(C(N)=O)cc2)N1 ZINC000587750001 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(C(N)=O)cc2)N1 ZINC000587750002 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(C(N)=O)cc2)N1 ZINC000587750003 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(C(N)=O)cc2)N1 ZINC000587750005 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccccc2C(N)=O)N1 ZINC000587750014 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccccc2C(N)=O)N1 ZINC000587750015 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccccc2C(N)=O)N1 ZINC000587750016 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccccc2C(N)=O)N1 ZINC000587750017 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(C(N)=O)c2)N1 ZINC000587751325 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(C(N)=O)c2)N1 ZINC000587751326 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(C(N)=O)c2)N1 ZINC000587751327 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(C(N)=O)c2)N1 ZINC000587751328 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccn2CC(=O)O)N1 ZINC000587751868 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccn2CC(=O)O)N1 ZINC000587751873 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccn2CC(=O)O)N1 ZINC000587751874 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccn2CC(=O)O)N1 ZINC000587751876 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC#N)(c2nccn2C)N1 ZINC000587752084 FG Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](CC#N)(c2nccn2C)N1 ZINC000587752086 FG Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CC#N)(c2nccn2C)N1 ZINC000587752087 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC#N)(c2nccn2C)N1 ZINC000587752089 FG Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc(N(C)C)nc2)N1 ZINC000587753186 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc(N(C)C)nc2)N1 ZINC000587753188 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc(N(C)C)nc2)N1 ZINC000587753190 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc(N(C)C)nc2)N1 ZINC000587753193 FG Annotated Anodyne COCCn1ccnc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587753527 FG Annotated Anodyne COCCn1ccnc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587753537 FG Annotated Anodyne COCCn1ccnc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587753538 FG Annotated Anodyne COCCn1ccnc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587753540 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](CCCNC(=O)C2CC2)N1 ZINC000587753972 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](CCCNC(=O)C2CC2)N1 ZINC000587753978 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](CCCNC(=O)C2CC2)N1 ZINC000587753980 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](CCCNC(=O)C2CC2)N1 ZINC000587753983 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc(N(C)C)nc2)N1 ZINC000587754010 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc(N(C)C)nc2)N1 ZINC000587754012 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc(N(C)C)nc2)N1 ZINC000587754014 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc(N(C)C)nc2)N1 ZINC000587754016 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](CCCNC(=O)C2CC2)N1 ZINC000587754298 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](CCCNC(=O)C2CC2)N1 ZINC000587754300 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](CCCNC(=O)C2CC2)N1 ZINC000587754302 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](CCCNC(=O)C2CC2)N1 ZINC000587754304 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](CNC(=O)C2CCCC2)N1 ZINC000587754720 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](CNC(=O)C2CCCC2)N1 ZINC000587754722 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](CNC(=O)C2CCCC2)N1 ZINC000587754724 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](CNC(=O)C2CCCC2)N1 ZINC000587754726 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](CNC(=O)C2CCCC2)N1 ZINC000587754873 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](CNC(=O)C2CCCC2)N1 ZINC000587754874 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](CNC(=O)C2CCCC2)N1 ZINC000587754875 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](CNC(=O)C2CCCC2)N1 ZINC000587754876 FG Annotated Anodyne CC(C)NC(=O)[C@]1(C(C)C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587755106 FG Annotated Anodyne CC(C)NC(=O)[C@@]1(C(C)C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587755113 FG Annotated Anodyne CC(C)NC(=O)[C@@]1(C(C)C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587755115 FG Annotated Anodyne CC(C)NC(=O)[C@]1(C(C)C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587755117 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccnc(N(C)C)n2)N1 ZINC000587755161 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccnc(N(C)C)n2)N1 ZINC000587755162 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccnc(N(C)C)n2)N1 ZINC000587755163 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccnc(N(C)C)n2)N1 ZINC000587755164 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](CNC(=O)C2CCC2)N1 ZINC000587755392 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](CNC(=O)C2CCC2)N1 ZINC000587755394 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](CNC(=O)C2CCC2)N1 ZINC000587755395 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](CNC(=O)C2CCC2)N1 ZINC000587755397 FG Annotated Anodyne CC(C)NC(=O)[C@]1(C(C)C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587755459 FG Annotated Anodyne CC(C)NC(=O)[C@@]1(C(C)C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587755460 FG Annotated Anodyne CC(C)NC(=O)[C@@]1(C(C)C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587755461 FG Annotated Anodyne CC(C)NC(=O)[C@]1(C(C)C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587755462 FG Annotated Anodyne COc1c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)nn1C ZINC000587755585 FG Annotated Anodyne COc1c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)nn1C ZINC000587755599 FG Annotated Anodyne COc1c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)nn1C ZINC000587755600 FG Annotated Anodyne COc1c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)nn1C ZINC000587755602 FG Annotated Anodyne COCCn1ccnc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756137 FG Annotated Anodyne COCCn1ccnc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756139 FG Annotated Anodyne COCCn1ccnc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756141 FG Annotated Anodyne COCCn1ccnc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756142 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](CNC(=O)C2CCC2)N1 ZINC000587756168 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](CNC(=O)C2CCC2)N1 ZINC000587756171 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](CNC(=O)C2CCC2)N1 ZINC000587756174 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](CNC(=O)C2CCC2)N1 ZINC000587756177 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccn2CC(=O)O)N1 ZINC000587756216 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccn2CC(=O)O)N1 ZINC000587756218 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccn2CC(=O)O)N1 ZINC000587756219 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccn2CC(=O)O)N1 ZINC000587756220 FG Annotated Anodyne CC[C@@]1(Cn2cncn2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587756380 FG Annotated Anodyne CC[C@@]1(Cn2cncn2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587756387 FG Annotated Anodyne CC[C@]1(Cn2cncn2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587756389 FG Annotated Anodyne CC[C@]1(Cn2cncn2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587756390 FG Annotated Anodyne CC(C)[C@]1(c2ncnn2C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756729 FG Annotated Anodyne CC(C)[C@@]1(c2ncnn2C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756736 FG Annotated Anodyne CC(C)[C@]1(c2ncnn2C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756738 FG Annotated Anodyne CC(C)[C@@]1(c2ncnn2C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756739 FG Annotated Anodyne CC1=C[C@@]2(CC(=O)N1C)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587756765 FG Annotated Anodyne CC1=C[C@@]2(CC(=O)N1C)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587756767 FG Annotated Anodyne CC1=C[C@]2(CC(=O)N1C)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587756768 FG Annotated Anodyne CC1=C[C@]2(CC(=O)N1C)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587756770 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(C(C)(C)n2cncn2)N1 ZINC000587756778 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(C(C)(C)n2cncn2)N1 ZINC000587756801 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(C(C)(C)n2cncn2)N1 ZINC000587756803 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(C(C)(C)n2cncn2)N1 ZINC000587756805 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)([C@@H](C)n2cncn2)N1 ZINC000587756866 FG Annotated Anodyne C[C@H](n1cncn1)[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587756878 FG Annotated Anodyne C[C@H](n1cncn1)[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587756879 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)([C@@H](C)n2cncn2)N1 ZINC000587756880 FG Annotated Anodyne Cc1nn(C)cc1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587757209 FG Annotated Anodyne Cc1nn(C)cc1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587757214 FG Annotated Anodyne Cc1nn(C)cc1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587757215 FG Annotated Anodyne Cc1nn(C)cc1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587757216 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(C(C)(C)n2cncn2)N1 ZINC000587757280 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(C(C)(C)n2cncn2)N1 ZINC000587757282 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(C(C)(C)n2cncn2)N1 ZINC000587757284 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(C(C)(C)n2cncn2)N1 ZINC000587757285 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC#N)(c2nccn2C)N1 ZINC000587757364 FG Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](CC#N)(c2nccn2C)N1 ZINC000587757365 FG Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CC#N)(c2nccn2C)N1 ZINC000587757367 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC#N)(c2nccn2C)N1 ZINC000587757368 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3c2cnn3C)N1 ZINC000587757636 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3c2cnn3C)N1 ZINC000587757639 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3c2cnn3C)N1 ZINC000587757641 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3c2cnn3C)N1 ZINC000587757643 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](Cn2cncn2)(C2CC2)N1 ZINC000587758267 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](Cn2cncn2)(C2CC2)N1 ZINC000587758269 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](Cn2cncn2)(C2CC2)N1 ZINC000587758271 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](Cn2cncn2)(C2CC2)N1 ZINC000587758272 FG Annotated Anodyne Cc1nc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cn1C ZINC000587758918 FG Annotated Anodyne Cc1nc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1C ZINC000587758920 FG Annotated Anodyne Cc1nc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cn1C ZINC000587758924 FG Annotated Anodyne Cc1nc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1C ZINC000587758926 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(CCn2cncn2)N1 ZINC000587758928 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(CCn2cncn2)N1 ZINC000587758931 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CCn2cncn2)N1 ZINC000587758935 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CCn2cncn2)N1 ZINC000587758940 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CN(C3CC3)C[C@H]2C)N1 ZINC000587759290 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CN(C3CC3)C[C@H]2C)N1 ZINC000587759294 FG Annotated Anodyne C[C@H]1CN(C2CC2)C[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587759296 FG Annotated Anodyne C[C@H]1CN(C2CC2)C[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587759298 FG Annotated Anodyne Cc1nc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cn1C ZINC000587759300 FG Annotated Anodyne Cc1nc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1C ZINC000587759302 FG Annotated Anodyne Cc1nc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cn1C ZINC000587759304 FG Annotated Anodyne Cc1nc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1C ZINC000587759306 FG Annotated Anodyne CC1=C[C@@]2(CC(=O)N1C)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587759650 FG Annotated Anodyne CC1=C[C@@]2(CC(=O)N1C)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587759651 FG Annotated Anodyne CC1=C[C@]2(CC(=O)N1C)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587759652 FG Annotated Anodyne CC1=C[C@]2(CC(=O)N1C)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587759653 FG Annotated Anodyne CCN1C(=O)C[C@@]2(C=C1C)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587759773 FG Annotated Anodyne CCN1C(=O)C[C@]2(C=C1C)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587759777 FG Annotated Anodyne CCN1C(=O)C[C@@]2(C=C1C)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587759778 FG Annotated Anodyne CCN1C(=O)C[C@]2(C=C1C)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587759780 FG Annotated Anodyne CCN1C(=O)C[C@@]2(C=C1C)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587759988 FG Annotated Anodyne CCN1C(=O)C[C@]2(C=C1C)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587759990 FG Annotated Anodyne CCN1C(=O)C[C@@]2(C=C1C)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587759992 FG Annotated Anodyne CCN1C(=O)C[C@]2(C=C1C)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587759994 FG Annotated Anodyne CC(C)[C@@]1(Cn2cncn2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587760018 FG Annotated Anodyne CC(C)[C@]1(Cn2cncn2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587760022 FG Annotated Anodyne CC(C)[C@@]1(Cn2cncn2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587760024 FG Annotated Anodyne CC(C)[C@]1(Cn2cncn2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587760026 FG Annotated Anodyne Cc1nn(C)cc1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587760130 FG Annotated Anodyne Cc1nn(C)cc1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587760131 FG Annotated Anodyne Cc1nn(C)cc1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587760132 FG Annotated Anodyne Cc1nn(C)cc1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587760133 FG Annotated Anodyne COCCn1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587760254 FG Annotated Anodyne COCCn1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587760255 FG Annotated Anodyne COCCn1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587760256 FG Annotated Anodyne COCCn1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587760257 FG Annotated Anodyne COc1c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)nn1C ZINC000587760315 FG Annotated Anodyne COc1c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)nn1C ZINC000587760316 FG Annotated Anodyne COc1c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)nn1C ZINC000587760317 FG Annotated Anodyne COc1c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)nn1C ZINC000587760318 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](Cn2cncn2)(C2CC2)N1 ZINC000587760688 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](Cn2cncn2)(C2CC2)N1 ZINC000587760689 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](Cn2cncn2)(C2CC2)N1 ZINC000587760691 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](Cn2cncn2)(C2CC2)N1 ZINC000587760693 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)([C@@H](C)n2cncn2)N1 ZINC000587760784 FG Annotated Anodyne C[C@H](n1cncn1)[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587760785 FG Annotated Anodyne C[C@H](n1cncn1)[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587760786 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)([C@@H](C)n2cncn2)N1 ZINC000587760787 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CN(C3CC3)C[C@H]2C)N1 ZINC000587760883 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CN(C3CC3)C[C@H]2C)N1 ZINC000587760884 FG Annotated Anodyne C[C@H]1CN(C2CC2)C[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587760885 FG Annotated Anodyne C[C@H]1CN(C2CC2)C[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587760886 FG Annotated Anodyne CC(C)[C@]1(c2ncnn2C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587760991 FG Annotated Anodyne CC(C)[C@@]1(c2ncnn2C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587760992 FG Annotated Anodyne CC(C)[C@]1(c2ncnn2C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587760993 FG Annotated Anodyne CC(C)[C@@]1(c2ncnn2C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587760994 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3c2cnn3C)N1 ZINC000587761007 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3c2cnn3C)N1 ZINC000587761008 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3c2cnn3C)N1 ZINC000587761009 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3c2cnn3C)N1 ZINC000587761010 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3nn(C)cc32)N1 ZINC000587761135 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3nn(C)cc32)N1 ZINC000587761136 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3nn(C)cc32)N1 ZINC000587761137 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3nn(C)cc32)N1 ZINC000587761138 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(Cc2cnn(C)c2)N1 ZINC000587761163 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(Cc2cnn(C)c2)N1 ZINC000587761164 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(Cc2cnn(C)c2)N1 ZINC000587761165 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(Cc2cnn(C)c2)N1 ZINC000587761166 FG Annotated Anodyne CC(C)[C@@]1(Cn2cncn2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587761503 FG Annotated Anodyne CC(C)[C@]1(Cn2cncn2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587761504 FG Annotated Anodyne CC(C)[C@@]1(Cn2cncn2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587761505 FG Annotated Anodyne CC(C)[C@]1(Cn2cncn2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587761506 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3nn(C)cc32)N1 ZINC000587761760 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3nn(C)cc32)N1 ZINC000587761761 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3nn(C)cc32)N1 ZINC000587761763 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3nn(C)cc32)N1 ZINC000587761764 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(Cc2cnn(C)c2)N1 ZINC000587762112 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(Cc2cnn(C)c2)N1 ZINC000587762113 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(Cc2cnn(C)c2)N1 ZINC000587762114 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(Cc2cnn(C)c2)N1 ZINC000587762115 FG Annotated Anodyne Cc1cc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)nn1C ZINC000587762484 FG Annotated Anodyne Cc1cc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)nn1C ZINC000587762485 FG Annotated Anodyne Cc1cc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)nn1C ZINC000587762486 FG Annotated Anodyne Cc1cc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)nn1C ZINC000587762487 FG Annotated Anodyne CC[C@@]1(Cn2cncn2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587762668 FG Annotated Anodyne CC[C@@]1(Cn2cncn2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587762669 FG Annotated Anodyne CC[C@]1(Cn2cncn2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587762670 FG Annotated Anodyne CC[C@]1(Cn2cncn2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587762671 FG Annotated Anodyne COCCn1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587762684 FG Annotated Anodyne COCCn1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587762685 FG Annotated Anodyne COCCn1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587762686 FG Annotated Anodyne COCCn1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587762687 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(CCn2cncn2)N1 ZINC000587762696 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(CCn2cncn2)N1 ZINC000587762697 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CCn2cncn2)N1 ZINC000587762698 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CCn2cncn2)N1 ZINC000587762699 FG Annotated Anodyne Cc1c([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cnn1C ZINC000587763096 FG Annotated Anodyne Cc1c([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cnn1C ZINC000587763097 FG Annotated Anodyne Cc1c([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cnn1C ZINC000587763098 FG Annotated Anodyne Cc1c([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cnn1C ZINC000587763099 FG Annotated Anodyne Cc1c([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cnn1C ZINC000587763308 FG Annotated Anodyne Cc1c([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cnn1C ZINC000587763309 FG Annotated Anodyne Cc1c([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cnn1C ZINC000587763310 FG Annotated Anodyne Cc1c([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cnn1C ZINC000587763311 FG Annotated Anodyne COCn1ncc(C)c1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587763676 FG Annotated Anodyne COCn1ncc(C)c1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587763677 FG Annotated Anodyne COCn1ncc(C)c1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587763678 FG Annotated Anodyne COCn1ncc(C)c1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587763679 FG Annotated Anodyne COCn1ncc(C)c1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587763865 FG Annotated Anodyne COCn1ncc(C)c1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587763866 FG Annotated Anodyne COCn1ncc(C)c1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587763867 FG Annotated Anodyne COCn1ncc(C)c1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587763869 FG Annotated Anodyne Cc1cc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)n(C)n1 ZINC000587764160 FG Annotated Anodyne Cc1cc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)n(C)n1 ZINC000587764161 FG Annotated Anodyne Cc1cc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)n(C)n1 ZINC000587764162 FG Annotated Anodyne Cc1cc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)n(C)n1 ZINC000587764163 FG Annotated Anodyne Cc1cc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)n(C)n1 ZINC000587764799 FG Annotated Anodyne Cc1cc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)n(C)n1 ZINC000587764800 FG Annotated Anodyne Cc1cc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)n(C)n1 ZINC000587764801 FG Annotated Anodyne Cc1cc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)n(C)n1 ZINC000587764802 FG Annotated Anodyne CC(=O)N1CCC[C@]2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587765022 FG Annotated Anodyne CC(=O)N1CCC[C@@]2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587765024 FG Annotated Anodyne CC(=O)N1CCC[C@@]2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587765026 FG Annotated Anodyne CC(=O)N1CCC[C@]2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587765027 FG Annotated Anodyne C#CCN1CCC2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587765043 FG Annotated Mild C#CCN1CCC2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587765044 FG Annotated Mild COC(=O)N1CCC2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587765738 FG Annotated Anodyne COC(=O)N1CCC2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587765743 FG Annotated Anodyne COC(=O)N1CCC2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587765795 FG Annotated Anodyne COC(=O)N1CCC2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587765796 FG Annotated Anodyne COCCN1CCC2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587766145 FG Annotated Anodyne COCCN1CCC2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587766149 FG Annotated Anodyne CCOC(=O)N1CC[C@@]2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587766387 FG Annotated Anodyne CCOC(=O)N1CC[C@]2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587766389 FG Annotated Anodyne CCOC(=O)N1CC[C@@]2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587766391 FG Annotated Anodyne CCOC(=O)N1CC[C@]2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587766394 FG Annotated Anodyne CC(=O)N1CCC[C@]2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587766680 FG Annotated Anodyne CC(=O)N1CCC[C@@]2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587766681 FG Annotated Anodyne CC(=O)N1CCC[C@@]2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587766682 FG Annotated Anodyne CC(=O)N1CCC[C@]2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587766684 FG Annotated Anodyne CCOC(=O)N1CC[C@@]2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587766685 FG Annotated Anodyne CCOC(=O)N1CC[C@]2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587766686 FG Annotated Anodyne CCOC(=O)N1CC[C@@]2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587766688 FG Annotated Anodyne CCOC(=O)N1CC[C@]2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587766689 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](C(C)(C)N2CCOCC2)N1 ZINC000587766886 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](C(C)(C)N2CCOCC2)N1 ZINC000587766887 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](C(C)(C)N2CCOCC2)N1 ZINC000587766888 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](C(C)(C)N2CCOCC2)N1 ZINC000587766890 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](C(C)(C)N2CCOCC2)N1 ZINC000587767009 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](C(C)(C)N2CCOCC2)N1 ZINC000587767011 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](C(C)(C)N2CCOCC2)N1 ZINC000587767013 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](C(C)(C)N2CCOCC2)N1 ZINC000587767015 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(CO)n2)N1 ZINC000587767882 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(CO)n2)N1 ZINC000587767884 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(CO)n2)N1 ZINC000587767886 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(CO)n2)N1 ZINC000587767888 FG Annotated Anodyne Cc1cc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)nn1C ZINC000587768056 FG Annotated Anodyne Cc1cc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)nn1C ZINC000587768057 FG Annotated Anodyne Cc1cc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)nn1C ZINC000587768058 FG Annotated Anodyne Cc1cc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)nn1C ZINC000587768060 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCN(C3CC3)C(=O)C2)N1 ZINC000587768228 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCN(C3CC3)C(=O)C2)N1 ZINC000587768229 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCN(C3CC3)C(=O)C2)N1 ZINC000587768230 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCN(C3CC3)C(=O)C2)N1 ZINC000587768231 FG Annotated Anodyne Cc1nccnc1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587768492 FG Annotated Anodyne Cc1nccnc1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587768498 FG Annotated Anodyne Cc1nccnc1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587768500 FG Annotated Anodyne Cc1nccnc1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587768501 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(CO)n2)N1 ZINC000587768953 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(CO)n2)N1 ZINC000587768954 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(CO)n2)N1 ZINC000587768955 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(CO)n2)N1 ZINC000587768956 FG Annotated Anodyne C=CN1CC[C@H]([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)C1=O ZINC000587769183 FG Annotated Anodyne C=CN1CC[C@H]([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)C1=O ZINC000587769184 FG Annotated Anodyne C=CN1CC[C@H]([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)C1=O ZINC000587769186 FG Annotated Anodyne C=CN1CC[C@H]([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)C1=O ZINC000587769187 FG Annotated Anodyne C#CCN1CCC2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587769331 FG Annotated Mild C#CCN1CCC2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587769333 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(/C=C/N2CCOCC2)N1 ZINC000587769429 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(/C=C/N2CCOCC2)N1 ZINC000587769432 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(/C=C/N2CCOCC2)N1 ZINC000587769434 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(/C=C/N2CCOCC2)N1 ZINC000587769436 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(CCN2CCOCC2)N1 ZINC000587769494 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(CCN2CCOCC2)N1 ZINC000587769496 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CCN2CCOCC2)N1 ZINC000587769501 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CCN2CCOCC2)N1 ZINC000587769503 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ncccc2O)N1 ZINC000587769549 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ncccc2O)N1 ZINC000587769550 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ncccc2O)N1 ZINC000587769551 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ncccc2O)N1 ZINC000587769552 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCn3cncc32)N1 ZINC000587770294 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCn3cncc32)N1 ZINC000587770297 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCn3cncc32)N1 ZINC000587770299 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCn3cncc32)N1 ZINC000587770301 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(O)cn2)N1 ZINC000587770308 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(O)cn2)N1 ZINC000587770310 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(O)cn2)N1 ZINC000587770311 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(O)cn2)N1 ZINC000587770313 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(CCN2CCOCC2)N1 ZINC000587770649 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(CCN2CCOCC2)N1 ZINC000587770650 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CCN2CCOCC2)N1 ZINC000587770652 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CCN2CCOCC2)N1 ZINC000587770654 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(CO)ccn2)N1 ZINC000587770927 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(CO)ccn2)N1 ZINC000587770928 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(CO)ccn2)N1 ZINC000587770929 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(CO)ccn2)N1 ZINC000587770930 FG Annotated Anodyne C=CN1CC[C@H]([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)C1=O ZINC000587771167 FG Annotated Anodyne C=CN1CC[C@H]([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)C1=O ZINC000587771172 FG Annotated Anodyne C=CN1CC[C@H]([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)C1=O ZINC000587771174 FG Annotated Anodyne C=CN1CC[C@H]([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)C1=O ZINC000587771175 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccnc(O)c2)N1 ZINC000587771513 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccnc(O)c2)N1 ZINC000587771515 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccnc(O)c2)N1 ZINC000587771516 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccnc(O)c2)N1 ZINC000587771517 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccnc2O)N1 ZINC000587771572 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccnc2O)N1 ZINC000587771573 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccnc2O)N1 ZINC000587771574 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccnc2O)N1 ZINC000587771578 FG Annotated Anodyne Cc1ncc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587771666 FG Annotated Anodyne Cc1ncc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587771668 FG Annotated Anodyne Cc1ncc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587771670 FG Annotated Anodyne Cc1ncc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587771671 FG Annotated Anodyne COCCN1CCC2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587771689 FG Annotated Anodyne COCCN1CCC2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587771690 FG Annotated Anodyne COc1ccnc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587771735 FG Annotated Anodyne COc1ccnc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587771747 FG Annotated Anodyne COc1ccnc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587771748 FG Annotated Anodyne COc1ccnc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587771750 FG Annotated Anodyne COCc1ncc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587772212 FG Annotated Anodyne COCc1ncc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587772219 FG Annotated Anodyne COCc1ncc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587772220 FG Annotated Anodyne COCc1ncc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587772222 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccncc2O)N1 ZINC000587772249 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccncc2O)N1 ZINC000587772251 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccncc2O)N1 ZINC000587772253 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccncc2O)N1 ZINC000587772255 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCN(C3CC3)C(=O)C2)N1 ZINC000587772262 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCN(C3CC3)C(=O)C2)N1 ZINC000587772264 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCN(C3CC3)C(=O)C2)N1 ZINC000587772266 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCN(C3CC3)C(=O)C2)N1 ZINC000587772268 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3ncccn23)N1 ZINC000587772270 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3ncccn23)N1 ZINC000587772288 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3ncccn23)N1 ZINC000587772289 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3ncccn23)N1 ZINC000587772290 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3cnccn23)N1 ZINC000587772291 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3cnccn23)N1 ZINC000587772292 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3cnccn23)N1 ZINC000587772293 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3cnccn23)N1 ZINC000587772294 FG Annotated Anodyne Cc1nccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587772295 FG Annotated Anodyne Cc1nccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587772296 FG Annotated Anodyne Cc1nccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587772297 FG Annotated Anodyne Cc1nccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587772299 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccnc(O)c2)N1 ZINC000587772609 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccnc(O)c2)N1 ZINC000587772612 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccnc(O)c2)N1 ZINC000587772614 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccnc(O)c2)N1 ZINC000587772616 FG Annotated Anodyne COCc1ncc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587772713 FG Annotated Anodyne COCc1ncc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587772714 FG Annotated Anodyne COCc1ncc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587772715 FG Annotated Anodyne COCc1ncc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587772716 FG Annotated Anodyne COc1nccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587772749 FG Annotated Anodyne COc1nccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587772750 FG Annotated Anodyne COc1nccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587772751 FG Annotated Anodyne COc1nccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587772752 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3cnccn23)N1 ZINC000587773051 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3cnccn23)N1 ZINC000587773052 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3cnccn23)N1 ZINC000587773054 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3cnccn23)N1 ZINC000587773055 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(Cc2ncccn2)N1 ZINC000587773132 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(Cc2ncccn2)N1 ZINC000587773136 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(O)nc2)N1 ZINC000587773278 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(O)nc2)N1 ZINC000587773281 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(O)nc2)N1 ZINC000587773282 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(O)nc2)N1 ZINC000587773283 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(Cc2ncccn2)N1 ZINC000587773388 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(Cc2ncccn2)N1 ZINC000587773389 FG Annotated Anodyne COc1cnc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)nc1 ZINC000587773433 FG Annotated Anodyne COc1cnc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)nc1 ZINC000587773434 FG Annotated Anodyne COc1cnc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)nc1 ZINC000587773435 FG Annotated Anodyne COc1cnc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)nc1 ZINC000587773436 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(O)nc2)N1 ZINC000587773694 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(O)nc2)N1 ZINC000587773695 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(O)nc2)N1 ZINC000587773697 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(O)nc2)N1 ZINC000587773699 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccncc2O)N1 ZINC000587773828 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccncc2O)N1 ZINC000587773829 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccncc2O)N1 ZINC000587773830 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccncc2O)N1 ZINC000587773831 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccnc2O)N1 ZINC000587773908 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccnc2O)N1 ZINC000587773909 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccnc2O)N1 ZINC000587773910 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccnc2O)N1 ZINC000587773911 FG Annotated Anodyne COc1cnc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587774204 FG Annotated Anodyne COc1cnc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587774205 FG Annotated Anodyne COc1cnc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587774206 FG Annotated Anodyne COc1cnc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587774207 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cnc(C#N)cn2)N1 ZINC000587774224 FG Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cnc(C#N)cn2)N1 ZINC000587774225 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cnc(C#N)cn2)N1 ZINC000587774226 FG Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cnc(C#N)cn2)N1 ZINC000587774227 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(CO)ccn2)N1 ZINC000587774240 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(CO)ccn2)N1 ZINC000587774241 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(CO)ccn2)N1 ZINC000587774242 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(CO)ccn2)N1 ZINC000587774243 FG Annotated Anodyne COc1ccnc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587774312 FG Annotated Anodyne COc1ccnc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587774313 FG Annotated Anodyne COc1ccnc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587774314 FG Annotated Anodyne COc1ccnc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587774315 FG Annotated Anodyne COc1ncc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587774344 FG Annotated Anodyne COc1ncc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587774345 FG Annotated Anodyne COc1ncc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587774346 FG Annotated Anodyne COc1ncc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587774347 FG Annotated Anodyne COc1cnc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587774483 FG Annotated Anodyne COc1cnc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587774484 FG Annotated Anodyne COc1cnc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587774485 FG Annotated Anodyne COc1cnc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587774487 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCn3cncc32)N1 ZINC000587774534 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCn3cncc32)N1 ZINC000587774536 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCn3cncc32)N1 ZINC000587774537 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCn3cncc32)N1 ZINC000587774538 FG Annotated Anodyne COC[C@]1(c2ccccn2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587774544 FG Annotated Anodyne COC[C@@]1(c2ccccn2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587774547 FG Annotated Anodyne COC[C@@]1(c2ccccn2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587774548 FG Annotated Anodyne COC[C@]1(c2ccccn2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587774549 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cnc(C#N)cn2)N1 ZINC000587774560 FG Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cnc(C#N)cn2)N1 ZINC000587774562 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cnc(C#N)cn2)N1 ZINC000587774563 FG Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cnc(C#N)cn2)N1 ZINC000587774564 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ncccc2O)N1 ZINC000587774591 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ncccc2O)N1 ZINC000587774592 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ncccc2O)N1 ZINC000587774593 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ncccc2O)N1 ZINC000587774594 FG Annotated Anodyne Cc1nccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587774613 FG Annotated Anodyne Cc1nccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587774614 FG Annotated Anodyne Cc1nccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587774615 FG Annotated Anodyne Cc1nccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587774616 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(Cc2cnccn2)N1 ZINC000587774665 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(Cc2cnccn2)N1 ZINC000587774666 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(Cc2cnccn2)N1 ZINC000587774667 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(Cc2cnccn2)N1 ZINC000587774668 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(Cc2cnccn2)N1 ZINC000587774693 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(Cc2cnccn2)N1 ZINC000587774694 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(Cc2cnccn2)N1 ZINC000587774695 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(Cc2cnccn2)N1 ZINC000587774696 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cn3cccnc3n2)N1 ZINC000587774701 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cn3cccnc3n2)N1 ZINC000587774702 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cn3cccnc3n2)N1 ZINC000587774703 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cn3cccnc3n2)N1 ZINC000587774704 FG Annotated Anodyne COC[C@@]1(c2ccccn2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587774765 FG Annotated Anodyne COC[C@]1(c2ccccn2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587774766 FG Annotated Anodyne COC[C@]1(c2ccccn2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587774767 FG Annotated Anodyne COC[C@@]1(c2ccccn2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587774768 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(O)cn2)N1 ZINC000587774797 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(O)cn2)N1 ZINC000587774798 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(O)cn2)N1 ZINC000587774799 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(O)cn2)N1 ZINC000587774800 FG Annotated Anodyne Cc1nccnc1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587774801 FG Annotated Anodyne Cc1nccnc1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587774802 FG Annotated Anodyne Cc1nccnc1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587774803 FG Annotated Anodyne Cc1nccnc1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587774804 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(/C=C/N2CCOCC2)N1 ZINC000587774810 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(/C=C/N2CCOCC2)N1 ZINC000587774811 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(/C=C/N2CCOCC2)N1 ZINC000587774812 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(/C=C/N2CCOCC2)N1 ZINC000587774813 FG Annotated Anodyne COc1ncc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587775168 FG Annotated Anodyne COc1ncc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587775170 FG Annotated Anodyne COc1ncc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587775171 FG Annotated Anodyne COc1ncc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587775173 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3ncccn23)N1 ZINC000587775637 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3ncccn23)N1 ZINC000587775638 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3ncccn23)N1 ZINC000587775639 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3ncccn23)N1 ZINC000587775640 FG Annotated Anodyne Cc1ncc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587775689 FG Annotated Anodyne Cc1ncc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587775690 FG Annotated Anodyne Cc1ncc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587775691 FG Annotated Anodyne Cc1ncc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587775692 FG Annotated Anodyne COc1cnc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)nc1 ZINC000587775941 FG Annotated Anodyne COc1cnc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)nc1 ZINC000587775942 FG Annotated Anodyne COc1cnc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)nc1 ZINC000587775944 FG Annotated Anodyne COc1cnc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)nc1 ZINC000587775945 FG Annotated Anodyne Cc1cc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)ncn1 ZINC000587776184 FG Annotated Anodyne Cc1cc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)ncn1 ZINC000587776186 FG Annotated Anodyne Cc1cc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)ncn1 ZINC000587776187 FG Annotated Anodyne Cc1cc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)ncn1 ZINC000587776188 FG Annotated Anodyne Cc1cc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)ncn1 ZINC000587776189 FG Annotated Anodyne Cc1cc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)ncn1 ZINC000587776191 FG Annotated Anodyne Cc1cc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)ncn1 ZINC000587776192 FG Annotated Anodyne Cc1cc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)ncn1 ZINC000587776193 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(Cc2ncccn2)N1 ZINC000587776336 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(Cc2ncccn2)N1 ZINC000587776337 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(Cc2ncccn2)N1 ZINC000587776338 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(Cc2ncccn2)N1 ZINC000587776339 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cn3cccnc3n2)N1 ZINC000587776551 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cn3cccnc3n2)N1 ZINC000587776553 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cn3cccnc3n2)N1 ZINC000587776555 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cn3cccnc3n2)N1 ZINC000587776557 FG Annotated Anodyne COc1nccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587776611 FG Annotated Anodyne COc1nccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587776612 FG Annotated Anodyne COc1nccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587776613 FG Annotated Anodyne COc1nccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587776614 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3ncncc32)N1 ZINC000587777272 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3ncncc32)N1 ZINC000587777275 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3ncncc32)N1 ZINC000587777276 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3ncncc32)N1 ZINC000587777277 FG Annotated Anodyne CCOC(=O)Cc1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587777318 FG Annotated Anodyne CCOC(=O)Cc1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000587777348 FG Annotated Anodyne CCOC(=O)Cc1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587777366 FG Annotated Anodyne CCOC(=O)Cc1nc2cc(C(=O)OC)c(Nc3ccccc3)c(F)c2[nH]1 ZINC000587777371 FG Annotated Anodyne CCOC(=O)Cc1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587777389 FG Annotated Anodyne CCOC(=O)Cc1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587777423 FG Annotated Anodyne CCOC(=O)Cc1nc2ccc(Oc3ccc(C(=O)OC)cc3)cc2[nH]1 ZINC000587777435 FG Annotated Anodyne CCOC(=O)Cc1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587777480 FG Annotated Anodyne CCOC(=O)Cc1nc2cc(OCC(C)C)c(Br)cc2[nH]1 ZINC000587777533 FG Annotated Anodyne CCOC(=O)Cc1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000587777564 FG Annotated Anodyne CCOC(=O)Cc1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587777687 FG Annotated Anodyne CCOC(=O)Cc1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000587777774 FG Annotated Anodyne CCOc1ccc(OCC)c(-c2nc3cc4c(cc3[nH]2)OCC(=O)N4)c1 ZINC000587778021 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc3c(cn2)OCO3)N1 ZINC000587778194 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc3c(cn2)OCO3)N1 ZINC000587778195 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc3c(cn2)OCO3)N1 ZINC000587778196 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc3c(cn2)OCO3)N1 ZINC000587778197 FG Annotated Anodyne CCOc1ccc(OCC)c(-c2nc3ccc(-n4cnnn4)cc3[nH]2)c1 ZINC000587778508 FG Annotated Anodyne Cc1ncncc1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587778693 FG Annotated Anodyne Cc1ncncc1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587778694 FG Annotated Anodyne Cc1ncncc1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587778695 FG Annotated Anodyne Cc1ncncc1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587778696 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3ncncc32)N1 ZINC000587778910 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3ncncc32)N1 ZINC000587778911 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3ncncc32)N1 ZINC000587778912 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3ncncc32)N1 ZINC000587778913 FG Annotated Anodyne CCOCCOCc1nc2cc(C(=O)OCC)cc(Br)c2[nH]1 ZINC000587779280 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc3c(cn2)OCO3)N1 ZINC000587779399 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc3c(cn2)OCO3)N1 ZINC000587779400 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc3c(cn2)OCO3)N1 ZINC000587779401 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc3c(cn2)OCO3)N1 ZINC000587779402 FG Annotated Anodyne Cc1ncncc1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587780059 FG Annotated Anodyne Cc1ncncc1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587780060 FG Annotated Anodyne Cc1ncncc1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587780061 FG Annotated Anodyne Cc1ncncc1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587780062 FG Annotated Anodyne CCOc1cc(-c2nc3cccc(S(=O)(=O)N(C)C)c3[nH]2)ccc1C ZINC000587780201 FG Annotated Anodyne CCOc1ccccc1OCc1nc2ccc(C(=O)OC)c(OC)c2[nH]1 ZINC000587780606 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc(COC/C=C/c3ccccc3)[nH]c2c1 ZINC000587780819 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc(COC/C=C\c3ccccc3)[nH]c2c1 ZINC000587780820 FG Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(CC(=O)OCc3ccccc3)nc2c1 ZINC000587780946 FG Annotated Anodyne N#Cc1cc(Br)c2[nH]c(CC(=O)OCc3ccccc3)nc2c1 ZINC000587780962 FG Annotated Mild O=C(Cc1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1)OCc1ccccc1 ZINC000587780986 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(COC/C=C/c3ccccc3)[nH]c12 ZINC000587781200 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(COC/C=C\c3ccccc3)[nH]c12 ZINC000587781201 FG Annotated Anodyne CCOc1ccccc1OCc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587781508 FG Annotated Bother Cc1nc2[nH]c(CC(=O)OCc3ccccc3)nc2cc1Br ZINC000587781837 FG Annotated Anodyne Cc1c(Br)cnc2[nH]c(CC(=O)OCc3ccccc3)nc12 ZINC000587781961 FG Annotated Anodyne Oc1ccc(OCc2ccccc2)cc1-c1nc2c(O)nc(S)nc2[nH]1 ZINC000587782200 FG Annotated Anodyne O=C(Cc1nc2ccc(Br)c(O)c2[nH]1)OCc1ccccc1 ZINC000587782601 FG Annotated Anodyne O=C(Cc1nc2c(F)cnc(Br)c2[nH]1)OCc1ccccc1 ZINC000587782721 FG Annotated Anodyne O=C(Cc1nc2cc(-n3cccn3)c(F)cc2[nH]1)OCc1ccccc1 ZINC000587782881 FG Annotated Anodyne COC(=O)Cc1ccccc1-c1nc2cc(Br)c(C)nc2[nH]1 ZINC000587782925 FG Annotated Anodyne COC(=O)Cc1ccccc1-c1nc2cc(C(=O)OC)cc(Cl)c2[nH]1 ZINC000587782930 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3ccccc3CC(=O)OC)[nH]c2c1 ZINC000587782951 FG Annotated Anodyne N=c1[nH]c2nc(-c3cc(OCc4ccccc4)ccc3O)nc-2c(Cl)[nH]1 ZINC000587783130 FG Annotated Anodyne COC(=O)Cc1ccccc1-c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587783309 FG Annotated Anodyne COC(=O)Cc1ccccc1-c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587783394 FG Annotated Anodyne COC(=O)Cc1ccccc1-c1nc2ccc(Br)c(O)c2[nH]1 ZINC000587783453 FG Annotated Anodyne COC(=O)C[C@H](C)Cc1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587783471 FG Annotated Anodyne COC(=O)Cc1ccccc1-c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587783611 FG Annotated Anodyne COc1cc(-c2nc3cc(Br)ncc3[nH]2)cc(OC)c1O ZINC000587783908 FG Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(CCOCC3CC3)nc2c1 ZINC000587783947 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(CCOCC3CC3)nc2c1 ZINC000587784374 FG Annotated Anodyne COc1cc(-c2nc3ccc(Br)nc3[nH]2)cc(OC)c1O ZINC000587784497 FG Annotated Anodyne COc1cc(/C=C\c2nc3ccnc(Br)c3[nH]2)cc(O)c1O ZINC000587784555 FG Annotated Clean COc1cc(/C=C/c2nc3ccnc(Br)c3[nH]2)cc(O)c1O ZINC000587784556 FG Annotated Clean COc1cc(-c2nc3cc(-n4cccn4)c(F)cc3[nH]2)cc(OC)c1O ZINC000587784613 FG Annotated Anodyne COc1cc(-c2nc3cncc(Br)c3[nH]2)cc(OC)c1O ZINC000587784819 FG Annotated Anodyne COc1cc(/C=C\c2nc3c(Br)ccnc3[nH]2)cc(O)c1O ZINC000587784857 FG Annotated Clean COc1cc(/C=C/c2nc3c(Br)ccnc3[nH]2)cc(O)c1O ZINC000587784858 FG Annotated Clean COc1cc(/C=C\c2nc3cc(Br)ncc3[nH]2)cc(O)c1O ZINC000587784995 FG Annotated Clean COc1cc(/C=C/c2nc3cc(Br)ncc3[nH]2)cc(O)c1O ZINC000587784996 FG Annotated Clean N=c1nc(O)c2nc(/C=C/c3ccc(OCc4ccccc4)cc3)[nH]c2[nH]1 ZINC000587785032 FG Annotated Anodyne N=c1nc(O)c2nc(/C=C\c3ccc(OCc4ccccc4)cc3)[nH]c2[nH]1 ZINC000587785036 FG Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3cc(OC)c(O)c(OC)c3)[nH]c2c1 ZINC000587785145 FG Annotated Anodyne COc1cc(/C=C/c2nc3cc4c(cc3[nH]2)NC(=O)CC4)cc(O)c1O ZINC000587785263 FG Annotated Clean COc1cc(/C=C\c2nc3cc4c(cc3[nH]2)NC(=O)CC4)cc(O)c1O ZINC000587785264 FG Annotated Clean COC(=O)C[C@H](C)Cc1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587785388 FG Annotated Clean CCOC(=O)c1ccc2nc(/C=C\c3cc(O)c(O)c(OC)c3)[nH]c2c1 ZINC000587785415 FG Annotated Clean CCOC(=O)c1ccc2nc(/C=C/c3cc(O)c(O)c(OC)c3)[nH]c2c1 ZINC000587785417 FG Annotated Clean COc1ccc(C=O)c(-c2nc3c(Br)cncc3[nH]2)c1OC ZINC000587785450 FG Annotated Anodyne COc1ccc(-c2cccc(-c3nc4c(O)nc(S)nc4[nH]3)c2)cc1O ZINC000587785521 FG Annotated Anodyne COc1ccc(C=O)c(-c2nc3c(Br)nccc3[nH]2)c1OC ZINC000587785561 FG Annotated Anodyne COc1ccc(C=O)c(-c2nc3nc(Br)ccc3[nH]2)c1OC ZINC000587785591 FG Annotated Anodyne COc1ccc(C=O)c(-c2nc3cc4c(cc3[nH]2)OCCCO4)c1OC ZINC000587785753 FG Annotated Anodyne CCOC(=O)Cc1ccc2[nH]c(-c3c(C=O)ccc(OC)c3OC)nc2c1 ZINC000587786067 FG Annotated Anodyne COc1ccc(C=O)c(-c2nc3cc(OCCN(C)C)ccc3[nH]2)c1OC ZINC000587786133 FG Annotated Anodyne COc1ccc(C=O)c(-c2nc3cnc(Br)cc3[nH]2)c1OC ZINC000587786162 FG Annotated Anodyne COc1cc(/C=C\c2nc3cc(-n4cccn4)c(F)cc3[nH]2)cc(O)c1O ZINC000587786325 FG Annotated Clean COc1cc(/C=C/c2nc3cc(-n4cccn4)c(F)cc3[nH]2)cc(O)c1O ZINC000587786326 FG Annotated Clean COc1ccc(C)cc1C(=O)CCc1nc2c(S)nc(S)nc2[nH]1 ZINC000587786335 FG Annotated Anodyne COc1ccc(C=O)cc1-c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587786347 FG Annotated Anodyne COc1cc(-c2nc3ccc(Br)c(O)c3[nH]2)cc(OC)c1O ZINC000587786400 FG Annotated Anodyne COc1cc(-c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)cc(OC)c1O ZINC000587786505 FG Annotated Anodyne COc1ccc(C=O)c(-c2nc3cnc(C(F)(F)F)cc3[nH]2)c1OC ZINC000587786620 FG Annotated Anodyne COc1ccc(-c2cccc(-c3nc4[nH]c(=N)[nH]c(Cl)c-4n3)c2)cc1O ZINC000587786635 FG Annotated Anodyne COC(=O)c1cccc2nc(CCC(=O)c3cc(C)ccc3OC)[nH]c12 ZINC000587786665 FG Annotated Anodyne COc1ccc(-c2cccc(-c3nc4nc(C#N)c(C#N)nc4[nH]3)c2)cc1O ZINC000587786670 FG Annotated Mild COc1cc(/C=C\c2nc3cncc(Br)c3[nH]2)cc(O)c1O ZINC000587786727 FG Annotated Clean COc1cc(/C=C/c2nc3cncc(Br)c3[nH]2)cc(O)c1O ZINC000587786729 FG Annotated Clean CCOC(=O)Cc1ccc2nc(/C=C\c3cc(O)c(O)c(OC)c3)[nH]c2c1 ZINC000587786797 FG Annotated Clean CCOC(=O)Cc1ccc2nc(/C=C/c3cc(O)c(O)c(OC)c3)[nH]c2c1 ZINC000587786798 FG Annotated Clean COC(=O)c1cc(Cl)c2[nH]c(-c3cc(OC)c(O)c(OC)c3)nc2c1 ZINC000587786802 FG Annotated Anodyne COC(=O)[C@@H]1C[C@@H]1c1ccc(-c2nc3nc(C(F)(F)F)ncc3[nH]2)cc1 ZINC000587786844 FG Annotated Anodyne COC(=O)[C@H]1C[C@@H]1c1ccc(-c2nc3nc(C(F)(F)F)ncc3[nH]2)cc1 ZINC000587786845 FG Annotated Anodyne COC(=O)[C@H]1C[C@H]1c1ccc(-c2nc3nc(C(F)(F)F)ncc3[nH]2)cc1 ZINC000587786846 FG Annotated Anodyne COC(=O)[C@@H]1C[C@H]1c1ccc(-c2nc3nc(C(F)(F)F)ncc3[nH]2)cc1 ZINC000587786847 FG Annotated Anodyne COc1cc(-c2nc3ccnc(Br)c3[nH]2)cc(OC)c1O ZINC000587786870 FG Annotated Anodyne COc1ccc(-c2nc3ccc(OCCN(C)C)cc3[nH]2)c(OC)c1C ZINC000587787051 FG Annotated Anodyne COc1cc(/C=C\c2nc3cc4c(cc3[nH]2)OCCCO4)cc(O)c1O ZINC000587787128 FG Annotated Clean COc1cc(/C=C/c2nc3cc4c(cc3[nH]2)OCCCO4)cc(O)c1O ZINC000587787131 FG Annotated Clean COc1cc(-c2nc3c(F)cnc(Br)c3[nH]2)cc(OC)c1O ZINC000587787132 FG Annotated Anodyne COc1ccc(C)cc1C(=O)CCc1nc2cc3c(cc2[nH]1)OCCO3 ZINC000587787144 FG Annotated Anodyne COc1ccc(C=O)c(-c2nc3ncc(C(F)(F)F)cc3[nH]2)c1OC ZINC000587787155 FG Annotated Anodyne COc1ccc(C=O)c(-c2nc3nccc(Br)c3[nH]2)c1OC ZINC000587787158 FG Annotated Anodyne COc1ccc(C=O)c(-c2nc3cc(F)c(-n4cccn4)cc3[nH]2)c1OC ZINC000587787176 FG Annotated Anodyne COC(=O)c1cc(Cl)c2nc(-c3c(C=O)ccc(OC)c3OC)[nH]c2c1 ZINC000587787181 FG Annotated Anodyne COc1ccc(C)cc1C(=O)CCc1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000587787188 FG Annotated Anodyne COc1ccc(C)cc1C(=O)CCc1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000587787302 FG Annotated Anodyne COc1ccc(C=O)cc1-c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587787309 FG Annotated Anodyne COc1ccc(C)cc1C(=O)CCc1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000587787348 FG Annotated Anodyne COc1ccc(C)cc1C(=O)CCc1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000587787360 FG Annotated Anodyne COc1ccc(C)cc1C(=O)CCc1nc2ccc(C(=O)N(C)C)cc2[nH]1 ZINC000587787624 FG Annotated Anodyne COc1ccc(C=O)c(-c2nc3ncc(Br)cc3[nH]2)c1OC ZINC000587787732 FG Annotated Anodyne COc1ccc(C)cc1C(=O)CCc1nc2cc3c(cc2[nH]1)OCC(=O)N3 ZINC000587787987 FG Annotated Anodyne COC(=O)c1cc2[nH]c(-c3ccc(OC)c(C)c3OC)nc2cc1OC ZINC000587788136 FG Annotated Anodyne COc1ccc(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)c(OC)c1C ZINC000587788194 FG Annotated Bother COC(=O)c1ccc2nc(-c3ccc(OC)c(C)c3OC)[nH]c2c1OC ZINC000587788258 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2[nH]ccc2C(=O)O)N1 ZINC000587788971 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2[nH]ccc2C(=O)O)N1 ZINC000587788985 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2[nH]ccc2C(=O)O)N1 ZINC000587788987 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2[nH]ccc2C(=O)O)N1 ZINC000587788989 FG Annotated Anodyne C=C1NC(=O)NC=C1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587789097 FG Annotated Anodyne C=C1NC(=O)NC=C1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587789103 FG Annotated Anodyne C=C1NC(=O)NC=C1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587789105 FG Annotated Anodyne C=C1NC(=O)NC=C1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587789107 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC(=O)NC(C)(C)C2)N1 ZINC000587789218 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC(=O)NC(C)(C)C2)N1 ZINC000587789220 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC(=O)NC(C)(C)C2)N1 ZINC000587789222 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CC(=O)NC(C)(C)C2)N1 ZINC000587789223 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2[nH]ccc2C(=O)O)N1 ZINC000587789327 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2[nH]ccc2C(=O)O)N1 ZINC000587789328 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2[nH]ccc2C(=O)O)N1 ZINC000587789329 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2[nH]ccc2C(=O)O)N1 ZINC000587789330 FG Annotated Anodyne COC(=O)c1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c[nH]1 ZINC000587789516 FG Annotated Anodyne COC(=O)c1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c[nH]1 ZINC000587789524 FG Annotated Anodyne COC(=O)c1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c[nH]1 ZINC000587789525 FG Annotated Anodyne COC(=O)c1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c[nH]1 ZINC000587789527 FG Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)[nH]1 ZINC000587789555 FG Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)[nH]1 ZINC000587789556 FG Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)[nH]1 ZINC000587789557 FG Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)[nH]1 ZINC000587789558 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3ncnn3c2)N1 ZINC000587789575 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3ncnn3c2)N1 ZINC000587789579 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3ncnn3c2)N1 ZINC000587789582 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3ncnn3c2)N1 ZINC000587789584 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(C(=O)O)[nH]2)N1 ZINC000587789739 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(C(=O)O)[nH]2)N1 ZINC000587789741 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(C(=O)O)[nH]2)N1 ZINC000587789745 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(C(=O)O)[nH]2)N1 ZINC000587789746 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc3ncnn23)N1 ZINC000587790476 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc3ncnn23)N1 ZINC000587790479 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc3ncnn23)N1 ZINC000587790480 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc3ncnn23)N1 ZINC000587790482 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3ccnn3c2)N1 ZINC000587790525 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3ccnn3c2)N1 ZINC000587790526 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3ccnn3c2)N1 ZINC000587790529 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3ccnn3c2)N1 ZINC000587790531 FG Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)[nH]1 ZINC000587790535 FG Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)[nH]1 ZINC000587790538 FG Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)[nH]1 ZINC000587790540 FG Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)[nH]1 ZINC000587790542 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CC3CCN(CC3)C2)N1 ZINC000587790815 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC3CCN(CC3)C2)N1 ZINC000587790818 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC3CCN(CC3)C2)N1 ZINC000587790820 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC3CCN(CC3)C2)N1 ZINC000587790822 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2c[nH]c(C(=O)O)c2)N1 ZINC000587790883 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2c[nH]c(C(=O)O)c2)N1 ZINC000587790884 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2c[nH]c(C(=O)O)c2)N1 ZINC000587790885 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2c[nH]c(C(=O)O)c2)N1 ZINC000587790886 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc(C(=O)O)no2)N1 ZINC000587790945 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc(C(=O)O)no2)N1 ZINC000587790946 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc(C(=O)O)no2)N1 ZINC000587790947 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc(C(=O)O)no2)N1 ZINC000587790948 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnn3ncccc23)N1 ZINC000587791009 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnn3ncccc23)N1 ZINC000587791010 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnn3ncccc23)N1 ZINC000587791011 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnn3ncccc23)N1 ZINC000587791013 FG Annotated Anodyne C#C[C@@]1(C(OCC)OCC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791149 FG Annotated Mild C#C[C@]1(C(OCC)OCC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791160 FG Annotated Mild C#C[C@]1(C(OCC)OCC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791162 FG Annotated Mild C#C[C@@]1(C(OCC)OCC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791164 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2c[nH]c(C(=O)O)c2)N1 ZINC000587791317 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2c[nH]c(C(=O)O)c2)N1 ZINC000587791319 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2c[nH]c(C(=O)O)c2)N1 ZINC000587791321 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2c[nH]c(C(=O)O)c2)N1 ZINC000587791323 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(N1)[C@H]1CC3C[C@H]2CN(C3)C1 ZINC000587791430 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C2(N1)[C@H]1CC3C[C@H]2CN(C3)C1 ZINC000587791433 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(N1)[C@H]1CC3C[C@H]2CN(C3)C1 ZINC000587791706 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(N1)[C@H]1CC3C[C@H]2CN(C3)C1 ZINC000587791710 FG Annotated Anodyne COc1ccc(OC)c(-c2nc3ccc(Br)nc3[nH]2)c1OC ZINC000587791828 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2[nH]nc3ncccc23)N1 ZINC000587792202 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2[nH]nc3ncccc23)N1 ZINC000587792203 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2[nH]nc3ncccc23)N1 ZINC000587792204 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2[nH]nc3ncccc23)N1 ZINC000587792205 FG Annotated Anodyne Cc1noc(C[C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587792514 FG Annotated Anodyne Cc1noc(C[C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587792515 FG Annotated Anodyne Cc1noc(C[C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587792516 FG Annotated Anodyne Cc1noc(C[C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587792517 FG Annotated Anodyne COc1ccc(OC)c(-c2nc3cnc(C(F)(F)F)[nH]c-3n2)c1OC ZINC000587792521 FG Annotated Anodyne COc1ccc(OC)c(-c2nc3cncc(Br)c3[nH]2)c1OC ZINC000587792534 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3c[nH]nc32)N1 ZINC000587793022 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3c[nH]nc32)N1 ZINC000587793027 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3c[nH]nc32)N1 ZINC000587793031 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3c[nH]nc32)N1 ZINC000587793034 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(C(=O)O)[nH]2)N1 ZINC000587793612 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(C(=O)O)[nH]2)N1 ZINC000587793613 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(C(=O)O)[nH]2)N1 ZINC000587793614 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(C(=O)O)[nH]2)N1 ZINC000587793615 FG Annotated Anodyne COc1ccc(OC)c(-c2nc3cc(Br)ncc3[nH]2)c1OC ZINC000587793821 FG Annotated Anodyne Cc1noc(C[C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587793823 FG Annotated Anodyne Cc1noc(C[C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587793824 FG Annotated Anodyne Cc1noc(C[C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587793825 FG Annotated Anodyne Cc1noc(C[C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587793826 FG Annotated Anodyne CCOC(=O)C1CC2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587793952 FG Annotated Anodyne CCOC(=O)C1CC2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587793963 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC(=O)NC(C)(C)C2)N1 ZINC000587794296 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC(=O)NC(C)(C)C2)N1 ZINC000587794297 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC(=O)NC(C)(C)C2)N1 ZINC000587794298 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CC(=O)NC(C)(C)C2)N1 ZINC000587794299 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnn3cccnc23)N1 ZINC000587794435 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnn3cccnc23)N1 ZINC000587794437 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnn3cccnc23)N1 ZINC000587794439 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnn3cccnc23)N1 ZINC000587794441 FG Annotated Anodyne COC(=O)c1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c[nH]1 ZINC000587794511 FG Annotated Anodyne COC(=O)c1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c[nH]1 ZINC000587794512 FG Annotated Anodyne COC(=O)c1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c[nH]1 ZINC000587794514 FG Annotated Anodyne COC(=O)c1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c[nH]1 ZINC000587794515 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2nc3ccccn3n2)N1 ZINC000587794526 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2nc3ccccn3n2)N1 ZINC000587794529 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2nc3ccccn3n2)N1 ZINC000587794530 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2nc3ccccn3n2)N1 ZINC000587794533 FG Annotated Anodyne CCOC(=O)C1CC2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587794834 FG Annotated Anodyne CCOC(=O)C1CC2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587794835 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3n[nH]cc32)N1 ZINC000587794993 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3n[nH]cc32)N1 ZINC000587794994 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3n[nH]cc32)N1 ZINC000587794995 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3n[nH]cc32)N1 ZINC000587794996 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3n[nH]cc32)N1 ZINC000587795153 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3n[nH]cc32)N1 ZINC000587795157 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3n[nH]cc32)N1 ZINC000587795161 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3n[nH]cc32)N1 ZINC000587795165 FG Annotated Anodyne CCOC(=O)[C@@]1(C2CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795234 FG Annotated Anodyne CCOC(=O)[C@@]1(C2CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795237 FG Annotated Anodyne CCOC(=O)[C@]1(C2CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795240 FG Annotated Anodyne CCOC(=O)[C@]1(C2CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795243 FG Annotated Anodyne COc1ccc(OC)c(-c2nc3c(Br)ccnc3[nH]2)c1OC ZINC000587795310 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CC3CCN(CC3)C2)N1 ZINC000587795542 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC3CCN(CC3)C2)N1 ZINC000587795543 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC3CCN(CC3)C2)N1 ZINC000587795544 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC3CCN(CC3)C2)N1 ZINC000587795545 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3c[nH]nc32)N1 ZINC000587795883 FG Annotated Anodyne COCCC[C@]1(COC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795884 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3c[nH]nc32)N1 ZINC000587795887 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3c[nH]nc32)N1 ZINC000587795889 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3c[nH]nc32)N1 ZINC000587795890 FG Annotated Anodyne COCCC[C@@]1(COC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795898 FG Annotated Anodyne COCCC[C@]1(COC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795901 FG Annotated Anodyne COCCC[C@@]1(COC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795904 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnn3cccnc23)N1 ZINC000587796094 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnn3cccnc23)N1 ZINC000587796096 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnn3cccnc23)N1 ZINC000587796098 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnn3cccnc23)N1 ZINC000587796100 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3ncnn3c2)N1 ZINC000587796101 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3ncnn3c2)N1 ZINC000587796102 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3ncnn3c2)N1 ZINC000587796103 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3ncnn3c2)N1 ZINC000587796104 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2nc3ccccn3n2)N1 ZINC000587796133 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2nc3ccccn3n2)N1 ZINC000587796134 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2nc3ccccn3n2)N1 ZINC000587796135 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2nc3ccccn3n2)N1 ZINC000587796136 FG Annotated Anodyne COCc1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)no1 ZINC000587796255 FG Annotated Anodyne COCc1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)no1 ZINC000587796256 FG Annotated Anodyne COCc1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)no1 ZINC000587796258 FG Annotated Anodyne COCc1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)no1 ZINC000587796260 FG Annotated Anodyne CCOC(=O)[C@@]1(C2CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587796457 FG Annotated Anodyne CCOC(=O)[C@@]1(C2CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587796459 FG Annotated Anodyne CCOC(=O)[C@]1(C2CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587796461 FG Annotated Anodyne CCOC(=O)[C@]1(C2CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587796464 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3ccnn3c2)N1 ZINC000587796838 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3ccnn3c2)N1 ZINC000587796839 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3ccnn3c2)N1 ZINC000587796840 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3ccnn3c2)N1 ZINC000587796841 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Nc1ccccc12 ZINC000587797294 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Nc1ccccc12 ZINC000587797296 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Nc1ccccc12 ZINC000587797298 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Nc1ccccc12 ZINC000587797302 FG Annotated Anodyne C#C[C@@]1(C(OCC)OCC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797305 FG Annotated Mild C#C[C@]1(C(OCC)OCC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797308 FG Annotated Mild C#C[C@]1(C(OCC)OCC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797310 FG Annotated Mild C#C[C@@]1(C(OCC)OCC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797311 FG Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Nc1ccccc12 ZINC000587797341 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Nc1ccccc12 ZINC000587797343 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Nc1ccccc12 ZINC000587797345 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Nc1ccccc12 ZINC000587797346 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2[nH]nc3ncccc23)N1 ZINC000587797453 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2[nH]nc3ncccc23)N1 ZINC000587797454 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2[nH]nc3ncccc23)N1 ZINC000587797900 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2[nH]nc3ncccc23)N1 ZINC000587797901 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc(C(=O)O)no2)N1 ZINC000587798337 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc(C(=O)O)no2)N1 ZINC000587798338 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc(C(=O)O)no2)N1 ZINC000587798339 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc(C(=O)O)no2)N1 ZINC000587798340 FG Annotated Anodyne COCc1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)no1 ZINC000587798342 FG Annotated Anodyne COCc1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)no1 ZINC000587798343 FG Annotated Anodyne COCc1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)no1 ZINC000587798344 FG Annotated Anodyne COCc1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)no1 ZINC000587798345 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc3ncnn23)N1 ZINC000587798390 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc3ncnn23)N1 ZINC000587798391 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc3ncnn23)N1 ZINC000587798392 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc3ncnn23)N1 ZINC000587798393 FG Annotated Anodyne COCCC[C@]1(COC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587798538 FG Annotated Anodyne COCCC[C@@]1(COC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587798540 FG Annotated Anodyne COCCC[C@]1(COC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587798541 FG Annotated Anodyne COCCC[C@@]1(COC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587798543 FG Annotated Anodyne COc1ccc(OC)c(-c2nc3ccnc(Br)c3[nH]2)c1OC ZINC000587798835 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnn3ncccc23)N1 ZINC000587798876 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnn3ncccc23)N1 ZINC000587798878 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnn3ncccc23)N1 ZINC000587798880 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnn3ncccc23)N1 ZINC000587798882 FG Annotated Anodyne CCOC(=O)[C@@H]1C[C@@H]1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799230 FG Annotated Anodyne CCOC(=O)[C@@H]1C[C@@H]1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799231 FG Annotated Anodyne CCOC(=O)[C@@H]1C[C@@H]1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799232 FG Annotated Anodyne CCOC(=O)[C@@H]1C[C@@H]1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799233 FG Annotated Anodyne C=C1NC(=O)NC=C1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799452 FG Annotated Anodyne C=C1NC(=O)NC=C1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799454 FG Annotated Anodyne C=C1NC(=O)NC=C1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799456 FG Annotated Anodyne C=C1NC(=O)NC=C1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799458 FG Annotated Anodyne CCOC(=O)[C@@H]1C[C@@H]1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800200 FG Annotated Anodyne CCOC(=O)[C@@H]1C[C@@H]1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800202 FG Annotated Anodyne CCOC(=O)[C@@H]1C[C@@H]1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800203 FG Annotated Anodyne CCOC(=O)[C@@H]1C[C@@H]1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800204 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3[nH]cncc2-3)N1 ZINC000587802191 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3[nH]cncc2-3)N1 ZINC000587802192 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3[nH]cncc2-3)N1 ZINC000587802193 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3[nH]cncc2-3)N1 ZINC000587802194 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3[nH]cncc2-3)N1 ZINC000587802547 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3[nH]cncc2-3)N1 ZINC000587802548 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3[nH]cncc2-3)N1 ZINC000587802549 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3[nH]cncc2-3)N1 ZINC000587802550 FG Annotated Anodyne C=CCOC(=O)C[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587803117 FG Annotated Mild C=CCOC(=O)C[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587803118 FG Annotated Mild C=CCOC(=O)C[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587803119 FG Annotated Mild C=CCOC(=O)C[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587803120 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(COCc3[nH]ccc32)N1 ZINC000587803327 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(COCc3[nH]ccc32)N1 ZINC000587803328 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(COCc3[nH]ccc32)N1 ZINC000587803329 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(COCc3[nH]ccc32)N1 ZINC000587803330 FG Annotated Anodyne C=CCOC(=O)C[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587803501 FG Annotated Mild C=CCOC(=O)C[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587803503 FG Annotated Mild C=CCOC(=O)C[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587803505 FG Annotated Mild C=CCOC(=O)C[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587803506 FG Annotated Mild COC(=O)[C@]1(/C=C(\C)OC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587803792 FG Annotated Anodyne COC(=O)[C@@]1(/C=C(\C)OC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587803798 FG Annotated Anodyne COC(=O)[C@@]1(/C=C(\C)OC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587803800 FG Annotated Anodyne COC(=O)[C@]1(/C=C(\C)OC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587803803 FG Annotated Anodyne COC(=O)C1([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)CC1 ZINC000587803823 FG Annotated Anodyne COC(=O)C1([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)CC1 ZINC000587803827 FG Annotated Anodyne COC(=O)C1([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)CC1 ZINC000587803830 FG Annotated Anodyne COC(=O)C1([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)CC1 ZINC000587803831 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(COCc3[nH]ccc32)N1 ZINC000587804011 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(COCc3[nH]ccc32)N1 ZINC000587804013 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(COCc3[nH]ccc32)N1 ZINC000587804014 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(COCc3[nH]ccc32)N1 ZINC000587804015 FG Annotated Anodyne COC(=O)C1(C)CC2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587804206 FG Annotated Anodyne COC(=O)C1(C)CC2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587804207 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587804277 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587804278 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587804279 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587804280 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@@]2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587805997 FG Annotated Anodyne COC(=O)[C@H]1CC[C@]2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587805999 FG Annotated Anodyne COC(=O)[C@H]1CC[C@@]2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587806000 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@@]2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587806001 FG Annotated Anodyne COC(=O)[C@H]1CC[C@@]2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587806002 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@]2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587806004 FG Annotated Anodyne COC(=O)[C@H]1CC[C@]2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587806005 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@]2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587806007 FG Annotated Anodyne COC(=O)C[C@@]1(C2CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587806041 FG Annotated Anodyne COC(=O)C[C@@]1(C2CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587806042 FG Annotated Anodyne COC(=O)C[C@]1(C2CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587806043 FG Annotated Anodyne COC(=O)C[C@]1(C2CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587806045 FG Annotated Anodyne COC(=O)[C@H]1CC[C@]2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587806076 FG Annotated Anodyne COC(=O)[C@H]1CC[C@@]2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587806077 FG Annotated Anodyne COC(=O)[C@H]1CC[C@@]2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587806079 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@@]2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587806080 FG Annotated Anodyne COC(=O)[C@H]1CC[C@]2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587806081 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@]2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587806082 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@@]2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587806084 FG Annotated Anodyne COC(=O)[C@@H]1CC[C@]2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587806085 FG Annotated Anodyne COC(=O)[C@@H]1C[C@]2(C=C1C)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587806091 FG Annotated Anodyne COC(=O)[C@@H]1C[C@@]2(C=C1C)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587806096 FG Annotated Anodyne COC(=O)[C@@H]1C[C@]2(C=C1C)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587806097 FG Annotated Anodyne COC(=O)[C@@H]1C[C@@]2(C=C1C)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587806098 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3[nH]ccnc2-3)N1 ZINC000587806177 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3[nH]ccnc2-3)N1 ZINC000587806181 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3[nH]ccnc2-3)N1 ZINC000587806184 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3[nH]ccnc2-3)N1 ZINC000587806186 FG Annotated Anodyne COC(=O)[C@]1(/C=C(\C)OC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587806989 FG Annotated Anodyne COC(=O)[C@@]1(/C=C(\C)OC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587806991 FG Annotated Anodyne COC(=O)[C@@]1(/C=C(\C)OC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587806993 FG Annotated Anodyne COC(=O)[C@]1(/C=C(\C)OC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587806994 FG Annotated Anodyne COC(=O)[C@@H]1C[C@]2(C=C1C)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587807553 FG Annotated Anodyne COC(=O)[C@@H]1C[C@@]2(C=C1C)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587807555 FG Annotated Anodyne COC(=O)[C@@H]1C[C@]2(C=C1C)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587807558 FG Annotated Anodyne COC(=O)[C@@H]1C[C@@]2(C=C1C)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587807559 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587807731 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587807732 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587807734 FG Annotated Anodyne COC(=O)[C@@H]1CCC[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587807735 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3[nH]ccnc2-3)N1 ZINC000587808589 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3[nH]ccnc2-3)N1 ZINC000587808593 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3[nH]ccnc2-3)N1 ZINC000587808597 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3[nH]ccnc2-3)N1 ZINC000587808601 FG Annotated Anodyne COC(=O)[C@@H]1C=C[C@@]2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587809037 FG Annotated Anodyne COC(=O)[C@@H]1C=C[C@@]2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587809040 FG Annotated Anodyne COC(=O)[C@@H]1C=C[C@]2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587809041 FG Annotated Anodyne COC(=O)[C@@H]1C=C[C@]2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587809042 FG Annotated Anodyne COC(=O)C1=C[C@]2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587809436 FG Annotated Anodyne COC(=O)C1=C[C@]2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587809442 FG Annotated Anodyne COC(=O)C1=C[C@@]2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587809445 FG Annotated Anodyne COC(=O)C1=C[C@@]2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587809448 FG Annotated Anodyne COC(=O)C1([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)CC1 ZINC000587809646 FG Annotated Anodyne COC(=O)C1([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)CC1 ZINC000587809649 FG Annotated Anodyne COC(=O)C1([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)CC1 ZINC000587809653 FG Annotated Anodyne COC(=O)C1([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)CC1 ZINC000587809656 FG Annotated Anodyne CCO[C@@H]1C[C@]2(N[C@@H](C)Cc3cc(Br)c(F)cc32)[C@H]1OC ZINC000587809806 FG Annotated Anodyne CCO[C@@H]1C[C@@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)[C@H]1OC ZINC000587809807 FG Annotated Anodyne CCO[C@@H]1C[C@@]2(N[C@@H](C)Cc3cc(Br)c(F)cc32)[C@H]1OC ZINC000587809808 FG Annotated Anodyne CCO[C@@H]1C[C@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)[C@H]1OC ZINC000587809809 FG Annotated Anodyne COC(=O)C1(C)CC2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587810084 FG Annotated Anodyne COC(=O)C1(C)CC2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587810087 FG Annotated Anodyne CC(=O)C(C(C)=O)[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587810102 FG Annotated Anodyne CC(=O)C(C(C)=O)[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587810122 FG Annotated Anodyne CC(=O)C(C(C)=O)[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587810126 FG Annotated Anodyne CC(=O)C(C(C)=O)[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587810130 FG Annotated Anodyne COC(=O)[C@@H]1C=C[C@@]2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587810218 FG Annotated Anodyne COC(=O)[C@@H]1C=C[C@]2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587810219 FG Annotated Anodyne COC(=O)[C@@H]1C=C[C@@]2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587810220 FG Annotated Anodyne COC(=O)[C@@H]1C=C[C@]2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587810221 FG Annotated Anodyne CCO[C@@H]1C[C@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)[C@H]1OC ZINC000587810304 FG Annotated Anodyne CCO[C@@H]1C[C@@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)[C@H]1OC ZINC000587810305 FG Annotated Anodyne CCO[C@@H]1C[C@@]2(N[C@@H](C)Cc3ccc(F)c(Br)c32)[C@H]1OC ZINC000587810306 FG Annotated Anodyne CCO[C@@H]1C[C@]2(N[C@@H](C)Cc3ccc(F)c(Br)c32)[C@H]1OC ZINC000587810307 FG Annotated Anodyne COC(=O)/C=C(\C)[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587810614 FG Annotated Anodyne COC(=O)/C=C(\C)[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587810616 FG Annotated Anodyne COC(=O)/C=C(\C)[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587810619 FG Annotated Anodyne COC(=O)/C=C(\C)[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587810623 FG Annotated Anodyne COC(=O)/C=C(\C)[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810676 FG Annotated Anodyne COC(=O)/C=C(\C)[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810680 FG Annotated Anodyne COC(=O)/C=C(\C)[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810683 FG Annotated Anodyne COC(=O)/C=C(\C)[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810685 FG Annotated Anodyne COC(=O)C[C@@]1(C2CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587811290 FG Annotated Anodyne COC(=O)C[C@@]1(C2CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587811291 FG Annotated Anodyne COC(=O)C[C@]1(C2CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587811292 FG Annotated Anodyne COC(=O)C[C@]1(C2CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587811293 FG Annotated Anodyne COC(=O)CC1CC2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587811783 FG Annotated Anodyne COC(=O)CC1CC2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587811784 FG Annotated Anodyne CC(=O)C(C(C)=O)[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587811858 FG Annotated Anodyne CC(=O)C(C(C)=O)[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587811861 FG Annotated Anodyne CC(=O)C(C(C)=O)[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587811862 FG Annotated Anodyne CC(=O)C(C(C)=O)[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587811865 FG Annotated Anodyne COC(=O)C1=C[C@]2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587812390 FG Annotated Anodyne COC(=O)C1=C[C@]2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587812393 FG Annotated Anodyne COC(=O)C1=C[C@@]2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587812395 FG Annotated Anodyne COC(=O)C1=C[C@@]2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587812398 FG Annotated Anodyne COC(=O)CC1CC2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587812574 FG Annotated Anodyne COC(=O)CC1CC2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587812575 FG Annotated Anodyne CC(=O)[C@@H]1C(=O)CCC[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587816609 FG Annotated Anodyne CC(=O)[C@@H]1C(=O)CCC[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587816610 FG Annotated Anodyne CC(=O)[C@@H]1C(=O)CCC[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587816611 FG Annotated Anodyne CC(=O)[C@@H]1C(=O)CCC[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587816612 FG Annotated Anodyne CC(=O)[C@@H]1C(=O)CCC[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587816721 FG Annotated Anodyne CC(=O)[C@@H]1C(=O)CCC[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587816722 FG Annotated Anodyne CC(=O)[C@@H]1C(=O)CCC[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587816723 FG Annotated Anodyne CC(=O)[C@@H]1C(=O)CCC[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587816724 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Cc1ccccc12 ZINC000587816975 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Cc1ccccc12 ZINC000587816976 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Cc1ccccc12 ZINC000587816977 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Cc1ccccc12 ZINC000587816978 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Cc1ccccc12 ZINC000587817017 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Cc1ccccc12 ZINC000587817018 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Cc1ccccc12 ZINC000587817019 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Cc1ccccc12 ZINC000587817020 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(C2C(=O)CCCC2=O)N1 ZINC000587818014 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(C2C(=O)CCCC2=O)N1 ZINC000587818015 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(C2C(=O)CCCC2=O)N1 ZINC000587818016 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(C2C(=O)CCCC2=O)N1 ZINC000587818017 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(C2C(=O)CCCC2=O)N1 ZINC000587818074 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(C2C(=O)CCCC2=O)N1 ZINC000587818075 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(C2C(=O)CCCC2=O)N1 ZINC000587818077 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(C2C(=O)CCCC2=O)N1 ZINC000587818078 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)[C@H]1C=C[C@H]2C[C@H]1C(=O)O ZINC000587820204 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)[C@H]1C=C[C@H]2C[C@@H]1C(=O)O ZINC000587820205 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)[C@H]1C=C[C@H]2C[C@@H]1C(=O)O ZINC000587820207 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)[C@H]1C=C[C@H]2C[C@H]1C(=O)O ZINC000587820209 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(O)c(O)c2O)N1 ZINC000587820976 FG Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(O)c(O)c2O)N1 ZINC000587820995 FG Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(O)c(O)c2O)N1 ZINC000587820998 FG Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(O)c(O)c2O)N1 ZINC000587821000 FG Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(O)c(O)c(O)c2)N1 ZINC000587822344 FG Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(O)c(O)c(O)c2)N1 ZINC000587822345 FG Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(O)c(O)c(O)c2)N1 ZINC000587822346 FG Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(O)c(O)c(O)c2)N1 ZINC000587822347 FG Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(O)c(O)c(O)c2)N1 ZINC000587823818 FG Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(O)c(O)c(O)c2)N1 ZINC000587823820 FG Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(O)c(O)c(O)c2)N1 ZINC000587823822 FG Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(O)c(O)c(O)c2)N1 ZINC000587823824 FG Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(O)cc(O)cc2O)N1 ZINC000587823925 FG Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(O)cc(O)cc2O)N1 ZINC000587823926 FG Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(O)cc(O)cc2O)N1 ZINC000587823927 FG Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(O)cc(O)cc2O)N1 ZINC000587823928 FG Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(O)cc(O)cc2O)N1 ZINC000587823948 FG Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(O)cc(O)cc2O)N1 ZINC000587823950 FG Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(O)cc(O)cc2O)N1 ZINC000587823952 FG Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(O)cc(O)cc2O)N1 ZINC000587823954 FG Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(O)c(O)cc2O)N1 ZINC000587824014 FG Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(O)c(O)cc2O)N1 ZINC000587824015 FG Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(O)c(O)cc2O)N1 ZINC000587824016 FG Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(O)c(O)cc2O)N1 ZINC000587824017 FG Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(O)c(O)c2O)N1 ZINC000587824217 FG Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(O)c(O)c2O)N1 ZINC000587824219 FG Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(O)c(O)c2O)N1 ZINC000587824221 FG Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(O)c(O)c2O)N1 ZINC000587824223 FG Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(O)c(O)cc2O)N1 ZINC000587824335 FG Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(O)c(O)cc2O)N1 ZINC000587824336 FG Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(O)c(O)cc2O)N1 ZINC000587824337 FG Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(O)c(O)cc2O)N1 ZINC000587824338 FG Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@H](C(=O)O)C2(C)C)N1 ZINC000587824677 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@@H](C(=O)O)C2(C)C)N1 ZINC000587824678 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@@H](C(=O)O)C2(C)C)N1 ZINC000587824679 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@H](C(=O)O)C2(C)C)N1 ZINC000587824680 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(O)c(CO)c2)N1 ZINC000587824983 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(O)c(CO)c2)N1 ZINC000587824984 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(O)c(CO)c2)N1 ZINC000587824985 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(O)c(CO)c2)N1 ZINC000587824986 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@H](C(=O)O)C2(C)C)N1 ZINC000587826351 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@@H](C(=O)O)C2(C)C)N1 ZINC000587826352 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@H](C(=O)O)C2(C)C)N1 ZINC000587826354 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@@H](C(=O)O)C2(C)C)N1 ZINC000587826356 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CO)(c2ccccc2)N1 ZINC000587827006 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CO)(c2ccccc2)N1 ZINC000587827007 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CO)(c2ccccc2)N1 ZINC000587827008 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CO)(c2ccccc2)N1 ZINC000587827009 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)CCC(=O)O)N1 ZINC000587827307 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)CCC(=O)O)N1 ZINC000587827309 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)CCC(=O)O)N1 ZINC000587827312 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)CCC(=O)O)N1 ZINC000587827314 FG Annotated Anodyne CC(=O)C[C@]1(CCC(=O)O)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587827349 FG Annotated Anodyne CC(=O)C[C@]1(CCC(=O)O)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587827350 FG Annotated Anodyne CC(=O)C[C@@]1(CCC(=O)O)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587827351 FG Annotated Anodyne CC(=O)C[C@@]1(CCC(=O)O)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587827352 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C(=O)O)(c2ccco2)N1 ZINC000587827800 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C(=O)O)(c2ccco2)N1 ZINC000587827801 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C(=O)O)(c2ccco2)N1 ZINC000587827802 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C(=O)O)(c2ccco2)N1 ZINC000587827803 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C(=O)O)(c2ccccc2)N1 ZINC000587827995 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C(=O)O)(c2ccccc2)N1 ZINC000587827996 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C(=O)O)(c2ccccc2)N1 ZINC000587827997 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C(=O)O)(c2ccccc2)N1 ZINC000587827998 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C(=O)O)(c2ccccc2)N1 ZINC000587828335 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C(=O)O)(c2ccccc2)N1 ZINC000587828336 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C(=O)O)(c2ccccc2)N1 ZINC000587828338 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C(=O)O)(c2ccccc2)N1 ZINC000587828340 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C=C(C(=O)O)OC2(C)C)N1 ZINC000587828910 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C=C(C(=O)O)OC2(C)C)N1 ZINC000587828911 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=C(C(=O)O)OC2(C)C)N1 ZINC000587828912 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=C(C(=O)O)OC2(C)C)N1 ZINC000587828913 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)[C@H]1C=C[C@H]2C[C@H]1C(=O)O ZINC000587829071 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)[C@H]1C=C[C@H]2C[C@@H]1C(=O)O ZINC000587829073 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)[C@H]1C=C[C@H]2C[C@@H]1C(=O)O ZINC000587829075 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)[C@H]1C=C[C@H]2C[C@H]1C(=O)O ZINC000587829077 FG Annotated Anodyne CC(=O)C[C@]1(CCC(=O)O)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587829123 FG Annotated Anodyne CC(=O)C[C@]1(CCC(=O)O)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587829125 FG Annotated Anodyne CC(=O)C[C@@]1(CCC(=O)O)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587829127 FG Annotated Anodyne CC(=O)C[C@@]1(CCC(=O)O)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587829129 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(O)c(CO)c2)N1 ZINC000587829773 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(O)c(CO)c2)N1 ZINC000587829775 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(O)c(CO)c2)N1 ZINC000587829777 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(O)c(CO)c2)N1 ZINC000587829779 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CO)(c2ccccc2)N1 ZINC000587829898 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CO)(c2ccccc2)N1 ZINC000587829900 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CO)(c2ccccc2)N1 ZINC000587829901 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CO)(c2ccccc2)N1 ZINC000587829903 FG Annotated Anodyne CC[C@@H]1OC=C[C@]2(N[C@@H](C)Cc3cc(Br)c(F)cc32)C1=O ZINC000587830013 FG Annotated Anodyne CC[C@@H]1OC=C[C@@]2(N[C@@H](C)Cc3cc(Br)c(F)cc32)C1=O ZINC000587830027 FG Annotated Anodyne CC[C@@H]1OC=C[C@@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)C1=O ZINC000587830031 FG Annotated Anodyne CC[C@@H]1OC=C[C@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)C1=O ZINC000587830035 FG Annotated Anodyne CC[C@@H]1OC=CC(=O)[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587830467 FG Annotated Mild CC[C@@H]1OC=CC(=O)[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587830468 FG Annotated Mild CC[C@@H]1OC=CC(=O)[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587830469 FG Annotated Mild CC[C@@H]1OC=CC(=O)[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587830470 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C=O)(c2ccc(O)cc2)N1 ZINC000587830515 FG Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](C=O)(c2ccc(O)cc2)N1 ZINC000587830519 FG Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C=O)(c2ccc(O)cc2)N1 ZINC000587830521 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C=O)(c2ccc(O)cc2)N1 ZINC000587830523 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C=O)(c2ccc(O)cc2)N1 ZINC000587830560 FG Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](C=O)(c2ccc(O)cc2)N1 ZINC000587830561 FG Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C=O)(c2ccc(O)cc2)N1 ZINC000587830563 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C=O)(c2ccc(O)cc2)N1 ZINC000587830565 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C(=O)O)(c2ccco2)N1 ZINC000587830730 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C(=O)O)(c2ccco2)N1 ZINC000587830732 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C(=O)O)(c2ccco2)N1 ZINC000587830733 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C(=O)O)(c2ccco2)N1 ZINC000587830734 FG Annotated Anodyne CC1=C[C@@]2(C=C(C(=O)O)O1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587830875 FG Annotated Anodyne CC1=C[C@@]2(C=C(C(=O)O)O1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587830876 FG Annotated Anodyne CC1=C[C@]2(C=C(C(=O)O)O1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587830877 FG Annotated Anodyne CC1=C[C@]2(C=C(C(=O)O)O1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587830878 FG Annotated Anodyne CC[C@@H]1OC(=O)[C@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)[C@H]1C ZINC000587831220 FG Annotated Anodyne CC[C@@H]1OC(=O)[C@]2(N[C@@H](C)Cc3ccc(F)c(Br)c32)[C@H]1C ZINC000587831222 FG Annotated Anodyne CC[C@@H]1OC(=O)[C@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)[C@@H]1C ZINC000587831224 FG Annotated Anodyne CC[C@@H]1OC(=O)[C@]2(N[C@@H](C)Cc3ccc(F)c(Br)c32)[C@@H]1C ZINC000587831226 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)CCC(=O)O)N1 ZINC000587831714 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)CCC(=O)O)N1 ZINC000587831717 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)CCC(=O)O)N1 ZINC000587831720 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)CCC(=O)O)N1 ZINC000587831723 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](Cc2ccco2)(C(=O)O)N1 ZINC000587831839 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](Cc2ccco2)(C(=O)O)N1 ZINC000587831854 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](Cc2ccco2)(C(=O)O)N1 ZINC000587831857 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](Cc2ccco2)(C(=O)O)N1 ZINC000587831860 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](Cc2ccco2)(C(=O)O)N1 ZINC000587832193 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](Cc2ccco2)(C(=O)O)N1 ZINC000587832194 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](Cc2ccco2)(C(=O)O)N1 ZINC000587832195 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](Cc2ccco2)(C(=O)O)N1 ZINC000587832196 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC2OCCO2)(C2CC2)N1 ZINC000587832324 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CC2OCCO2)(C2CC2)N1 ZINC000587832327 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CC2OCCO2)(C2CC2)N1 ZINC000587832329 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC2OCCO2)(C2CC2)N1 ZINC000587832332 FG Annotated Anodyne CO[C@@H]1C[C@H]([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)[C@H](OC)O1 ZINC000587832396 FG Annotated Anodyne CO[C@@H]1C[C@H]([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)[C@@H](OC)O1 ZINC000587832398 FG Annotated Anodyne CO[C@@H]1C[C@H]([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)[C@@H](OC)O1 ZINC000587832401 FG Annotated Anodyne CO[C@@H]1C[C@H]([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)[C@H](OC)O1 ZINC000587832403 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C=O)(c2cccc(O)c2)N1 ZINC000587832537 FG Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](C=O)(c2cccc(O)c2)N1 ZINC000587832539 FG Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C=O)(c2cccc(O)c2)N1 ZINC000587832541 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C=O)(c2cccc(O)c2)N1 ZINC000587832543 FG Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C=C(C(=O)O)OC2(C)C)N1 ZINC000587833395 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C=C(C(=O)O)OC2(C)C)N1 ZINC000587833397 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=C(C(=O)O)OC2(C)C)N1 ZINC000587833400 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=C(C(=O)O)OC2(C)C)N1 ZINC000587833403 FG Annotated Anodyne CC1=C[C@@]2(C=C(C(=O)O)O1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587833442 FG Annotated Anodyne CC1=C[C@@]2(C=C(C(=O)O)O1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587833445 FG Annotated Anodyne CC1=C[C@]2(C=C(C(=O)O)O1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587833450 FG Annotated Anodyne CC1=C[C@]2(C=C(C(=O)O)O1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587833453 FG Annotated Anodyne CC[C@@H]1OC=CC(=O)[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587833513 FG Annotated Mild CC[C@@H]1OC=CC(=O)[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587833516 FG Annotated Mild CC[C@@H]1OC=CC(=O)[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587833519 FG Annotated Mild CC[C@@H]1OC=CC(=O)[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587833521 FG Annotated Mild COC[C@]1(C2CCOCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587833708 FG Annotated Anodyne COC[C@@]1(C2CCOCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587833709 FG Annotated Anodyne COC[C@@]1(C2CCOCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587833711 FG Annotated Anodyne COC[C@]1(C2CCOCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587833712 FG Annotated Anodyne COC1([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)CCOCC1 ZINC000587833791 FG Annotated Anodyne COC1([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)CCOCC1 ZINC000587833807 FG Annotated Anodyne COC1([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)CCOCC1 ZINC000587833809 FG Annotated Anodyne COC1([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)CCOCC1 ZINC000587833810 FG Annotated Anodyne CO[C@@H]1C[C@H]([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)[C@H](OC)O1 ZINC000587833872 FG Annotated Anodyne CO[C@@H]1C[C@H]([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)[C@@H](OC)O1 ZINC000587833873 FG Annotated Anodyne CO[C@@H]1C[C@H]([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)[C@@H](OC)O1 ZINC000587833874 FG Annotated Anodyne CO[C@@H]1C[C@H]([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)[C@H](OC)O1 ZINC000587833876 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](COC2CCOCC2)N1 ZINC000587834002 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](COC2CCOCC2)N1 ZINC000587834004 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](COC2CCOCC2)N1 ZINC000587834005 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](COC2CCOCC2)N1 ZINC000587834009 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C=O)(c2cccc(O)c2)N1 ZINC000587834081 FG Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](C=O)(c2cccc(O)c2)N1 ZINC000587834083 FG Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C=O)(c2cccc(O)c2)N1 ZINC000587834085 FG Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C=O)(c2cccc(O)c2)N1 ZINC000587834086 FG Annotated Mild CC[C@@H]1OC(=O)[C@]2(N[C@@H](C)Cc3cc(Br)c(F)cc32)[C@H]1C ZINC000587834407 FG Annotated Anodyne CC[C@@H]1OC(=O)[C@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)[C@@H]1C ZINC000587834408 FG Annotated Anodyne CC[C@@H]1OC(=O)[C@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)[C@H]1C ZINC000587834410 FG Annotated Anodyne CC[C@@H]1OC(=O)[C@]2(N[C@@H](C)Cc3cc(Br)c(F)cc32)[C@@H]1C ZINC000587834411 FG Annotated Anodyne CC[C@@H]1OC=C[C@@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)C1=O ZINC000587834759 FG Annotated Anodyne CC[C@@H]1OC=C[C@@]2(N[C@@H](C)Cc3ccc(F)c(Br)c32)C1=O ZINC000587834760 FG Annotated Anodyne CC[C@@H]1OC=C[C@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)C1=O ZINC000587834761 FG Annotated Anodyne CC[C@@H]1OC=C[C@]2(N[C@@H](C)Cc3ccc(F)c(Br)c32)C1=O ZINC000587834762 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(C2(C)COCOC2)N1 ZINC000587834908 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(C2(C)COCOC2)N1 ZINC000587834916 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(C2(C)COCOC2)N1 ZINC000587834918 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(C2(C)COCOC2)N1 ZINC000587834919 FG Annotated Anodyne COC1([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)CCOCC1 ZINC000587835539 FG Annotated Anodyne COC1([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)CCOCC1 ZINC000587835540 FG Annotated Anodyne COC1([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)CCOCC1 ZINC000587835541 FG Annotated Anodyne COC1([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)CCOCC1 ZINC000587835542 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC2OCCO2)(C2CC2)N1 ZINC000587836146 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CC2OCCO2)(C2CC2)N1 ZINC000587836147 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CC2OCCO2)(C2CC2)N1 ZINC000587836149 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC2OCCO2)(C2CC2)N1 ZINC000587836150 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](COC2CCOCC2)N1 ZINC000587836477 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](COC2CCOCC2)N1 ZINC000587836478 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](COC2CCOCC2)N1 ZINC000587836479 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](COC2CCOCC2)N1 ZINC000587836480 FG Annotated Anodyne COC[C@]1(C2CCOCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587836663 FG Annotated Anodyne COC[C@@]1(C2CCOCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587836664 FG Annotated Anodyne COC[C@@]1(C2CCOCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587836665 FG Annotated Anodyne COC[C@]1(C2CCOCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587836666 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(C2(C)COCOC2)N1 ZINC000587836683 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(C2(C)COCOC2)N1 ZINC000587836684 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(C2(C)COCOC2)N1 ZINC000587836685 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(C2(C)COCOC2)N1 ZINC000587836686 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC3=C2COCO3)N1 ZINC000587837407 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC3=C2COCO3)N1 ZINC000587837408 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC3=C2COCO3)N1 ZINC000587837409 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC3=C2COCO3)N1 ZINC000587837410 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=C[C@H]3OC(C)(C)O[C@H]32)N1 ZINC000587837759 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C=C[C@H]3OC(C)(C)O[C@H]32)N1 ZINC000587837760 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C=C[C@H]3OC(C)(C)O[C@H]32)N1 ZINC000587837761 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=C[C@H]3OC(C)(C)O[C@H]32)N1 ZINC000587837762 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=C[C@H]3OC(C)(C)O[C@H]32)N1 ZINC000587838589 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C=C[C@H]3OC(C)(C)O[C@H]32)N1 ZINC000587838590 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C=C[C@H]3OC(C)(C)O[C@H]32)N1 ZINC000587838591 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=C[C@H]3OC(C)(C)O[C@H]32)N1 ZINC000587838592 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC3=C2COCO3)N1 ZINC000587838783 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC3=C2COCO3)N1 ZINC000587838784 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC3=C2COCO3)N1 ZINC000587838785 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC3=C2COCO3)N1 ZINC000587838786 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Oc1ccccc12 ZINC000587840750 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)Oc1ccccc12 ZINC000587840751 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Oc1ccccc12 ZINC000587840752 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)Oc1ccccc12 ZINC000587840753 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Oc1ccccc12 ZINC000587841033 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)Oc1ccccc12 ZINC000587841034 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Oc1ccccc12 ZINC000587841035 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)Oc1ccccc12 ZINC000587841036 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CN)(c2cccs2)N1 ZINC000587847464 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CN)(c2cccs2)N1 ZINC000587847490 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CN)(c2cccs2)N1 ZINC000587847491 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CN)(c2cccs2)N1 ZINC000587847492 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(C(N)=O)cs2)N1 ZINC000587848922 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(C(N)=O)cs2)N1 ZINC000587848923 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(C(N)=O)cs2)N1 ZINC000587848924 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(C(N)=O)cs2)N1 ZINC000587848925 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CN)(c2cccs2)N1 ZINC000587848994 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CN)(c2cccs2)N1 ZINC000587848995 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CN)(c2cccs2)N1 ZINC000587849120 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CN)(c2cccs2)N1 ZINC000587849123 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(C(N)=O)s2)N1 ZINC000587849215 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(C(N)=O)s2)N1 ZINC000587849217 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(C(N)=O)s2)N1 ZINC000587849218 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(C(N)=O)s2)N1 ZINC000587849220 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(C(N)=O)s2)N1 ZINC000587849298 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(C(N)=O)s2)N1 ZINC000587849299 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(C(N)=O)s2)N1 ZINC000587849300 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(C(N)=O)s2)N1 ZINC000587849301 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(C(N)=O)cs2)N1 ZINC000587850552 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(C(N)=O)cs2)N1 ZINC000587850553 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(C(N)=O)cs2)N1 ZINC000587850554 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(C(N)=O)cs2)N1 ZINC000587850555 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2csc(=N)[nH]2)N1 ZINC000587855548 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2csc(=N)[nH]2)N1 ZINC000587855563 FG Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2csc(=N)[nH]2)N1 ZINC000587855565 FG Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2csc(=N)[nH]2)N1 ZINC000587855566 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2csc(=N)[nH]2)N1 ZINC000587856696 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2csc(=N)[nH]2)N1 ZINC000587856697 FG Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2csc(=N)[nH]2)N1 ZINC000587856698 FG Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2csc(=N)[nH]2)N1 ZINC000587856699 FG Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)CCC(N)=O ZINC000587857905 FG Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)[C@@H]1COCCO1 ZINC000587858525 FG Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)[C@H]1COCCO1 ZINC000587858526 FG Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1nccn(C)c1=O ZINC000587858710 FG Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1CCS(C)(=O)=O ZINC000587859168 FG Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1nc(N)cc(O)n1 ZINC000587859216 FG Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1nc[nH]n1 ZINC000587859305 FG Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1nncc(O)n1 ZINC000587859756 FG Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1cc(O)nc(O)n1 ZINC000587859795 FG Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1nnc(C)c(O)n1 ZINC000587860622 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1cc(Cl)[nH]c(=N)n1 ZINC000587861347 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cc[nH]c(=N)c1 ZINC000587861793 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1ccc(=N)[nH]c1 ZINC000587862150 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cnc(C)nc1 ZINC000587862182 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cnc(C)cn1 ZINC000587862412 FG Annotated Anodyne COCCO[C@H](C)C(=O)n1nc(-c2ccccc2C(F)(F)F)cc1OC ZINC000587862421 FG Annotated Anodyne COCCO[C@@H](C)C(=O)n1nc(-c2ccccc2C(F)(F)F)cc1OC ZINC000587862425 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1ccc(O)nc1 ZINC000587862430 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1ccncc1N ZINC000587862493 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1nc(C)cc(O)n1 ZINC000587862507 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ccnc(N(C)C)n1 ZINC000587862584 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cncnc1C ZINC000587862688 FG Annotated Anodyne CCn1ccc(C(=O)n2nc(-c3ccccc3C(F)(F)F)cc2OC)n1 ZINC000587862696 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)CC1(C)OCCO1 ZINC000587862710 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)Cn1ccc(C)n1 ZINC000587862718 FG Annotated Anodyne CCn1nccc1C(=O)n1nc(-c2ccccc2C(F)(F)F)cc1OC ZINC000587862738 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)Cn1nccc1C ZINC000587862773 FG Annotated Anodyne COc1ccc(-n2nc(-c3ccccc3C(F)(F)F)cc2OC)nn1 ZINC000587862904 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)Cn1cccn1 ZINC000587862915 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)Cn1cc(C)cn1 ZINC000587862937 FG Annotated Anodyne CCn1cc(C(=O)n2nc(-c3ccccc3C(F)(F)F)cc2OC)cn1 ZINC000587862942 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cc(C)nn1C ZINC000587862963 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cnn(C)c1C ZINC000587862989 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1[nH]cnc1C ZINC000587863008 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1c[nH]nc1C ZINC000587863084 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ccc2nncn2n1 ZINC000587863086 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cc(C)n(C)n1 ZINC000587863142 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)N=c1cc[nH]cc1 ZINC000587863304 FG Annotated Anodyne COC[C@H](C)NC(=S)n1nc(-c2ccccc2C(F)(F)F)cc1OC ZINC000587863373 FG Annotated Anodyne COC[C@@H](C)NC(=S)n1nc(-c2ccccc2C(F)(F)F)cc1OC ZINC000587863376 FG Annotated Anodyne COCCCNC(=O)n1nc(-c2ccccc2C(F)(F)F)cc1OC ZINC000587863394 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ncnc2c1cnn2C ZINC000587863413 FG Annotated Anodyne COCCCNC(=S)n1nc(-c2ccccc2C(F)(F)F)cc1OC ZINC000587863434 FG Annotated Anodyne C=C1C=C(n2nc(-c3ccccc3C(F)(F)F)cc2OC)c2nncn2N1 ZINC000587863437 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ncnc2[nH]cnc12 ZINC000587863485 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1csnn1 ZINC000587863497 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)Cc1cc[nH]n1 ZINC000587863563 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ccc2nnc(C)n2n1 ZINC000587863631 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1ccncn1 ZINC000587863870 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cc(C)[nH]n1 ZINC000587863967 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1[C@@]1(C)CCS(=O)(=O)C1 ZINC000587864127 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1[C@]1(C)CCS(=O)(=O)C1 ZINC000587864134 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=S)N1CCOCC1 ZINC000587864252 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1snnc1C ZINC000587864280 FG Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)Cc1cc(C)[nH]n1 ZINC000587864373 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1cnccn1 ZINC000587864476 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1cccnn1 ZINC000587864580 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1ncccn1 ZINC000587864601 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1nccn1C ZINC000587865621 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1cc(O)nc(O)n1 ZINC000587865714 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1nc(N)cc(O)n1 ZINC000587865822 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1nnc(C)c(O)n1 ZINC000587865888 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1ccnc(O)n1 ZINC000587865988 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=S)NCCOC ZINC000587866014 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1CCN1CCOCC1 ZINC000587866024 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)[C@@H]1COCCO1 ZINC000587866110 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)[C@H]1COCCO1 ZINC000587866111 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1ccn(C)n1 ZINC000587866169 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1cc[nH]n1 ZINC000587866288 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1cc(O)ncn1 ZINC000587866385 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1cnc[nH]1 ZINC000587866474 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1nccn(C)c1=O ZINC000587866483 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1cn[nH]c1 ZINC000587866555 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1ccc2nncn2n1 ZINC000587866758 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1CCS(C)(=O)=O ZINC000587866778 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1ccnn1C ZINC000587866822 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1cnn(C)c1 ZINC000587866893 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ncccc1C ZINC000587867270 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cccc(C)n1 ZINC000587867285 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccc(O)cc1 ZINC000587867402 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1[C@@H]1CCS(=O)(=O)C1 ZINC000587867451 FG Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1[C@H]1CCS(=O)(=O)C1 ZINC000587867452 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccccc1N ZINC000587867466 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@H](C)OC(C)C ZINC000587867468 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@@H](C)OC(C)C ZINC000587867469 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccc(F)cn1 ZINC000587867529 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccncc1F ZINC000587867556 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@@H]1OCC[C@@H]1C ZINC000587867637 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cnc(Cl)cn1 ZINC000587867740 FG Annotated Anodyne CCc1cc(O)nc(-n2nc(-c3ccc(C(F)(F)F)nc3)cc2OC)n1 ZINC000587867780 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cccc(O)c1 ZINC000587867826 FG Annotated Anodyne CCN(CC)CCC(=O)n1nc(-c2ccc(C(F)(F)F)nc2)cc1OC ZINC000587867845 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cc2c(nn1)CCC2 ZINC000587867879 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)Cc1cccnc1 ZINC000587867902 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)Cc1ccncc1 ZINC000587867921 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)CCCCCO ZINC000587867946 FG Annotated Anodyne CCOc1cc(-n2nc(-c3ccc(C(F)(F)F)nc3)cc2OC)ncn1 ZINC000587867949 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccc(Cl)nn1 ZINC000587868011 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ncccc1[N+](=O)[O-] ZINC000587868050 FG Annotated Bother COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccc(N)cc1 ZINC000587868053 FG Annotated Anodyne COc1cccc(-n2nc(-c3ccc(C(F)(F)F)nc3)cc2OC)n1 ZINC000587868121 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1nc(C)c(C)c(O)n1 ZINC000587868132 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)Cc1ccccn1 ZINC000587868143 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccc([N+](=O)[O-])cn1 ZINC000587868151 FG Annotated Bother COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccc(C)nc1 ZINC000587868188 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@@H]1CCCOC1 ZINC000587868225 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@H]1CCCOC1 ZINC000587868226 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cc(Cl)ncn1 ZINC000587868308 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccnc(Cl)n1 ZINC000587868345 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ncc(Cl)cn1 ZINC000587868365 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccncc1[N+](=O)[O-] ZINC000587868408 FG Annotated Bother COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccccc1C(N)=O ZINC000587868452 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1oc(C)nc1C ZINC000587868477 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1n[nH]cc1Cl ZINC000587868634 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)C1CCOCC1 ZINC000587868644 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)NCc1ccco1 ZINC000587868694 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ncccc1C(=O)O ZINC000587868697 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)Cc1cccn1C ZINC000587868720 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccnc(C(=O)O)c1 ZINC000587868800 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1nccnc1Cl ZINC000587868805 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cnnc(O)c1Cl ZINC000587868860 FG Annotated Anodyne COc1cc(C)nc(-n2nc(-c3ccc(C(F)(F)F)nc3)cc2OC)n1 ZINC000587868891 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cc(C(=O)O)ccn1 ZINC000587868910 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)NCC(F)(F)F ZINC000587868918 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cncc(Cl)n1 ZINC000587868940 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccc(C(=O)O)cn1 ZINC000587868964 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ncncc1Cl ZINC000587869037 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccnc2c1cnn2C ZINC000587869081 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cc(SC)ncn1 ZINC000587869123 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1scnc1C ZINC000587869164 FG Annotated Anodyne CCCCNC(=S)n1nc(-c2ccc(C(F)(F)F)nc2)cc1OC ZINC000587869318 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=S)N[C@H](C)C1CC1 ZINC000587869331 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=S)N[C@@H](C)C1CC1 ZINC000587869332 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cncs1 ZINC000587869366 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)CC1CCNCC1 ZINC000587869431 FG Annotated Anodyne C=C(C)CNC(=S)n1nc(-c2ccc(C(F)(F)F)nc2)cc1OC ZINC000587869539 FG Annotated Mild COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=S)NCC1CCC1 ZINC000587869589 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1csc(C)n1 ZINC000587869734 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccnc(SC)n1 ZINC000587869769 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1nccs1 ZINC000587869847 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)CN1CCCCC1 ZINC000587869993 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1c(C)n[nH]c1C ZINC000587870047 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@@H](C)N1CCCC1 ZINC000587870054 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@H](C)N1CCCC1 ZINC000587870055 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@H](C)n1cccn1 ZINC000587870058 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@@H](C)n1cccn1 ZINC000587870059 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)CCN1CCCC1 ZINC000587870073 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cscn1 ZINC000587870115 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1ccnc(N(C)C)c1 ZINC000587870146 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cncc(NC(C)=O)c1 ZINC000587870151 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=S)NC(C)(C)C ZINC000587870178 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cccc(OC)c1O ZINC000587870220 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1nc2ccccn2n1 ZINC000587870238 FG Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccc2nccn2n1 ZINC000587870257 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)C(=O)Nc1ccccc1 ZINC000587870426 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1nnc(Cl)cc1C(=O)O ZINC000587870597 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1ccn(C(F)F)n1 ZINC000587870665 FG Annotated Anodyne CCOc1oc(C(=O)n2nc(-c3cccc(F)c3)cc2OCC)nc1C ZINC000587870818 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)CNC(=O)c1ccccc1 ZINC000587870839 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1nc(F)c(F)c(N)c1F ZINC000587870848 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)Cc1ccc(O)c(N)c1 ZINC000587870856 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1ccc(O)c(C)c1O ZINC000587871022 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)CNC(=O)OC(C)(C)C ZINC000587871035 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1nc(Cl)nc2[nH]cnc12 ZINC000587871122 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1ccnn1C(F)F ZINC000587871167 FG Annotated Anodyne C=CCn1ncc(-n2nc(-c3cccc(F)c3)cc2OCC)c(Cl)c1=O ZINC000587871224 FG Annotated Mild CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cccc([N+](=O)[O-])c1O ZINC000587871233 FG Annotated Bother CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1nn(C)c(C)c1Cl ZINC000587871339 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1cnn(CC)c(=O)c1Cl ZINC000587871365 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1ccc(-n2ccnc2)nn1 ZINC000587871458 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1c(Cl)c(C)nn1C ZINC000587871555 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cc(N)cc([N+](=O)[O-])c1 ZINC000587871587 FG Annotated Bother CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1n[nH]c2c1CCCC2 ZINC000587871624 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cc(-c2cc[nH]c2)[nH]n1 ZINC000587871694 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C1=NS(=O)(=O)c2ccccc21 ZINC000587871813 FG Annotated Anodyne Cn1cc(Br)c(C(=O)n2nc3cc2oc2ccc(F)cc32)n1 ZINC000587871857 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](C)n1cc([N+](=O)[O-])cn1 ZINC000587871859 FG Annotated Bother CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](C)n1cc([N+](=O)[O-])cn1 ZINC000587871862 FG Annotated Bother CCOc1cc(-c2cccc(F)c2)nn1-c1nccc(-c2ccn(C)n2)n1 ZINC000587871903 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1ccc(CN(C)C)o1 ZINC000587871935 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cc(-c2ccc[nH]2)[nH]n1 ZINC000587871970 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)NCCc1ccccn1 ZINC000587871982 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1ccc(-n2cccn2)nn1 ZINC000587872015 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cnc2n[nH]c(C)c2c1 ZINC000587872027 FG Annotated Anodyne Cc1[nH]nc(C(=O)n2nc3cc2oc2ccc(F)cc32)c1Br ZINC000587872094 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1nc2ccccc2[nH]c1=O ZINC000587872474 FG Annotated Anodyne CCOC(=O)c1cnc(-n2nc(-c3cccc(F)c3)cc2OCC)nc1C ZINC000587872492 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=S)NCCc1ccccn1 ZINC000587872523 FG Annotated Anodyne CCCCn1c(O)nc(-n2nc(-c3cccc(F)c3)cc2OCC)cc1=O ZINC000587872669 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)CN1CCCCCC1=O ZINC000587872672 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1ccc2nccn2c1 ZINC000587872696 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)CNC(=O)c1cccs1 ZINC000587872759 FG Annotated Anodyne COc1ncc(Br)nc1-n1nc2cc1oc1ccc(F)cc21 ZINC000587872833 FG Annotated Anodyne O=C(Cn1cc(Br)cn1)n1nc2cc1oc1ccc(F)cc21 ZINC000587872872 FG Annotated Anodyne COc1cc(C(=O)n2nc3cc2oc2ccc(F)cc32)cc(OC)c1O ZINC000587873072 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1nc2ccccc2n(C)c1=O ZINC000587873074 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1ccccc1S(C)(=O)=O ZINC000587873143 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=S)NCc1cccnc1 ZINC000587873293 FG Annotated Anodyne Cn1ncc(Br)c1C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587873357 FG Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1nnnn1-c1ccccc1 ZINC000587873461 FG Annotated Anodyne O=C(COc1ccc2c(c1)OCO2)n1nc2cc1oc1ccc(F)cc21 ZINC000587873496 FG Annotated Anodyne Fc1ccc2oc3cc(nn3-c3cc(C(F)(F)F)nc4ncnn34)c2c1 ZINC000587873535 FG Annotated Anodyne COC(=O)c1ccc(OCC(=O)n2nc3cc2oc2ccc(F)cc32)cc1 ZINC000587873671 FG Annotated Anodyne NNC(=O)CCCCCCCC(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587873691 FG Annotated Reactive O=C(NCC(=O)n1nc2cc1oc1ccc(F)cc21)c1cccc(F)c1 ZINC000587873722 FG Annotated Anodyne Cn1nc(C(=O)n2nc3cc2oc2ccc(F)cc32)cc1C(F)(F)F ZINC000587873833 FG Annotated Anodyne Cn1nc(C(F)(F)F)cc1C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587873961 FG Annotated Anodyne O=C(NCC(=O)n1nc2cc1oc1ccc(F)cc21)OCc1ccccc1 ZINC000587874122 FG Annotated Anodyne O=C(Cn1cc(Cl)c([N+](=O)[O-])n1)n1nc2cc1oc1ccc(F)cc21 ZINC000587874369 FG Annotated Bother Cc1nn(CCC(=O)n2nc3cc2oc2ccc(F)cc32)c(C)c1[N+](=O)[O-] ZINC000587874436 FG Annotated Bother Cc1nn(CCC(=O)n2nc3cc2oc2ccc(F)cc32)cc1[N+](=O)[O-] ZINC000587874483 FG Annotated Bother CC(C)(C(=O)n1nc2cc1oc1ccc(F)cc21)n1cc([N+](=O)[O-])cn1 ZINC000587874513 FG Annotated Bother CC(C)(C)OC(=O)NCCNC(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587874523 FG Annotated Anodyne O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)n1nc2cc1oc1ccc(F)cc21 ZINC000587874607 FG Annotated Bother CC[C@H](C(=O)n1nc2cc1oc1ccc(F)cc21)n1cc([N+](=O)[O-])cn1 ZINC000587874616 FG Annotated Bother CC[C@@H](C(=O)n1nc2cc1oc1ccc(F)cc21)n1cc([N+](=O)[O-])cn1 ZINC000587874617 FG Annotated Bother C[C@H](Cn1cc([N+](=O)[O-])cn1)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587874632 FG Annotated Bother C[C@@H](Cn1cc([N+](=O)[O-])cn1)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587874634 FG Annotated Bother Cc1cccc(-n2cnc(C(=O)n3nc4cc3oc3ccc(F)cc43)c2)n1 ZINC000587874732 FG Annotated Anodyne CS(=O)(=O)c1ccc(NC(=O)n2nc3cc2oc2ccc(F)cc32)cc1 ZINC000587874766 FG Annotated Anodyne Cc1nn(C)cc1-c1cc(C(=O)n2nc3cc2oc2ccc(F)cc32)no1 ZINC000587874831 FG Annotated Anodyne CS(=O)(=O)c1cccc(C(=O)n2nc3cc2oc2ccc(F)cc32)c1 ZINC000587874891 FG Annotated Anodyne O=C([C@@H]1CCCN(c2ncccn2)C1)n1nc2cc1oc1ccc(F)cc21 ZINC000587874905 FG Annotated Anodyne O=C([C@H]1CCCN(c2ncccn2)C1)n1nc2cc1oc1ccc(F)cc21 ZINC000587874906 FG Annotated Anodyne C[C@](Cc1ccc(O)c(O)c1)(C(=O)O)n1nc2cc1oc1ccc(F)cc21 ZINC000587874941 FG Annotated Clean Cc1cc([N+](=O)[O-])nn1CCC(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587875013 FG Annotated Bother Cc1nn([C@H](C)C(=O)n2nc3cc2oc2ccc(F)cc32)cc1[N+](=O)[O-] ZINC000587875027 FG Annotated Bother Cc1nn([C@@H](C)C(=O)n2nc3cc2oc2ccc(F)cc32)cc1[N+](=O)[O-] ZINC000587875029 FG Annotated Bother Cc1cc([N+](=O)[O-])nn1C[C@@H](C)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587875080 FG Annotated Bother Cc1cc([N+](=O)[O-])nn1C[C@H](C)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587875081 FG Annotated Bother Cc1cc([N+](=O)[O-])nn1[C@H](C)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587875598 FG Annotated Bother Cc1cc([N+](=O)[O-])nn1[C@@H](C)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587875599 FG Annotated Bother O=C(Cc1ccc(O)c([N+](=O)[O-])c1)n1nc2cc1oc1ccc(F)cc21 ZINC000587875612 FG Annotated Bother O=C(C1CCN(c2ncccn2)CC1)n1nc2cc1oc1ccc(F)cc21 ZINC000587875736 FG Annotated Anodyne Nc1c(C(=O)n2nc3cc2oc2ccc(F)cc32)cnn1-c1ccccc1 ZINC000587875856 FG Annotated Anodyne O=C1C[C@@H](C(=O)n2nc3cc2oc2ccc(F)cc32)CN1Cc1ccco1 ZINC000587875881 FG Annotated Anodyne O=C1C[C@H](C(=O)n2nc3cc2oc2ccc(F)cc32)CN1Cc1ccco1 ZINC000587875882 FG Annotated Anodyne Cc1c([N+](=O)[O-])cnn1CCC(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587876157 FG Annotated Bother O=C(Cc1ccc(Cl)cc1Cl)NCC#CCc1ccc([N+](=O)[O-])o1 ZINC000587876158 FG Annotated Mild C[C@@H]1CN(C[C@@H](C)C(=O)n2nc3cc2oc2ccc(F)cc32)C[C@@H](C)O1 ZINC000587876194 FG Annotated Anodyne C[C@H]1CN(C[C@H](C)C(=O)n2nc3cc2oc2ccc(F)cc32)C[C@@H](C)O1 ZINC000587876197 FG Annotated Anodyne C[C@H]1CN(C[C@@H](C)C(=O)n2nc3cc2oc2ccc(F)cc32)C[C@@H](C)O1 ZINC000587876198 FG Annotated Anodyne C[C@@H](CN1C[C@@H](C)O[C@H](C)C1)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587876199 FG Annotated Anodyne Cc1c(-c2cc(C(=O)n3nc4cc3oc3ccc(F)cc43)no2)cnn1C ZINC000587876245 FG Annotated Anodyne CC(C)(C)OC(=O)N1CC(C(=O)n2nc3cc2oc2ccc(F)cc32)C1 ZINC000587876263 FG Annotated Anodyne NNC(=O)c1ccc2nc(-n3nc4cc3oc3ccc(F)cc43)sc2c1 ZINC000587876614 FG Annotated Reactive O=S(=O)(NC1CC1)c1ccc(-n2nc3cc2oc2ccc(F)cc32)cc1 ZINC000587876642 FG Annotated Anodyne CS(=O)(=O)c1ccc(C(=O)n2nc3cc2oc2ccc(F)cc32)cc1 ZINC000587876692 FG Annotated Anodyne O=C1Nc2ccccc2O[C@H]1CC(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587876696 FG Annotated Anodyne O=C1Nc2ccccc2O[C@@H]1CC(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587876697 FG Annotated Anodyne O=C([C@@H]1CCc2nnc(C3CC3)n2C1)n1nc2cc1oc1ccc(F)cc21 ZINC000587876917 FG Annotated Anodyne O=C([C@H]1CCc2nnc(C3CC3)n2C1)n1nc2cc1oc1ccc(F)cc21 ZINC000587876922 FG Annotated Anodyne Cc1cc(C#N)cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1N ZINC000587877293 FG Annotated Mild Nc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1C=O ZINC000587877294 FG Annotated Mild N#Cc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1O ZINC000587877326 FG Annotated Mild Nc1c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cccc1C=O ZINC000587877515 FG Annotated Mild O=Cc1c(O)cccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587877536 FG Annotated Mild CNc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1N ZINC000587877598 FG Annotated Mild N#Cc1c(O)cccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587877599 FG Annotated Mild O=Cc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1O ZINC000587877736 FG Annotated Mild N#CCc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1O ZINC000587878083 FG Annotated Mild N#Cc1c(N)cccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587878109 FG Annotated Mild O=Cc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c(O)c1 ZINC000587878412 FG Annotated Mild N#Cc1cc(O)ccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587878427 FG Annotated Mild COc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c(N)c1 ZINC000587878453 FG Annotated Mild Nc1cc(C=O)ccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587878569 FG Annotated Mild N#Cc1ccc(O)c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587878590 FG Annotated Mild N#CCc1ccc(N)c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587878644 FG Annotated Mild N#Cc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c(C=O)c1 ZINC000587878732 FG Annotated Mild N#Cc1cc(C=O)ccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587878763 FG Annotated Mild O=Cc1cc(O)ccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587878785 FG Annotated Mild COc1cc(O)ccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587878817 FG Annotated Mild COc1cc(N)ccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587878831 FG Annotated Mild N#Cc1ccc(C=O)c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587878846 FG Annotated Mild N=c1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c(Cl)c[nH]1 ZINC000587879041 FG Annotated Mild O=CNc1ccccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587879370 FG Annotated Mild O=Cc1ccc(O)cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587879394 FG Annotated Mild O=Cc1ccc(O)c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587879879 FG Annotated Mild COc1ccc(N)cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587879907 FG Annotated Mild COc1ccc(N)c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587879977 FG Annotated Mild N#Cc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1C=O ZINC000587879992 FG Annotated Mild Cc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc(N)c1N ZINC000587880136 FG Annotated Mild CCc1[nH]c(C#N)cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587880180 FG Annotated Mild COc1cccc(N)c1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587880241 FG Annotated Mild N#Cc1ccc(O)cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587880265 FG Annotated Mild O=CC(=O)c1ccccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587880346 FG Annotated Mild COc1ccc(O)cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587880349 FG Annotated Mild N=c1[nH]ccc(Cl)c1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587880910 FG Annotated Mild N[C@@H]1Cc2ccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cc2C1 ZINC000587884601 FG Annotated Mild N[C@H]1Cc2ccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cc2C1 ZINC000587884603 FG Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc2c(c1)C(=O)OC2 ZINC000587885068 FG Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc2c(c1)COC2=O ZINC000587885258 FG Annotated Mild N=c1[nH]c2ccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cc2o1 ZINC000587885370 FG Annotated Mild CCn1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1C#N ZINC000587885863 FG Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc2nc(O)[nH]c2c1 ZINC000587886064 FG Annotated Mild N=c1[nH]c2cc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)ccc2o1 ZINC000587886909 FG Annotated Mild C[C@@H](N)c1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cn1 ZINC000587887228 FG Annotated Mild C[C@H](N)c1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cn1 ZINC000587887229 FG Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc2c1CNCC2 ZINC000587887818 FG Annotated Mild CCOc1cncc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587887828 FG Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc2c1CCNC2 ZINC000587887917 FG Annotated Mild O=C1Cc2cccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)c2C1 ZINC000587888214 FG Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc2c1COC2=O ZINC000587888339 FG Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cnc2c(c1)CCO2 ZINC000587888432 FG Annotated Mild N#CCc1cncc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587888537 FG Annotated Mild N=c1[nH]oc2cccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)c12 ZINC000587888663 FG Annotated Mild Nc1c[nH]c2ncc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cc12 ZINC000587888750 FG Annotated Mild Cc1nc2cc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cnc2[nH]1 ZINC000587888817 FG Annotated Mild N=c1[nH]c2c(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cccc2o1 ZINC000587889518 FG Annotated Mild C#CCOc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)nc1 ZINC000587889721 FG Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc([N+](=O)[O-])n1 ZINC000587889942 FG Annotated Mild COCc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)n1 ZINC000587889973 FG Annotated Mild N=c1[nH]oc2c(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cccc12 ZINC000587890094 FG Annotated Mild CCOc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)n1 ZINC000587890122 FG Annotated Mild N=c1[nH]c2cccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)c2o1 ZINC000587890149 FG Annotated Mild N#CCc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)n1 ZINC000587890253 FG Annotated Mild N[C@@H](N=O)c1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)o1 ZINC000587890371 FG Annotated Mild N[C@H](N=O)c1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)o1 ZINC000587890372 FG Annotated Mild CCCc1ncc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)[nH]1 ZINC000587890891 FG Annotated Mild C=C1C=Cn2c(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cnc2N1 ZINC000587890931 FG Annotated Mild NCc1sccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587896200 FG Annotated Mild N#Cc1sc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1N ZINC000587897426 FG Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cscc1C(=O)O ZINC000587899167 FG Annotated Mild COc1ccc(C#Cc2cc(Cl)ccc2OC)c(-c2n[nH]c(=N)o2)c1 ZINC000587899528 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C(N)=O)c([N+](=O)[O-])cc1Cl ZINC000587899827 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C)ccc1N1C(=O)C=CC1=O ZINC000587899844 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc([N+](=O)[O-])c(C(N)=O)cc1Cl ZINC000587900049 FG Annotated Mild CNc1c(C#Cc2cc(Cl)ccc2OC)cc(C(=O)OC)cc1[N+](=O)[O-] ZINC000587900098 FG Annotated Mild COC(=O)c1cc(C#Cc2cc(Cl)ccc2OC)c(N)c([N+](=O)[O-])c1 ZINC000587900196 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(-c2nc(=O)o[nH]2)ccc1OC ZINC000587900236 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C[C@H](N=O)C(=O)O)ccc1O ZINC000587900288 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C[C@@H](N=O)C(=O)O)ccc1O ZINC000587900293 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(N2CC[C@@H](N)C2=O)cc1C ZINC000587900364 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(N2CC[C@H](N)C2=O)cc1C ZINC000587900365 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C=O)cc(OC)c1OC(C)=O ZINC000587900508 FG Annotated Mild COC(=O)[C@H](Cc1ccc(O)c(C#Cc2cc(Cl)ccc2OC)c1)N=O ZINC000587900963 FG Annotated Mild COC(=O)[C@@H](Cc1ccc(O)c(C#Cc2cc(Cl)ccc2OC)c1)N=O ZINC000587900965 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C=O)cc(OC)c1OCC#N ZINC000587901116 FG Annotated Mild CCOC(=O)C1=C(CC#Cc2cc(Cl)ccc2OC)C(C)(C)OC1=O ZINC000587901205 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(N)ccc1N1CCC(O)CC1 ZINC000587901638 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(N)ccc1CN1CCN(C)CC1 ZINC000587901694 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(N2CCOCC2)ccc1C=O ZINC000587901695 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1Cc1noc(CN)n1 ZINC000587901746 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1[C@H](O)[C@H](C#N)CN(C)C ZINC000587901850 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1[C@H](O)[C@@H](C#N)CN(C)C ZINC000587901851 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1[C@@H](O)[C@H](C#N)CN(C)C ZINC000587901852 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1[C@@H](O)[C@@H](C#N)CN(C)C ZINC000587901853 FG Annotated Mild COC(=O)[C@H](C)Cn1nc(C)c(C#Cc2cc(Cl)ccc2OC)c1C ZINC000587902836 FG Annotated Mild COC(=O)[C@@H](C)Cn1nc(C)c(C#Cc2cc(Cl)ccc2OC)c1C ZINC000587902837 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C(C)=O)c(/C=C\N(C)C)[nH]c1=O ZINC000587902856 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C(C)=O)c(/C=C/N(C)C)[nH]c1=O ZINC000587902858 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1-n1nnnc1CCl ZINC000587902884 FG Annotated Reactive COC(=O)c1nc(O)c(C#Cc2cc(Cl)ccc2OC)cc1Cl ZINC000587902896 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)c(C)nc1NN ZINC000587902901 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc2c(N)nn(C)c2nc1C1CC1 ZINC000587903171 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc(C)nc1OCc1nonc1C ZINC000587903246 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)c(NN)nc1C ZINC000587903329 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1c(OC2CCCC2)n[nH]c1C(=O)O ZINC000587903394 FG Annotated Mild CCOC(=O)c1[nH]nc(OC(C)C)c1C#Cc1cc(Cl)ccc1OC ZINC000587903397 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1c(O)nc(=N)[nH]c1-c1ccccc1 ZINC000587903778 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc([N+](=O)[O-])c(C#N)c([N+](=O)[O-])c1 ZINC000587903884 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc([C@H](C#N)N2CCNCC2)cc1 ZINC000587905589 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc([C@@H](C#N)N2CCNCC2)cc1 ZINC000587905590 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(Cc2noc(CN)n2)cc1 ZINC000587905841 FG Annotated Mild COC(=O)c1cc(C#Cc2cc(Cl)ccc2OC)cc2[nH]c(=N)oc12 ZINC000587906995 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc2c(cc1C(C)=O)OCC(=O)N2 ZINC000587907395 FG Annotated Mild CCn1cc(C#Cc2cc(Cl)ccc2OC)c(C(=O)/C=C\N(C)C)n1 ZINC000587907516 FG Annotated Mild CCn1cc(C#Cc2cc(Cl)ccc2OC)c(C(=O)/C=C/N(C)C)n1 ZINC000587907517 FG Annotated Mild CCN(CC)CCN=c1ccc(C#Cc2cc(Cl)ccc2OC)c[nH]1 ZINC000587908141 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc2cc(C(=O)O)c(=O)oc2cc1O ZINC000587908266 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cncc(C2(O)CCOCC2)c1C ZINC000587908314 FG Annotated Mild CCOC(=O)/C=C/c1c[nH]cc(C#Cc2cc(Cl)ccc2OC)c1=N ZINC000587908416 FG Annotated Mild CCOC(=O)/C=C\c1c[nH]cc(C#Cc2cc(Cl)ccc2OC)c1=N ZINC000587908417 FG Annotated Mild CCN1CCN(c2ccc(C#Cc3cc(Cl)ccc3OC)cn2)CC1 ZINC000587908511 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cnn(-c2ccc([N+](=O)[O-])cn2)c1 ZINC000587908797 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc2oc(N)c(C=O)c(=O)c2c1 ZINC000587908877 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc2c(c1)N1C(=O)ONC1=CO2 ZINC000587908932 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cnn(Cc2cc(C(=O)O)co2)c1 ZINC000587909025 FG Annotated Mild COC(=O)[C@@H]1CC(=O)c2cc(C#Cc3cc(Cl)ccc3OC)ccc2O1 ZINC000587909092 FG Annotated Mild COC(=O)[C@H]1CC(=O)c2cc(C#Cc3cc(Cl)ccc3OC)ccc2O1 ZINC000587909093 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cnn(Cc2ccc(C(=O)O)o2)c1 ZINC000587909099 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cnn(C[C@@H]2CN(C(C)C)CCO2)c1 ZINC000587909391 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cnn(C[C@H]2CN(C(C)C)CCO2)c1 ZINC000587909393 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc2nc(O)n3ncnc3c2c1 ZINC000587909431 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc2[nH]cc([N+](=O)[O-])c(=O)c2c1 ZINC000587909507 FG Annotated Mild CCCc1nc(Cn2cc(C#Cc3cc(Cl)ccc3OC)cn2)no1 ZINC000587909627 FG Annotated Mild COC(=O)c1nc(C#Cc2cc(Cl)ccc2OC)c2cccnc2c1O ZINC000587910429 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1nc(Br)ccc1CO ZINC000587910473 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc(N(C)C)c(Br)n1 ZINC000587910483 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C#N)nc(Br)c1N ZINC000587910485 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1nc(Br)cnc1OC ZINC000587910493 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(CO)c(Br)n1 ZINC000587910498 FG Annotated Mild COC(=O)c1cc(N)c(C#Cc2cc(Cl)ccc2OC)nc1Cl ZINC000587910583 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(C(=O)N(C)OC)c(Cl)n1 ZINC000587910680 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1nc(C#N)cc(Br)c1N ZINC000587910826 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc(Br)c(N)c1N ZINC000587910850 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc(Br)nc1OC ZINC000587910854 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1nc(Br)cnc1N(C)C ZINC000587910914 FG Annotated Mild C=C1NC(=O)c2c(C#Cc3cc(Cl)ccc3OC)cc(OC)cc2N1 ZINC000587911201 FG Annotated Mild C=C1C=C(C(=O)O)n2nc(C)c(C#Cc3cc(Cl)ccc3OC)c2N1 ZINC000587911285 FG Annotated Mild COc1cc(C#Cc2cc(Cl)ccc2OC)c2c(c1)NC(=O)[C@@H](C)O2 ZINC000587911305 FG Annotated Mild COc1cc(C#Cc2cc(Cl)ccc2OC)c2c(c1)NC(=O)[C@H](C)O2 ZINC000587911306 FG Annotated Mild C=C1C=C(C)n2nc(C(=O)O)c(C#Cc3cc(Cl)ccc3OC)c2N1 ZINC000587911346 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1nn(C)c(Br)c1[N+](=O)[O-] ZINC000587911433 FG Annotated Mild COC(=O)c1cnn([C@H]2CCCCO2)c1C#Cc1cc(Cl)ccc1OC ZINC000587911610 FG Annotated Mild COC(=O)c1cnn([C@@H]2CCCCO2)c1C#Cc1cc(Cl)ccc1OC ZINC000587911613 FG Annotated Mild CCOC(=O)c1cc(C#Cc2cc(Cl)ccc2OC)c2[nH]nnc2c1 ZINC000587911684 FG Annotated Mild CCOC(=O)c1cc(C#Cc2cc(Cl)ccc2OC)c2oc(=N)[nH]c2c1 ZINC000587911708 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1nc(C=O)n(C)c1Br ZINC000587911736 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1c(Br)nc(C=O)n1C ZINC000587911817 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1c([N+](=O)[O-])c(Br)nn1C ZINC000587911826 FG Annotated Mild COC(=O)c1cc(C#Cc2cc(Cl)ccc2OC)c2[nH]c(O)nc2c1 ZINC000587911829 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(=NC(=O)OC(C)(C)C)[nH]n1C ZINC000587911860 FG Annotated Mild COC(=O)c1cc(C#Cc2cc(Cl)ccc2OC)c2oc(=N)[nH]c2c1 ZINC000587911896 FG Annotated Mild COC(=O)c1c[nH]c2c(C#Cc3cc(Cl)ccc3OC)cccc2c1=O ZINC000587911904 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(CNCCn2ccnc2)o1 ZINC000587911969 FG Annotated Mild COC(=O)c1[nH]nc(Br)c1C#Cc1cc(Cl)ccc1OC ZINC000587912009 FG Annotated Mild CCn1ncc(Br)c(C#Cc2cc(Cl)ccc2OC)c1=O ZINC000587912032 FG Annotated Mild COc1ccc(Cl)cc1C#CC1=C[C@H](C(=O)O)N(c2ccc(C)cc2)N1 ZINC000587912098 FG Annotated Mild COc1ccc(Cl)cc1C#CC1=C[C@@H](C(=O)O)N(c2ccc(C)cc2)N1 ZINC000587912099 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1nc(Br)[nH]c1[N+](=O)[O-] ZINC000587912112 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)cn(C)c1=O ZINC000587912333 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C)c2nc3c(n2c1)CNCC3 ZINC000587912405 FG Annotated Mild COC(=O)c1cn2cc(C)cc(C#Cc3cc(Cl)ccc3OC)c2n1 ZINC000587912574 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1c(OC)cnn(C2CCCC2)c1=O ZINC000587912593 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1[nH]nc(Br)c1[N+](=O)[O-] ZINC000587912626 FG Annotated Mild COC(=O)c1n[nH]c(C#Cc2cc(Cl)ccc2OC)c1Br ZINC000587912627 FG Annotated Mild COc1ccc(Cl)cc1C#CC1=C2C=C(Br)C=C[C@@H]2NN1 ZINC000587912640 FG Annotated Mild COc1ccc(Cl)cc1C#CC1=C2C=C(Br)C=C[C@H]2NN1 ZINC000587912644 FG Annotated Mild COc1ccc(Cl)cc1C#CC1=CC(=O)C(Br)=CC1=O ZINC000587912648 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc2nc(CCl)cc(=O)n2c1 ZINC000587912662 FG Annotated Reactive COc1ccc(Cl)cc1C#CC1=C[C@@H](CNC(=O)OC(C)(C)C)ON1 ZINC000587912692 FG Annotated Mild COc1ccc(Cl)cc1C#CC1=C[C@H](CNC(=O)OC(C)(C)C)ON1 ZINC000587912695 FG Annotated Mild COc1ccc(Cl)cc1C#CC1=CC2=C(Br)NN[C@H]2C=C1 ZINC000587912831 FG Annotated Mild COc1ccc(Cl)cc1C#CC1=CC2=C(Br)NN[C@@H]2C=C1 ZINC000587912832 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1[nH]nc(NC(C)=O)c1Br ZINC000587912899 FG Annotated Mild COC(=O)c1cc(O)c2n[nH]c(C#Cc3cc(Cl)ccc3OC)c2c1 ZINC000587913026 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cn(C)cc(Br)c1=O ZINC000587913091 FG Annotated Mild COC(=O)c1cn2cc(C#Cc3cc(Cl)ccc3OC)c(C)cc2n1 ZINC000587913093 FG Annotated Mild CCOC(=O)CC1=CNC2=CC=C(C#Cc3cc(Cl)ccc3OC)CN12 ZINC000587913178 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ncc(N2CCOCC2)nc1Cl ZINC000587913185 FG Annotated Mild CCOC(=O)/C(C#N)=C1/C=CC(C#Cc2cc(Cl)ccc2OC)=CN1 ZINC000587913233 FG Annotated Reactive CCOC(=O)/C(C#N)=C1\C=CC(C#Cc2cc(Cl)ccc2OC)=CN1 ZINC000587913234 FG Annotated Reactive CCOC(=O)c1c(C)nc2[nH]cc(C#Cc3cc(Cl)ccc3OC)nc1-2 ZINC000587913245 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1c(NC(C)=O)n[nH]c1Br ZINC000587913280 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ncc(Br)nc1C=O ZINC000587913349 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc(Br)c(C=O)n1 ZINC000587913558 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc(N)c(OCC(F)(F)F)n1 ZINC000587914044 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1c[nH]c(=N)c(Br)c1F ZINC000587915065 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1c(F)c(Br)c[nH]c1=N ZINC000587915614 FG Annotated Mild CCOC(=O)c1[nH]nc(OC(F)F)c1C#Cc1cc(Cl)ccc1OC ZINC000587915815 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cn(-c2ccc(C#N)cc2F)[nH]c1=N ZINC000587916058 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(CN2CCNCC2)c(F)c1 ZINC000587916886 FG Annotated Mild COc1ccc(Cl)cc1C#CC1=CC(=O)N(c2ccc(F)cc2)C1=O ZINC000587917050 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)c(F)[nH]c1=N ZINC000587917551 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(F)c2[nH]cc(C(=O)O)c(=O)c2c1 ZINC000587917665 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(S(=O)(=O)CC#N)s1 ZINC000587917687 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(F)cc2c(=O)c(C(=O)O)c[nH]c12 ZINC000587917861 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1n[nH]cc1I ZINC000587917941 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc(I)cn1 ZINC000587918025 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1sc(S(N)(=O)=O)cc1Cl ZINC000587918135 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1-c1nnc(S)n1N ZINC000587918778 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(-c2nnc(S)n2N)cc1 ZINC000587918801 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1N1CCCS1(=O)=O ZINC000587918964 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(Sc2nnnn2C)c(N)c1 ZINC000587919077 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc2cnc(SC)[nH]c-2nc1=O ZINC000587919344 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C)c2nc(C(N)=S)cn2c1 ZINC000587919629 FG Annotated Mild CCN1CCN(c2nc(C#Cc3cc(Cl)ccc3OC)cs2)CC1 ZINC000587920314 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(C(=O)N[C@@H](C)C(=O)O)s1 ZINC000587920507 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(C(=O)N[C@H](C)C(=O)O)s1 ZINC000587920508 FG Annotated Mild O=C1CN(c2ncccc2-c2nc(-c3cccc(Cl)c3)cs2)CCN1 ZINC000587920787 FG Annotated Anodyne COc1ccc(Cl)cc1C#Cc1nc(Br)sc1CO ZINC000587921141 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1sc(Br)nc1CO ZINC000587921217 FG Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc(N2C(=O)CCCC2=O)s1 ZINC000587921258 FG Annotated Mild Cc1ccc(-c2csc(-c3cccnc3N3CCNC(=O)C3)n2)cc1C ZINC000587921492 FG Annotated Anodyne NS(=O)(=O)c1cccc(-c2nc(-c3cc(F)ccc3F)cs2)c1 ZINC000587921537 FG Annotated Anodyne O=C1CN(c2ncccc2-c2nc(-c3cc(F)ccc3F)cs2)CCN1 ZINC000587921928 FG Annotated Anodyne O=C1CN(c2ncccc2-c2nc(-c3ccc(F)c(F)c3)cs2)CCN1 ZINC000587922105 FG Annotated Anodyne NS(=O)(=O)c1cccc(-c2nc(-c3ccc(F)c(F)c3)cs2)c1 ZINC000587922107 FG Annotated Anodyne CCN(c1ccc(-c2csc(-c3cncnc3)n2)cc1)S(C)(=O)=O ZINC000587922544 FG Annotated Anodyne CCN(c1ccc(-c2csc([C@@H]3CCOC3)n2)cc1)S(C)(=O)=O ZINC000587922955 FG Annotated Anodyne CCN(c1ccc(-c2csc([C@H]3CCOC3)n2)cc1)S(C)(=O)=O ZINC000587922964 FG Annotated Anodyne CCN(c1ccc(-c2csc(-c3cccnc3N)n2)cc1)S(C)(=O)=O ZINC000587923349 FG Annotated Anodyne CCN(c1ccc(-c2csc(-c3ccc(=N)[nH]c3)n2)cc1)S(C)(=O)=O ZINC000587923584 FG Annotated Anodyne CCOC(OCC)c1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1 ZINC000587923736 FG Annotated Anodyne CS(=O)(=O)Nc1ccc(-c2csc(CCN3CCCCC3)n2)cc1 ZINC000587923746 FG Annotated Anodyne C[C@H](Cc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1)n1cccn1 ZINC000587923751 FG Annotated Anodyne C[C@@H](Cc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1)n1cccn1 ZINC000587923752 FG Annotated Anodyne CN(c1ccc(-c2csc(CCc3ccncc3)n2)cc1)S(C)(=O)=O ZINC000587923762 FG Annotated Anodyne COCC1(c2nc(-c3ccc(N(C)S(C)(=O)=O)cc3)cs2)CCC1 ZINC000587923785 FG Annotated Anodyne COCC1(c2nc(-c3ccc(NS(C)(=O)=O)cc3)cs2)CCC1 ZINC000587923793 FG Annotated Anodyne CCOC(OCC)c1nc(-c2ccc(N(C)S(C)(=O)=O)cc2)cs1 ZINC000587923795 FG Annotated Anodyne CCO/C(C)=C(/C#N)c1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1 ZINC000587923811 FG Annotated Reactive CCO/C(C)=C(\C#N)c1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1 ZINC000587923813 FG Annotated Reactive CN(c1ccc(-c2csc(-c3ccc(N)cc3)n2)cc1)S(C)(=O)=O ZINC000587923953 FG Annotated Anodyne C[C@H](Cn1cccn1)c1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1 ZINC000587924000 FG Annotated Anodyne C[C@@H](Cn1cccn1)c1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1 ZINC000587924001 FG Annotated Anodyne COc1ncccc1-c1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1 ZINC000587924034 FG Annotated Anodyne COc1ccc(-c2nc(-c3ccc(NS(C)(=O)=O)cc3)cs2)cn1 ZINC000587924035 FG Annotated Anodyne CS(=O)(=O)Nc1ccc(-c2csc(-c3ccc4nonc4c3)n2)cc1 ZINC000587924446 FG Annotated Anodyne CCOc1cc([C@H](C)[N+](=O)[O-])c(OCC)n1-c1cc(O)cc(C(=O)O)c1 ZINC000587925026 FG Annotated Bother CCOc1cc([C@@H](C)[N+](=O)[O-])c(OCC)n1-c1cc(O)cc(C(=O)O)c1 ZINC000587925027 FG Annotated Bother COc1ccc(CCCc2nc3cc4c(cc3[nH]2)OCC(=O)N4)cc1OC ZINC000587925211 FG Annotated Anodyne COc1cc(C2(c3nc4nc(Br)c[nH]c-4n3)CC2)ccc1C ZINC000587925288 FG Annotated Anodyne COc1ccc(CCCc2nc3ccc([C@@H](N)N=O)cc3[nH]2)cc1OC ZINC000587925385 FG Annotated Anodyne COc1ccc(CCCc2nc3ccc([C@H](N)N=O)cc3[nH]2)cc1OC ZINC000587925386 FG Annotated Anodyne COC(=O)c1cc2[nH]c(-c3c(OC)ccc(OC)c3OC)nc2cc1OC ZINC000587925467 FG Annotated Anodyne COC(=O)c1ccc2nc(-c3c(OC)ccc(OC)c3OC)[nH]c2c1OC ZINC000587925476 FG Annotated Anodyne CC[C@H](c1ccc(OC)c(OC)c1)c1nc2cc3c(cc2[nH]1)OCC(=O)N3 ZINC000587925492 FG Annotated Anodyne CC[C@@H](c1ccc(OC)c(OC)c1)c1nc2cc3c(cc2[nH]1)OCC(=O)N3 ZINC000587925493 FG Annotated Anodyne COc1ccc(C[C@@H](C)c2nc3c(S)nc(S)nc3[nH]2)cc1OC ZINC000587925717 FG Annotated Anodyne COc1ccc(C[C@H](C)c2nc3c(S)nc(S)nc3[nH]2)cc1OC ZINC000587925719 FG Annotated Anodyne COc1ccc(OC)c(-c2nc3cc4c(cc3[nH]2)OCCCO4)c1OC ZINC000587926019 FG Annotated Anodyne COc1ccc(C[C@@H](C)c2nc3cc4c(cc3[nH]2)OCC(=O)N4)cc1OC ZINC000587926181 FG Annotated Anodyne COc1ccc(C[C@H](C)c2nc3cc4c(cc3[nH]2)OCC(=O)N4)cc1OC ZINC000587926183 FG Annotated Anodyne COc1ccc(CCCc2nc3c(S)nc(S)nc3[nH]2)cc1OC ZINC000587926301 FG Annotated Anodyne COc1ccc(CCCc2nc3ccc(C(=O)N(C)C)cc3[nH]2)cc1OC ZINC000587926313 FG Annotated Anodyne COc1ccc(-c2ccc(-c3nc4cnnc(O)c4[nH]3)c(O)c2)cc1OC ZINC000587926625 FG Annotated Anodyne COc1ccc(OC)c(-c2nc3ccc(OCCN(C)C)cc3[nH]2)c1OC ZINC000587926971 FG Annotated Anodyne CC[C@H](c1ccc(OC)c(OC)c1)c1nc2c(S)nc(S)nc2[nH]1 ZINC000587926996 FG Annotated Anodyne CC[C@@H](c1ccc(OC)c(OC)c1)c1nc2c(S)nc(S)nc2[nH]1 ZINC000587927003 FG Annotated Anodyne CC[C@@H](c1ccc(OC)c(OC)c1)c1nc2ccc(-n3cnnn3)cc2[nH]1 ZINC000587927005 FG Annotated Anodyne CC[C@H](c1ccc(OC)c(OC)c1)c1nc2ccc(-n3cnnn3)cc2[nH]1 ZINC000587927009 FG Annotated Anodyne COc1ccc(Cc2nc3ccc(OCCN(C)C)cc3[nH]2)cc1OC ZINC000587927310 FG Annotated Anodyne COc1ccc(Cc2nc3cc(-n4cccn4)c(F)cc3[nH]2)cc1OC ZINC000587927493 FG Annotated Anodyne Cc1ccc(-c2ccc(S(C)(=O)=O)cc2)n1-c1cc(O)cc(C(=O)O)c1 ZINC000587927565 FG Annotated Clean COc1cc(C2(c3nc4ccc(S(=O)(=O)O)cc4[nH]3)CC2)ccc1C ZINC000587928055 FG Annotated Anodyne COc1ccc(OC)c(-c2nc3cc4c(cc3[nH]2)NC(=O)CC4)c1OC ZINC000587928104 FG Annotated Anodyne COc1ccc(OC)c(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)c1OC ZINC000587928223 FG Annotated Bother COc1ccc(CCCc2nc3c(S)nc(S)nc3[nH]2)c(OC)c1 ZINC000587928325 FG Annotated Anodyne COc1ccc(/C=C\Cc2nc3cc4c(cc3[nH]2)OCC(=O)N4)c(OC)c1 ZINC000587928418 FG Annotated Anodyne COc1ccc(/C=C/Cc2nc3cc4c(cc3[nH]2)OCC(=O)N4)c(OC)c1 ZINC000587928419 FG Annotated Anodyne COc1ccccc1CC(=O)c1nc2nc(Cl)nc(C(F)(F)F)c2[nH]1 ZINC000587928974 FG Annotated Anodyne COc1ccc(CCCc2nc3ccc([C@@H](N)N=O)cc3[nH]2)c(OC)c1 ZINC000587929125 FG Annotated Anodyne COc1ccc(CCCc2nc3ccc([C@H](N)N=O)cc3[nH]2)c(OC)c1 ZINC000587929126 FG Annotated Anodyne COc1ccccc1CC(=O)c1nc2ncc(Br)c(C)c2[nH]1 ZINC000587929201 FG Annotated Anodyne COc1ccc(-c2cccc(-c3nc4c[nH]c(=N)[nH]c-4n3)c2C)c(OC)c1 ZINC000587929316 FG Annotated Anodyne COc1ccc(CCCc2nc3cc4nc(O)[nH]c4cc3[nH]2)c(OC)c1 ZINC000587929565 FG Annotated Anodyne COc1ccc(CCCc2nc3cc4c(cc3[nH]2)OCC(=O)N4)c(OC)c1 ZINC000587929622 FG Annotated Anodyne COc1ccccc1CC(=O)c1nc2c(Br)ncc(F)c2[nH]1 ZINC000587929880 FG Annotated Anodyne COC(=O)c1cc(Cl)c2nc(C(=O)Cc3ccccc3OC)[nH]c2c1 ZINC000587930305 FG Annotated Anodyne COc1ccccc1CC(=O)c1nc2cc(F)c(-n3cccn3)cc2[nH]1 ZINC000587930740 FG Annotated Anodyne COc1ccccc1CC(=O)c1nc2c(O)c(Br)ccc2[nH]1 ZINC000587930752 FG Annotated Anodyne COc1cccc(CCc2nc3ccc(C4=C(C)CC(=O)NN4)cc3[nH]2)c1 ZINC000587930770 FG Annotated Anodyne COc1ccccc1CC(=O)c1nc2nc(C)c(Br)cc2[nH]1 ZINC000587931114 FG Annotated Anodyne COc1cccc(Cc2nc3cc(I)cnc3[nH]2)c1 ZINC000587931202 FG Annotated Anodyne COc1cccc(-c2cc(O)cc(-c3nc4c(O)nc(S)nc4[nH]3)c2)c1 ZINC000587931585 FG Annotated Anodyne COc1cccc(-c2cc(O)cc(-c3nc4[nH]c(=N)[nH]c(Cl)c-4n3)c2)c1 ZINC000587931688 FG Annotated Anodyne COc1cc(O)cc(-c2cccc(-c3nc4c(O)nc(S)nc4[nH]3)c2)c1 ZINC000587932132 FG Annotated Anodyne CCOC(=O)Cc1ccc2[nH]c(C(=O)Cc3ccccc3OC)nc2c1 ZINC000587932136 FG Annotated Anodyne COc1cc(O)cc(-c2cccc(-c3nc4nc(C#N)c(C#N)nc4[nH]3)c2)c1 ZINC000587932188 FG Annotated Mild COc1cccc([C@H](C)Cc2nc3ccc(S(=O)(=O)N(C)C)cc3[nH]2)c1 ZINC000587932434 FG Annotated Anodyne COc1cccc([C@@H](C)Cc2nc3ccc(S(=O)(=O)N(C)C)cc3[nH]2)c1 ZINC000587932440 FG Annotated Anodyne COc1cccc(Cc2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)c1 ZINC000587932752 FG Annotated Anodyne COc1cccc([C@H](C)Cc2nc3cccc(S(=O)(=O)N(C)C)c3[nH]2)c1 ZINC000587932912 FG Annotated Anodyne COc1cccc([C@@H](C)Cc2nc3cccc(S(=O)(=O)N(C)C)c3[nH]2)c1 ZINC000587932914 FG Annotated Anodyne COc1cc(O)cc(-c2cccc(-c3nc4[nH]c(=N)[nH]c(Cl)c-4n3)c2)c1 ZINC000587932971 FG Annotated Anodyne COc1ccccc1-c1ccc(-c2nc3nc(C#N)c(C#N)[nH]c-3n2)cc1 ZINC000587933310 FG Annotated Mild COc1cccc(-c2cc(O)cc(-c3nc4nc(C#N)c(C#N)nc4[nH]3)c2)c1 ZINC000587933397 FG Annotated Mild COc1cccc(C2(c3nc4ccc(S(N)(=O)=O)cc4[nH]3)CCCC2)c1 ZINC000587933463 FG Annotated Anodyne COc1ccccc1[C@]1(C)C[C@@H]1c1nc2ccc(S(=O)(=O)O)cc2[nH]1 ZINC000587933516 FG Annotated Anodyne COc1ccccc1[C@@]1(C)C[C@@H]1c1nc2ccc(S(=O)(=O)O)cc2[nH]1 ZINC000587933517 FG Annotated Anodyne COc1ccccc1[C@@]1(C)C[C@H]1c1nc2ccc(S(=O)(=O)O)cc2[nH]1 ZINC000587933518 FG Annotated Anodyne COc1ccccc1[C@]1(C)C[C@H]1c1nc2ccc(S(=O)(=O)O)cc2[nH]1 ZINC000587933519 FG Annotated Anodyne COc1cccc(C2(c3nc4ccc(-n5cnnn5)cc4[nH]3)CCCC2)c1 ZINC000587933589 FG Annotated Anodyne COc1cccc(C2(c3nc4cccc(S(N)(=O)=O)c4[nH]3)CCCC2)c1 ZINC000587933915 FG Annotated Anodyne COc1ccc2c(c1)CCC=C2Cc1nc2ccc(S(=O)(=O)O)cc2[nH]1 ZINC000587933944 FG Annotated Anodyne COc1ccc([C@H](O)[C@H](C)c2nc3cc4c(cc3[nH]2)NC(=O)CC4)cc1 ZINC000587934041 FG Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3cc4c(cc3[nH]2)NC(=O)CC4)cc1 ZINC000587934043 FG Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3cc4c(cc3[nH]2)NC(=O)CC4)cc1 ZINC000587934044 FG Annotated Anodyne COc1ccc([C@@H](O)[C@@H](C)c2nc3cc4c(cc3[nH]2)NC(=O)CC4)cc1 ZINC000587934045 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@H](C)[C@@H](O)c3ccc(OC)cc3)[nH]c2c1OC ZINC000587934121 FG Annotated Anodyne COC(=O)c1ccc2nc([C@H](C)[C@H](O)c3ccc(OC)cc3)[nH]c2c1OC ZINC000587934122 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@H](C)[C@H](O)c3ccc(OC)cc3)[nH]c2c1OC ZINC000587934123 FG Annotated Anodyne COC(=O)c1ccc2nc([C@H](C)[C@@H](O)c3ccc(OC)cc3)[nH]c2c1OC ZINC000587934124 FG Annotated Anodyne COc1ccc2c(c1)CCC=C2Cc1nc2ccc(-n3cnnn3)cc2[nH]1 ZINC000587934283 FG Annotated Anodyne COc1ccc2cc([C@@H](C)c3nc4nc(C#N)c(C#N)nc4[nH]3)ccc2c1 ZINC000587934318 FG Annotated Mild COC(=O)c1cc2[nH]c([C@H](C)[C@@H](O)c3ccc(OC)cc3)nc2cc1OC ZINC000587934394 FG Annotated Anodyne COC(=O)c1cc2[nH]c([C@@H](C)[C@@H](O)c3ccc(OC)cc3)nc2cc1OC ZINC000587934395 FG Annotated Anodyne COC(=O)c1cc2[nH]c([C@@H](C)[C@H](O)c3ccc(OC)cc3)nc2cc1OC ZINC000587934396 FG Annotated Anodyne COC(=O)c1cc2[nH]c([C@H](C)[C@H](O)c3ccc(OC)cc3)nc2cc1OC ZINC000587934397 FG Annotated Anodyne COc1ccc(C2(c3nc4nc(C#N)c(C#N)nc4[nH]3)CC3(CCC3)C2)cc1 ZINC000587934467 FG Annotated Mild COc1ccc2c(c1)CCC=C2Cc1nc2cc3c(cc2[nH]1)OCC(=O)N3 ZINC000587934621 FG Annotated Anodyne COc1ccc(C2(c3nc4c(O)nc(O)nc4[nH]3)CC3(CCC3)C2)cc1 ZINC000587934839 FG Annotated Anodyne COc1cc(C(C)=O)c(OC)n1-c1cccc(Br)c1[N+](=O)[O-] ZINC000587935489 FG Annotated Bother COc1cc(C#N)c(OC)n1-c1cccc(Br)c1[N+](=O)[O-] ZINC000587935583 FG Annotated Mild COC(=O)c1cc(-n2c(O)cc(C)c2O)c(Cl)cc1Br ZINC000587935657 FG Annotated Anodyne CC(=O)SCc1cc(O)n(-c2cccc(Br)c2N)c1O ZINC000587935691 FG Annotated Anodyne Nc1ccc(-c2cc(O)n(-c3c(N)cccc3Br)c2O)cc1 ZINC000587935791 FG Annotated Anodyne CCOc1cc(C=O)c(OCC)n1-c1c(N)cccc1Br ZINC000587935809 FG Annotated Anodyne CC(=O)SCc1cc(O)n(-c2cccc(C3=NC(C)(C)CO3)c2)c1O ZINC000587935897 FG Annotated Anodyne Nc1ccc(-c2cc(O)n(-c3cccc(Br)c3N)c2O)cc1 ZINC000587936552 FG Annotated Anodyne COc1ccc(-c2cccc(-c3nc4nc(C#N)c(C#N)nc4[nH]3)c2)cc1 ZINC000587936658 FG Annotated Mild COC(=O)c1cc(-n2c(O)ccc2OC)c(Cl)cc1Br ZINC000587937398 FG Annotated Anodyne CCOc1cc(C=O)c(OCC)n1-c1cccc(Br)c1N ZINC000587937506 FG Annotated Anodyne COc1ccc([C@@H](O)[C@@H](C)c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)cc1 ZINC000587937559 FG Annotated Bother COc1ccc([C@@H](O)[C@H](C)c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)cc1 ZINC000587937560 FG Annotated Bother COc1ccc([C@H](O)[C@@H](C)c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)cc1 ZINC000587937561 FG Annotated Bother COc1ccc([C@H](O)[C@H](C)c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)cc1 ZINC000587937562 FG Annotated Bother CC(=O)SCc1cc(O)n(-c2c(N)cccc2Br)c1O ZINC000587937735 FG Annotated Anodyne COc1cccc(-c2cccc(-n3c4c(c5c3OC(=O)C5)CC(=O)O4)c2)c1 ZINC000587938249 FG Annotated Anodyne COc1cc(C(C)=O)c(OC)n1-c1cccc(-c2cccc(C(=O)O)n2)c1 ZINC000587938274 FG Annotated Anodyne COc1ccc([C@@H](c2ccccc2)c2nc3nc(C#N)c(C#N)nc3[nH]2)cc1 ZINC000587938369 FG Annotated Mild COc1ccc([C@H](c2ccccc2)c2nc3nc(C#N)c(C#N)nc3[nH]2)cc1 ZINC000587938370 FG Annotated Mild COc1ccc2c(c1)C[C@@H](c1nc3nc(Br)c[nH]c-3n1)CC2 ZINC000587938622 FG Annotated Anodyne COc1ccc2c(c1)C[C@H](c1nc3nc(Br)c[nH]c-3n1)CC2 ZINC000587938623 FG Annotated Anodyne COc1ccc([C@H](O)[C@H](C)c2nc3ccc(C(=O)N(C)C)cc3[nH]2)cc1 ZINC000587938639 FG Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3ccc(C(=O)N(C)C)cc3[nH]2)cc1 ZINC000587938640 FG Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3ccc(C(=O)N(C)C)cc3[nH]2)cc1 ZINC000587938641 FG Annotated Anodyne COc1ccc([C@@H](O)[C@@H](C)c2nc3ccc(C(=O)N(C)C)cc3[nH]2)cc1 ZINC000587938642 FG Annotated Anodyne COc1ccc([C@@H](O)[C@@H](C)c2nc3cnc(C(F)(F)F)[nH]c-3n2)cc1 ZINC000587938728 FG Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3cnc(C(F)(F)F)[nH]c-3n2)cc1 ZINC000587938729 FG Annotated Anodyne COc1ccc([C@H](O)[C@H](C)c2nc3cnc(C(F)(F)F)[nH]c-3n2)cc1 ZINC000587938730 FG Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3cnc(C(F)(F)F)[nH]c-3n2)cc1 ZINC000587938731 FG Annotated Anodyne Cc1cc2c(n1-c1nn(-c3ncccn3)cc1Br)CCCC2 ZINC000587939202 FG Annotated Anodyne CCOC(=O)c1cc(C)n(-c2cc(C(=O)O)ncc2Br)c1C ZINC000587939555 FG Annotated Anodyne CC(C)(C)Oc1ccc(O)n1-c1cc(C(=O)O)ncc1Br ZINC000587939564 FG Annotated Anodyne COc1ccc(OC)n1-c1cc(Br)cnc1Br ZINC000587939573 FG Annotated Anodyne CCOc1ccc(OCC)n1-c1cc(C(=O)O)ncc1Br ZINC000587939607 FG Annotated Anodyne Cc1ncc(-n2c(O)cc(Cc3ccccc3)c2O)nc1Br ZINC000587939688 FG Annotated Anodyne O=c1c(Br)c[nH]cc1-n1c(O)cc(-c2cccc(F)c2)c1O ZINC000587939880 FG Annotated Anodyne C=CCOc1ccc(OCC=C)n1-c1cnc(C)c(Br)n1 ZINC000587939967 FG Annotated Mild C=CCOc1ccc(OCC=C)n1-c1c[nH]cc(Br)c1=O ZINC000587940001 FG Annotated Mild O=c1c(Br)c[nH]cc1-n1c(O)cc(-c2ccc(F)cc2)c1O ZINC000587940066 FG Annotated Anodyne CCOc1cc(-n2c(OC)cc(C#N)c2OC)c(Cl)cc1C(=O)O ZINC000587940210 FG Annotated Mild C=C(C(=O)O)c1cc(O)n(-c2cc(Cl)cc(Br)c2)c1O ZINC000587940358 FG Annotated Anodyne CCOc1cc(C(C)=O)c(OCC)n1-c1cnc(C)c(Br)n1 ZINC000587940725 FG Annotated Anodyne O=c1c(Br)c[nH]cc1-n1c(O)cc(C2CCCCC2)c1O ZINC000587940860 FG Annotated Anodyne CCOc1cc(-n2c(OC)cc(C(C)=O)c2OC)c(Cl)cc1C(=O)O ZINC000587941141 FG Annotated Anodyne COc1cc(C)c(O)n1-c1cc(Br)cnc1Br ZINC000587941183 FG Annotated Anodyne O=c1c(Br)c[nH]cc1-n1c(O)cc(-c2ccccc2F)c1O ZINC000587941451 FG Annotated Anodyne COc1cc(C(C)=O)c(OC)n1NCc1ccccc1Br ZINC000587941514 FG Annotated Anodyne Cc1c(C)c(O)n(-c2cc(Br)cnc2Br)c1O ZINC000587941551 FG Annotated Anodyne Cc1ccccc1-c1cc(O)n(-c2c[nH]cc(Br)c2=O)c1O ZINC000587941762 FG Annotated Anodyne CCOc1cc([C@H](C)[N+](=O)[O-])c(OCC)n1-c1ccnc(CCl)n1 ZINC000587941895 FG Annotated Reactive CCOc1cc([C@@H](C)[N+](=O)[O-])c(OCC)n1-c1ccnc(CCl)n1 ZINC000587941897 FG Annotated Reactive COc1c(C)cc(O)n1-c1cc(Br)cnc1Br ZINC000587941953 FG Annotated Anodyne O=C(O)CCc1cc(O)n(-c2cc(Cl)cc(Br)c2)c1O ZINC000587941988 FG Annotated Anodyne CC(=O)SCc1cc(O)n(NCc2ccccc2Br)c1O ZINC000587942132 FG Annotated Anodyne Cc1ccc(-c2cc(O)n(-c3c[nH]cc(Br)c3=O)c2O)cc1 ZINC000587942230 FG Annotated Anodyne O=C(O)c1cc(-n2c(O)cc(-c3ccco3)c2O)c(Br)cn1 ZINC000587942306 FG Annotated Anodyne O=c1c(Br)c[nH]cc1-n1c(O)ccc1OCc1ccccc1 ZINC000587942358 FG Annotated Anodyne COc1cc(C#N)c(OC)n1-c1cc2cnccc2c(Br)n1 ZINC000587942375 FG Annotated Mild O=C1Cc2c3c(n(CCCc4ccc(Cl)c(Cl)c4)c2O1)OC(=O)C3 ZINC000587943144 FG Annotated Anodyne C=C(C(=O)O)c1cc(O)n(-c2cc(F)c(Br)cc2F)c1O ZINC000587943427 FG Annotated Anodyne CC(=O)SCc1cc(O)n([C@H](COc2cc(F)cc(F)c2)N=O)c1O ZINC000587944080 FG Annotated Anodyne CC(=O)SCc1cc(O)n([C@@H](COc2cc(F)cc(F)c2)N=O)c1O ZINC000587944081 FG Annotated Anodyne COc1cc(C(C)=O)c(OC)n1[C@@H](COc1cc(F)cc(F)c1)N=O ZINC000587944119 FG Annotated Anodyne COc1cc(C(C)=O)c(OC)n1[C@H](COc1cc(F)cc(F)c1)N=O ZINC000587944120 FG Annotated Anodyne O=C(O)Cc1cc(O)n(CC[C@@H](c2ccc(F)cc2)c2ccco2)c1O ZINC000587944387 FG Annotated Anodyne O=C(O)Cc1cc(O)n(CC[C@H](c2ccc(F)cc2)c2ccco2)c1O ZINC000587944392 FG Annotated Anodyne Oc1cc(Cc2ccccc2)c(O)n1-c1nc(N2CCCCC2)ncc1F ZINC000587944464 FG Annotated Anodyne CCOc1cc(CC(C)=O)c(OCC)n1-c1n[nH]c(-c2ccccc2F)n1 ZINC000587944547 FG Annotated Anodyne O=C1Cc2c3c(n(-c4ccc(-c5cccc(F)c5)c(F)c4)c2O1)OC(=O)C3 ZINC000587944573 FG Annotated Anodyne COc1cccc(-c2cc(O)n(-c3n[nH]c(-c4ccccc4F)n3)c2O)c1 ZINC000587944585 FG Annotated Anodyne COc1cc(C(C)=O)c(OC)n1-c1cc(C)n(Cc2ccccc2F)n1 ZINC000587944611 FG Annotated Anodyne Oc1cc(Cc2ccccc2)c(O)n1-c1n[nH]c(-c2ccccc2F)n1 ZINC000587945187 FG Annotated Anodyne Nc1ccc(-c2cc(O)n(-c3nc(N4CCCCC4)ncc3F)c2O)cc1 ZINC000587945237 FG Annotated Anodyne CCOc1cc(C=O)c(OCC)n1-c1nc(N2CCCCC2)ncc1F ZINC000587945332 FG Annotated Anodyne CC(=O)SCc1cc(O)n(-c2cnc(Cc3ccc(F)cc3)nc2)c1O ZINC000587945414 FG Annotated Anodyne COc1ccc2c(c1)C[C@H](c1nc3ccc(S(=O)(=O)O)cc3[nH]1)CC2 ZINC000587945530 FG Annotated Anodyne COc1ccc2c(c1)C[C@@H](c1nc3ccc(S(=O)(=O)O)cc3[nH]1)CC2 ZINC000587945531 FG Annotated Anodyne COc1cc(C(C)=O)c(OC)n1-c1cnc(Cc2ccc(F)cc2)nc1 ZINC000587945931 FG Annotated Anodyne Oc1cc(-c2ccccc2)c(O)n1-c1nc(N2CCCCC2)ncc1F ZINC000587946161 FG Annotated Anodyne COc1ccccc1-c1cc(O)n(-c2n[nH]c(-c3ccccc3F)n2)c1O ZINC000587946243 FG Annotated Anodyne Nc1ccc(-c2cc(O)n(-c3n[nH]c(-c4ccccc4F)n3)c2O)cc1 ZINC000587946295 FG Annotated Anodyne COc1ccc2c(c1)C[C@H](c1nc3ccc(S(C)(=O)=O)cc3[nH]1)CC2 ZINC000587946763 FG Annotated Anodyne COc1ccc2c(c1)C[C@@H](c1nc3ccc(S(C)(=O)=O)cc3[nH]1)CC2 ZINC000587946764 FG Annotated Anodyne CCOc1cc(C(C)=O)c(OCC)n1-c1n[nH]c(-c2ccccc2F)n1 ZINC000587946792 FG Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4cccc(C(=O)O)c4[nH]1)(C3)C2 ZINC000587949736 FG Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4ccc([C@H](N)N=O)cc4[nH]1)(C3)C2 ZINC000587949777 FG Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4ccc([C@@H](N)N=O)cc4[nH]1)(C3)C2 ZINC000587949778 FG Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4cc5c(cc4[nH]1)OCO5)(C3)C2 ZINC000587949854 FG Annotated Anodyne CC[C@H](O[C@@H]1CCC[C@@H](C)C1)c1nc2ccc(S(N)(=O)=O)cc2[nH]1 ZINC000587950286 FG Annotated Anodyne CC[C@H](O[C@H]1CCC[C@H](C)C1)c1nc2ccc(S(N)(=O)=O)cc2[nH]1 ZINC000587950289 FG Annotated Anodyne CC[C@H](O[C@@H]1CCC[C@H](C)C1)c1nc2ccc(S(N)(=O)=O)cc2[nH]1 ZINC000587950290 FG Annotated Anodyne CC[C@H](O[C@H]1CCC[C@@H](C)C1)c1nc2ccc(S(N)(=O)=O)cc2[nH]1 ZINC000587950291 FG Annotated Anodyne O=C1COc2cc3[nH]c(COC45CC6CC(CC(C6)C4)C5)nc3cc2N1 ZINC000587950523 FG Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4cncc([N+](=O)[O-])c4[nH]1)(C3)C2 ZINC000587950526 FG Annotated Bother CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4ccc(CCO)cc4[nH]1)(C3)C2 ZINC000587950540 FG Annotated Anodyne CO[C@@H](C)COC1CCC(c2nc3c(S)nc(S)nc3[nH]2)CC1 ZINC000587950779 FG Annotated Anodyne CO[C@H](C)COC1CCC(c2nc3c(S)nc(S)nc3[nH]2)CC1 ZINC000587950784 FG Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4ccc(C(=O)O)cc4[nH]1)(C3)C2 ZINC000587950832 FG Annotated Anodyne CO[C@@H](C)COC1CCC(c2nc3ccc(C(=O)N(C)C)cc3[nH]2)CC1 ZINC000587950886 FG Annotated Anodyne CO[C@H](C)COC1CCC(c2nc3ccc(C(=O)N(C)C)cc3[nH]2)CC1 ZINC000587950887 FG Annotated Anodyne CC[C@H](O[C@@H]1CCC[C@@H](C)C1)c1nc2cccc(S(N)(=O)=O)c2[nH]1 ZINC000587950945 FG Annotated Anodyne CC[C@H](O[C@H]1CCC[C@@H](C)C1)c1nc2cccc(S(N)(=O)=O)c2[nH]1 ZINC000587950946 FG Annotated Anodyne CC[C@H](O[C@H]1CCC[C@H](C)C1)c1nc2cccc(S(N)(=O)=O)c2[nH]1 ZINC000587950948 FG Annotated Anodyne CC[C@H](O[C@@H]1CCC[C@H](C)C1)c1nc2cccc(S(N)(=O)=O)c2[nH]1 ZINC000587950950 FG Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4cc5nc(O)[nH]c5cc4[nH]1)(C3)C2 ZINC000587951032 FG Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4cc([N+](=O)[O-])cnc4[nH]1)(C3)C2 ZINC000587951042 FG Annotated Bother O=S(=O)(O)c1ccc2nc(COC34CC5CC(CC(C5)C3)C4)[nH]c2c1 ZINC000587951065 FG Annotated Anodyne N#Cc1nc2nc(Cc3ccccc3Oc3ccccc3)[nH]c2nc1C#N ZINC000587951078 FG Annotated Mild c1cc2nc(COC34CC5CC(CC(C5)C3)C4)[nH]c2cc1-n1cnnn1 ZINC000587951482 FG Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4cc(C#N)c(C#N)cc4[nH]1)(C3)C2 ZINC000587951728 FG Annotated Mild CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4cc5c(cc4[nH]1)OCCO5)(C3)C2 ZINC000587951737 FG Annotated Anodyne CO[C@H](C)COC1CCC(c2nc3nc(Br)c[nH]c-3n2)CC1 ZINC000587952131 FG Annotated Anodyne CO[C@@H](C)COC1CCC(c2nc3nc(Br)c[nH]c-3n2)CC1 ZINC000587952162 FG Annotated Anodyne CO[C@H](C)COC1CCC(c2nc3cc(F)cc(C(=O)O)c3[nH]2)CC1 ZINC000587952355 FG Annotated Anodyne CO[C@@H](C)COC1CCC(c2nc3cc(F)cc(C(=O)O)c3[nH]2)CC1 ZINC000587952356 FG Annotated Anodyne CO[C@@H](C)COC1CCC(c2nc3cc(C(=O)O)c(F)cc3[nH]2)CC1 ZINC000587952519 FG Annotated Anodyne CO[C@H](C)COC1CCC(c2nc3cc(C(=O)O)c(F)cc3[nH]2)CC1 ZINC000587952520 FG Annotated Anodyne CO[C@H](C)COC1CCC(c2nc3cnc(C(F)(F)F)[nH]c-3n2)CC1 ZINC000587952638 FG Annotated Anodyne CO[C@@H](C)COC1CCC(c2nc3cnc(C(F)(F)F)[nH]c-3n2)CC1 ZINC000587952639 FG Annotated Anodyne O=C(CCc1ccccc1)c1nc2[nH]c(O)nc(NCc3ccccc3)c-2n1 ZINC000587953783 FG Annotated Anodyne CC1=C(c2ccc3[nH]c(C(=O)CCc4ccccc4)nc3c2)NNC(=O)C1 ZINC000587954377 FG Annotated Anodyne Cc1ccccc1C(C)(C)c1nc2cccc(S(=O)(=O)N(C)C)c2[nH]1 ZINC000587955033 FG Annotated Anodyne CCc1ccc(C(=O)CCc2nc3nc(Br)c[nH]c-3n2)cc1 ZINC000587955473 FG Annotated Anodyne CC(C)(CC(=O)O)Cc1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587955843 FG Annotated Anodyne CC(C)(CC(=O)O)Cc1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587956045 FG Annotated Clean CC(C)(CC(=O)O)Cc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587956124 FG Annotated Bother CC(C)(CC(=O)O)Cc1nc2ccc(I)cc2[nH]1 ZINC000587956138 FG Annotated Anodyne N#Cc1nc2nc([C@@H](Cc3ccccc3)c3ccccc3)[nH]c2nc1C#N ZINC000587956142 FG Annotated Mild N#Cc1nc2nc([C@H](Cc3ccccc3)c3ccccc3)[nH]c2nc1C#N ZINC000587956147 FG Annotated Mild CC(C)(CC(=O)O)Cc1nc2cccc(I)c2[nH]1 ZINC000587956322 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(CC(C)(C)CC(=O)O)nc2c1 ZINC000587956405 FG Annotated Anodyne CCc1ccc(C(=O)CCc2nc3ccc(S(=O)(=O)O)cc3[nH]2)cc1 ZINC000587956411 FG Annotated Anodyne CCC[C@H](c1nc2ccc(S(=O)(=O)N3CCOCC3)cc2[nH]1)C(C)C ZINC000587957031 FG Annotated Anodyne CCC[C@@H](c1nc2ccc(S(=O)(=O)N3CCOCC3)cc2[nH]1)C(C)C ZINC000587957035 FG Annotated Anodyne N=c1nc(O)c2nc(CCCCCCCCCCCCC(=O)O)[nH]c2[nH]1 ZINC000587957185 FG Annotated Anodyne C[C@H](CCC(=O)O)Cc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587959781 FG Annotated Bother C[C@H](CCc1nc2cc(Br)cc(C(=O)O)c2[nH]1)CC(=O)O ZINC000587960049 FG Annotated Anodyne C[C@H](CCc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1)CC(=O)O ZINC000587960112 FG Annotated Bother COC(=O)c1cc(Br)c2[nH]c(CC[C@@H](C)CC(=O)O)nc2c1 ZINC000587960274 FG Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(C[C@@H]3C[C@H]3c3ccccc3)[nH]c12 ZINC000587960320 FG Annotated Anodyne NS(=O)(=O)c1cccc2nc(Cc3ccccc3-c3ccccc3)[nH]c12 ZINC000587960323 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(C[C@H](C)CCC(=O)O)nc2c1 ZINC000587960562 FG Annotated Anodyne C[C@H]1C(=O)CC[C@@H]1Cc1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587960727 FG Annotated Anodyne C[C@@H]1C(=O)CC[C@@H]1Cc1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587960728 FG Annotated Anodyne C[C@H]1C(=O)CC[C@H]1Cc1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587960729 FG Annotated Anodyne C[C@@H]1C(=O)CC[C@H]1Cc1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587960730 FG Annotated Anodyne N#Cc1cc(Br)c2[nH]c(Cc3ccc(CC(=O)O)cc3)nc2c1 ZINC000587961031 FG Annotated Mild C[C@H]1C(=O)CC[C@H]1Cc1nc2cccc(I)c2[nH]1 ZINC000587961167 FG Annotated Anodyne C[C@@H]1C(=O)CC[C@@H]1Cc1nc2cccc(I)c2[nH]1 ZINC000587961201 FG Annotated Anodyne Cc1c(Br)cnc2[nH]c(Cc3ccc(CC(=O)O)cc3)nc12 ZINC000587961203 FG Annotated Anodyne C[C@@H]1C(=O)CC[C@H]1Cc1nc2cccc(I)c2[nH]1 ZINC000587961205 FG Annotated Anodyne C[C@H]1C(=O)CC[C@@H]1Cc1nc2cccc(I)c2[nH]1 ZINC000587961209 FG Annotated Anodyne C[C@H]1C(=O)CC[C@H]1Cc1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587961304 FG Annotated Clean C[C@@H]1C(=O)CC[C@@H]1Cc1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587961305 FG Annotated Clean C[C@@H]1C(=O)CC[C@H]1Cc1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587961306 FG Annotated Clean C[C@H]1C(=O)CC[C@@H]1Cc1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587961307 FG Annotated Clean C[C@H]1C(=O)CC[C@@H]1Cc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587961318 FG Annotated Bother C[C@@H]1C(=O)CC[C@@H]1Cc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587961319 FG Annotated Bother C[C@H]1C(=O)CC[C@H]1Cc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587961320 FG Annotated Bother C[C@@H]1C(=O)CC[C@H]1Cc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587961321 FG Annotated Bother O=C(O)Cc1ccc(Cc2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)cc1 ZINC000587961542 FG Annotated Anodyne C[C@H](CCC(=O)O)Cc1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587961741 FG Annotated Anodyne C[C@H]1C(=O)CC[C@H]1Cc1nc2ccc(S(=O)(=O)C(F)(F)F)cc2[nH]1 ZINC000587962080 FG Annotated Anodyne C[C@@H]1C(=O)CC[C@@H]1Cc1nc2ccc(S(=O)(=O)C(F)(F)F)cc2[nH]1 ZINC000587962083 FG Annotated Anodyne CC[C@@]1(Cc2nc3ccc(-n4cnnn4)cc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587962119 FG Annotated Anodyne CC[C@]1(Cc2nc3ccc(-n4cnnn4)cc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587962125 FG Annotated Anodyne O=C(O)Cc1ccc(Cc2nc3ccc(Br)c(O)c3[nH]2)cc1 ZINC000587962168 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc2nc(C[C@@H]3C[C@H]3c3ccccc3)[nH]c2c1 ZINC000587962203 FG Annotated Anodyne CC[C@]1(Cc2nc3c(O)nc(S)nc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587962292 FG Annotated Anodyne CC[C@@]1(Cc2nc3c(O)nc(S)nc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587962302 FG Annotated Anodyne CC[C@]1(Cc2nc3[nH]c(=N)[nH]c(Cl)c-3n2)CC(=O)c2ccccc2C1 ZINC000587962307 FG Annotated Anodyne CC[C@@]1(Cc2nc3[nH]c(=N)[nH]c(Cl)c-3n2)CC(=O)c2ccccc2C1 ZINC000587962308 FG Annotated Anodyne C[C@@H]1C(=O)CC[C@H]1Cc1nc2ccc(S(=O)(=O)C(F)(F)F)cc2[nH]1 ZINC000587962349 FG Annotated Anodyne C[C@H]1C(=O)CC[C@@H]1Cc1nc2ccc(S(=O)(=O)C(F)(F)F)cc2[nH]1 ZINC000587962350 FG Annotated Anodyne C[C@H](CCc1nc2ccc(I)cc2[nH]1)CC(=O)O ZINC000587962587 FG Annotated Anodyne O=C(O)Cc1ccc(Cc2nc3c(F)cnc(Br)c3[nH]2)cc1 ZINC000587962666 FG Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(Cc3ccc(CC(=O)O)cc3)nc2c1 ZINC000587962669 FG Annotated Anodyne C[C@H](CCC(=O)O)Cc1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587962686 FG Annotated Clean C[C@H](CCC(=O)O)Cc1nc2ccc(I)cc2[nH]1 ZINC000587963048 FG Annotated Anodyne C[C@H](CCc1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O)CC(=O)O ZINC000587963146 FG Annotated Clean C[C@H](CCc1nc2cccc(I)c2[nH]1)CC(=O)O ZINC000587963211 FG Annotated Anodyne C[C@H]1C(=O)CC[C@@H]1Cc1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587963223 FG Annotated Bother C[C@@H]1C(=O)CC[C@@H]1Cc1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587963224 FG Annotated Bother C[C@H]1C(=O)CC[C@H]1Cc1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587963225 FG Annotated Bother C[C@@H]1C(=O)CC[C@H]1Cc1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587963226 FG Annotated Bother COC(=O)c1cc(Br)c2[nH]c(C[C@@H]3CCC(=O)[C@@H]3C)nc2c1 ZINC000587963345 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(C[C@H]3CCC(=O)[C@H]3C)nc2c1 ZINC000587963362 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(C[C@@H]3CCC(=O)[C@H]3C)nc2c1 ZINC000587963364 FG Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(C[C@H]3CCC(=O)[C@@H]3C)nc2c1 ZINC000587963366 FG Annotated Anodyne C[C@H](CCC(=O)O)Cc1nc2cccc(I)c2[nH]1 ZINC000587963398 FG Annotated Anodyne C[C@H]1C(=O)CC[C@H]1Cc1nc2ccc(I)cc2[nH]1 ZINC000587963945 FG Annotated Anodyne C[C@@H]1C(=O)CC[C@@H]1Cc1nc2ccc(I)cc2[nH]1 ZINC000587963946 FG Annotated Anodyne C[C@@H]1C(=O)CC[C@H]1Cc1nc2ccc(I)cc2[nH]1 ZINC000587963947 FG Annotated Anodyne C[C@H]1C(=O)CC[C@@H]1Cc1nc2ccc(I)cc2[nH]1 ZINC000587963948 FG Annotated Anodyne CCOC(=O)c1cc(Br)c2nc(/C=C/C=C/C(=O)O)[nH]c2c1 ZINC000587965287 FG Annotated Anodyne CCOC(=O)c1cc(Br)c2nc(/C=C/C=C\C(=O)O)[nH]c2c1 ZINC000587965288 FG Annotated Anodyne O=C(O)/C=C/C=C\c1nc2c(Br)ncc(Br)c2[nH]1 ZINC000587965847 FG Annotated Anodyne O=C(O)/C=C/C=C/c1nc2c(Br)ncc(Br)c2[nH]1 ZINC000587965853 FG Annotated Anodyne Cc1ccc(C(=O)/C=C\c2nc3cccc(S(=O)(=O)N(C)C)c3[nH]2)cc1 ZINC000587965960 FG Annotated Mild Cc1ccc(C(=O)/C=C/c2nc3cccc(S(=O)(=O)N(C)C)c3[nH]2)cc1 ZINC000587965961 FG Annotated Mild CCOC(=O)Cc1ccc2nc([C@@]34C[C@H]5C[C@@H](C3)C(=O)[C@H](C5)C4)[nH]c2c1 ZINC000587968372 FG Annotated Anodyne COC(=O)c1cc2[nH]c([C@@]34C[C@H]5C[C@@H](C3)C(=O)[C@H](C5)C4)nc2cc1OC ZINC000587968408 FG Annotated Anodyne O=C1[C@H]2C[C@H]3C[C@@H]1C[C@@](c1nc4ccc(CN5CCOCC5)cc4[nH]1)(C3)C2 ZINC000587968516 FG Annotated Anodyne COC(=O)c1ccc2nc([C@@]34C[C@H]5C[C@@H](C3)C(=O)[C@H](C5)C4)[nH]c2c1OC ZINC000587969307 FG Annotated Anodyne O=C1[C@H]2C[C@H]3C[C@@H]1C[C@@](c1nc4cc([N+](=O)[O-])c([N+](=O)[O-])cc4[nH]1)(C3)C2 ZINC000587969597 FG Annotated Bother O=C(O)[C@H]1C(c2nc3ccc(Sc4ccccc4)cc3[nH]2)[C@@H]1C(=O)O ZINC000587969981 FG Annotated Anodyne O=C(O)[C@@H]1[C@H](C(=O)O)[C@@H]1c1nc2ccc(Sc3ccccc3)cc2[nH]1 ZINC000587969989 FG Annotated Anodyne O=C(O)[C@H]1[C@H](c2nc3ccc(Sc4ccccc4)cc3[nH]2)[C@H]1C(=O)O ZINC000587969991 FG Annotated Anodyne O=C1CCC(c2ccccc2)(c2nc3nc(Br)c[nH]c-3n2)CC1 ZINC000587970689 FG Annotated Anodyne COc1cc2c(cc1O)O[C@H]1c3cc4c(cc3OC[C@@H]21)OC(C)(C)[C@H](O)C4 ZINC000059085729 FG Annotated Anodyne O=C1c2cc(O)cc(O)c2[C@@H](c2ccc(O)cc2)[C@@H]1c1cc(O)cc(O)c1 ZINC000059185203 FG Annotated Anodyne C/C=C/C1=CC2=C(CO1)C(=O)[C@]1(C)OC(=O)[C@@H](C(=O)CCCCC)[C@@H]1C2 ZINC000059200520 FG Annotated Mild C/C=C/C1=CC2=C(CO1)C(=O)[C@]1(C)OC(=O)[C@@H](C(=O)CCCCC)[C@H]1C2 ZINC000059200521 FG Annotated Mild Cc1c(COc2cc(OCCC(C)(C)O)ccn2)[nH]c2ccccc2c1=O ZINC000059224623 FG Annotated Anodyne Cc1cc(NC(=O)C2CCOCC2)ccc1N1CC[C@H](N2CCC[C@@H]2C)C1 ZINC000059262785 FG Annotated Anodyne Cc1cc(NC(=O)C2CCOCC2)ccc1N1CC[C@@H](N2CCC[C@@H]2C)C1 ZINC000059262787 FG Annotated Anodyne Cc1cc(N2CC[C@H](N3CCC[C@@H]3C)C2)ccc1NC(=O)C1CCOCC1 ZINC000059262788 FG Annotated Anodyne Cc1cc(N2CC[C@@H](N3CCC[C@@H]3C)C2)ccc1NC(=O)C1CCOCC1 ZINC000059262790 FG Annotated Anodyne Cc1cc(C(=O)Nc2ccc(N3CC[C@H](N4CCC[C@@H]4C)C3)cc2C)n[nH]1 ZINC000059263575 FG Annotated Anodyne O=c1[nH][nH]c2nc(CNCc3cccc(C(F)(F)F)c3)nc3cccc1c32 ZINC000059275400 FG Annotated Anodyne CCO[P@@](=O)(c1ccccc1)c1c(C(N)=O)[nH]c2ccc(Cl)cc12 ZINC000059425476 FG Annotated Reactive CCO[P@](=O)(c1ccccc1)c1c(C(N)=O)[nH]c2ccc(Cl)cc12 ZINC000059425477 FG Annotated Reactive CCOc1ccc2c(c1O)-c1c(O)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3 ZINC000059586856 FG Annotated Bother in-vitro biogenic O=C(O)c1cc2ccc(O)c3oc4cc(O)c(O)cc4c(c1C(=O)O)c23 ZINC000059587126 FG Annotated Clean in-vitro biogenic CCOc1c(O)ccc2c1-c1c(O)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3 ZINC000059587179 FG Annotated Bother in-vitro biogenic CO[C@@H]1c2cc(O)ccc2OC[C@H]1[C@H]1COc2ccc(O)cc2[C@@H]1OC ZINC000059587309 FG Annotated Anodyne in-vitro biogenic COC(=O)[C@]1(C=O)CCC[C@]2(C=O)[C@H]3Cc4occc4[C@H](C)[C@@H]3CC[C@H]21 ZINC000059588338 FG Annotated Mild in-vitro biogenic COc1cc(O)cc([C@H]2OC[C@H]3[C@@H](c4ccc(O)c(OC)c4)OC[C@@H]23)c1 ZINC000059588570 FG Annotated Anodyne in-vitro biogenic COc1cc2c(cc1OC)[C@H]1[C@@H](CO2)Oc2c(ccc3occc23)[C@H]1O ZINC000059729335 FG Annotated Anodyne COc1cc2c(cc1OC)[C@@H]1[C@H](O)c3ccc4occc4c3O[C@H]1CO2 ZINC000059729336 FG Annotated Anodyne CC1(C)Oc2cc3c(cc2C[C@H]1O)[C@H]1Oc2cc4c(cc2[C@@H]1CO3)OCO4 ZINC000059729440 FG Annotated Anodyne CC1(C)Oc2cc3c(cc2C[C@H]1O)[C@H]1Oc2cc4c(cc2[C@H]1CO3)OCO4 ZINC000059729443 FG Annotated Anodyne CC1=CCc2c(cc(O)c(C(=O)/C=C/c3ccc(O)c(O)c3)c2O)OC1 ZINC000059773536 FG Annotated Mild CC(C)(O)[C@@H]1Cc2c(ccc3c2oc2oc4cc(O)cc(O)c4c(=O)c23)O1 ZINC000059778158 FG Annotated Bother CC(C)(O)[C@H]1Cc2c(ccc3c2oc2oc4cc(O)cc(O)c4c(=O)c23)O1 ZINC000059778165 FG Annotated Bother CCOC(=O)C1(CC2CC2)CCN(Cc2cnc(N(C)C)s2)CC1 ZINC000059782035 FG Annotated Anodyne COCCNCCN1CCN(c2ccc(C)cc2)C[C@@H]1c1ccccc1 ZINC000059790656 FG Annotated Anodyne COc1ccc([C@H]2NCc3ccc4c(c3-n3cccc32)OCO4)cc1OC ZINC000059817920 FG Annotated Anodyne COc1ccc([C@@H]2NCc3ccc4c(c3-n3cccc32)OCO4)cc1OC ZINC000059817921 FG Annotated Anodyne C=C1CC[C@@H]2O[C@@]2(C)CC[C@@H]2C[C@@H](OC(=O)[C@H]2C)[C@@](C)(O)CC[C@H]1OO ZINC000059930423 FG Annotated Reactive C=C1CC[C@@H]2O[C@@]2(C)CC[C@@H]2C[C@@H](OC(=O)[C@H]2C)[C@@](C)(O)CC[C@@H]1OO ZINC000059930426 FG Annotated Reactive C[C@@H]1C(=O)O[C@@H]2C[C@H]1CC[C@]1(C)O[C@H]1CC[C@@](C)(OO)/C=C/C[C@]2(C)O ZINC000059930433 FG Annotated Reactive C[C@@H]1C(=O)O[C@@H]2C[C@H]1CC[C@]1(C)O[C@H]1CC[C@](C)(OO)/C=C/C[C@]2(C)O ZINC000059930437 FG Annotated Reactive CC(=O)O[C@@H]1CN(S(=O)(=O)c2ccc(C)cc2)C[C@@H]1C1CCCCC1 ZINC000006001947 FG Annotated Anodyne CC(=O)O[C@H]1CN(S(=O)(=O)c2ccc(C)cc2)C[C@@H]1C1CCCCC1 ZINC000006001948 FG Annotated Anodyne O=C1c2ccccc2C(=O)c2c(NC(=O)C3CC3)ccc(NC(=O)C3CC3)c21 ZINC000006005524 FG Annotated Clean Cc1sc2nc3n(c(=O)c2c1C)N=C(c1ccc([N+](=O)[O-])cc1)CS3 ZINC000006006833 FG Annotated Bother O=S(=O)(/N=C(/NO)Nc1ccc(Cl)cc1)c1cc2ccccc2o1 ZINC000006010139 FG Annotated Mild COC(=O)/C(=C1\OC(=O)C(c2ccc(OC)cc2)=C1O)c1ccccc1 ZINC000006018222 FG Annotated Anodyne N[C@H]1CCCC[C@@H]1N1C(=O)c2ccccc2[C@@]1(O)c1ccc(Cl)cc1 ZINC000006018579 FG Annotated Anodyne N[C@H]1CCCC[C@@H]1N1C(=O)c2ccccc2[C@]1(O)c1ccc(Cl)cc1 ZINC000006018580 FG Annotated Anodyne CS/C=C\C(=O)O[C@@H]1CCC2=CC(=O)C(C(C)(C)O)=C[C@]2(C)[C@H]1C ZINC000006018592 FG Annotated Mild CCOC(=O)C(C(=O)OCC)[C@@H]1C=CC[C@H]2c3ccccc3COC[C@@H]21 ZINC000006020219 FG Annotated Anodyne CCOC(=O)C(C(=O)OCC)[C@H]1C=CC[C@H]2c3ccccc3COC[C@H]12 ZINC000006020221 FG Annotated Anodyne CCOC(=O)C(C(=O)OCC)[C@@H]1C=CC[C@@H]2c3ccccc3COC[C@@H]21 ZINC000006020223 FG Annotated Anodyne CCOC(=O)C(C(=O)OCC)[C@H]1C=CC[C@@H]2c3ccccc3COC[C@@H]21 ZINC000006020226 FG Annotated Anodyne C=C1C[C@H](OC(=O)c2ccc(O)cc2)[C@@H]2[C@](C)(CC[C@@]2(O)C(C)C)C[C@@H]1O ZINC000006020297 FG Annotated Mild CCOC(=O)C1(C(=O)OCC)[C@H]2CCC[C@H]3ON=C([C@@H]23)[C@@H]1c1ccccc1 ZINC000006040356 FG Annotated Anodyne CCOC(=O)C1(C(=O)OCC)[C@H](c2ccccc2)C2=NO[C@@H]3CCC[C@H]1[C@H]23 ZINC000006040357 FG Annotated Anodyne O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1cccc2nc3ccccc3nc12 ZINC000006041339 FG Annotated Reactive NCCN1C(=O)c2cc(Cl)c(Cl)cc2[C@@]1(O)c1ccc(Cl)cc1 ZINC000006041423 FG Annotated Anodyne CCN(CC)CCCOc1cc2c(cc1OC)C(=O)N1CCC[C@H]1C=N2 ZINC000006041585 FG Annotated Anodyne COc1ccccc1NC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(C)s1 ZINC000006049105 FG Annotated Anodyne COc1ccccc1NC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(C)s1 ZINC000006049106 FG Annotated Anodyne Cc1ccc(-n2c(C)nnc2SCC(=O)Nc2ccccc2C#N)cc1 ZINC000006056643 FG Annotated Mild C=C1C[C@]23C[C@H]1CC[C@H]2[C@]1(C(=O)O)CCC[C@@](C)(C(=O)O)[C@H]1[C@@H]3C(=O)O ZINC000006067304 FG Annotated Mild in-vitro COc1cc2c(cc1OC)-c1c(O)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3 ZINC000006068289 FG Annotated Bother COc1ccc2c(c1OC)C[C@H]1c3c(cc4c(c3-2)OCO4)CC[N+]1(C)[O-] ZINC000006068295 FG Annotated Bother COc1ccc2c(c1OC)C[C@@H]1c3c(cc4c(c3-2)OCO4)CC[N+]1(C)[O-] ZINC000006068296 FG Annotated Bother C[C@H]1CCC[C@H](NC(=O)Cn2cc(C(F)(F)F)cc(Cl)c2=O)[C@@H]1C ZINC000006199843 FG Annotated Anodyne C[C@H]1CCC[C@@H](NC(=O)Cn2cc(C(F)(F)F)cc(Cl)c2=O)[C@@H]1C ZINC000006199854 FG Annotated Anodyne O=S(=O)(c1ccccc1)n1c2cc3cccnc3nc2c2cccnc21 ZINC000006244647 FG Annotated Bother CCN1c2ncccc2C(=O)Nc2c(C)cc(N3CCSCC3)nc21 ZINC000006385188 FG Annotated Anodyne CCNc1cccnc1N1CCN(C(=O)c2ccc3ccccc3n2)CC1 ZINC000006385415 FG Annotated Anodyne CCNc1cccnc1N1CCN(C(=O)c2nc3ccccc3s2)CC1 ZINC000006385427 FG Annotated Anodyne CCOC(=O)Nc1cc2c(c(N)n1)N=C(c1ccc(OC)cc1)[C@H](C)N2 ZINC000006403203 FG Annotated Anodyne CCOC(=O)Nc1cc2c(c(N)n1)N=C(c1ccc(OC)cc1)[C@@H](C)N2 ZINC000006403206 FG Annotated Anodyne COc1ccc([C@H]2[C@@H]3CCc4ccccc4C3=NN2C(N)=S)cc1OC ZINC000006411754 FG Annotated Anodyne CC[C@H](C)/C=C(C)\C=C\C1=CC2=CC(=O)[C@](C)(O)[C@H](OC(C)=O)[C@H]2CO1 ZINC000006412263 FG Annotated Mild Cn1c(O)c(/N=N\C(=O)Cn2ccc(C(F)(F)F)n2)c2ccccc21 ZINC000006413751 FG Annotated Clean CSc1cccc(NS(=O)(=O)c2ccc3[nH]c(=O)sc3c2)c1 ZINC000006415952 FG Annotated Anodyne CCc1c(C(=O)c2cc(C)cc(C)c2)n(CCC2=CCCC2)c(=O)[nH]c1=O ZINC000006425232 FG Annotated Anodyne CCc1c(C(=O)c2cc(C)cc(C)c2)n(CCC2CC=CC2)c(=O)[nH]c1=O ZINC000006425233 FG Annotated Anodyne CCc1c(C(=O)c2cc(C)cc(C)c2)n(CC[C@H]2C=CCC2)c(=O)[nH]c1=O ZINC000006425238 FG Annotated Anodyne CCc1c(C(=O)c2cc(C)cc(C)c2)n(CC[C@@H]2C=CCC2)c(=O)[nH]c1=O ZINC000006425240 FG Annotated Anodyne C[C@H](SC(=S)N1CCOCC1)c1cc2oc(=O)n(C)c2cc1Cl ZINC000006437357 FG Annotated Anodyne C=CC[C@H]1C(=O)C=C(OC)[C@@]2(OC)[C@H]1O[C@@H](c1ccc3c(c1)OCO3)[C@@H]2C ZINC000006469293 FG Annotated Mild CSc1nn(-c2c([N+](=O)[O-])c(C)nn2C)c(-c2cccs2)c1C#N ZINC000006469850 FG Annotated Mild COc1cc(CN2Sc3ccccc3[S@]2=O)cc(OC)c1OC ZINC000006483654 FG Annotated Anodyne COc1cc(CN2Sc3ccccc3[S@@]2=O)cc(OC)c1OC ZINC000006483655 FG Annotated Anodyne Cc1nn(C(=O)c2ccncc2)c2c1[C@H](c1ccccc1O)SC(=N)N2 ZINC000006483974 FG Annotated Anodyne COc1ccc(C[C@H]2CCC(=O)[C@@H]2Cc2ccc(O)c(O)c2)cc1OC ZINC000006484666 FG Annotated Clean Cc1ccc(S(=O)(=O)NNC(=S)Nc2cccc3ccccc23)cc1 ZINC000006487506 FG Annotated Anodyne C[C@H](C(=O)c1c(O)c2c(c3c1OC(=O)C[C@H]3C)OC(C)(C)C=C2)[C@@H](C)O ZINC000006488116 FG Annotated Anodyne C[C@@H]1CC(=O)Oc2c(C(=O)[C@H](C)[C@@H](C)O)c(O)c3c(c21)OC(C)(C)C=C3 ZINC000006488118 FG Annotated Anodyne Cc1cc(C)c([C@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)cc1CN1CCCC1 ZINC000006492436 FG Annotated Reactive Cc1cc(C)c([C@@H]2C(C#N)=C(N)Oc3n[nH]c(C)c32)cc1CN1CCCC1 ZINC000006492437 FG Annotated Reactive CCSc1nc(O)c2c(n1)N=C(C)/C(=C(\O)OC)[C@@H]2c1ccncc1 ZINC000006494088 FG Annotated Anodyne C[C@H]1CC(=O)Oc2c(C(=O)[C@@H](C)[C@@H](C)O)c(O)c3c(c21)OC(C)(C)C=C3 ZINC000006494877 FG Annotated Anodyne C[C@H]1CC(=O)Oc2c(C(=O)[C@H](C)[C@@H](C)O)c(O)c3c(c21)OC(C)(C)C=C3 ZINC000006494878 FG Annotated Anodyne CC(C)/C=C/C(=O)N1CCC[C@H](N2CCN(c3ccccc3F)CC2)C1 ZINC000061688092 FG Annotated Anodyne CC(C)/C=C/C(=O)N1CCC[C@@H](N2CCN(c3ccccc3F)CC2)C1 ZINC000061688093 FG Annotated Anodyne O=c1[nH]c2ccccc2cc1-c1nnn(-c2ccc(Cl)c(Cl)c2)n1 ZINC000061688131 FG Annotated Anodyne CCCC[C@@H]1CNCCN1CCCc1cc(OC)c(OC)c(OC)c1 ZINC000061711142 FG Annotated Anodyne COc1ccc([C@H]2NCc3ccc4c(c3-n3cccc32)OCO4)cc1O ZINC000061852981 FG Annotated Anodyne COc1ccc([C@@H]2NCc3ccc4c(c3-n3cccc32)OCO4)cc1O ZINC000061852982 FG Annotated Anodyne CCNC(=O)[C@]1(C)CCCN(C(=O)c2sc(-c3ccccc3)nc2C)C1 ZINC000061895327 FG Annotated Anodyne CCNC(=O)[C@@]1(C)CCCN(C(=O)c2sc(-c3ccccc3)nc2C)C1 ZINC000061895329 FG Annotated Anodyne CCCCC(=O)N(C)c1c(C)nc2ccc(C(=O)N3CCCCC3)cn12 ZINC000061895565 FG Annotated Anodyne COC(=O)c1ccc(C[C@]2(C)C(=O)Nc3ccc(OC(F)(F)F)cc32)o1 ZINC000061895609 FG Annotated Anodyne COC(=O)c1ccc(C[C@@]2(C)C(=O)Nc3ccc(OC(F)(F)F)cc32)o1 ZINC000061895610 FG Annotated Anodyne CCc1nc2c(OCC(=O)C(C)(C)C)cccn2c1N(C)C(=O)C1CC1 ZINC000061895715 FG Annotated Anodyne CC(=O)Nc1cccc(Oc2nc(NCCN(C)C)nc3ccsc23)c1 ZINC000061895920 FG Annotated Anodyne CCCCNC(=O)[C@]1(C)CCCCN1C(=O)c1cc(C)n(C(C)(C)C)n1 ZINC000061896052 FG Annotated Anodyne CCCCNC(=O)[C@@]1(C)CCCCN1C(=O)c1cc(C)n(C(C)(C)C)n1 ZINC000061896053 FG Annotated Anodyne CCCNC(=O)[C@]1(C)CCN(C(=O)COc2ccc(C(C)(C)C)cc2)C1 ZINC000061896411 FG Annotated Anodyne CCCNC(=O)[C@@]1(C)CCN(C(=O)COc2ccc(C(C)(C)C)cc2)C1 ZINC000061896414 FG Annotated Anodyne NC(=O)c1cccc(Nc2nc([C@@H](N)CCc3ccccc3)cs2)n1 ZINC000061896442 FG Annotated Anodyne NC(=O)c1cccc(Nc2nc([C@H](N)CCc3ccccc3)cs2)n1 ZINC000061896444 FG Annotated Anodyne CCc1nc2ccc(C(=O)N(C)CCN(C)C)cn2c1N(C)CCC(C)C ZINC000061896483 FG Annotated Anodyne COc1cccc(CN2CC[C@@]2(C)C(=O)Nc2ccc(C)c(O)c2)c1F ZINC000061896668 FG Annotated Anodyne COc1cccc(CN2CC[C@]2(C)C(=O)Nc2ccc(C)c(O)c2)c1F ZINC000061896670 FG Annotated Anodyne Cc1ccccc1-c1cc2nc(NCCCN(C)C)n(C)c(=O)c2s1 ZINC000061896967 FG Annotated Anodyne Cc1ccsc1-c1cc2nc(NCCCN(C)C)n(C)c(=O)c2s1 ZINC000061896970 FG Annotated Anodyne COc1ccc(NC(=O)[C@@H]2Cc3c(-c4cccc(F)c4)ccnc3O2)cn1 ZINC000061897318 FG Annotated Anodyne COc1ccc(NC(=O)[C@H]2Cc3c(-c4cccc(F)c4)ccnc3O2)cn1 ZINC000061897320 FG Annotated Anodyne COCCNc1nc(NCCOC)c2sc(-c3ccccc3)cc2n1 ZINC000061897464 FG Annotated Anodyne CCNC(=O)Nc1ccc2c(c1)c(=O)n(C)n2Cc1ccc(Cl)cc1 ZINC000061897467 FG Annotated Anodyne CS(=O)(=O)c1ccc(Nc2nc([C@H](N)c3ccccc3)cs2)cc1 ZINC000061897477 FG Annotated Anodyne CS(=O)(=O)c1ccc(Nc2nc([C@@H](N)c3ccccc3)cs2)cc1 ZINC000061897478 FG Annotated Anodyne CC(=O)c1ccc(-c2cnc3c(NC=O)cc(-c4cnn(C)c4)cn23)cc1 ZINC000061897485 FG Annotated Anodyne N[C@@H](c1csc(Nc2ccc(C(=O)NCCO)cc2)n1)C1CCCCC1 ZINC000061898409 FG Annotated Anodyne N[C@H](c1csc(Nc2ccc(C(=O)NCCO)cc2)n1)C1CCCCC1 ZINC000061898411 FG Annotated Anodyne Cc1nc(C(F)(F)F)ccc1C(=O)N1CCC[C@@]1(C)C(=O)NCC(C)C ZINC000061898466 FG Annotated Anodyne Cc1nc(C(F)(F)F)ccc1C(=O)N1CCC[C@]1(C)C(=O)NCC(C)C ZINC000061898468 FG Annotated Anodyne C=C(C)Cn1c2ccc(NC(=O)NCCc3cccs3)cc2c(=O)n1C ZINC000061898716 FG Annotated Mild CCCCN(C=O)c1c(CC)nc2ccc(C(=O)N3CCCCC3)cn12 ZINC000061898720 FG Annotated Anodyne CC(=O)c1cccc(-c2ccnc3c2C[C@H](C(=O)NCc2ccco2)O3)c1 ZINC000061902676 FG Annotated Anodyne CC(=O)c1cccc(-c2ccnc3c2C[C@@H](C(=O)NCc2ccco2)O3)c1 ZINC000061902677 FG Annotated Anodyne COCCNc1nc(NCc2cccc(OC)c2OC)c2sccc2n1 ZINC000061902761 FG Annotated Anodyne NC(=O)c1ccc(Nc2nc([C@@H](N)COCc3ccccc3)cs2)cc1 ZINC000061902795 FG Annotated Anodyne NC(=O)c1ccc(Nc2nc([C@H](N)COCc3ccccc3)cs2)cc1 ZINC000061902796 FG Annotated Anodyne CCNC(=O)[C@]1(C)CCCN(C(=O)c2cccnc2Oc2ccccc2)C1 ZINC000061902886 FG Annotated Anodyne CCNC(=O)[C@@]1(C)CCCN(C(=O)c2cccnc2Oc2ccccc2)C1 ZINC000061902887 FG Annotated Anodyne CCCNC(=O)[C@]1(C)CCN(C(=O)COc2ccc(Cl)cc2Cl)C1 ZINC000061903181 FG Annotated Anodyne CCCNC(=O)[C@@]1(C)CCN(C(=O)COc2ccc(Cl)cc2Cl)C1 ZINC000061903182 FG Annotated Anodyne CN(C)c1ccc(-c2ccnc3c2C[C@](C)(C(=O)NCC2CC2)O3)cc1 ZINC000061903403 FG Annotated Anodyne CN(C)c1ccc(-c2ccnc3c2C[C@@](C)(C(=O)NCC2CC2)O3)cc1 ZINC000061903404 FG Annotated Anodyne CCc1nc2ccc(C(=O)NCCC(C)C)cn2c1N(CC)CCN(C)C ZINC000061903716 FG Annotated Anodyne C=CCNc1nc2cc(-c3cccc(NC(C)=O)c3)sc2c(=O)n1C ZINC000061903736 FG Annotated Mild CCc1nc2c(OCCn3cccc3)cccn2c1N(C)C(=O)C1CC1 ZINC000061904080 FG Annotated Anodyne COc1cc(NC(=O)[C@]2(C)CCCN(C(C)C)C2)cc(OC)c1OC ZINC000061904420 FG Annotated Anodyne COc1cc(NC(=O)[C@@]2(C)CCCN(C(C)C)C2)cc(OC)c1OC ZINC000061904421 FG Annotated Anodyne Cc1ccsc1C(=O)N1CC[C@@]1(C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000061904611 FG Annotated Anodyne Cc1ccsc1C(=O)N1CC[C@]1(C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000061904612 FG Annotated Anodyne CCNC(=S)Nc1ccc2c(c1)c(=O)n(C)n2Cc1ccc(Cl)cc1 ZINC000061905034 FG Annotated Anodyne COCCNc1nc(NCc2ccc(NC(C)=O)cc2)c2sccc2n1 ZINC000061905256 FG Annotated Anodyne COCOc1ccc(-c2ncc(OC)nc2NC(=O)c2ccsc2)cc1 ZINC000061905667 FG Annotated Anodyne COCOc1cccc(CN2CC[C@@]2(C)C(=O)Nc2ccc(C)c(O)c2)c1 ZINC000061905733 FG Annotated Anodyne COCOc1cccc(CN2CC[C@]2(C)C(=O)Nc2ccc(C)c(O)c2)c1 ZINC000061905734 FG Annotated Anodyne CCCC(C)(C)C(=O)N1CC[C@@]1(C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000061906421 FG Annotated Anodyne CCCC(C)(C)C(=O)N1CC[C@]1(C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000061906422 FG Annotated Anodyne N[C@H](CO)c1csc(NC(=O)Nc2ccccc2Cc2ccccc2)n1 ZINC000061906494 FG Annotated Anodyne N[C@@H](CO)c1csc(NC(=O)Nc2ccccc2Cc2ccccc2)n1 ZINC000061906495 FG Annotated Anodyne Cc1ccc(F)cc1-c1cc2nc(NCCCN(C)C)n(C)c(=O)c2s1 ZINC000061906958 FG Annotated Anodyne O=C(Nc1ccccc1)[C@@H]1Cc2c(-c3ccc4c(c3)OCO4)ccnc2O1 ZINC000061907163 FG Annotated Anodyne O=C(Nc1ccccc1)[C@H]1Cc2c(-c3ccc4c(c3)OCO4)ccnc2O1 ZINC000061907164 FG Annotated Anodyne C[C@]1(C(=O)N2Cc3ccccc3C2)CCN1C(=O)C1(c2ccccc2)CC1 ZINC000061907177 FG Annotated Anodyne C[C@@]1(C(=O)N2Cc3ccccc3C2)CCN1C(=O)C1(c2ccccc2)CC1 ZINC000061907178 FG Annotated Anodyne Cc1ccc(OCCN2CC[C@@]2(C)C(=O)Nc2ccc3c(c2)OCO3)cc1 ZINC000061907304 FG Annotated Anodyne Cc1ccc(OCCN2CC[C@]2(C)C(=O)Nc2ccc3c(c2)OCO3)cc1 ZINC000061907305 FG Annotated Anodyne COc1cccc(CN2CC[C@]2(C)C(=O)Nc2ccc3c(c2)OCO3)c1F ZINC000061907649 FG Annotated Anodyne COc1cccc(CN2CC[C@@]2(C)C(=O)Nc2ccc3c(c2)OCO3)c1F ZINC000061907650 FG Annotated Anodyne CCCC(=O)N1CCC[C@H](c2cc(C(=O)NCc3ccc(F)cc3)no2)C1 ZINC000061907691 FG Annotated Anodyne CCCC(=O)N1CCC[C@@H](c2cc(C(=O)NCc3ccc(F)cc3)no2)C1 ZINC000061907692 FG Annotated Anodyne COCCNC(=O)[C@@]1(C)CCN(C(=O)c2cc(-c3ccccc3)cs2)C1 ZINC000061908144 FG Annotated Anodyne COCCNC(=O)[C@]1(C)CCN(C(=O)c2cc(-c3ccccc3)cs2)C1 ZINC000061908145 FG Annotated Anodyne C#Cc1ccc(NC(=O)[C@@]2(C)CCN2C(=O)C2(c3ccccc3)CC2)cc1 ZINC000061908515 FG Annotated Mild C#Cc1ccc(NC(=O)[C@]2(C)CCN2C(=O)C2(c3ccccc3)CC2)cc1 ZINC000061908516 FG Annotated Mild CCCNC(=O)[C@]1(C)CCCN(Cc2cc(-c3ccccc3)n(C)n2)C1 ZINC000061908567 FG Annotated Anodyne CCCNC(=O)[C@@]1(C)CCCN(Cc2cc(-c3ccccc3)n(C)n2)C1 ZINC000061908568 FG Annotated Anodyne COC(=O)c1cccc(CN2C(=O)[C@@H](C)Sc3ccc(C#N)cc32)c1 ZINC000061908661 FG Annotated Mild COC(=O)c1cccc(CN2C(=O)[C@H](C)Sc3ccc(C#N)cc32)c1 ZINC000061908662 FG Annotated Mild CCNC(=S)Nc1ccc2c(c1)c(=O)n(C)n2-c1cc(C)cc(C)c1 ZINC000061908668 FG Annotated Anodyne CCCCNC(=O)[C@]1(C)CCN1C(=O)c1ccc(OC)c(C(F)(F)F)c1 ZINC000061908727 FG Annotated Anodyne CCCCNC(=O)[C@@]1(C)CCN1C(=O)c1ccc(OC)c(C(F)(F)F)c1 ZINC000061908728 FG Annotated Anodyne C=C(C)Cn1c2ccc(NC(=O)NCc3ccc(F)cc3)cc2c(=O)n1C ZINC000061908913 FG Annotated Mild CC(C)N1C[C@@]2(CC(c3ccccc3F)=NO2)CN1C(=O)c1ccco1 ZINC000061920879 FG Annotated Anodyne CC(C)N1C[C@]2(CC(c3ccccc3F)=NO2)CN1C(=O)c1ccco1 ZINC000061920880 FG Annotated Anodyne CC(C)(C)OC(=O)NCCc1onc(-c2ccccc2F)c1C(=O)O ZINC000061920899 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCc2onc(-c3ccc([N+](=O)[O-])cc3)c2C1=O ZINC000061920905 FG Annotated Bother C[C@H]1NC(=O)c2cc3ccccc3cc2-n2c1nc1ccc(F)cc1c2=O ZINC000061921281 FG Annotated Anodyne C[C@@H]1NC(=O)c2cc3ccccc3cc2-n2c1nc1ccc(F)cc1c2=O ZINC000061921282 FG Annotated Anodyne C[C@H]1NC(=O)c2cc3ccccc3cc2-n2c1nc1cc(F)ccc1c2=O ZINC000061921283 FG Annotated Anodyne C[C@@H]1NC(=O)c2cc3ccccc3cc2-n2c1nc1cc(F)ccc1c2=O ZINC000061921284 FG Annotated Anodyne Cc1cc(C)c2c(=O)n3c(nc2c1)[C@@H](CC(C)C)NC(=O)c1cccnc1-3 ZINC000061921411 FG Annotated Anodyne Cc1cc(C)c2c(=O)n3c(nc2c1)[C@H](CC(C)C)NC(=O)c1cccnc1-3 ZINC000061921412 FG Annotated Anodyne CC(C)C[C@H]1NC(=O)c2cccnc2-n2c1nc1cc(Cl)ccc1c2=O ZINC000061921419 FG Annotated Anodyne CC(C)C[C@@H]1NC(=O)c2cccnc2-n2c1nc1cc(Cl)ccc1c2=O ZINC000061921420 FG Annotated Anodyne C[C@H](NC(=O)c1[nH]cnc1C(=O)Nc1ccccc1F)c1ccccc1 ZINC000061922168 FG Annotated Anodyne C[C@@H](NC(=O)c1[nH]cnc1C(=O)Nc1ccccc1F)c1ccccc1 ZINC000061922170 FG Annotated Anodyne CCCCN1C[C@H](CSC)[C@@H](CC(=O)Nc2ccc(OC)cc2)C1=O ZINC000061923615 FG Annotated Anodyne CC(=O)N1C[C@H]2CON(C)[C@H]2C[C@H]1c1ccc(-c2ccc(C#N)cc2)cc1 ZINC000061924011 FG Annotated Mild CC(=O)N1C[C@H]2CON(C)[C@H]2C[C@H]1c1cccc(-c2ccc(C#N)cc2)c1 ZINC000061924160 FG Annotated Mild COCC(=O)N1C[C@H]2CON(C)[C@H]2C[C@H]1c1cccc(-c2ccccc2)c1 ZINC000061924161 FG Annotated Anodyne CON(Cc1ccccc1)S(=O)(=O)c1ccccc1Br ZINC000061924286 FG Annotated Anodyne C=C(C)[C@@H]1c2cc(C(=O)OC)c(o2)C[C@H](C(=C)C)[C@H]2O[C@H]2C2=C[C@H]1OC2=O ZINC000061924483 FG Annotated Mild CCCNC(=O)[C@]1(C)CCCN(Cc2cc(-c3ccccc3)nn2C)C1 ZINC000061925703 FG Annotated Anodyne CCCNC(=O)[C@@]1(C)CCCN(Cc2cc(-c3ccccc3)nn2C)C1 ZINC000061925704 FG Annotated Anodyne CC(C)(C)c1ccc(C(=O)N2CC[C@]2(C)C(=O)NCC(F)(F)F)cc1 ZINC000061925818 FG Annotated Anodyne CC(C)(C)c1ccc(C(=O)N2CC[C@@]2(C)C(=O)NCC(F)(F)F)cc1 ZINC000061925819 FG Annotated Anodyne COCCNC(=O)[C@@]1(C)CCCN(Cc2ccc(-c3ccccn3)cc2)C1 ZINC000061926079 FG Annotated Anodyne COCCNC(=O)[C@]1(C)CCCN(Cc2ccc(-c3ccccn3)cc2)C1 ZINC000061926080 FG Annotated Anodyne N[C@H](Cc1cnc[nH]1)c1csc(Nc2ccc(C(F)(F)F)cn2)n1 ZINC000061926144 FG Annotated Anodyne N[C@@H](Cc1cnc[nH]1)c1csc(Nc2ccc(C(F)(F)F)cn2)n1 ZINC000061926145 FG Annotated Anodyne CCOC(=O)[C@]1(C)CCCN(C(=O)c2c(-c3ccccc3)noc2C)C1 ZINC000061926160 FG Annotated Anodyne CCOC(=O)[C@@]1(C)CCCN(C(=O)c2c(-c3ccccc3)noc2C)C1 ZINC000061926161 FG Annotated Anodyne O=C(NCc1ccncc1)[C@H]1Cc2c(-c3ccc(Cl)cc3)ccnc2O1 ZINC000061926196 FG Annotated Anodyne O=C(NCc1ccncc1)[C@@H]1Cc2c(-c3ccc(Cl)cc3)ccnc2O1 ZINC000061926197 FG Annotated Anodyne CCCCNC(=O)[C@]1(C)CCN1C(=O)c1cccnc1Oc1ccccc1 ZINC000061926250 FG Annotated Anodyne CCCCNC(=O)[C@@]1(C)CCN1C(=O)c1cccnc1Oc1ccccc1 ZINC000061926251 FG Annotated Anodyne Cc1ccc(NC(=O)[C@]2(C)CCN2Cc2cccc3c2OCO3)cc1O ZINC000061926530 FG Annotated Anodyne Cc1ccc(NC(=O)[C@@]2(C)CCN2Cc2cccc3c2OCO3)cc1O ZINC000061926531 FG Annotated Anodyne CCCNC(=O)c1cc([C@@H]2CCCN(C(=O)c3cc(F)ccc3C)C2)on1 ZINC000061926814 FG Annotated Anodyne CCCNC(=O)c1cc([C@H]2CCCN(C(=O)c3cc(F)ccc3C)C2)on1 ZINC000061926815 FG Annotated Anodyne COc1ccc([C@](C)(NC(C)=O)c2nc(-c3cncnc3)cs2)cc1 ZINC000061926875 FG Annotated Anodyne COc1ccc([C@@](C)(NC(C)=O)c2nc(-c3cncnc3)cs2)cc1 ZINC000061926876 FG Annotated Anodyne CC(C)=CCn1c2ccc(NC(=O)Nc3cccnc3)cc2c(=O)n1C ZINC000061926888 FG Annotated Anodyne COc1cc(OC)nc(Nc2nc([C@H](N)CCc3ccccc3)cs2)n1 ZINC000061926973 FG Annotated Anodyne COc1cc(OC)nc(Nc2nc([C@@H](N)CCc3ccccc3)cs2)n1 ZINC000061926974 FG Annotated Anodyne COc1cc(CNC(=O)c2cc(-c3cc(C)cc(F)c3)[nH]n2)cc(OC)c1 ZINC000061927028 FG Annotated Anodyne CCc1nc2ccc(C(=O)NCCC(C)C)cn2c1N(CC)CCOC ZINC000061927482 FG Annotated Anodyne COCCNc1nc(Nc2ccc(C(=O)OC)cc2)c2sccc2n1 ZINC000061927676 FG Annotated Anodyne CCCNC(=O)[C@]1(C)CCCN(C(=O)c2ccc(OC(F)F)cc2)C1 ZINC000061927823 FG Annotated Anodyne CCCNC(=O)[C@@]1(C)CCCN(C(=O)c2ccc(OC(F)F)cc2)C1 ZINC000061927824 FG Annotated Anodyne CCCNC(=O)[C@]1(C)CCN(C(=O)c2cccnc2Oc2ccccc2)C1 ZINC000061928095 FG Annotated Anodyne CCCNC(=O)[C@@]1(C)CCN(C(=O)c2cccnc2Oc2ccccc2)C1 ZINC000061928097 FG Annotated Anodyne C[C@]1(C(=O)Nc2ccc3[nH]cnc3c2)CCN1C(=O)C1(c2ccccc2)CC1 ZINC000061929381 FG Annotated Anodyne C[C@@]1(C(=O)Nc2ccc3[nH]cnc3c2)CCN1C(=O)C1(c2ccccc2)CC1 ZINC000061929383 FG Annotated Anodyne COc1ccc(OC)c(NC(=O)Nc2nc([C@@H](N)C(C)C)cs2)c1 ZINC000061930330 FG Annotated Anodyne COc1ccc(OC)c(NC(=O)Nc2nc([C@H](N)C(C)C)cs2)c1 ZINC000061930332 FG Annotated Anodyne COc1ccc(NC(=O)[C@@]2(C)Cc3c(-c4ccccc4)ccnc3O2)cn1 ZINC000061930439 FG Annotated Anodyne COc1ccc(NC(=O)[C@]2(C)Cc3c(-c4ccccc4)ccnc3O2)cn1 ZINC000061930442 FG Annotated Anodyne Cc1cscc1-c1cc2nc(NCCCN(C)C)n(C)c(=O)c2s1 ZINC000061930964 FG Annotated Anodyne CCC(=O)c1ccc(OCc2cn(CC(=O)c3ccc(O)cc3)nn2)cc1 ZINC000061931023 FG Annotated Anodyne C=CCC[C@@H]1CN(Cc2ccco2)S(=O)(=O)c2c(F)cccc2O1 ZINC000061931158 FG Annotated Mild C=CCC[C@H]1CN(Cc2ccco2)S(=O)(=O)c2c(F)cccc2O1 ZINC000061931160 FG Annotated Mild Cc1ccc(CNCCCn2cnc(C(=O)Nc3ccc(C)c(C)c3)n2)o1 ZINC000061936040 FG Annotated Anodyne S=C1NCCN1CC1CCN(CCC23CC4CC(CC(C4)C2)C3)CC1 ZINC000061936164 FG Annotated Anodyne CCCCN1C(=O)[C@@H](C(=O)OCc2ccccc2)CC2=C1CCCC2=O ZINC000061942732 FG Annotated Mild CCCCN1C(=O)[C@H](C(=O)OCc2ccccc2)CC2=C1CCCC2=O ZINC000061942734 FG Annotated Mild O=S1(=O)N[C@@H](CC2CCCCC2)COc2cc(Br)ccc21 ZINC000061943354 FG Annotated Anodyne CCN1CCN(C(=O)c2cc3cc4cc(OC)ccc4nc3s2)CC1 ZINC000061943421 FG Annotated Anodyne C[C@H]1NS(=O)(=O)c2ccc(Br)cc2O[C@H]1c1ccccc1 ZINC000061944680 FG Annotated Anodyne CN1CCN(NC(=O)c2c(-c3ccccc3)sc3ccccc23)CC1 ZINC000061948007 FG Annotated Anodyne CON(C)C(=O)C[C@H](CNC(=O)OC(C)(C)C)c1ccc(Cl)cc1 ZINC000061948212 FG Annotated Anodyne CON(C)C(=O)C[C@@H](CNC(=O)OC(C)(C)C)c1ccc(Cl)cc1 ZINC000061948214 FG Annotated Anodyne O=C1c2ccccc2[C@@H]2C[C@H](NC34CC5CC(CC(C5)C3)C4)[C@@H](O)CCN12 ZINC000061959043 FG Annotated Anodyne CC[C@H]1C/C=C\Cc2ccccc2[C@H](C(=O)C[C@@H](O)CC(C)=O)OC1=O ZINC000061959150 FG Annotated Anodyne CC[C@@H]1CCCCc2ccccc2[C@@H](C(=O)C[C@H](O)CC(C)=O)OC1=O ZINC000061959152 FG Annotated Anodyne CC[C@@H]1C/C=C\Cc2ccccc2[C@@H](C(=O)C[C@H](O)CC(C)=O)OC1=O ZINC000061959155 FG Annotated Anodyne CC[C@H]1CCCCc2ccccc2[C@@H](C(=O)C[C@@H](O)CC(C)=O)OC1=O ZINC000061959157 FG Annotated Anodyne CC[C@H]1C/C=C\Cc2ccccc2[C@@H](C(=O)C[C@@H](O)CC(C)=O)OC1=O ZINC000061959158 FG Annotated Anodyne CC(=O)C[C@@H](O)CC(=O)[C@@H]1OC(=O)CCCCCCCc2ccccc21 ZINC000061959161 FG Annotated Anodyne CC[C@@H]1CCCCc2ccccc2[C@H](C(=O)C[C@H](O)CC(C)=O)OC1=O ZINC000061959162 FG Annotated Anodyne CC[C@@H]1C/C=C\Cc2ccccc2[C@H](C(=O)C[C@H](O)CC(C)=O)OC1=O ZINC000061959164 FG Annotated Anodyne CC[C@@H]1CCCCc2ccccc2[C@H](C(=O)C[C@@H](O)CC(C)=O)OC1=O ZINC000061959218 FG Annotated Anodyne CC[C@@H]1CCCCc2ccccc2[C@@H](C(=O)C[C@@H](O)CC(C)=O)OC1=O ZINC000061959220 FG Annotated Anodyne CC[C@@H]1C/C=C\Cc2ccccc2[C@H](C(=O)C[C@@H](O)CC(C)=O)OC1=O ZINC000061959222 FG Annotated Anodyne CC[C@@H]1C/C=C\Cc2ccccc2[C@@H](C(=O)C[C@@H](O)CC(C)=O)OC1=O ZINC000061959223 FG Annotated Anodyne CC(C)C[C@@H](CN1C(N)=NC[C@@H]1C)NC(=O)CC12CC3CC(CC(C3)C1)C2 ZINC000061959633 FG Annotated Anodyne CNCCNC[C@H](Cc1cccc2ccccc12)NCCc1ccccc1 ZINC000061959724 FG Annotated Anodyne COc1cc2c(C#CCCO)c(-c3ccsc3)oc(=O)c2cc1OC ZINC000061969101 FG Annotated Mild CCO/C(O)=C1\C(C)=NC(=S)N[C@@H]1c1cc2c(cc1Cl)OCO2 ZINC000617966483 FG Annotated Anodyne CCO/C(O)=C1\C(C)=NC(=S)N[C@H]1c1cc2c(cc1Cl)OCO2 ZINC000617966484 FG Annotated Anodyne Cc1cccc(NC(=O)Cn2c(O)c(N=NC(N)=O)c3ccccc32)c1 ZINC000617978361 FG Annotated Clean O=[N+]([O-])c1ccccc1N=Nc1c(O)[nH]c2ccc(S(=O)(=O)O)cc12 ZINC000617995172 FG Annotated Clean CC/N=c1\c(NC(=O)c2c(OC)cccc2OC)c(O)oc2ccccc12 ZINC000617997450 FG Annotated Anodyne CC/N=c1\c(NC(=O)Cc2ccc(OC)cc2)c(O)oc2ccccc12 ZINC000617997465 FG Annotated Anodyne C/N=c1\c(NS(=O)(=O)c2ccc(C)c(C)c2)c(O)oc2ccccc12 ZINC000617997500 FG Annotated Anodyne CC/N=c1\c(NS(=O)(=O)c2ccc(C)cc2)c(O)oc2ccccc12 ZINC000617997504 FG Annotated Anodyne CC/N=c1\c(NS(=O)(=O)c2ccc(C)c(C)c2)c(O)oc2ccccc12 ZINC000617997510 FG Annotated Anodyne Cc1nc2sc([C@H](c3cccs3)N3C[C@H](C)O[C@@H](C)C3)c(O)n2n1 ZINC000618006795 FG Annotated Anodyne COC(=O)c1nc2n(n1)[C@@H](c1ccc(Cl)cc1)C1=C(O)CCCC1=N2 ZINC000618007255 FG Annotated Anodyne COC(=O)c1nc2n(n1)[C@H](c1ccc(Cl)cc1)C1=C(O)CCCC1=N2 ZINC000618007256 FG Annotated Anodyne COC(=O)c1ccc(C)c(NC(=O)CCSSCCN(C)C)c1 ZINC000618007553 FG Annotated Reactive CN(C)CCSSCCCC(=O)N=c1cc(-c2cccs2)[nH][nH]1 ZINC000618007582 FG Annotated Reactive CN(C)CCSSCCNC(=O)c1ccc(Cl)nc1Cl ZINC000618007606 FG Annotated Reactive CCC(=O)Nc1cccc(NC(=O)NCCSSCCN(C)C)c1 ZINC000618007683 FG Annotated Reactive CN(C)CCSSCCNC(=O)Nc1cc(Cl)ccc1C#N ZINC000618007742 FG Annotated Reactive CN(C)CCSSCCNC(=O)c1cc(Cl)ncc1Cl ZINC000618007866 FG Annotated Reactive CCSc1nnc(NC(=O)CCCSSCCN(C)C)s1 ZINC000618007908 FG Annotated Reactive CN(C)CCSSCCCNC(=O)c1ccc(Cl)nc1Cl ZINC000618008180 FG Annotated Reactive CN(C)CCSSCCNC(=O)c1ccc(Br)s1 ZINC000618008201 FG Annotated Reactive Cc1ccc(C(C)C)c(O)c1C(=O)NCCSSCCN(C)C ZINC000618008324 FG Annotated Reactive CN(C)CCSSCCNC(=O)c1cc(Cl)c(N)c(Cl)c1 ZINC000618008648 FG Annotated Reactive NS(=O)(=O)c1ccc(N=Nc2c(O)[nH]c3ccc4ncccc4c23)cc1 ZINC000618008656 FG Annotated Clean NC(=O)CCNC1CCN(c2cccc(-c3cc4ccccc4[nH]3)c2)CC1 ZINC000618008673 FG Annotated Anodyne CN(C)CCSSCCNC(=O)c1ccc2cc(O)ccc2c1 ZINC000618008796 FG Annotated Reactive CN(C)CCSSCCNC(=O)C1=Cc2c(Cl)cccc2OC1 ZINC000618008883 FG Annotated Reactive CCC(CC)C(=O)c1c[nH]c(C(=O)NCCSSCCN(C)C)c1 ZINC000618009013 FG Annotated Reactive CN(C)CCSSCCNC(=O)c1cc(Cl)cc(Cl)c1N ZINC000618009314 FG Annotated Reactive CN(C)CCSSCCCn1cc(-c2ccc(CC#N)cc2)nn1 ZINC000618009506 FG Annotated Reactive O=C1NC(=O)C2(CCN(c3cccc(-c4cc5ccccc5[nH]4)c3)CC2)N1 ZINC000618009533 FG Annotated Anodyne COc1ccccc1-c1cn(CCCSSCCN(C)C)nn1 ZINC000618009547 FG Annotated Reactive CN(C)CCSSCCN(C)C(=O)COc1cccc(Cl)c1 ZINC000618009793 FG Annotated Reactive CN(C)CCSSCCCn1cc(-c2ccc(N(C)C)cc2)nn1 ZINC000618009892 FG Annotated Reactive CN(C)CCSSCCN(C)C(=O)c1ccc(Br)o1 ZINC000618010015 FG Annotated Reactive CN(C)CCSSCCCn1cc(-c2ccc([N+](=O)[O-])cc2)nn1 ZINC000618010113 FG Annotated Reactive CN(C)CCSSCCCNC(=O)c1ccc(Br)o1 ZINC000618012533 FG Annotated Reactive COc1ccc(-c2cn(CCSSCCN(C)C)nn2)c(C)c1 ZINC000618012539 FG Annotated Reactive Cn1ncnc1CN[C@@H]1CCN(c2cccc(-c3cc4ccccc4[nH]3)c2)C1 ZINC000618012694 FG Annotated Anodyne Cn1ncnc1CN[C@H]1CCN(c2cccc(-c3cc4ccccc4[nH]3)c2)C1 ZINC000618012698 FG Annotated Anodyne Cc1cccnc1[C@H](NC(=O)[C@@H]1CC[C@H](c2ccco2)NC1=O)C(C)C ZINC000618015470 FG Annotated Anodyne Cc1cccnc1[C@H](NC(=O)[C@@H]1CC[C@@H](c2ccco2)NC1=O)C(C)C ZINC000618015472 FG Annotated Anodyne Cc1cccnc1[C@H](NC(=O)[C@H]1CC[C@@H](c2ccco2)NC1=O)C(C)C ZINC000618015473 FG Annotated Anodyne Cc1cccnc1[C@H](NC(=O)[C@H]1CC[C@H](c2ccco2)NC1=O)C(C)C ZINC000618015474 FG Annotated Anodyne C[C@@H]1NC(=O)[C@@H](CCC(=O)Oc2ccc3oc4ccccc4c3c2)[C@@H](C)N1 ZINC000618016129 FG Annotated Anodyne C[C@@H]1NC(=O)[C@H](CCC(=O)Oc2ccc3oc4ccccc4c3c2)[C@H](C)N1 ZINC000618016130 FG Annotated Anodyne C[C@@H]1NC(=O)[C@H](CCC(=O)Oc2ccc3oc4ccccc4c3c2)[C@@H](C)N1 ZINC000618016131 FG Annotated Anodyne C[C@@H]1NC(=O)[C@@H](CCC(=O)Oc2ccc3oc4ccccc4c3c2)[C@H](C)N1 ZINC000618016132 FG Annotated Anodyne O=C1CNCCOCCOc2ccccc2Oc2ccc(Cl)cc2N1 ZINC000618016929 FG Annotated Anodyne Cc1nc2cc(C(=O)NCCSSCCN(C)C)cc(Cl)c2[nH]1 ZINC000618016947 FG Annotated Reactive CN(C)CCSSCCCNC(=O)c1ccc(C(F)(F)F)nc1 ZINC000618017097 FG Annotated Reactive CN(C)CCSSCCCNC(=O)c1cc(-c2cccs2)on1 ZINC000618017157 FG Annotated Reactive CN(C)CCSSCCCNC(=O)c1cccc(C(F)(F)F)n1 ZINC000618017218 FG Annotated Reactive CN(C)CCSSCCCNC(=O)Cc1ccc2cc[nH]c2c1 ZINC000618017457 FG Annotated Reactive CN(C)CCSSCCCNC(=O)c1ccc(C(F)(F)F)cn1 ZINC000618017559 FG Annotated Reactive CN(C)CCSSCCCNC(=O)c1cc(C2CCCC2)no1 ZINC000618017730 FG Annotated Reactive CN(C)CCSSCCCNC(=O)Cc1cn(C)c2ccccc12 ZINC000618017757 FG Annotated Reactive CN(C)CCSSCCCNC(=O)c1cccnc1C(F)(F)F ZINC000618017776 FG Annotated Reactive CC1=Nc2ncnn2[C@@H](c2ccccc2F)/C1=C(\O)OC[C@@H]1CCCO1 ZINC000618019092 FG Annotated Anodyne CC1=Nc2ncnn2[C@H](c2ccccc2F)/C1=C(\O)OC[C@@H]1CCCO1 ZINC000618019093 FG Annotated Anodyne CC1=Nc2ncnn2[C@H](c2ccccc2F)/C1=C(\O)OC[C@H]1CCCO1 ZINC000618019094 FG Annotated Anodyne CC1=Nc2ncnn2[C@@H](c2ccccc2F)/C1=C(\O)OC[C@H]1CCCO1 ZINC000618019095 FG Annotated Anodyne O=C(O)[C@H]1Nc2c(cccc2S(=O)(=O)c2ccccc2)[C@H]2C=CC[C@H]12 ZINC000062241712 FG Annotated Clean O=C(O)[C@@H]1Nc2c(cccc2S(=O)(=O)c2ccccc2)[C@H]2C=CC[C@@H]21 ZINC000062241717 FG Annotated Clean O=C(O)[C@H]1Nc2c(cccc2S(=O)(=O)c2ccccc2)[C@H]2C=CC[C@@H]12 ZINC000062241721 FG Annotated Clean O=C(O)[C@@H]1Nc2c(cccc2S(=O)(=O)c2ccccc2)[C@H]2C=CC[C@H]21 ZINC000062241723 FG Annotated Clean C=CCN1CCN(c2c(Cl)cccc2NC(=O)c2cscn2)CC1 ZINC000062241907 FG Annotated Mild Cc1cccc(NC(=O)c2ccc(F)o2)c1N1CCC2(CC1)OCCO2 ZINC000062241949 FG Annotated Anodyne Cc1ccc(C(=O)Nc2cccc(C)c2N2CCC3(CC2)OCCO3)o1 ZINC000062241957 FG Annotated Anodyne Nc1ncccc1C(=O)O[C@@H](C(=O)NC1CCCCCC1)c1ccccc1 ZINC000621428615 FG Annotated Anodyne Nc1ncccc1C(=O)O[C@H](C(=O)NC1CCCCCC1)c1ccccc1 ZINC000621428616 FG Annotated Anodyne Cn1ccnc1SCc1cc(=O)n2c(-c3ccccc3)csc2n1 ZINC000621429899 FG Annotated Anodyne NC(=O)c1sc2cncc(N3CCC(Oc4ccccc4)CC3)c2c1N ZINC000621430208 FG Annotated Anodyne CCc1c(C)c(C#N)c2nc3ccc(N4CCOCC4)cc3n2c1OC ZINC000621431742 FG Annotated Mild Cn1nccc1NC(=O)c1cnn2c(C(F)F)cc(-c3ccccc3)nc12 ZINC000621431874 FG Annotated Anodyne O=C(Nc1ccccc1-c1nc[nH]n1)c1cc(F)cnc1N1CCCCC1 ZINC000621432742 FG Annotated Anodyne Cc1ccc(C(=O)Nc2ccccc2-c2nc[nH]n2)c(N2CCCCC2)n1 ZINC000621432757 FG Annotated Anodyne CO/C(O)=C1/C(C)=NC(=S)N[C@H]1c1ccc(OC)c(Br)c1 ZINC000621471881 FG Annotated Anodyne CO/C(O)=C1/C(C)=NC(=S)N[C@@H]1c1ccc(OC)c(Br)c1 ZINC000621471882 FG Annotated Anodyne CCO/C(O)=C1/C(C)=NC(=S)N[C@H]1c1cccc(OC)c1OCC ZINC000621474142 FG Annotated Anodyne CCO/C(O)=C1/C(C)=NC(=S)N[C@@H]1c1cccc(OC)c1OCC ZINC000621474143 FG Annotated Anodyne NC(=O)c1cncc(NC(=O)c2cc3c(s2)-c2ccccc2OC3)c1 ZINC000621476135 FG Annotated Anodyne COC(=O)c1cccc(N2Cc3cc(Br)ccc3CC2=O)c1 ZINC000621476524 FG Annotated Anodyne COC(=O)c1ccc(N2Cc3cc(Br)ccc3CC2=O)cc1 ZINC000621476526 FG Annotated Anodyne COC(=O)c1ccc(N2CCc3c(Br)cccc3C2=O)cc1 ZINC000621476566 FG Annotated Anodyne Cc1nc(-c2cccnc2)sc1C(=O)N(C1CC1)C1CCN(C)CC1 ZINC000621477777 FG Annotated Anodyne O=C(Nc1cccc(-n2cnnc2)c1)c1cc(C(F)(F)F)cc2nc[nH]c12 ZINC000621477785 FG Annotated Anodyne COc1nc(/C(=N/O)Sc2ccc(Cl)cc2)nc(N2CCCC2)n1 ZINC000621477850 FG Annotated Mild C=CS(=O)(=O)N(C)CCN(C)Cc1ccc(-c2ccc(Cl)cc2)o1 ZINC000621485915 FG Annotated Anodyne Oc1ncc(I)c2nc(-c3cccc(Cl)c3)cn12 ZINC000063298483 FG Annotated Anodyne CNC(=O)/C=C/c1cnc(N)c2c(-c3ccc4c(c3)OCO4)csc12 ZINC000063298489 FG Annotated Anodyne O=c1[nH]c2ccc(Br)cc2n1-c1cc(Cl)c(O)cc1O ZINC000063539329 FG Annotated Anodyne CC(C)(C)OC(=O)Cc1nc(-c2ccc(NS(C)(=O)=O)cc2)cs1 ZINC000063629840 FG Annotated Anodyne CC(C)Nc1cc(N2CCC(n3cc(C4CCCC4)nn3)CC2)ncn1 ZINC000063883719 FG Annotated Anodyne O=C(O)CCC1=C(c2ccccc2)NC(=S)N[C@@H]1c1ccccc1O ZINC000064252028 FG Annotated Clean COc1ccc([C@@H]2c3c(ccc4ccccc34)O[C@H]3N=CNC(=O)[C@@H]32)cc1 ZINC000064393129 FG Annotated Anodyne COc1ccc([C@H]2c3c(ccc4ccccc34)O[C@H]3N=CNC(=O)[C@H]23)cc1 ZINC000064393130 FG Annotated Anodyne COc1ccc([C@@H]2c3c(ccc4ccccc34)O[C@@H]3N=CNC(=O)[C@@H]32)cc1 ZINC000064393131 FG Annotated Anodyne COc1ccc([C@H]2c3c(ccc4ccccc34)O[C@@H]3N=CNC(=O)[C@@H]32)cc1 ZINC000064393132 FG Annotated Anodyne O=C1/C(=C/c2ccccc2[N+](=O)[O-])CNC/C1=C\c1ccccc1[N+](=O)[O-] ZINC000064403879 FG Annotated Mild NCCCCNCCCCNCCCC/N=C1/CCCc2ccccc2N1 ZINC000064436713 FG Annotated Mild CN1CCN(Cn2nc(C34CC5CC(CC(C5)C3)C4)sc2=S)CC1 ZINC000064446529 FG Annotated Anodyne COc1ccc([C@@H]2c3ccc4ccccc4c3O[C@H]3N=CNC(=O)[C@@H]32)cc1 ZINC000064446755 FG Annotated Anodyne COc1ccc([C@H]2c3ccc4ccccc4c3O[C@H]3N=CNC(=O)[C@H]23)cc1 ZINC000064446757 FG Annotated Anodyne COc1ccc([C@@H]2c3ccc4ccccc4c3O[C@@H]3N=CNC(=O)[C@@H]32)cc1 ZINC000064446759 FG Annotated Anodyne COc1ccc([C@H]2c3ccc4ccccc4c3O[C@@H]3N=CNC(=O)[C@@H]32)cc1 ZINC000064446761 FG Annotated Anodyne Nc1nnc2c3ccccc3c(Oc3ccc(Br)cc3)nn12 ZINC000064447077 FG Annotated Anodyne CC(C)Cc1ccc([C@@H](C)c2nn(CN3CCNCC3)c(=S)o2)cc1 ZINC000064448669 FG Annotated Anodyne CC(C)Cc1ccc([C@H](C)c2nn(CN3CCNCC3)c(=S)o2)cc1 ZINC000064448671 FG Annotated Anodyne COC(=O)/C(=C1/OC(=O)C(c2ccc(OC)cc2)=C1O)c1ccsc1 ZINC000064448801 FG Annotated Anodyne COc1ccc([C@@H]2c3ccc4cccnc4c3O[C@H]3NC(=O)NC(=N)[C@@H]32)cc1 ZINC000064453877 FG Annotated Anodyne COc1ccc([C@H]2c3ccc4cccnc4c3O[C@H]3NC(=O)NC(=N)[C@H]23)cc1 ZINC000064453878 FG Annotated Anodyne COc1ccc([C@@H]2c3ccc4cccnc4c3O[C@@H]3NC(=O)NC(=N)[C@@H]32)cc1 ZINC000064453880 FG Annotated Anodyne COc1ccc([C@H]2c3ccc4cccnc4c3O[C@@H]3NC(=O)NC(=N)[C@@H]32)cc1 ZINC000064453882 FG Annotated Anodyne O=S(=O)(Nc1cc(F)c(O)c(F)c1)c1ccc(N2CCCC2)cc1 ZINC000064454132 FG Annotated Clean O=S(=O)(c1ccc(Cl)s1)c1cn([C@@H]2CCNC2)c2ncccc12 ZINC000064479857 FG Annotated Anodyne O=S(=O)(c1ccc(Cl)s1)c1cn([C@H]2CCNC2)c2ncccc12 ZINC000064479858 FG Annotated Anodyne COC(=O)c1cc(NC(=O)/C=C\c2cccs2)ccc1N1CCOCC1 ZINC000064503355 FG Annotated Anodyne Cc1ccccc1Cn1cc(C(=O)C2=C(O)C(=O)OC2)c2c(O)cccc21 ZINC000064504082 FG Annotated Mild CCOc1cc(C(F)(F)F)nc(-c2ccc(NC(=O)CCl)cn2)n1 ZINC000064512199 FG Annotated Reactive O=C(Nc1ccc(-c2nc(O)cc(C(F)(F)F)n2)nc1)C(F)(F)Cl ZINC000064512579 FG Annotated Anodyne CC(C)N1CCN(C(=O)c2ccc3c(CN4CCCCC4)c[nH]c3c2)CC1 ZINC000064513012 FG Annotated Anodyne Fc1cc(F)cc(-c2cn(C[C@@H]3Cc4c([nH]c5ccccc45)CN3)nn2)c1 ZINC000064513636 FG Annotated Anodyne Cc1cccc(Cn2cc(C(=O)C3=C(O)C(=O)OC3)c3c(O)cccc32)c1 ZINC000064513886 FG Annotated Mild COC(=O)c1cc(NC/C=C/c2cccs2)ccc1N1CCOCC1 ZINC000064521181 FG Annotated Anodyne C=CCOc1cc(C(F)(F)F)nc(-c2ccc(NC(=O)CCl)cn2)n1 ZINC000064526868 FG Annotated Reactive O=C(CCC1=CCCN(CCCCc2ccc(Cl)cc2)C1=O)NO ZINC000064527358 FG Annotated Bother Cc1c(-c2ccccc2)c(N2CC[C@H](N(C)C)C2)c2oc(N)nc2c1C#N ZINC000064527539 FG Annotated Mild CC(C)N1CCN(Cc2c[nH]c3cc(C(=O)N4CCCCC4)ccc23)CC1 ZINC000064527732 FG Annotated Anodyne CC(C)N1CCN(C(=O)c2cccc3c(CN4CCCCC4)c[nH]c23)CC1 ZINC000064527869 FG Annotated Anodyne CC(C)(C)c1ccc(CCCN2CCC=C(CCC(=O)NO)C2=O)cc1 ZINC000064527882 FG Annotated Bother Cc1ccc(Cn2cc(C(=O)C3=C(O)C(=O)OC3)c3c(O)cccc32)cc1 ZINC000064528254 FG Annotated Mild CC(C)COC(=O)N[C@@H]1CCN(C(=O)OC2C3CC4CC(C3)CC2C4)C1 ZINC000064528416 FG Annotated Anodyne O=c1c2c(Nc3ccccc3)n[nH]c2ncn1-c1nc2ccccc2s1 ZINC000064532159 FG Annotated Anodyne CC(C)OC(=O)N[C@@H]1CCN(C(=O)OC2C3CC4CC(C3)CC2C4)C1 ZINC000064539117 FG Annotated Anodyne CCCOC(=O)N[C@@H]1CCN(C(=O)OC2C3CC4CC(C3)CC2C4)C1 ZINC000064539118 FG Annotated Anodyne O=C1Nc2c(C(F)(F)F)cccc2[C@]1(c1ccc(O)cc1)n1ccnc1 ZINC000064540595 FG Annotated Anodyne O=C1Nc2c(C(F)(F)F)cccc2[C@@]1(c1ccc(O)cc1)n1ccnc1 ZINC000064540596 FG Annotated Anodyne Cc1cc(CO[P@@](N)(=O)N(CCCl)CCCl)ccc1[N+](=O)[O-] ZINC000064548556 FG Annotated Reactive N[P@](=O)(OCc1ccc([N+](=O)[O-])c(F)c1)N(CCCl)CCCl ZINC000064548557 FG Annotated Reactive N[P@@](=O)(OCc1ccc([N+](=O)[O-])c(F)c1)N(CCCl)CCCl ZINC000064548558 FG Annotated Reactive N[P@](=O)(OCc1ccc([N+](=O)[O-])cc1F)N(CCCl)CCCl ZINC000064548559 FG Annotated Reactive N[P@@](=O)(OCc1ccc([N+](=O)[O-])cc1F)N(CCCl)CCCl ZINC000064548560 FG Annotated Reactive Cc1ccc(CNCC2(F)CCN(C(=O)c3cc(C)cs3)CC2)nc1 ZINC000064549190 FG Annotated Anodyne Cc1ccc(CNCC2(F)CCN(C(=O)c3ccc(F)s3)CC2)nc1 ZINC000064549285 FG Annotated Anodyne CN1CCC(N(c2nc3cc[nH]c(=O)c3c3cc(F)ccc23)C2CC2)CC1 ZINC000064549441 FG Annotated Bother C[C@]12CC[C@H]3C[C@@]3(C)C1=C(O)C(=O)c1c2c(O)c2oc(CO)cc2c1O ZINC000064549822 FG Annotated Mild C[C@@H]1Oc2c(O)c3c(c(O)c2[C@H]1O)C(=O)C(O)=C1C(C)(C)CCC[C@@]13C ZINC000064558999 FG Annotated Mild Cn1c(CSc2ccccc2)nc2c(CN3CCOCC3)c(O)ccc21 ZINC000064559134 FG Annotated Clean CNc1cc2c(cc1S(=O)(=O)Nc1ccc(C)c(C)c1)CCC(=O)N2 ZINC000064581748 FG Annotated Anodyne Cc1cc(=O)oc2cc(SC3=NS(=O)(=O)c4ccccc43)ccc12 ZINC000064587596 FG Annotated Anodyne O=C1CCCC2=C1C1(CCSCC1)N=C(Nc1nc3ccccc3o1)N2 ZINC000064593774 FG Annotated Mild O=C1CCCC2=C1[C@]1(CCSC1)N=C(Nc1nc3ccccc3o1)N2 ZINC000064622036 FG Annotated Mild O=C1CCCC2=C1[C@@]1(CCSC1)N=C(Nc1nc3ccccc3o1)N2 ZINC000064622038 FG Annotated Mild CN1CC[C@@]2([C@@]34CCN(C)[C@@H]3N(C)c3ccccc34)c3ccccc3N[C@@H]12 ZINC000064624404 FG Annotated Anodyne in-man COC(=O)c1ccc2c(c1)S(=O)(=O)N=C2Sc1cc(C)ccc1C ZINC000064664158 FG Annotated Anodyne Cc1ccc(NS(=O)(=O)c2cc3c(cc2N(C)C)NC(=O)CC3)cc1C ZINC000064693674 FG Annotated Anodyne CC(=O)c1ccc(-c2cn(C[C@@H]3Cc4c([nH]c5ccccc45)CN3)nn2)cc1 ZINC000064744329 FG Annotated Anodyne S=C1C[C@@H](NCc2ccccc2)C[C@@H]2[C@H]3CCCN4CCC[C@@H](CN12)[C@@H]34 ZINC000064750433 FG Annotated Anodyne C(=N/Nc1nnc(-c2nnc(N/N=C/c3ccccc3)o2)o1)\c1ccccc1 ZINC000006514365 FG Annotated Mild Cc1cc(C)cc(C(=O)c2c(C(C)C)c(=O)[nH]c(=O)n2CC2CC=CC2)c1 ZINC000006521897 FG Annotated Anodyne Cc1cc(C)cc(Sc2c(C)c(=O)[nH]c(=O)n2OCc2ccccc2)c1 ZINC000006521941 FG Annotated Anodyne Cc1csc2nc(CNS(=O)(=O)c3ccc4c(c3)CCCC4)cn12 ZINC000006529090 FG Annotated Anodyne CCc1nnc(S)n1/N=C/c1c[nH]c2ccc(Br)cc12 ZINC000006544026 FG Annotated Mild O=C(/C=C/c1ccc(C(F)(F)F)cc1)c1c(=O)o[nH][n+]1-c1ccccc1 ZINC000006575822 FG Annotated Mild C[C@H]1C(=O)[C@H](C)[C@H](c2ccc3c(c2)OCO3)N[C@@H]1c1ccc2c(c1)OCO2 ZINC000006576716 FG Annotated Anodyne C[C@H]1C(=O)[C@H](C)[C@H](c2ccc3c(c2)OCO3)N[C@H]1c1ccc2c(c1)OCO2 ZINC000006576718 FG Annotated Anodyne COc1ccc(NC(=O)CCCC2=NS(=O)(=O)c3ccccc3N2)cc1 ZINC000006577305 FG Annotated Anodyne aggregator O=S1(=O)Nc2ccc(Cl)cc2[C@](C#Cc2ccccc2)(C2CC2)N1 ZINC000006578452 FG Annotated Mild O=S1(=O)Nc2ccc(Cl)cc2[C@@](C#Cc2ccccc2)(C2CC2)N1 ZINC000006578461 FG Annotated Mild Clc1ncnc2c1nc(I)n2Cc1ccccc1 ZINC000006580993 FG Annotated Anodyne Nc1ccc(Cl)cc1S(=O)(=O)n1ccc([C@@H](O)c2ccccc2)c1 ZINC000006581882 FG Annotated Anodyne Nc1ccc(Cl)cc1S(=O)(=O)n1ccc([C@H](O)c2ccccc2)c1 ZINC000006582152 FG Annotated Anodyne CCOc1ccc2c(c1)=C(c1ccc(C)cc1)NN=C(c1ccc(C)cc1)N=2 ZINC000006601932 FG Annotated Anodyne CC[C@@H](C)c1ccccc1NC(=O)COc1ccc(-n2cnnn2)cc1 ZINC000006652341 FG Annotated Anodyne CC[C@H](C)c1ccccc1NC(=O)COc1ccc(-n2cnnn2)cc1 ZINC000006652347 FG Annotated Anodyne Cc1ccc(COC(=O)N2CC[C@@H](CNc3ncccn3)[C@H](F)C2)cc1 ZINC000006716891 FG Annotated Anodyne O=S1(=O)N=C(Nc2ccccc2Cl)Nc2c(O)cc(Cl)cc21 ZINC000006718557 FG Annotated Anodyne O=C(CCc1nc2cccnc2n1Cc1cccs1)NCc1ccco1 ZINC000006737774 FG Annotated Anodyne CCN(CC)CCNC(=O)c1cc2c(=O)[nH]c3ccc(C)cc3c2s1 ZINC000006738596 FG Annotated Anodyne CC1(COc2ccc(Cl)cc2NC(=O)Nc2cnc(C#N)cn2)COC1 ZINC000006745071 FG Annotated Mild O=C(NCc1cccs1)c1cccc2c1C(=O)N(Cc1cccnc1)C2 ZINC000006746011 FG Annotated Anodyne CCOc1ccccc1CNC(=O)c1oc2c(c1C)-c1[nH]ncc1CC2 ZINC000006748394 FG Annotated Anodyne COC(=O)c1ccc(-c2nc(O)c3c(n2)Oc2ccc(F)cc2C3)cc1 ZINC000006748545 FG Annotated Anodyne CCCN(CCC)C(=O)Cn1nc(CC)n2c(cc3sc(C)cc32)c1=O ZINC000006749425 FG Annotated Anodyne CCCc1cc(O)n2nc(NCc3ccc(Br)cc3)nc2n1 ZINC000006752700 FG Annotated Anodyne in-vitro CCCN1CCN(C(=O)c2cccc3c2C(=O)N(C2CCCCC2)C3)CC1 ZINC000006771311 FG Annotated Anodyne COc1ccc(N(C)C(=O)c2cc3c(=O)[nH]c4ccccc4c3n2C)cc1 ZINC000006771849 FG Annotated Anodyne COC(=O)c1ccccc1NC(=O)C1=C(C)C(=O)OC12CCC(C)CC2 ZINC000006772311 FG Annotated Anodyne CC[C@@H]1CCCCN1CCCNC(=O)C1=C(C)C(=O)OC12CCCCC2 ZINC000006772420 FG Annotated Anodyne CC[C@H]1CCCCN1CCCNC(=O)C1=C(C)C(=O)OC12CCCCC2 ZINC000006772421 FG Annotated Anodyne CC1=C(C(=O)N[C@@H](C)c2ccc3c(c2)OCCO3)C2(CCCCC2)OC1=O ZINC000006772450 FG Annotated Anodyne CC1=C(C(=O)N[C@H](C)c2ccc3c(c2)OCCO3)C2(CCCCC2)OC1=O ZINC000006772451 FG Annotated Anodyne O=c1c2ccccc2n2c(-c3cccnc3)nnc2n1Cc1ccc(F)cc1 ZINC000006781202 FG Annotated Anodyne O=C(CN1C(=O)c2ccccc2Sc2ncccc21)N1CCCCC1 ZINC000006796926 FG Annotated Anodyne CCc1nnc(NC2=NS(=O)(=O)C(c3ccc(Cl)cc3)=C2C)s1 ZINC000006797138 FG Annotated Anodyne C[C@@H](C(=O)NCCC1=CCCCC1)n1c(=O)c2cccn2c2cccnc21 ZINC000006797366 FG Annotated Anodyne C[C@H](C(=O)NCCC1=CCCCC1)n1c(=O)c2cccn2c2cccnc21 ZINC000006797368 FG Annotated Anodyne Cc1ccc2c(c1)N(C(=O)CCC(=O)NCc1ccccc1)C[C@H](C)O2 ZINC000006797888 FG Annotated Anodyne Cc1ccc2c(c1)N(C(=O)CCC(=O)NCc1ccccc1)C[C@@H](C)O2 ZINC000006797890 FG Annotated Anodyne Cc1ccc(CNC(=O)CCC(=O)N2C[C@H](C)Oc3ccccc32)cc1 ZINC000006798261 FG Annotated Anodyne Cc1ccc(CNC(=O)CCC(=O)N2C[C@@H](C)Oc3ccccc32)cc1 ZINC000006798263 FG Annotated Anodyne C[C@@H](CNC(=O)CCC(=O)N1CCOc2ccccc21)c1ccccc1 ZINC000006798470 FG Annotated Anodyne C[C@H](CNC(=O)CCC(=O)N1CCOc2ccccc21)c1ccccc1 ZINC000006798472 FG Annotated Anodyne Cc1cc(C)c2c(n1)SCC(=O)N2CC(=O)Nc1c(C)cccc1C ZINC000006802746 FG Annotated Anodyne Cc1cc(C)c2c(n1)SCC(=O)N2CC(=O)Nc1cc(F)ccc1F ZINC000006802820 FG Annotated Anodyne Cc1nc2c3ccccc3nc(N3CCN(c4ccccc4F)CC3)n2n1 ZINC000006803031 FG Annotated Anodyne Cc1ccc(C)c(N2CCN(C(=O)Cn3cc4c(n3)CCCCC4)CC2)c1 ZINC000006803061 FG Annotated Anodyne CCCCN(C1=N[C@@H]2CS(=O)(=O)C[C@@H]2S1)c1ccc(Cl)cc1 ZINC000006803591 FG Annotated Anodyne CCCCN(C1=N[C@H]2CS(=O)(=O)C[C@@H]2S1)c1ccc(Cl)cc1 ZINC000006803593 FG Annotated Anodyne CCCCN(C1=N[C@@H]2CS(=O)(=O)C[C@H]2S1)c1ccc(Cl)cc1 ZINC000006803595 FG Annotated Anodyne CCCCN(C1=N[C@H]2CS(=O)(=O)C[C@H]2S1)c1ccc(Cl)cc1 ZINC000006803597 FG Annotated Anodyne CC1=CC2=N[C@@](Cc3ccccc3)(NC(=O)c3ccccc3)C(=O)N2C=C1 ZINC000006806645 FG Annotated Anodyne CC1=CC2=N[C@](Cc3ccccc3)(NC(=O)c3ccccc3)C(=O)N2C=C1 ZINC000006806646 FG Annotated Anodyne CC1=CN2C(=O)[C@](Cc3ccccc3)(NC(=O)c3ccccc3)N=C2C=C1 ZINC000006806663 FG Annotated Anodyne CC1=CN2C(=O)[C@@](Cc3ccccc3)(NC(=O)c3ccccc3)N=C2C=C1 ZINC000006806664 FG Annotated Anodyne CC1=CC=CN2C(=O)[C@](Cc3ccccc3)(NC(=O)c3ccccc3)N=C12 ZINC000006806667 FG Annotated Anodyne CC1=CC=CN2C(=O)[C@@](Cc3ccccc3)(NC(=O)c3ccccc3)N=C12 ZINC000006806668 FG Annotated Anodyne COc1ccc(CN2C(=O)CC[C@@]2(C)C(=O)NC2CCC(C)CC2)cc1 ZINC000006818800 FG Annotated Anodyne COc1ccc(CN2C(=O)CC[C@]2(C)C(=O)NC2CCC(C)CC2)cc1 ZINC000006818802 FG Annotated Anodyne CCc1nn([C@@H](CC)C(=O)NC2CCCC2)c(=O)c2cc3oc(C)cc3n12 ZINC000006821519 FG Annotated Anodyne CCc1nn([C@H](CC)C(=O)NC2CCCC2)c(=O)c2cc3oc(C)cc3n12 ZINC000006821522 FG Annotated Anodyne CCc1nn([C@@H](CC)C(=O)NCCC(C)C)c(=O)c2cc3oc(C)cc3n12 ZINC000006821562 FG Annotated Anodyne CCc1nn([C@H](CC)C(=O)NCCC(C)C)c(=O)c2cc3oc(C)cc3n12 ZINC000006821567 FG Annotated Anodyne CCc1c(C)nc(-c2cccc(C(F)(F)F)c2)nc1N1CCNCC1 ZINC000006837956 FG Annotated Anodyne Cc1ccc2onc(CNC(=O)N3CCN(C4CCCCC4)CC3)c2c1 ZINC000006866086 FG Annotated Anodyne COC(=O)c1ccc(-c2ccco2)n1CC(=O)N1CCc2ccccc2C1 ZINC000006870570 FG Annotated Anodyne Cc1ccc2c(c1)N(CC(=O)N1CCC(C)CC1)C(=O)c1cccnc1O2 ZINC000006878088 FG Annotated Anodyne CCN(c1cccc(C)c1)S(=O)(=O)c1ccc2c(c1)NC(=O)CS2 ZINC000006892696 FG Annotated Anodyne O=c1cc(CSc2nncn3c2cc2sccc23)nc2ccccn12 ZINC000006893759 FG Annotated Anodyne Cc1nnc(SCC(=O)NCc2ccco2)c2cc3sccc3n12 ZINC000006893826 FG Annotated Anodyne CC[C@H](Sc1nncn2c1cc1occc12)C(=O)NCc1ccco1 ZINC000006893980 FG Annotated Anodyne CC[C@@H](Sc1nncn2c1cc1occc12)C(=O)NCc1ccco1 ZINC000006893981 FG Annotated Anodyne CCCNC(=O)c1ccc(C[S@@](=O)c2ccc(Br)cc2)o1 ZINC000006895508 FG Annotated Anodyne CCCNC(=O)c1ccc(C[S@](=O)c2ccc(Br)cc2)o1 ZINC000006895509 FG Annotated Anodyne O=S1(=O)CC/C(=N\Nc2ccc(C(F)(F)F)cn2)c2cc(F)ccc21 ZINC000006896454 FG Annotated Mild CCc1nc(SC)ncc1C(=O)N1CCN(c2cc(C)ccc2C)CC1 ZINC000006900305 FG Annotated Anodyne CCOCCCNC(=O)Cc1ccc(-n2c(CC)nc3cccnc32)cc1 ZINC000006900933 FG Annotated Anodyne COc1cccc2c1Oc1ncccc1N(C(=O)CCC(=O)NC(C)C)C2 ZINC000006902138 FG Annotated Anodyne Cc1nn(C)c2c1c(-c1ccccc1)cc(=O)n2Cc1ccc2nonc2c1 ZINC000006917807 FG Annotated Anodyne Cc1ccc(S(=O)(=O)CC(=O)c2cc3cccc(C)c3oc2=O)cc1 ZINC000006918026 FG Annotated Anodyne CCOCCCNC(=O)c1oc2ccc3c(c2c1C)[C@H](O)CC(C)(C)O3 ZINC000006940631 FG Annotated Anodyne CCOCCCNC(=O)c1oc2ccc3c(c2c1C)[C@@H](O)CC(C)(C)O3 ZINC000006940635 FG Annotated Anodyne O=c1cc(-c2ccc3c(c2)OCCO3)[nH]c2c(-c3ccc(F)cc3)cnn12 ZINC000653630349 FG Annotated Anodyne CCc1coc(-c2cnn3c(=O)cc(-c4ccc5c(cnn5CC)c4)[nH]c23)n1 ZINC000653633833 FG Annotated Anodyne CCc1nn2c(=O)cc(-c3ccc4nn[nH]c4c3)[nH]c2c1-c1ccccc1 ZINC000653662276 FG Annotated Anodyne O=C(N[C@@H]1CC[C@@H](O)CC1)c1ccc(O)c2nc(-c3cccs3)[nH]c12 ZINC000653662922 FG Annotated Anodyne Cc1ccccc1-c1nnc2ccc(-c3cccc(C(=O)NCCO)c3)cn12 ZINC000653663455 FG Annotated Anodyne c1nc(-c2nnc3ccc(-c4ccc(N5CCOCC5)cc4)cn23)cs1 ZINC000653663483 FG Annotated Anodyne COc1cc(Cl)ccc1-c1cc(=O)n2ncc(-c3ccccn3)c2[nH]1 ZINC000653663531 FG Annotated Anodyne Cc1nn2c(=O)cc(-c3ccc4c(c3C)OCO4)[nH]c2c1-c1ccccn1 ZINC000653663970 FG Annotated Anodyne O=[N+]([O-])c1cc(C2=NN/C(=N/Cc3ccco3)SC2)ccc1Cl ZINC000653663975 FG Annotated Mild Nc1ncc(-c2cc(N3CC[C@@H](F)C3)nc(C3CC3)n2)cc1OC(F)F ZINC000653664382 FG Annotated Anodyne CN(C)c1ccc(-c2cnc3cnc(-c4cccc(C(N)=O)c4)cn23)cc1 ZINC000653664703 FG Annotated Anodyne CCc1noc2cc(-c3cc(=O)n4ncc(-c5ncc(C)o5)c4[nH]3)ccc12 ZINC000653664890 FG Annotated Anodyne Cc1coc2ccc(-c3cc(=O)n4nc(N)c(-c5ccccn5)c4[nH]3)cc12 ZINC000653665234 FG Annotated Anodyne CCn1ncc2cc(-c3cc(=O)n4nc(-c5ccc(F)cc5)[nH]c4n3)ccc21 ZINC000653666148 FG Annotated Anodyne O=c1cc(-c2ccc3nn[nH]c3c2)[nH]c2c(-c3ccc(Cl)cc3)cnn12 ZINC000653667433 FG Annotated Anodyne CS(=O)(=O)Nc1cccc(-c2cn3c(-c4cccs4)cnc3cn2)c1 ZINC000653667546 FG Annotated Anodyne Nc1nn2c(=O)cc(-c3ccc(C(F)(F)F)cc3)[nH]c2c1-c1ccccn1 ZINC000653668342 FG Annotated Anodyne Cc1cc2cc(-c3cc(=O)n4nc(N)c(-c5ccccn5)c4[nH]3)ccc2o1 ZINC000653668349 FG Annotated Anodyne N[C@@H]1CCC[C@H](NC(=O)c2ccc(O)c3[nH]c([C@H]4C[C@H]5CC[C@H]4C5)nc23)C1 ZINC000653670302 FG Annotated Anodyne N[C@@H]1CCC[C@@H](NC(=O)c2ccc(O)c3[nH]c([C@H]4C[C@H]5CC[C@H]4C5)nc23)C1 ZINC000653670303 FG Annotated Anodyne N[C@@H]1CCC[C@H](NC(=O)c2ccc(O)c3[nH]c([C@@H]4C[C@H]5CC[C@H]4C5)nc23)C1 ZINC000653670304 FG Annotated Anodyne N[C@@H]1CCC[C@@H](NC(=O)c2ccc(O)c3[nH]c([C@@H]4C[C@H]5CC[C@H]4C5)nc23)C1 ZINC000653670305 FG Annotated Anodyne Cc1nccn1-c1cc(-c2cnc(N)c(OC(F)F)c2)nc(C2CC2)n1 ZINC000653671209 FG Annotated Anodyne CCc1nn2c(=O)cc(-c3ccc4n[nH]cc4c3)[nH]c2c1-c1ccccn1 ZINC000653671925 FG Annotated Anodyne O=c1cc(-c2ccc(-c3ncco3)cc2)[nH]c2c(-c3ccccn3)cnn12 ZINC000653677634 FG Annotated Anodyne CCn1cc(-c2cc(-c3cnc(N)c(OC(F)F)c3)nc(C3CC3)n2)cn1 ZINC000653678266 FG Annotated Anodyne O=C(Nc1cnc2cnc(-c3cnn(Cc4ccccc4)c3)cn12)C1CCC1 ZINC000653678273 FG Annotated Anodyne Nc1nn2c(=O)cc(-c3ccc(Cl)cc3F)[nH]c2c1-c1ccccn1 ZINC000653679917 FG Annotated Anodyne NC[C@@H]1CC[C@@H](CNC(=O)c2ccnc3nc(-c4cccs4)[nH]c23)CC1 ZINC000653680406 FG Annotated Anodyne CS(=O)(=O)c1ccc(-c2cnc3ccc(Cc4ccccc4)nn23)cc1 ZINC000653681024 FG Annotated Anodyne O=c1cc(-c2ccc3c(c2)OC(F)(F)O3)[nH]c2c(-c3ccccn3)cnn12 ZINC000653681686 FG Annotated Anodyne C[C@@H]1CCc2cc(-c3nccn3C)ccc2N1C(=O)c1ccc(O)cc1O ZINC000653682150 FG Annotated Anodyne C[C@H]1CCc2cc(-c3nccn3C)ccc2N1C(=O)c1ccc(O)cc1O ZINC000653682151 FG Annotated Anodyne C[C@@H]1CCc2cc(-c3ccnn3C)ccc2N1C(=O)c1ccc(O)cc1O ZINC000653682163 FG Annotated Anodyne C[C@H]1CCc2cc(-c3ccnn3C)ccc2N1C(=O)c1ccc(O)cc1O ZINC000653682164 FG Annotated Anodyne Nc1ncc(-c2cc(N3CC[C@H](F)C3)nc(C3CC3)n2)cc1OC(F)F ZINC000653682402 FG Annotated Anodyne CCc1nn2c(=O)cc(-c3ccc4c(cnn4C)c3)[nH]c2c1-c1ccccn1 ZINC000653684246 FG Annotated Anodyne O=c1cc(-c2ccc3n[nH]cc3c2)nc2[nH]c(-c3ccc(Cl)cc3)nn12 ZINC000653684279 FG Annotated Anodyne COc1cc2c(cc1OC)-c1cc3cc(=O)c(OC)c(OC)c-3cn1CC2 ZINC000653687120 FG Annotated Anodyne Nc1nc(C(=O)NCc2cccc3cccnc23)c2cccc(Cl)c2n1 ZINC000653687469 FG Annotated Anodyne COc1ccc([C@@H]2CC(=O)c3c(cc(O)c(CNC(C)C)c3O)O2)cc1O ZINC000653689031 FG Annotated Clean N=C(NOC(=O)Nc1ccccc1C(F)(F)F)c1ccc2nonc2c1 ZINC000653692097 FG Annotated Mild COc1cc(/C(=N/O)c2nc(-c3ccc(C)cc3)no2)cc(OC)c1OC ZINC000653692098 FG Annotated Mild Cc1ocnc1C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1F ZINC000653693411 FG Annotated Anodyne C[C@H](Cc1nc(=O)c2cnc(-c3ccccc3Cl)n2[nH]1)C(F)(F)F ZINC000653693925 FG Annotated Anodyne CCO/C(C)=N/n1c(C)nc2c(oc3nc(C(F)(F)F)ccc32)c1=O ZINC000653697835 FG Annotated Mild CCOC(=O)C1=C(C)N2CC/C(=C\c3ccc(OC)cc3)C(=O)N=C2S1 ZINC000653699591 FG Annotated Anodyne O=C(Cc1c[nH]c2ccccc12)N1CCN(c2noc3ccccc23)CC1 ZINC000653704601 FG Annotated Anodyne O/N=C/c1cn(Cc2cn(-c3ccc(Cl)cc3)nn2)c2ncccc12 ZINC000653704645 FG Annotated Mild COc1ccc(-c2cc(C(=O)NCCCCCCS)n[nH]2)cc1OC ZINC000653705307 FG Annotated Mild CC1(C)OCc2c(Nc3n[nH]c(Cl)c3Cl)nc(-c3cn[nH]c3)nc21 ZINC000653705994 FG Annotated Anodyne Nc1c(-c2ccc(Cl)cc2)n[nH]c1C(=O)N/N=C/c1ccc(F)cc1 ZINC000653706702 FG Annotated Reactive CC1(C)OCc2c(Nc3n[nH]c4ccc(F)cc34)nc(-c3cn[nH]c3)nc21 ZINC000653707414 FG Annotated Anodyne CC1(C)OCc2c(Nc3n[nH]c4cc(F)ccc34)nc(-c3cn[nH]c3)nc21 ZINC000653707422 FG Annotated Anodyne CC1(C)OCc2c(Nc3n[nH]c4c(F)cccc34)nc(-c3cn[nH]c3)nc21 ZINC000653707433 FG Annotated Anodyne CC1(C)OCc2c(Nc3n[nH]c4cccc(F)c34)nc(-c3cn[nH]c3)nc21 ZINC000653707453 FG Annotated Anodyne Fc1ccc2c(CN3CCO[C@H](COc4cccc(F)n4)C3)c[nH]c2c1 ZINC000653708479 FG Annotated Anodyne CCOC(=O)c1[nH]c2ccc(Cl)cc2c1/C=N\NC(=O)c1ccncc1 ZINC000653708679 FG Annotated Reactive S=C(NCc1cccnc1)SCCc1noc(-c2ccccc2)n1 ZINC000653709065 FG Annotated Clean O/N=C/c1cn(Cc2cn(-c3ccc(F)c(Cl)c3)nn2)c2ncccc12 ZINC000653709171 FG Annotated Mild COc1ccc2cc(CCCn3nnnc3-c3ccccc3)oc(=O)c2c1 ZINC000653709179 FG Annotated Anodyne NC(=O)c1nnc2c3ccccc3c(Oc3ccc(Cl)cc3Cl)nn12 ZINC000653709676 FG Annotated Anodyne COc1cc(C(=O)c2c[nH]c3cccc(OC)c23)c(N)c(OC)c1OC ZINC000653711365 FG Annotated Anodyne C[C@]12CC[C@H]3[C@@H](CC=C4C=C(c5nn[nH]n5)CC[C@@]43C)[C@@H]1CCC(=O)N2 ZINC000653712864 FG Annotated Anodyne CCOC(=O)c1cc2c(s1)C(=O)c1c(Br)cccc1C2=O ZINC000653712991 FG Annotated Clean CN(c1nc(-c2cn[nH]c2)nc2c1COC2(C)C)c1n[nH]c2ccccc12 ZINC000653713014 FG Annotated Anodyne CCOc1ccc2nnnc(Nc3cccc(OC(F)(F)F)c3)c2n1 ZINC000653713039 FG Annotated Anodyne S=C(NCc1cccnc1)SCCc1nnc(-c2ccccc2)o1 ZINC000653713056 FG Annotated Clean COc1cc(C(=O)c2c[nH]c3c(OC)cccc23)c(N)c(OC)c1OC ZINC000653713183 FG Annotated Anodyne CCC(=O)SCCCCCCNC(=O)c1cc(-c2ccncc2)[nH]n1 ZINC000653714159 FG Annotated Anodyne CCCCn1c(N)c(-c2nc3ccccc3[nH]2)c2nc(C#N)c(C#N)nc21 ZINC000653714213 FG Annotated Mild Cc1ccccc1CNc1cc(-c2nccs2)nc(NCCC(=O)O)n1 ZINC000653714280 FG Annotated Anodyne CCCCCNc1nc(N)nc2c1cc(-c1ccc(F)cc1)c(=O)n2C ZINC000653715020 FG Annotated Anodyne Nc1c(C(=O)N/N=C/c2ccc(F)cc2)oc2nc(C(F)(F)F)ccc12 ZINC000653715970 FG Annotated Reactive O=c1c2oc3nc(C(F)(F)F)ccc3c2ncn1/N=C/c1ccccc1 ZINC000653715971 FG Annotated Mild O/N=C/c1cn(Cc2cn(-c3ccccc3Cl)nn2)c2ncccc12 ZINC000653717147 FG Annotated Mild COc1cc([C@@H]2/C(=C\c3ccc(O)c(O)c3)C(=O)c3cccn32)ccc1O ZINC000653717420 FG Annotated Mild COc1cc([C@H]2/C(=C\c3ccc(O)c(O)c3)C(=O)c3cccn32)ccc1O ZINC000653717421 FG Annotated Mild CC(=O)c1c(C(F)(F)F)[n+](=O)c2cc(F)c(N3CCCCC3)cc2n1O ZINC000653717496 FG Annotated Anodyne Cc1ccc(-c2c(C(=O)CF)n(CCCO)c3ncnc(N(C)C)c23)cc1 ZINC000653717504 FG Annotated Anodyne CCNS(=O)(=O)c1ccc(NC2CCCC2)c(NCc2ccncc2)c1 ZINC000653717555 FG Annotated Anodyne O=C(O)c1ccnc(-c2cc(NCc3cccc4c3OCO4)ccc2O)c1 ZINC000653719546 FG Annotated Anodyne Cc1ccn2c(C(=O)NCCCC(=O)OCc3ccccc3)c(C)nc2c1 ZINC000653719881 FG Annotated Anodyne C=C1CC[C@H]2[C@@](C)(NC(N)=O)CCC[C@]2(C)[C@H]1CC[C@H](C)CNC(N)=O ZINC000653720447 FG Annotated Mild COc1cc(-c2cc(CO)c3c(OC)c(OC)c(OC)cc3n2)ccc1O ZINC000653721424 FG Annotated Anodyne COc1ccc(-c2cc(CO)c3c(OC)c(OC)c(OC)cc3n2)cc1 ZINC000653721448 FG Annotated Anodyne O=C(O)CSc1nnc(NC(=S)Nc2cccc(Cl)c2)s1 ZINC000653723519 FG Annotated Anodyne O=C(O)CSc1nnc(NC(=S)Nc2ccc(Cl)cc2)s1 ZINC000653724719 FG Annotated Anodyne Cc1ccc2c(c1)[n+](=O)c(C(=O)/C=C/c1ccc([N+](=O)[O-])s1)c(C)n2O ZINC000653725387 FG Annotated Mild O=C(Nc1ccc2c(/C=N/c3cccnc3)n[nH]c2c1)Nc1nncs1 ZINC000653725588 FG Annotated Mild CCC(=O)Nc1ccc2nc(N3CCNCC3)nc(-c3ccccc3)c2c1 ZINC000653725607 FG Annotated Anodyne CNS(=O)(=O)c1ccc(NC2CCCCC2)c(NCc2ccncc2)c1 ZINC000653726168 FG Annotated Anodyne COc1cc2nc(-c3ccc(O)cc3O)cc(C(=O)O)c2c(OC)c1OC ZINC000653729340 FG Annotated Anodyne Cc1nn(C(=O)c2[nH]nc(-c3ccc(Cl)cc3)c2N)c(C)c1Cl ZINC000653730435 FG Annotated Anodyne CCOC(=O)CO/N=C1\C[C@H](C)C[C@@H]2O/C(=C\CC(C)C)[C@](C)(O)[C@H]12 ZINC000653732488 FG Annotated Mild CCOC(=O)[C@@H](COC(=O)c1ccccc1OC(C)=O)c1ccc(F)cc1 ZINC000653733803 FG Annotated Anodyne CCOC(=O)[C@H](COC(=O)c1ccccc1OC(C)=O)c1ccc(F)cc1 ZINC000653733804 FG Annotated Anodyne O=C(Nc1ccc2c(/C=N/c3ccccn3)n[nH]c2c1)Nc1nncs1 ZINC000653737720 FG Annotated Mild Cc1ncc(NC(=O)c2cccc([C@@H]3C[C@H]3NC3CCOCC3)c2)s1 ZINC000653737731 FG Annotated Anodyne COc1c(O)ccc2c1[C@H](O)N(C)c1c-2ccc2cc3c(cc12)OCO3 ZINC000653737747 FG Annotated Anodyne COc1c(O)ccc2c1[C@@H](O)N(C)c1c-2ccc2cc3c(cc12)OCO3 ZINC000653737748 FG Annotated Anodyne Cn1cc(-c2ccc(Cc3n[nH]c4ccc(N5CCOCC5)cc34)cc2)cn1 ZINC000653742693 FG Annotated Anodyne O=c1c2cccnc2ncn1Cc1noc(/C=C/c2ccc(Cl)cc2)n1 ZINC000653746588 FG Annotated Anodyne C[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1C(=O)N[C@@H]1N(O)C(=O)c1ccccc1 ZINC000653746720 FG Annotated Reactive COc1cc(OC)c2c(=O)n(Cc3ccc(OC)c(OC)c3)ccc2c1 ZINC000653748820 FG Annotated Anodyne CC(C)(C)n1nnc2c1CC[C@@H](c1nc(Cc3ccc(F)cc3)no1)C2 ZINC000653751509 FG Annotated Anodyne CC(C)(C)n1nnc2c1CC[C@H](c1nc(Cc3ccc(F)cc3)no1)C2 ZINC000653751510 FG Annotated Anodyne CN(C)CCCN=c1nc(-c2[nH]c3ccccc3c2C=O)[nH]c2ccccc12 ZINC000653751715 FG Annotated Anodyne CN(C)c1ccc(-c2noc([C@H]3CCc4c(nnn4C(C)(C)C)C3)n2)cc1 ZINC000653753005 FG Annotated Anodyne CN(C)c1ccc(-c2noc([C@@H]3CCc4c(nnn4C(C)(C)C)C3)n2)cc1 ZINC000653753010 FG Annotated Anodyne COc1cc(/C(=N/O)c2noc(-c3ccc(C)cc3)n2)cc(OC)c1OC ZINC000653755997 FG Annotated Mild CCNC(=O)Nc1cn(-c2ncccn2)c2cc(-c3cccnc3)cnc12 ZINC000653757115 FG Annotated Anodyne CS(=O)(=O)Nc1cccc(-c2ccc3nnc(-c4ccccc4)n3c2)c1 ZINC000653758385 FG Annotated Anodyne CCNC(=O)Nc1cn(-c2ncc(C)cn2)c2cc(-c3cccnc3)cnc12 ZINC000653760730 FG Annotated Anodyne CCNC(=O)Nc1cn(-c2nccc(C)n2)c2cc(-c3cccnc3)cnc12 ZINC000653760735 FG Annotated Anodyne COC(=O)CSc1c(F)c(F)c2cc(C(=O)OC)sc2c1F ZINC000653760830 FG Annotated Anodyne C[C@@]12CCC[C@]3(COC1=O)C1=C(C=C[C@@H]23)C(=O)C=C(O[Si](C)(C)C)C1=O ZINC000653762408 FG Annotated Reactive c1cc(-c2nnc3ccc(-c4ccc(N5CCOCC5)cc4)cn23)ccn1 ZINC000653763894 FG Annotated Anodyne Nc1nc(N)nc(-c2ccc(Oc3ccc(Br)cc3)cc2)n1 ZINC000653766389 FG Annotated Anodyne O=C(c1ccc(F)cc1)c1c(C(F)(F)F)[n+](=O)c2ccc(F)cc2n1O ZINC000653766975 FG Annotated Anodyne O=C(O)[C@H]1CC=CC[C@H]1c1c2ccc(=O)c(O)c-2oc2cc(O)ccc12 ZINC000653769208 FG Annotated Bother O=C(O)[C@@H]1CC=CC[C@@H]1c1c2ccc(=O)c(O)c-2oc2cc(O)ccc12 ZINC000653769209 FG Annotated Bother O=C(O)[C@H]1CC=CC[C@@H]1c1c2ccc(=O)c(O)c-2oc2cc(O)ccc12 ZINC000653769210 FG Annotated Bother O=C(O)[C@@H]1CC=CC[C@H]1c1c2ccc(=O)c(O)c-2oc2cc(O)ccc12 ZINC000653769211 FG Annotated Bother COc1cc(Cn2ccc3cccc(OC)c3c2=O)cc(OC)c1OC ZINC000653771347 FG Annotated Anodyne COc1cc(/C(=N/O)c2nc(-c3ccsc3)no2)cc(OC)c1OC ZINC000653774534 FG Annotated Mild COc1cc(/C(=N/O)c2nc(-c3cccs3)no2)cc(OC)c1OC ZINC000653774565 FG Annotated Mild Cc1cc(C)cc(S(=O)(=O)N2[C@H](CO)CC[C@@H]2c2ccc(F)cc2)c1 ZINC000653777938 FG Annotated Anodyne Cc1nc2sc3ccccc3n2c1C(=O)NNC(=O)C1CCCCC1 ZINC000653782494 FG Annotated Reactive CC(C)N1C(=O)CN(Cc2ccc(-c3ccc(CC(=O)O)cc3)cc2)C1=O ZINC000653783615 FG Annotated Anodyne C[C@H](NC(=O)c1nc(N)nc2c(F)cccc12)c1cccc2cccnc12 ZINC000653784917 FG Annotated Anodyne COC(=O)c1cc2c(s1)C(=O)c1c(Br)cccc1C2=O ZINC000653784938 FG Annotated Clean COC[C@@H](C)n1cc(C(=O)C(=O)Nc2ccc(OC)nc2)c2ccccc21 ZINC000653785898 FG Annotated Anodyne COC[C@H](C)n1cc(C(=O)C(=O)Nc2ccc(OC)nc2)c2ccccc21 ZINC000653785899 FG Annotated Anodyne O=C(Nc1cccc(Br)n1)c1nc(Br)cs1 ZINC000653786027 FG Annotated Anodyne CC(=O)c1cc(-c2cccc3nccn23)c2cc(N3CCN(C)CC3)ccn12 ZINC000653786054 FG Annotated Anodyne CC(=O)c1cc(-c2ncc(C)cc2F)c2cc(N3CCOCC3)ccn12 ZINC000653786117 FG Annotated Anodyne O=C(OCC12CC3CC(CC(C3)C1)C2)c1cc(N(O)[C@@H]2CCCO2)on1 ZINC000653787236 FG Annotated Anodyne O=C(OCC12CC3CC(CC(C3)C1)C2)c1cc(N(O)[C@H]2CCCO2)on1 ZINC000653787239 FG Annotated Anodyne COC[C@H]1CN(c2ccc(-n3cc(-c4ccccn4)cn3)c(F)c2)C(=O)O1 ZINC000653787281 FG Annotated Anodyne COc1cc2c(cc1O)C(=O)/C(=C/c1ccc(OC)c(OC)c1OC)C2 ZINC000653787763 FG Annotated Mild O=C1CSc2ccccc2N1Cc1cn(Cc2ccc(F)cc2)nn1 ZINC000653787997 FG Annotated Anodyne CC(=O)Nc1nc(Cl)c(-c2c(F)cccc2F)n(CC(C)C)c1=O ZINC000653788037 FG Annotated Anodyne CC[C@H](C)Cn1c(-c2c(F)cccc2F)c(Cl)nc(C(=O)NC)c1=O ZINC000653788052 FG Annotated Anodyne O=C(NCCCCc1ccc([N+](=O)[O-])cc1)n1c(=O)oc2ccccc21 ZINC000653790219 FG Annotated Bother COc1ccc2c(c1)c(C(=O)C(=O)Nc1ccc(OC)nc1)cn2C(C)C ZINC000653790373 FG Annotated Anodyne COc1ccc(NC(=O)C(=O)c2cn(C(C)C)c3cccc(OC)c23)cn1 ZINC000653790389 FG Annotated Anodyne COc1ccc2c(C(=O)C(=O)Nc3ccc(OC)nc3)cn(C(C)C)c2c1 ZINC000653790491 FG Annotated Anodyne CC(C)c1nc(C(=O)NC[C@H]2[C@@H]3CN(CC(C)(C)F)C[C@H]23)c2ccccn12 ZINC000653790510 FG Annotated Anodyne COc1ccc(NC(=O)C(=O)c2cn(C(C)C)c3c(OC)cccc23)cn1 ZINC000653791979 FG Annotated Anodyne C/C(=N\N=C1/SCC(=O)N1Cc1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000653792855 FG Annotated Mild C/C(=N\N=C1/SCC(=O)N1Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000653792878 FG Annotated Mild CC(C)c1nc(C(=O)NC[C@H]2[C@@H]3CN(CC4CCC4)C[C@H]23)c2ccccn12 ZINC000653792956 FG Annotated Anodyne Cc1nc2ccccc2n1CC(=O)N1CC[C@]2(C)c3ccccc3N(C)[C@@H]12 ZINC000653793697 FG Annotated Anodyne Cc1nc2ccccc2n1CC(=O)N1CC[C@]2(C)c3ccccc3N(C)[C@H]12 ZINC000653793698 FG Annotated Anodyne Cc1nc2ccccc2n1CC(=O)N1CC[C@@]2(C)c3ccccc3N(C)[C@@H]12 ZINC000653793699 FG Annotated Anodyne Cc1nc2ccccc2n1CC(=O)N1CC[C@@]2(C)c3ccccc3N(C)[C@H]12 ZINC000653793700 FG Annotated Anodyne C[C@@H](NC(=O)c1nc(N)nc2c(F)cccc12)c1cccc2cccnc12 ZINC000653793975 FG Annotated Anodyne CCCN(CCC)c1ccc2nc3c(C(=O)OC)cc(=O)c(O)c-3oc2c1 ZINC000653794535 FG Annotated Bother Cc1cc(=O)oc2c1ccc1oc(=N)c(C(=O)NCc3ccccc3)cc12 ZINC000653795185 FG Annotated Bother C=CCn1c(-c2c(F)cc(F)cc2F)c(Cl)nc(-n2cccn2)c1=O ZINC000653795235 FG Annotated Mild COc1ccc(-c2nc(N)n(-c3ncnc4cc(Cl)ccc34)n2)cc1 ZINC000653795310 FG Annotated Anodyne O=C(NCCCCc1ccccc1)n1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000653795399 FG Annotated Bother CCCCOC(=O)c1cc(=O)c(O)c2oc3cc(N(C)C)ccc3nc1-2 ZINC000653795828 FG Annotated Bother N=C(N)Nc1ccc(CNc2c(-c3cccnc3)nc3ccccn23)cc1 ZINC000653796424 FG Annotated Anodyne CCCOc1nccc2c(-c3cnc(-c4ccc(CO)nc4)s3)[nH]nc12 ZINC000653799883 FG Annotated Anodyne Nc1nc(O)c2[nH]cc(C(=O)c3c(Cl)cc(Cl)cc3Cl)c2n1 ZINC000653801612 FG Annotated Anodyne O=C1N/C(=C\c2ccc(O)cc2)C(=O)N1c1ccc(Br)cc1 ZINC000653802194 FG Annotated Anodyne O=C1N/C(=C\c2ccc(O)cc2)C(=O)N1c1cccc(Br)c1 ZINC000653802220 FG Annotated Anodyne Cc1ccc(C(=O)NNC(=O)c2c(C)nc3sc4ccccc4n23)cc1 ZINC000653802234 FG Annotated Reactive C#CCNC(=O)c1cc2c(cc1OC)[C@@]1(C)CC[C@H](O)C(C)(C)[C@@H]1CC2 ZINC000653804909 FG Annotated Mild COc1cccc(-c2cc(C(C)=O)n3ccc(N4CCOCC4)cc23)n1 ZINC000653804994 FG Annotated Anodyne CO[C@@]1(C(C)C)C=C2C(=O)C[C@@H]3C(C)(C)[C@H](O)CC[C@@]3(C)[C@@H]2C[C@H]1O ZINC000653808151 FG Annotated Mild NS(=O)(=O)c1ccc(N2N=C(c3ccco3)C[C@H]2c2cccs2)cc1 ZINC000653810120 FG Annotated Anodyne NS(=O)(=O)c1ccc(N2N=C(c3ccco3)C[C@@H]2c2cccs2)cc1 ZINC000653810121 FG Annotated Anodyne C[C@@H]1OC[C@@]2(C)[C@H]3CC[C@@]4(CO4)[C@@H](/C=C/C4=CCOC4=O)[C@]3(C)CC[C@H]2O1 ZINC000653811101 FG Annotated Anodyne C[C@]1(O)C[C@](c2ccc(OC(F)(F)F)cc2)([C@H](O)c2ccccn2)C1 ZINC000653816305 FG Annotated Anodyne C[C@]1(O)C[C@@](c2ccc(OC(F)(F)F)cc2)([C@@H](O)c2ccccn2)C1 ZINC000653816311 FG Annotated Anodyne C[C@]1(O)C[C@](c2cccc(OC(F)(F)F)c2)([C@H](O)c2ccccn2)C1 ZINC000653816313 FG Annotated Anodyne Cc1nn(-c2ccccc2)c2nc(CNc3ccccc3)n(CC#N)c(=O)c12 ZINC000653819610 FG Annotated Mild OC[C@@H]1CCCN1c1ncnc2sc(Nc3c(F)cccc3F)nc12 ZINC000653821003 FG Annotated Anodyne CCc1ccccc1NC(=O)CSc1nc(-c2ccc(O)cc2)n[nH]1 ZINC000653821070 FG Annotated Anodyne CN1C(=S)N(c2cccc(Cl)c2)C(=O)/C1=C/c1ccc(O)cc1O ZINC000653822834 FG Annotated Anodyne C[C@]1(O)C[C@@](c2ccc(OC(F)(F)F)cc2)([C@H](O)c2ccccn2)C1 ZINC000653823125 FG Annotated Anodyne C[C@]1(O)C[C@@](c2cccc(OC(F)(F)F)c2)([C@H](O)c2ccccn2)C1 ZINC000653823126 FG Annotated Anodyne Clc1ccc(C2=Nn3c(nnc3-c3n[nH]c4c3CCC4)SC2)s1 ZINC000653823152 FG Annotated Anodyne CC(C)(C)OC(=O)NCCC[C@H]1N=C2C[C@H]3C[C@H](C3(C)C)[C@@]2(C)OC1=O ZINC000653825280 FG Annotated Anodyne Cc1c(C(=O)CSc2nc3ccccc3o2)[n+](=O)c2ccccc2n1O ZINC000653826087 FG Annotated Anodyne CCc1ccccc1NC(=O)CSc1n[nH]c(-c2ccccc2N)n1 ZINC000653826112 FG Annotated Anodyne COc1ccc(SCC(=O)c2c(C)n(O)c3ccccc3[n+]2=O)cc1 ZINC000653826116 FG Annotated Anodyne Nc1ccccc1-c1nc(SCC(=O)Nc2ccccc2Cl)n[nH]1 ZINC000653831306 FG Annotated Anodyne CC(C)(C)OC(=O)NCCC[C@@H]1N=C2C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)OC1=O ZINC000653831345 FG Annotated Anodyne O=c1oc2ccc(Cl)cc2c(=O)n1-c1ccc(Br)cc1F ZINC000653831361 FG Annotated Anodyne Cc1ncccc1NC(=O)NC(=O)CSc1nc2ccccc2nc1C ZINC000653833439 FG Annotated Anodyne Cc1ccc(NC(=O)NC(=O)CSc2nc3ccccc3nc2C)cn1 ZINC000653833446 FG Annotated Anodyne Cc1ccncc1NC(=O)NC(=O)CSc1nc2ccccc2nc1C ZINC000653833449 FG Annotated Anodyne C[C@@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000653834564 FG Annotated Bother C[C@H]1CN(C(=O)OC(C)(C)C)CCN1C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000653834565 FG Annotated Bother Cn1cc(-c2ccc(-c3cncc4ccc(N5CCNC5=O)nc34)cc2)cn1 ZINC000653834580 FG Annotated Anodyne CCc1ccc(N2C(=O)/C(=C/c3cccc(O)c3O)N(C)C2=S)cc1 ZINC000653834970 FG Annotated Clean O=c1oc2ccc(Br)cc2c(=O)n1-c1ccc(Cl)cc1F ZINC000653834981 FG Annotated Anodyne O=C1C=CC(=O)C(c2cc(-c3ccc(C(=O)N4CCCCC4)s3)on2)=C1 ZINC000653835454 FG Annotated Mild Oc1nc(-c2cc(-c3ccsn3)n(Cc3ccccc3F)n2)ncc1F ZINC000653835871 FG Annotated Anodyne O=C(O)Cc1cc(CC(=O)O)cc(-c2ccc(Br)s2)c1 ZINC000653837586 FG Annotated Anodyne Cc1cccnc1NC(=O)NC(=O)CSc1nc2ccccc2nc1C ZINC000653837906 FG Annotated Anodyne Cc1nc2ccccc2nc1SCC(=O)NC(=O)N(C)c1ccccc1 ZINC000653837918 FG Annotated Anodyne Cc1ccc(NC(=O)NC(=O)CSc2nc3ccccc3nc2C)nc1 ZINC000653838530 FG Annotated Anodyne CN1C(=S)N(c2ccc3c(c2)CCC3)C(=O)/C1=C/c1cccc(O)c1O ZINC000653840611 FG Annotated Clean CCc1ccc(N2C(=O)/C(=C/c3ccc(O)cc3O)N(C)C2=S)cc1 ZINC000653840634 FG Annotated Anodyne CN1C(=S)N(c2cccc(Cl)c2)C(=O)/C1=C/c1cccc(O)c1O ZINC000653840647 FG Annotated Clean FC(F)(c1ccc2ncccc2c1)c1nnc2ncc(-c3ccco3)nn12 ZINC000653842788 FG Annotated Anodyne CCc1ccc(N2C(=O)N(C3CC3)[C@@]3(OC(=O)c4ccccc43)C2=O)cc1 ZINC000653845406 FG Annotated Anodyne CCc1ccc(N2C(=O)N(C3CC3)[C@]3(OC(=O)c4ccccc43)C2=O)cc1 ZINC000653845407 FG Annotated Anodyne CCN(Cc1cc(=O)n2c(C(C)=O)c(C)sc2n1)c1ccc(F)cc1 ZINC000653845438 FG Annotated Anodyne CCCN1C(=O)N(c2ccccc2CC)C(=O)[C@]12OC(=O)c1ccccc12 ZINC000653847633 FG Annotated Anodyne CCCN1C(=O)N(c2ccccc2CC)C(=O)[C@@]12OC(=O)c1ccccc12 ZINC000653847634 FG Annotated Anodyne O=C1O[C@]2(C(=O)N(c3ccc(Cl)cc3)C(=O)N2C2CC2)c2ccccc21 ZINC000653847639 FG Annotated Anodyne O=C1O[C@@]2(C(=O)N(c3ccc(Cl)cc3)C(=O)N2C2CC2)c2ccccc21 ZINC000653847640 FG Annotated Anodyne CN1CCN(CCOc2nn(-c3ccccc3F)c3ccc(F)cc23)C1=O ZINC000653848727 FG Annotated Anodyne O=C1OCCN1CCOc1nn(-c2ccccc2F)c2ccc(F)cc12 ZINC000653848761 FG Annotated Anodyne CC(C)CN1c2cc(-n3c(O)nc4ncccc43)ccc2C(=O)NC1(C)C ZINC000653850804 FG Annotated Anodyne CO[C@]12C(=O)C[C@@H]3[C@](C)(CCC[C@@]3(C)C(=O)O)[C@H]1CC[C@@]1(C(C)C)O[C@H]12 ZINC000653850849 FG Annotated Anodyne CCN(Cc1cc(=O)n2c([C@@H](C)O)c(C)sc2n1)c1ccc(F)cc1 ZINC000653851001 FG Annotated Anodyne CCN(Cc1cc(=O)n2c([C@H](C)O)c(C)sc2n1)c1ccc(F)cc1 ZINC000653851002 FG Annotated Anodyne CCCN1C(=O)N(c2ccc(CC)cc2)C(=O)[C@]12OC(=O)c1ccccc12 ZINC000653851553 FG Annotated Anodyne CCCN1C(=O)N(c2ccc(CC)cc2)C(=O)[C@@]12OC(=O)c1ccccc12 ZINC000653851554 FG Annotated Anodyne CO[C@H]1C(=O)C2=C[C@@](O)(C(C)C)CC[C@@H]2[C@@]2(C)CCC[C@@](C)(C(=O)O)[C@H]12 ZINC000653851676 FG Annotated Mild C[C@H](OCn1c(COCc2ccccc2)cc(O)nc1=O)c1ccccc1 ZINC000653852819 FG Annotated Anodyne C[C@@H](OCn1c(COCc2ccccc2)cc(O)nc1=O)c1ccccc1 ZINC000653852820 FG Annotated Anodyne Oc1nccn1CCOc1nn(-c2ccccc2F)c2ccc(F)cc12 ZINC000653852839 FG Annotated Anodyne COc1cc(-c2cn(C)c(=O)c3ccccc23)c(OC)cc1CN(C)C ZINC000653857509 FG Annotated Anodyne O=C1C(O)=C([C@H](NCc2ccco2)c2ccccn2)C(=O)c2ccccc21 ZINC000653857526 FG Annotated Mild O=C1C(O)=C([C@@H](NCc2ccco2)c2ccccn2)C(=O)c2ccccc21 ZINC000653857527 FG Annotated Mild C[C@@H]1CC(=O)Nc2cccc(C(=O)N[C@H]3CCOc4ccccc43)c2N1 ZINC000653857961 FG Annotated Anodyne C[C@@H]1CC(=O)Nc2cccc(C(=O)N[C@@H]3CCOc4ccccc43)c2N1 ZINC000653857962 FG Annotated Anodyne N#CN/C(=N/CCSc1ccccc1)N[C@H]1CC[C@@H](c2cnc[nH]2)CC1 ZINC000653859705 FG Annotated Mild C[C@H](c1ccc2nc(O)sc2c1)c1ccn(-c2ccc(CCO)cn2)n1 ZINC000653861769 FG Annotated Anodyne C[C@@H](c1ccc2nc(O)sc2c1)c1ccn(-c2ccc(CCO)cn2)n1 ZINC000653861770 FG Annotated Anodyne N#CN/C(=N/CCSc1ccccc1)N[C@@H]1CC[C@@H](c2cnc[nH]2)CC1 ZINC000653861881 FG Annotated Mild O=C1C(O)=C([C@@H](NCCCCl)c2ccccn2)C(=O)c2ccccc21 ZINC000653864020 FG Annotated Reactive O=C1C(O)=C([C@H](NCCCCl)c2ccccn2)C(=O)c2ccccc21 ZINC000653864021 FG Annotated Reactive CCn1cc(-c2csc(N)n2)c(=O)c2cc(F)c(N3CCCC3)cc21 ZINC000653866672 FG Annotated Anodyne Cc1ccc(C(=O)N2CC(=O)N(C3CCCCC3)C(=O)C23CCCC3)cc1 ZINC000653871542 FG Annotated Anodyne N#CN/C(=N/CCSc1ccccc1)NC[C@@H]1CC[C@@H](c2cnc[nH]2)C1 ZINC000653871624 FG Annotated Mild N#CN/C(=N/CCSc1ccccc1)NC[C@H]1CC[C@@H](c2cnc[nH]2)C1 ZINC000653871633 FG Annotated Mild O=C1CN(C(=O)c2ccccc2)C2(CCCC2)C(=O)N1C1CCCCC1 ZINC000653871785 FG Annotated Anodyne O=C(/C=C/N1CCc2c(ncn2Cc2ccccc2)C1)c1ccccc1O ZINC000653876622 FG Annotated Mild COc1cc(-c2cn(C)c(=O)c3ccccc23)cc(OC)c1CN(C)C ZINC000653878518 FG Annotated Anodyne COC(=O)Nc1cc(Br)c(Br)cc1C(=O)OC ZINC000653887869 FG Annotated Anodyne NC(=O)c1cncc(OCc2cccc(NC(=O)C3=CCCCC3)c2)c1 ZINC000653888018 FG Annotated Anodyne O=S(=O)(Oc1cc(CSc2ccccn2)[nH]n1)c1ccc(F)cc1 ZINC000653889446 FG Annotated Anodyne Cc1ccc(S(=O)(=O)Oc2cc(CSc3ccccn3)[nH]n2)cc1 ZINC000653889475 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCN(/C=C/C(=O)c2ccccc2O)C2(CC2)C1 ZINC000653899285 FG Annotated Mild C[C@H]1C[C@@H](C)CN(CCCCOc2ccc(=O)n(-c3ccccc3)n2)C1 ZINC000653901680 FG Annotated Anodyne C[C@@H]1C[C@@H](C)CN(CCCCOc2ccc(=O)n(-c3ccccc3)n2)C1 ZINC000653901681 FG Annotated Anodyne C[C@H]1C[C@H](C)CN(CCCCOc2ccc(=O)n(-c3ccccc3)n2)C1 ZINC000653901682 FG Annotated Anodyne COC(=O)[C@@]1(C)CC[C@H]2[C@@H](CC[C@@H]3C[C@H](OS(=O)(=O)O)CC[C@]23C)C1 ZINC000653903319 FG Annotated Anodyne COc1cccc([C@]2(OCC(F)(F)F)SC=C(C)n3c2noc3=O)c1 ZINC000653905305 FG Annotated Anodyne COc1cccc([C@@]2(OCC(F)(F)F)SC=C(C)n3c2noc3=O)c1 ZINC000653905307 FG Annotated Anodyne Cc1nc(-c2ccccc2)ccc1C(=O)N/N=C1\C(=O)N(C)c2ccccc21 ZINC000653905710 FG Annotated Reactive CC(=O)OCCCn1c(/C=C/c2ccc(C#N)cc2)nc2ccccc2c1=O ZINC000653914351 FG Annotated Mild CCOC(=O)[C@@H]1[C@@H]2C=C[C@@H](C2)[C@@]12C(=O)Nc1ccc(OC(F)(F)F)cc12 ZINC000653915668 FG Annotated Anodyne CCOC(=O)[C@H]1[C@@H]2C=C[C@@H](C2)[C@]12C(=O)Nc1ccc(OC(F)(F)F)cc12 ZINC000653915670 FG Annotated Anodyne N#CN/C(=N/CCSc1ccccc1)NC[C@@H]1CC[C@H](c2cnc[nH]2)C1 ZINC000653916386 FG Annotated Mild N#CN/C(=N/CCSc1ccccc1)NC[C@H]1CC[C@H](c2cnc[nH]2)C1 ZINC000653916387 FG Annotated Mild COc1cc2[nH]cc(Cc3cc(OC)c(OC)c(OC)c3N)c2cc1OC ZINC000653918564 FG Annotated Anodyne O=C1Nc2nc(Nc3ccccc3)nc(O)c2C[C@@H]1c1c(F)cccc1F ZINC000653918595 FG Annotated Anodyne O=C1Nc2nc(Nc3ccccc3)nc(O)c2C[C@H]1c1c(F)cccc1F ZINC000653918596 FG Annotated Anodyne CCCC(=O)OCCCNC(=S)Nc1cc(OC)c(Cl)cc1OC ZINC000066073846 FG Annotated Anodyne O/N=C1\NCc2cc(Nc3c(-c4ncccn4)oc4cnccc34)ccc21 ZINC000066075021 FG Annotated Mild N[C@H](Cc1cc(F)ccc1F)C1CCN([C@@H]2CCC[C@H](C(=O)O)C2)CC1 ZINC000066075814 FG Annotated Anodyne N[C@H](Cc1cc(F)ccc1F)C1CCN([C@H]2CCC[C@H](C(=O)O)C2)CC1 ZINC000066075816 FG Annotated Anodyne N[C@H](Cc1cc(F)ccc1F)C1CCN([C@@H]2CCC[C@@H](C(=O)O)C2)CC1 ZINC000066075818 FG Annotated Anodyne N[C@H](Cc1cc(F)ccc1F)C1CCN([C@H]2CCC[C@@H](C(=O)O)C2)CC1 ZINC000066075820 FG Annotated Anodyne Cc1ccc(-n2c(S)nnc2N2N=C(c3ccccc3)CCC2=O)cc1 ZINC000066076478 FG Annotated Anodyne CCCOC(=O)CCCNC(=S)Nc1cc(OC)c(Cl)cc1OC ZINC000066077181 FG Annotated Anodyne O=C1C[C@H](OCc2ccccc2)C[C@@H]2[C@H]3CCCN4CCC[C@@H](CN12)[C@@H]34 ZINC000066078296 FG Annotated Anodyne O=C1C[C@@H](OCc2ccccc2)C[C@@H]2[C@H]3CCCN4CCC[C@@H](CN12)[C@@H]34 ZINC000066078297 FG Annotated Anodyne O=C1c2ccc(C#Cc3ccccc3)cc2C(=O)N1CCc1ccncc1 ZINC000066079580 FG Annotated Mild CCOC(=O)c1c(N)oc2c1c(Br)c(O)c1ncccc12 ZINC000066097201 FG Annotated Anodyne O=C(O)c1cc(CN2CCc3c(Cl)cccc3C2)c2ccccn2c1=O ZINC000066097806 FG Annotated Anodyne CNc1nn2c(C)cc(C)nc2c1S(=O)(=O)c1ccc(F)c(Cl)c1 ZINC000066098171 FG Annotated Anodyne Cc1c(CC(=O)O)c2ccsc2n1Cc1ccc(S(C)(=O)=O)cc1 ZINC000066098459 FG Annotated Anodyne CC1(C)CCc2c(O)c(C(=O)CC(=O)c3ccccc3)c(O)c(C=O)c2O1 ZINC000066098811 FG Annotated Anodyne CCOC(=O)CSc1nc(-n2nc(C)cc2C)c2c(c1C#N)CCCC2 ZINC000066099104 FG Annotated Mild CC(/C=C/C(=O)O)=C\[C@H](C)S(=O)(=O)c1ccc(Br)cc1 ZINC000066100940 FG Annotated Anodyne CC(/C=C/C(=O)O)=C\[C@@H](C)S(=O)(=O)c1ccc(Br)cc1 ZINC000066100942 FG Annotated Anodyne Nc1nc(-c2ccc(P(=O)(O)O)o2)c(-c2ccc(Cl)cc2)s1 ZINC000066101017 FG Annotated Anodyne CSc1ccc(OCc2nc(Br)c([N+](=O)[O-])n2C)cc1 ZINC000066101510 FG Annotated Bother O=C1c2cccc3c2c(nn3Cc2ccccc2)CN1[C@H]1CN2CCC1CC2 ZINC000066101780 FG Annotated Anodyne O=C1CCCN1Cc1ccc(-n2nc(C(F)(F)F)c3c2COCC3)cc1 ZINC000066101800 FG Annotated Anodyne CN(C)S(=O)(=O)c1ccc(-n2nc(C(F)(F)F)c3c2CCCC3)cc1 ZINC000066102510 FG Annotated Anodyne CC(C)Cc1sc(Br)nc1-c1ccc(P(=O)(O)O)o1 ZINC000066102762 FG Annotated Anodyne Cc1ccc(C2=NN(c3nnc(S)n3-c3ccccc3)C(=O)CC2)cc1 ZINC000066102973 FG Annotated Anodyne Nc1nc(-c2cc(P(=O)(O)O)ccc2F)c(-c2ccccc2)s1 ZINC000066103236 FG Annotated Anodyne CC1=C[C@@H](O)[C@]2(C[C@H]3C(C)=CC[C@H]4[C@](C)(CO)CCC[C@]34C)O[C@@H]2C1=O ZINC000066103884 FG Annotated Mild CCN1CCC(n2cc(-c3nnc(-c4cccc(Cl)c4)o3)nn2)CC1 ZINC000066105152 FG Annotated Anodyne CN(C)C(=O)Cc1ccc(-n2nc(C(F)(F)F)c3c2CCCC3)cc1 ZINC000066112239 FG Annotated Anodyne CC(/C=C/C(=O)NO)=C\[C@H](C)S(=O)(=O)c1ccc(Cl)c(Cl)c1 ZINC000066112326 FG Annotated Bother CC(/C=C/C(=O)NO)=C\[C@@H](C)S(=O)(=O)c1ccc(Cl)c(Cl)c1 ZINC000066112327 FG Annotated Bother O=C1CCCN1Cc1ccc(-n2nc(C(F)(F)F)c3c2CCOC3)cc1 ZINC000066113012 FG Annotated Anodyne CSc1ccc(-c2sc(N)nc2-c2ccc(P(=O)(O)O)o2)cc1 ZINC000066113398 FG Annotated Anodyne O=C1CCCC2=C1[C@@H](c1cccs1)[C@@H](NC(=O)c1ccccc1)C(=O)O2 ZINC000066113704 FG Annotated Mild O=C1CCCC2=C1[C@@H](c1cccs1)[C@H](NC(=O)c1ccccc1)C(=O)O2 ZINC000066113707 FG Annotated Mild O=C1CCCC2=C1[C@H](c1cccs1)[C@@H](NC(=O)c1ccccc1)C(=O)O2 ZINC000066113710 FG Annotated Mild O=C1CCCC2=C1[C@H](c1cccs1)[C@H](NC(=O)c1ccccc1)C(=O)O2 ZINC000066113713 FG Annotated Mild C#CCO[C@@H](CCC)C1=C(Br)/C(=C/Br)OC1=O ZINC000066114034 FG Annotated Mild C#CCO[C@H](CCC)C1=C(Br)/C(=C/Br)OC1=O ZINC000066114037 FG Annotated Mild CCCCc1nc2c(c3c1C[C@@H](C)OC3)CN(C(=O)c1cccnc1)CC2 ZINC000066123554 FG Annotated Anodyne CCc1cc(C(=O)N[C@@H]2CCCc3c2cnn3-c2ccccc2F)no1 ZINC000066129063 FG Annotated Anodyne CCc1cc(C(=O)N[C@H]2CCCc3c2cnn3-c2ccccc2F)no1 ZINC000066129065 FG Annotated Anodyne COC(=O)[C@]12Cc3ccccc3[C@H]1C[C@@H](C)[C@@H](C)N2C(=O)C(F)(F)F ZINC000066129283 FG Annotated Anodyne COC(=O)[C@]12Cc3ccccc3[C@@H]1C[C@@H](C)[C@@H](C)N2C(=O)C(F)(F)F ZINC000066129286 FG Annotated Anodyne COC(=O)[C@]12Cc3ccccc3[C@@H]1C[C@H](C)[C@@H](C)N2C(=O)C(F)(F)F ZINC000066129288 FG Annotated Anodyne COC1=C[C@H](C(=O)NCc2ccccn2)[C@H](C)[C@H](c2ccccc2)CC1=O ZINC000066138213 FG Annotated Mild COC1=C[C@H](C(=O)NCc2ccccn2)[C@@H](C)[C@H](c2ccccc2)CC1=O ZINC000066138217 FG Annotated Mild COC1=C[C@H](C(=O)NCc2ccccn2)[C@@H](C)[C@@H](c2ccccc2)CC1=O ZINC000066138220 FG Annotated Mild COc1cc(CO[C@@H]2C=C[C@H](c3ccccc3)O[C@@H]2CO)cc(OC)c1 ZINC000066138725 FG Annotated Anodyne COc1cc(CO[C@H]2C=C[C@H](c3ccccc3)O[C@@H]2CO)cc(OC)c1 ZINC000066138728 FG Annotated Anodyne COc1cc(CO[C@@H]2C=C[C@@H](c3ccccc3)O[C@@H]2CO)cc(OC)c1 ZINC000066138731 FG Annotated Anodyne O=C1CCCC2=C1[C@@H](c1cccnc1)N=C(Nc1nc3ccccc3o1)N2 ZINC000066147909 FG Annotated Mild O=C1CCCC2=C1[C@H](c1cccnc1)N=C(Nc1nc3ccccc3o1)N2 ZINC000066147916 FG Annotated Mild COCCN1C(=O)N[C@H](c2ccc(Br)cc2)C(C(C)=O)=C1C ZINC000066148905 FG Annotated Mild O=C1CCCC2=C1[C@@H](c1ccncc1)N=C(Nc1nc3ccccc3o1)N2 ZINC000066157057 FG Annotated Mild O=C1CCCC2=C1[C@H](c1ccncc1)N=C(Nc1nc3ccccc3o1)N2 ZINC000066157058 FG Annotated Mild O=[N+]([O-])c1ccc(O[C@H]2CCc3ccccc3[C@@H]2n2ccnn2)c(F)c1 ZINC000066166788 FG Annotated Bother CCN1C(NCC(C)C)=N[C@@H](CCc2ccccc2)[C@@H](C(=O)OC)[C@@H]1C ZINC000066166900 FG Annotated Anodyne CCN1C(NCC(C)C)=N[C@@H](CCc2ccccc2)[C@H](C(=O)OC)[C@@H]1C ZINC000066166901 FG Annotated Anodyne COc1cc(CCN[C@H](C)COc2c(C)cc(C#N)cc2C)ccc1O ZINC000066166937 FG Annotated Mild COc1cc(CCN[C@@H](C)COc2c(C)cc(C#N)cc2C)ccc1O ZINC000066166938 FG Annotated Mild COc1ccc(CCN[C@H](C)COc2c(C)cc(C#N)cc2C)cc1O ZINC000066167046 FG Annotated Mild COc1ccc(CCN[C@@H](C)COc2c(C)cc(C#N)cc2C)cc1O ZINC000066167047 FG Annotated Mild COc1ccc(-c2c(CO)c(CO)c3n2Cc2ccccc2C3)cc1OC ZINC000066251130 FG Annotated Anodyne O=C(O)[C@@H]1CS[C@H](c2cn(-c3ccccc3)nc2-c2ccccc2)N1 ZINC000066251179 FG Annotated Anodyne O=C(O)[C@@H]1CS[C@@H](c2cn(-c3ccccc3)nc2-c2ccccc2)N1 ZINC000066251180 FG Annotated Anodyne C=CCn1c(=O)c2cc(OC)c(OC)cc2c2c(=O)[nH]c3ccccc3c21 ZINC000066251773 FG Annotated Mild CC(C)(C)N(CCc1ccccc1)C(=O)COC(=O)c1ccc([N+](=O)[O-])o1 ZINC000066251842 FG Annotated Bother CO[C@@H]1CC=C2NN(c3ccc(C)cc3)C(=O)C[C@]2(c2ccccc2)O1 ZINC000066251899 FG Annotated Anodyne O=C1OC[C@H](Cc2ccc3c(c2)OCO3)[C@H]1[C@@H](O)c1ccccc1Cl ZINC000066252460 FG Annotated Anodyne O=C1OC[C@H](Cc2ccc3c(c2)OCO3)[C@H]1[C@H](O)c1ccccc1Cl ZINC000066252835 FG Annotated Anodyne COc1ccc(-c2cc(CO)n(C[C@H](O)c3ccc(Cl)cc3)n2)cc1 ZINC000066258873 FG Annotated Anodyne COc1ccc(-c2cc(CO)n(C[C@@H](O)c3ccc(Cl)cc3)n2)cc1 ZINC000066258874 FG Annotated Anodyne COc1ccc([C@H](O)Cn2nc(-c3ccc(Cl)cc3)cc2CO)cc1 ZINC000066259073 FG Annotated Anodyne COc1ccc([C@@H](O)Cn2nc(-c3ccc(Cl)cc3)cc2CO)cc1 ZINC000066259074 FG Annotated Anodyne COc1ccc(N2NC3=CC[C@@H](OC)O[C@@]3(c3ccccc3)CC2=O)cc1 ZINC000066259162 FG Annotated Anodyne COc1ccc([C@@H]2CC(=O)N2c2cc(OC)c(OC)c(OC)c2)cc1OC ZINC000066259191 FG Annotated Anodyne COc1ccc([C@H]2CC(=O)N2c2cc(OC)c(OC)c(OC)c2)cc1OC ZINC000066259192 FG Annotated Anodyne COc1ccc([C@H]2[C@@H](C)C(=O)N2c2cc(OC)c(OC)c(OC)c2)cc1 ZINC000066259673 FG Annotated Anodyne COc1ccc([C@H]2[C@H](C)C(=O)N2c2cc(OC)c(OC)c(OC)c2)cc1 ZINC000066259674 FG Annotated Anodyne COc1ccc([C@@H]2[C@@H](C)C(=O)N2c2cc(OC)c(OC)c(OC)c2)cc1 ZINC000066259675 FG Annotated Anodyne COc1ccc([C@@H]2[C@H](C)C(=O)N2c2cc(OC)c(OC)c(OC)c2)cc1 ZINC000066259676 FG Annotated Anodyne C/C=C(/C)C(=O)OCc1c(C(C)=O)c(O)c(OC)c2c1[C@@H](C)[C@@H](O)C=C2 ZINC000066259867 FG Annotated Anodyne O=c1[nH]c(CCn2cnc3ccccc32)nc2sc3c(c12)CCCC3 ZINC000066261907 FG Annotated Anodyne COC(=O)c1cc(-c2ccc(N)cc2)c2c(=O)n(-c3ccccc3)[nH]c2c1 ZINC000066263024 FG Annotated Anodyne Cc1ncc(CN2CC[C@]3(CCCN(Cc4ccc(F)cc4)C3)C2)cn1 ZINC000067654182 FG Annotated Anodyne Cc1ncc(CN2CC[C@@]3(CCCN(Cc4ccc(F)cc4)C3)C2)cn1 ZINC000067654183 FG Annotated Anodyne F[C@H]1CNCC[C@H]1Oc1cccc2ccc(-c3nnc4ccccn34)nc12 ZINC000068198067 FG Annotated Anodyne CO/C=C/C(=O)c1cc2c3c(c(N)cc(NC(=O)CC(C)C)c3n1)N=C2 ZINC000068198668 FG Annotated Mild CCCOc1ccc([C@@H]2C(=O)NC(=O)N2c2ccc3nc[nH]c3c2)cc1 ZINC000068200375 FG Annotated Anodyne CCCOc1ccc([C@H]2C(=O)NC(=O)N2c2ccc3nc[nH]c3c2)cc1 ZINC000068200376 FG Annotated Anodyne O=c1ccn(-c2ccncc2)nc1-c1ccnn1-c1ccnc2ccccc12 ZINC000068245690 FG Annotated Anodyne COc1ccc(-c2nn3c(-c4ccc(C#N)nc4)cnc3s2)cc1OC ZINC000068247391 FG Annotated Mild C[C@]1(COCc2ccc(OC(F)(F)F)cc2)Cn2cc([N+](=O)[O-])nc2O1 ZINC000068248631 FG Annotated Anodyne C[C@@]1(COCc2ccc(OC(F)(F)F)cc2)Cn2cc([N+](=O)[O-])nc2O1 ZINC000068248633 FG Annotated Anodyne COCCOc1ccc(-c2c(C)nc3c(-c4ccncc4)ccnn23)cn1 ZINC000068268149 FG Annotated Anodyne COc1ccc(N2C(=N)C(=S)N(c3ccc(OC)cc3OC)C2=O)cc1 ZINC000069061649 FG Annotated Anodyne COc1cc2c(c(OC)c1OC)C(=O)c1c(cc(C)c(C)c1OC)C2=O ZINC000069482124 FG Annotated Clean in-vitro biogenic CN1CCCC[C@H]1c1c(O)cc2oc(C3=CC[C@@H](O)C=C3)cc(=O)c2c1O ZINC000069482286 FG Annotated Clean in-vitro biogenic COc1cc(O)c2c(c1)C(=O)c1cc(OC)c(CC=C(C)C)c(O)c1C2=O ZINC000069482539 FG Annotated Clean in-vitro biogenic CCOC(=O)c1c(S(=O)(=O)N(CC(C)C)CC(C)C)c(C)n(C)c1C ZINC000007002769 FG Annotated Anodyne COc1ccc(-c2cc(C)no2)cc1S(=O)(=O)NCc1cccc(C)c1 ZINC000007005461 FG Annotated Anodyne Cc1ccccc1-c1n[nH]c(SCc2cc(=O)n3ccsc3n2)n1 ZINC000007007179 FG Annotated Anodyne C[C@H]1[C@@H]2CC[C@@H](C)[C@@H]2C(=O)O[C@H]1O[C@@H]1OC(=O)[C@@H]2[C@@H](C)CC[C@@H]2[C@H]1C ZINC000070454209 FG Annotated Anodyne in-vitro biogenic COc1c(C(C)C)cc(O)c2c1CC[C@@]1(O)C3=C(CC[C@@]21C)C(=O)OC3 ZINC000070454212 FG Annotated Anodyne in-vitro biogenic Cc1cc(O)c2c(c1)C(=O)C(c1c(C)cc(O)c3c1C(=O)C=CC3=O)=CC2=O ZINC000070454227 FG Annotated Mild in-vitro biogenic C/C=C1\CN2CCc3c4c[cH-]ccc-4nc3[C@@H]2C[C@@H]1/C(=C\OC)C(=O)OC ZINC000070455504 FG Annotated Anodyne in-vitro biogenic C=C[C@H]1CN2CCc3c(nc4cccc[c-]34)[C@H]2C[C@@H]1/C(=C\OC)C(=O)OC ZINC000070455506 FG Annotated Mild in-vitro biogenic COc1ccc(N/N=C2\CCNC(=O)c3[nH]c4ccc(Cl)cc4c32)cn1 ZINC000070460234 FG Annotated Mild O=C1NCC/C(=N\Nc2ccc(Cl)cn2)c2c1[nH]c1ccc(F)cc21 ZINC000070460245 FG Annotated Mild O=C1NCC/C(=N\Nc2cccnc2Cl)c2c1[nH]c1ccc(F)cc21 ZINC000070460253 FG Annotated Mild CCCc1cc(=O)oc2c(C(=O)N3CCCCC3)c(OC)cc(OC)c12 ZINC000070463289 FG Annotated Anodyne CCCCNc1nc(N2CCCC[C@@H]2CCO)nc2c1NCN2C(C)C ZINC000070719315 FG Annotated Anodyne CCCCNc1nc(N2CCCC[C@H]2CCO)nc2c1NCN2C(C)C ZINC000070719318 FG Annotated Anodyne Cc1cc(C(=O)N2CCC[C@H](CN3CCC(C(F)(F)F)CC3)C2)no1 ZINC000070725306 FG Annotated Anodyne Cc1cc(C(=O)N2CCC[C@@H](CN3CCC(C(F)(F)F)CC3)C2)no1 ZINC000070725308 FG Annotated Anodyne COc1ccc(N2C(=O)N(Cc3ccccc3)C(=N)C2=S)c(OC)c1 ZINC000071281020 FG Annotated Anodyne COc1ccc(OC)c(-c2cccc3c(N)c(C(=O)NC(C)C)nnc23)c1 ZINC000071281231 FG Annotated Anodyne C/C=C1/CN2[C@H]3C[C@@]45C(=Nc6c(OC)cc(OC)cc64)OC[C@H]3[C@H]1C[C@H]25 ZINC000071281389 FG Annotated Anodyne NC1=N[C@H](c2ccccc2)NC(NCCCSc2ccc(Cl)cc2)=N1 ZINC000071282249 FG Annotated Anodyne NC1=N[C@@H](c2ccccc2)NC(NCCCSc2ccc(Cl)cc2)=N1 ZINC000071282252 FG Annotated Anodyne CCCNC(=O)c1nnc2c(-c3cc(C)ccc3OC)cccc2c1N ZINC000071282274 FG Annotated Anodyne O=C1C=C(N2CCN(c3ccccc3Cl)CC2)C(=O)c2c(O)cccc21 ZINC000071294239 FG Annotated Mild CCN1Cc2nc3c(-c4cc(OC)ccc4OC)cccc3c(N)c2C1=O ZINC000071294283 FG Annotated Anodyne NC1=N[C@H](c2ccccc2)NC(NCCCCOc2ccc(Cl)cc2)=N1 ZINC000071294546 FG Annotated Anodyne NC1=N[C@@H](c2ccccc2)NC(NCCCCOc2ccc(Cl)cc2)=N1 ZINC000071294547 FG Annotated Anodyne COc1ncccc1-c1cccc2c(N)c3c(nc12)CN(C1CCC1)C3=O ZINC000071295403 FG Annotated Anodyne O=C(O)c1cc2cc(Br)cc(OC[C@@H]3CCCNC3)c2o1 ZINC000071295423 FG Annotated Anodyne O=C(O)c1cc2cc(Br)cc(OC[C@H]3CCCNC3)c2o1 ZINC000071295424 FG Annotated Anodyne O=C(O)c1cc2cc(Br)cc(OCC3CCNCC3)c2o1 ZINC000071295483 FG Annotated Anodyne CS(=O)(=O)c1ccc([C@H]2SCCC(=O)N2C2CCCCC2)cc1 ZINC000071295537 FG Annotated Anodyne CS(=O)(=O)c1ccc([C@@H]2SCCC(=O)N2C2CCCCC2)cc1 ZINC000071295538 FG Annotated Anodyne CS(=O)(=O)c1ccc([C@H]2SCCC(=O)N2Cc2ccccc2)cc1 ZINC000071296094 FG Annotated Anodyne CS(=O)(=O)c1ccc([C@@H]2SCCC(=O)N2Cc2ccccc2)cc1 ZINC000071296095 FG Annotated Anodyne COc1ccc(/C=C/C(=O)c2ccc(C)cc2)c(CN2CCOCC2)c1O ZINC000071296300 FG Annotated Mild N#CCC1=NN=C(c2ccc(Br)cc2)[C@@H](Br)O1 ZINC000071296757 FG Annotated Reactive N#CCC1=NN=C(c2ccc(Br)cc2)[C@H](Br)O1 ZINC000071296758 FG Annotated Reactive COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@@H](CC[C@@H]21)[C@]1(O)OCO[C@@H]13 ZINC000071315880 FG Annotated Anodyne CCCNC(=O)c1ccc(-n2cc(-c3cc(F)cc(F)c3)nn2)cc1O ZINC000071315918 FG Annotated Anodyne CC(C)C(=O)c1c(C(F)(F)F)[n+]([O-])c2cc(Cl)c(Cl)cc2[n+]1[O-] ZINC000071316135 FG Annotated Anodyne CC(=O)OC[C@]12CCC(=O)C=C1[C@@]1(C)C=C(C#N)C(=O)C(C)(C)[C@@H]1CC2 ZINC000071316386 FG Annotated Reactive O=S(=O)(Nc1cncc(-c2ccc3nccn3c2)c1)c1ccccc1 ZINC000071316585 FG Annotated Anodyne CC(C)(C)N/C(O)=N/S(=O)(=O)c1ccccc1N[C@@H]1C[C@H]2CC[C@@H]1C2 ZINC000071317392 FG Annotated Mild Cc1cc(NCCN)c2ccc3c(ccc4c(NCCN)cc(C)nc43)c2n1 ZINC000071317563 FG Annotated Bother CCOC(=O)c1oc2c(Cl)c(Cl)c(OC(C)=O)c(C#N)c2c1N ZINC000071317686 FG Annotated Mild CCN1CCC(n2cc(-c3noc(-c4ccc(Cl)cc4)n3)nn2)CC1 ZINC000071317801 FG Annotated Anodyne CCC(=O)c1c(C(F)(F)F)[n+]([O-])c2cc(Cl)c(Cl)cc2[n+]1[O-] ZINC000071317862 FG Annotated Anodyne O=C(c1ccccc1)c1c(C(F)(F)F)[n+]([O-])c2cc(Cl)ccc2[n+]1[O-] ZINC000071317865 FG Annotated Anodyne CCCNC(=O)c1cc(-n2cc(-c3cc(F)cc(F)c3)nn2)ccc1O ZINC000071318180 FG Annotated Anodyne COc1cc([C@H]2C3=C(COC3=O)Nc3ccc4cn[nH]c4c32)ccc1F ZINC000071318753 FG Annotated Anodyne COc1cc([C@@H]2C3=C(COC3=O)Nc3ccc4cn[nH]c4c32)ccc1F ZINC000071318754 FG Annotated Anodyne CN1CCC(C(=O)N2CC[C@@](O)(c3ccccc3)[C@@H]3CCCC[C@@H]32)CC1 ZINC000071318789 FG Annotated Anodyne CCCNC(=O)c1cc(-n2cc(-c3cccc(Cl)c3)nn2)ccc1O ZINC000071318934 FG Annotated Anodyne CCCNC(=O)c1ccc(-n2cc(-c3cccc(Cl)c3)nn2)cc1O ZINC000071318972 FG Annotated Anodyne N#Cc1c(Cn2ccc3c4c(ncc32)C(=O)N(O)CC4)ccc(F)c1Cl ZINC000071319081 FG Annotated Mild COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@](O)(CO)C3 ZINC000071319341 FG Annotated Anodyne CCN(CCCF)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 ZINC000071319370 FG Annotated Anodyne C[C@@H](NC(=O)c1nc(N2CCC(F)(F)CC2)c2cnccn12)C(C)(C)C ZINC000071329235 FG Annotated Anodyne COC(=O)C1=C[C@]2(C)C3=CC(=O)C(C#N)=C[C@]3(C)CC[C@H]2C(C)(C)C1=O ZINC000071329289 FG Annotated Reactive Cc1ccc(-c2c3c(nc4nc(O)[nH]c(=O)c24)-c2ccccc2C3=O)cc1 ZINC000071329856 FG Annotated Clean C#CC#C[C@]12C=C(C#N)C(=O)C=C1[C@@]1(C)C=C(C#N)C(=O)C(C)(C)[C@@H]1CC2 ZINC000071329935 FG Annotated Reactive CC1=C2OCCCCCCN3C(=O)[C@@](O)(c4ccccc43)[C@@]2(C)SC1=O ZINC000071330010 FG Annotated Mild CC1=C2OCCCCCCN3C(=O)[C@@](O)(c4ccccc43)[C@]2(C)SC1=O ZINC000071330011 FG Annotated Mild CC1=C2OCCCCCCN3C(=O)[C@](O)(c4ccccc43)[C@@]2(C)SC1=O ZINC000071330012 FG Annotated Mild CC1=C2OCCCCCCN3C(=O)[C@](O)(c4ccccc43)[C@]2(C)SC1=O ZINC000071330013 FG Annotated Mild Cc1nc(N)nc(-n2c(Nc3ccc4cc[nH]c4c3)nc3ccccc32)n1 ZINC000071330063 FG Annotated Anodyne CC(C)[C@@]1(c2ccc(-c3ccc4ccccc4c3)[nH]c2=O)OC(=O)NC1=O ZINC000071332235 FG Annotated Anodyne Cc1oc(-c2ccccc2)cc1C[N+]1(C)C(=O)[C@@H]2[C@H]3CC[C@H](O3)[C@@H]2C1=O ZINC000071333462 FG Annotated Bother COc1ccc(/C=N/Nc2cc(N/N=C/c3ccc(OC)cc3)[nH]n2)cc1 ZINC000071333682 FG Annotated Mild CC(C)[C@@]1(c2c[nH]c(-c3ccc4ccccc4c3)cc2=O)OC(=O)NC1=O ZINC000071333781 FG Annotated Anodyne CC(C)[C@]1(c2c[nH]c(-c3ccc4ccccc4c3)cc2=O)OC(=O)NC1=O ZINC000071333782 FG Annotated Anodyne Clc1cccc(-n2nnnc2NCc2cccc3c2OCO3)c1Cl ZINC000071334154 FG Annotated Anodyne O=C1NC(=O)[C@](c2ccc(-c3ccc4ccccc4c3)[nH]c2=O)(C2CC2)O1 ZINC000071334408 FG Annotated Anodyne O=C1NC(=O)[C@@](c2ccc(-c3ccc4ccccc4c3)[nH]c2=O)(C2CC2)O1 ZINC000071334412 FG Annotated Anodyne COC(=O)[C@@H]1C[C@H](Oc2cccc(Cl)c2)CN1C(=O)OC(C)(C)C ZINC000071340397 FG Annotated Anodyne CCOC(=O)[C@]12C(=O)OCC=C1CO[C@H]2c1ccc(Cl)c(Cl)c1 ZINC000071340596 FG Annotated Anodyne CCOC(=O)[C@@]12C(=O)OCC=C1CO[C@H]2c1ccc(Cl)c(Cl)c1 ZINC000071340597 FG Annotated Anodyne CCOC(=O)[C@]12C(=O)OCC=C1CO[C@@H]2c1ccc(Cl)c(Cl)c1 ZINC000071340598 FG Annotated Anodyne CCOC(=O)[C@@]12C(=O)OCC=C1CO[C@@H]2c1ccc(Cl)c(Cl)c1 ZINC000071340599 FG Annotated Anodyne CC(C)(C)OC(=O)NC[C@H](NO)c1c[nH]c2cc(Br)ccc12 ZINC000071340881 FG Annotated Anodyne CC(C)(C)OC(=O)NC[C@@H](NO)c1c[nH]c2cc(Br)ccc12 ZINC000071340882 FG Annotated Anodyne CC(C)(C)OC(=O)NC[C@H](NO)c1c[nH]c2cccc(Br)c12 ZINC000071340904 FG Annotated Anodyne CC(C)(C)OC(=O)NC[C@@H](NO)c1c[nH]c2cccc(Br)c12 ZINC000071340905 FG Annotated Anodyne CC(C)[C@]1(c2ccc(-c3ccc4ccccc4c3)[nH]c2=O)OC(=O)NC1=O ZINC000071341265 FG Annotated Anodyne C#CCOc1ccc(CONC(=O)c2cc(Cl)c(Cl)[nH]2)cc1OC ZINC000071418514 FG Annotated Mild CCCN1CCN(C(=O)c2nn(C)c3c2CSc2ccc(C)cc2-3)CC1 ZINC000071928182 FG Annotated Anodyne Fc1ccc(-c2[nH]ncc2CNCc2ccccc2-n2cncn2)c(F)c1 ZINC000071928219 FG Annotated Anodyne C[C@H](/N=c1/c(-c2ccc(Cl)cc2)c(O)c1=O)c1ccc2c(c1)OCCO2 ZINC000071928388 FG Annotated Anodyne C[C@@H](/N=c1/c(-c2ccc(Cl)cc2)c(O)c1=O)c1ccc2c(c1)OCCO2 ZINC000071928389 FG Annotated Anodyne Cc1cc(C(=O)NCc2ccc(F)cc2)c2c([C@@H]3CCCN3)noc2n1 ZINC000071995355 FG Annotated Anodyne Cc1cc(C(=O)NCc2ccc(F)cc2)c2c([C@H]3CCCN3)noc2n1 ZINC000071995356 FG Annotated Anodyne Cc1cccc(N2Cc3c(NC4CCCC4)ncnc3N(C)CC2=O)c1 ZINC000071995918 FG Annotated Anodyne NC(=O)c1cccc([C@@](O)(c2cccnc2)c2ccc(Cl)cc2F)c1 ZINC000072100857 FG Annotated Anodyne NC(=O)c1cccc([C@](O)(c2cccnc2)c2ccc(Cl)cc2F)c1 ZINC000072100858 FG Annotated Anodyne COCCN(CCOC)Cc1coc(-c2ccccc2Br)n1 ZINC000072100874 FG Annotated Anodyne CCc1ccc(Oc2ncccc2/C(=N\O)N[C@@H]2CCCC[C@@H]2O)cc1 ZINC000072100888 FG Annotated Mild CCc1ccc(Oc2ncccc2/C(=N\O)N[C@H]2CCCC[C@@H]2O)cc1 ZINC000072100889 FG Annotated Mild CCc1ccc(Oc2ncccc2/C(=N\O)N[C@@H]2CCCC[C@H]2O)cc1 ZINC000072100890 FG Annotated Mild CCc1ccc(Oc2ncccc2/C(=N\O)N[C@H]2CCCC[C@H]2O)cc1 ZINC000072100891 FG Annotated Mild C=CCN1CCN(/C(=N\O)c2ccc(C)nc2Oc2cccc(F)c2)CC1 ZINC000072101121 FG Annotated Mild CC(C)COc1ncccc1/C(=N/O)N1CCN(c2ccccc2)CC1 ZINC000072101132 FG Annotated Mild Cc1ccc(/C(=N/O)N2CCOCC2)c(Oc2cccc3cnccc23)n1 ZINC000072101245 FG Annotated Mild Cc1ccc(/C(=N/O)NC[C@@H]2CCCO2)c(OCc2cccc(F)c2)n1 ZINC000072101326 FG Annotated Mild Cc1ccc(/C(=N/O)NC[C@H]2CCCO2)c(OCc2cccc(F)c2)n1 ZINC000072101327 FG Annotated Mild COC[C@H](C)N/C(=N\O)c1cccnc1Oc1ccccc1OC(C)C ZINC000072101622 FG Annotated Mild COC[C@@H](C)N/C(=N\O)c1cccnc1Oc1ccccc1OC(C)C ZINC000072101623 FG Annotated Mild COc1cc(C)ccc1Oc1nc(C)ccc1/C(=N/O)NC[C@@H]1CCCO1 ZINC000072101635 FG Annotated Mild COc1cc(C)ccc1Oc1nc(C)ccc1/C(=N/O)NC[C@H]1CCCO1 ZINC000072101636 FG Annotated Mild COc1ccccc1COc1nc(C)ccc1/C(=N/O)NCCSC ZINC000072101638 FG Annotated Mild O/N=C(\NCc1cc(F)cc(F)c1)c1cccnc1OCC(F)(F)F ZINC000072101639 FG Annotated Mild CCN1CCN(Cc2coc(-c3ccc(OC(F)(F)F)cc3)n2)CC1 ZINC000072101771 FG Annotated Anodyne O=[N+]([O-])c1ccc(N2CCN(Cc3coc(-c4ccco4)n3)CC2)cc1 ZINC000072101773 FG Annotated Bother Cc1ccc(/C(=N/O)NCCN2CCCC2)c(Oc2ccc(F)cc2)n1 ZINC000072101919 FG Annotated Mild CCOCCCN[C@@H](c1nc(C(C)C)c(N2CCOCC2)o1)C1CC1 ZINC000072101927 FG Annotated Anodyne CCOCCCN[C@H](c1nc(C(C)C)c(N2CCOCC2)o1)C1CC1 ZINC000072101928 FG Annotated Anodyne CC(C)CS(=O)(=O)N[C@@H](c1ccc(C(F)(F)F)cc1)c1cnccn1 ZINC000072102041 FG Annotated Anodyne CC(C)CS(=O)(=O)N[C@H](c1ccc(C(F)(F)F)cc1)c1cnccn1 ZINC000072102042 FG Annotated Anodyne N#Cc1ccc([C@H](c2cccnc2)N2CCN(c3nccs3)CC2)cc1 ZINC000072102161 FG Annotated Mild N#Cc1ccc([C@@H](c2cccnc2)N2CCN(c3nccs3)CC2)cc1 ZINC000072102162 FG Annotated Mild CC(C)Oc1ccc([C@](O)(c2cccnc2)c2cccc(C(N)=O)c2)cc1 ZINC000072102383 FG Annotated Anodyne CC(C)Oc1ccc([C@@](O)(c2cccnc2)c2cccc(C(N)=O)c2)cc1 ZINC000072102384 FG Annotated Anodyne CC(C)CC(=O)N1CCN([C@@H](c2ccc(Cl)cc2)c2cncnc2)CC1 ZINC000072102441 FG Annotated Anodyne CC(C)CC(=O)N1CCN([C@H](c2ccc(Cl)cc2)c2cncnc2)CC1 ZINC000072102442 FG Annotated Anodyne Cc1ccc(/C(=N/O)NCc2ccccn2)c(OCc2ccccc2F)n1 ZINC000072102689 FG Annotated Mild Clc1ccc(-c2nc(CNCCN3CCOCC3)co2)c(Cl)c1 ZINC000072102691 FG Annotated Anodyne O/N=C(\NCc1ccncc1)c1ccnc(Oc2ccc(F)c(F)c2)c1 ZINC000072102861 FG Annotated Mild Cc1ccc(Oc2cc(/C(=N/O)N3CCOCC3)ccn2)c2c1CCC2 ZINC000072103032 FG Annotated Mild O=C(NC1CCN([C@@H](c2ccc(Cl)cc2)c2cncnc2)CC1)C1CC1 ZINC000072103095 FG Annotated Anodyne O=C(NC1CCN([C@H](c2ccc(Cl)cc2)c2cncnc2)CC1)C1CC1 ZINC000072103096 FG Annotated Anodyne COc1ccc(Oc2ncccc2/C(=N/O)NCc2cccnc2)cc1 ZINC000072103147 FG Annotated Mild COC[C@H](C)N/C(=N\O)c1ccc(Oc2c(F)c(F)cc(F)c2F)nc1 ZINC000072103276 FG Annotated Mild COC[C@@H](C)N/C(=N\O)c1ccc(Oc2c(F)c(F)cc(F)c2F)nc1 ZINC000072103277 FG Annotated Mild CC(C)C(=O)N1CCN([C@@H](c2ccc(Cl)cc2)c2cncnc2)CC1 ZINC000072103455 FG Annotated Anodyne CC(C)C(=O)N1CCN([C@H](c2ccc(Cl)cc2)c2cncnc2)CC1 ZINC000072103456 FG Annotated Anodyne Cc1ccc(/C(=N/O)N2CC[C@H](N(C)C)C2)c(Oc2cccc(F)c2)n1 ZINC000072103802 FG Annotated Mild Cc1ccc(/C(=N/O)N2CC[C@@H](N(C)C)C2)c(Oc2cccc(F)c2)n1 ZINC000072103803 FG Annotated Mild CCN(CC)CCC(=O)Nc1csc2c1C(=O)c1ccccc1C2=O ZINC000072105101 FG Annotated Clean Brc1cnc2nc3ccc4ccc(C5=NCCN5)cc4n3c2c1 ZINC000072105125 FG Annotated Bother C[C@@H](NC[C@@H]1Cc2ccccc2S(=O)(=O)N1)c1cccc2ccccc12 ZINC000072106491 FG Annotated Anodyne C[C@@H](NC[C@H]1Cc2ccccc2S(=O)(=O)N1)c1cccc2ccccc12 ZINC000072106492 FG Annotated Anodyne C[C@@]1(c2ccc(Br)nc2)OC(=O)N(Nc2ccccc2)C1=O ZINC000072107004 FG Annotated Anodyne C[C@]1(c2ccc(Br)nc2)OC(=O)N(Nc2ccccc2)C1=O ZINC000072107005 FG Annotated Anodyne COC(=O)c1ccc2c(-c3ccnc(SCCN(C)C)n3)c[nH]c2c1 ZINC000072107067 FG Annotated Anodyne C[C@]1(OC(=O)c2ccccc2)COC2=C(Cl)C(=O)C(=O)c3cccc1c32 ZINC000072107236 FG Annotated Mild C[C@@]1(OC(=O)c2ccccc2)COC2=C(Cl)C(=O)C(=O)c3cccc1c32 ZINC000072107237 FG Annotated Mild CC(=O)NC1=NN(C(C)=O)[C@@H](c2cc3cccc(C)c3nc2Cl)S1 ZINC000072107376 FG Annotated Anodyne CC(=O)NC1=NN(C(C)=O)[C@H](c2cc3cccc(C)c3nc2Cl)S1 ZINC000072107377 FG Annotated Anodyne CCOCc1ccccc1CCN1CC(=O)Nc2cc([N+](=O)[O-])ccc21 ZINC000072108092 FG Annotated Bother Cc1cc(O)c(=O)c(O)c2c1C[C@@H]([C@](C)(O)CSc1ccccc1)CC2 ZINC000072108504 FG Annotated Anodyne Cc1cc(O)c(=O)c(O)c2c1C[C@@H]([C@@](C)(O)CSc1ccccc1)CC2 ZINC000072108505 FG Annotated Anodyne CN[C@H]1CC[C@@]2(C)C(=C[C@@H](O)[C@@H]3[C@@H]2CC[C@]24C(=O)O[C@@H](C)[C@H]2CC[C@@H]34)C1 ZINC000072108528 FG Annotated Anodyne N#Cc1c(-c2ccccc2)cc(N2CCNCC2)n2c1nc1ccccc12 ZINC000072109207 FG Annotated Mild O=C1NC2(CC2)Cc2[nH]c3c(c21)CCc1cnc(-c2ccccc2F)nc1-3 ZINC000072109360 FG Annotated Anodyne CSc1ccnc(NCc2ccc(CNc3ncc(F)cn3)cc2)n1 ZINC000072109813 FG Annotated Anodyne CCCc1ccccc1OS(=O)(=O)c1ccc(N2CCCNC2=O)cc1 ZINC000072110959 FG Annotated Anodyne CCCCCCCCN1c2nccc[n+]2C[C@@]1(O)c1ccc(OC)cc1 ZINC000072112026 FG Annotated Mild CCCCCCCCN1c2nccc[n+]2C[C@@]1(O)c1ccc([N+](=O)[O-])cc1 ZINC000072113375 FG Annotated Mild O=[N+]([O-])c1cc(O)c2c(CCn3cncn3)c(-c3ccc(F)cc3)[nH]c2c1 ZINC000072114305 FG Annotated Bother CC(C)CNCc1ccc(-c2ccccc2S(=O)(=O)N2CCCC2)nc1 ZINC000072114373 FG Annotated Anodyne CC(C)CNCc1ccc(-c2ncccc2S(=O)(=O)N2CCCC2)cc1 ZINC000072114374 FG Annotated Anodyne CC(C)CNCc1ccc(-c2cccnc2S(=O)(=O)N2CCCC2)cc1 ZINC000072114551 FG Annotated Anodyne CC(C)CNCc1ccc(-c2ccccc2S(=O)(=O)N2CCCC2)cn1 ZINC000072114859 FG Annotated Anodyne COc1ccc([C@H](CC(=O)c2ccccc2)NC(C)=O)c(OC)c1OC ZINC000072114903 FG Annotated Anodyne COc1ccc([C@@H](CC(=O)c2ccccc2)NC(C)=O)c(OC)c1OC ZINC000072114904 FG Annotated Anodyne CO[C@@H]1Cc2c(cnn2-c2ccccc2)C2(CCN(CC(C)C)CC2)O1 ZINC000072116170 FG Annotated Anodyne O=c1oc2ccccc2cc1-c1cs/c(=N\N=C/c2ccc(O)cc2)[nH]1 ZINC000072116521 FG Annotated Mild N#Cc1c(N)nc(Nc2ccc3oc(=O)ccc3c2)nc1-c1ccccc1 ZINC000072116628 FG Annotated Mild CC(C)/N=C(\NC1=NC(=O)CN1C(C)C)Nc1ccc(Cl)c(Cl)c1 ZINC000072116743 FG Annotated Mild N#Cc1c(-c2ccccc2)nc(Nc2ccc3oc(=O)ccc3c2)[nH]c1=O ZINC000072116765 FG Annotated Mild O=S(=O)(CC1=NCCO1)c1c(-c2ccccc2)noc1-c1ccccc1 ZINC000072116787 FG Annotated Anodyne NC(=O)c1sc2nc(CCl)[nH]c(=O)c2c1-c1ccc(Cl)cc1 ZINC000072117993 FG Annotated Reactive Cc1cc(C#N)cc(C)c1Oc1ccc(=O)n(Nc2cccc(C#N)c2)n1 ZINC000072118292 FG Annotated Mild COc1ccc2cc3n(c(=O)c2c1OC)CC=Cc1cc2c(cc1-3)OCO2 ZINC000072118334 FG Annotated Anodyne NC(=O)c1sc(-c2ccccc2)cc1S(=O)(=O)c1ccc(F)cc1 ZINC000072118990 FG Annotated Anodyne CCc1cc([C@@H]2CC(=O)N2c2cc(OC)c(OC)c(OC)c2)c(O)cc1O ZINC000072119932 FG Annotated Clean C/N=C1\Nc2cc(-c3cccc(CCC(=O)O)c3)sc2N2[C@@H](C)C=N[C@@H]12 ZINC000072120103 FG Annotated Mild O=S(=O)(c1ccccc1)c1cnc2ncnn2c1-c1ccc(Cl)cc1 ZINC000072120159 FG Annotated Anodyne O=S1(=O)N(CC[C@@H]2CCCNC2)c2ccccc2N1c1ccccc1 ZINC000072120306 FG Annotated Anodyne O=S1(=O)N(CC[C@H]2CCCNC2)c2ccccc2N1c1ccccc1 ZINC000072120307 FG Annotated Anodyne Cc1ccc(Cl)cc1C(=O)N1CCC2(CC1)c1ccccc1[C@@H](N)[C@@H]2O ZINC000072120957 FG Annotated Anodyne O=S(=O)(Cc1c(F)cccc1Cl)c1ccc(-c2ccccn2)nn1 ZINC000072123011 FG Annotated Anodyne CC1=CC[C@@]2(C)[C@@H](O)C[C@@](O)(C(C)C)[C@@H]2[C@@H](OC(=O)c2ccc(O)cc2)C1 ZINC000072123537 FG Annotated Anodyne C[C@H](O[C@@H]1COc2nc([N+](=O)[O-])cn2C1)c1ccc(OC(F)(F)F)cc1 ZINC000072124410 FG Annotated Bother C[C@@H](O[C@@H]1COc2nc([N+](=O)[O-])cn2C1)c1ccc(OC(F)(F)F)cc1 ZINC000072124411 FG Annotated Bother C[C@H](Nc1ncc(C(N)=O)c2[nH]c3cc(-c4cnn(C)c4)ccc3c12)C1CC1 ZINC000072124688 FG Annotated Anodyne C[C@@H](Nc1ncc(C(N)=O)c2[nH]c3cc(-c4cnn(C)c4)ccc3c12)C1CC1 ZINC000072124689 FG Annotated Anodyne O=[N+]([O-])c1cn2c(n1)OC[C@@H](Oc1ccc(-c3ccc(F)cc3)cc1)C2 ZINC000072124760 FG Annotated Bother [CH2-]c1c2c(C)nc(OC)c(C#N)c2nc[n+]1CCc1ccc(Cl)cc1 ZINC000072125724 FG Annotated Mild CCCCN(C[C@](C)(O)c1ccccc1)S(=O)(=O)c1ccc(O)cc1 ZINC000072126101 FG Annotated Anodyne CCCCN(C[C@@](C)(O)c1ccccc1)S(=O)(=O)c1ccc(O)cc1 ZINC000072126102 FG Annotated Anodyne CCOC(=O)c1ccc(OCCC2CCN(c3ccc(C)nn3)CC2)nc1 ZINC000072126998 FG Annotated Anodyne CCOC(=O)c1ccc(OCCC2CCN(c3ccc(C)nn3)CC2)cn1 ZINC000072126999 FG Annotated Anodyne CCOC(=O)c1ccc(COCC2CCN(c3ccc(C)nn3)CC2)cc1 ZINC000072127598 FG Annotated Anodyne Oc1ccc(CCc2nnc3n2N=C(c2ccc(F)cc2)CS3)cc1 ZINC000072127948 FG Annotated Anodyne Cc1ccc(N2CCC(CCOc3ccc([S@](C)=O)cc3)CC2)nn1 ZINC000072127969 FG Annotated Anodyne Cc1ccc(N2CCC(CCOc3ccc([S@@](C)=O)cc3)CC2)nn1 ZINC000072127970 FG Annotated Anodyne Cc1ccc(C2=Nn3c(CCc4ccc(O)cc4)nnc3SC2)cc1 ZINC000072128580 FG Annotated Anodyne CCCCN1C[C@H](CSC)[C@H](CC(=O)Nc2ccc(OC)cc2)C1=O ZINC000072136690 FG Annotated Anodyne CCCCN1C[C@@H](CSC)[C@H](CC(=O)Nc2ccc(OC)cc2)C1=O ZINC000072136691 FG Annotated Anodyne CCCCN1C[C@@H](CSC)[C@@H](CC(=O)Nc2ccc(OC)cc2)C1=O ZINC000072136692 FG Annotated Anodyne CCOC(=O)C1=CCN(S(=O)(=O)c2ccccc2C)[C@@H]1c1ccccc1 ZINC000072136791 FG Annotated Anodyne CCOC(=O)C1=CCN(S(=O)(=O)c2ccccc2C)[C@H]1c1ccccc1 ZINC000072136792 FG Annotated Anodyne Cc1cc2c(cc1C)N1C(=O)c3cc4ccccc4cc3NC(=O)[C@@H]1C(=O)N2 ZINC000072139674 FG Annotated Anodyne Cc1cc2c(cc1C)N1C(=O)c3cc4ccccc4cc3NC(=O)[C@H]1C(=O)N2 ZINC000072139675 FG Annotated Anodyne CCCCn1nnnc1[C@@H](CC)N1CCN(C/C=C/c2ccccc2)CC1 ZINC000072139972 FG Annotated Anodyne CCCCn1nnnc1[C@H](CC)N1CCN(C/C=C/c2ccccc2)CC1 ZINC000072139973 FG Annotated Anodyne CCCCOC[C@H]1CN(CCCC)S(=O)(=O)c2c(F)cccc2O1 ZINC000072141045 FG Annotated Anodyne CCCCOC[C@@H]1CN(CCCC)S(=O)(=O)c2c(F)cccc2O1 ZINC000072141046 FG Annotated Anodyne N[C@H](Cc1ccccc1)C(=O)Nc1ccc(Cl)cc1C(=O)c1ccc[nH]1 ZINC000072141139 FG Annotated Anodyne Clc1nc(I)nc2c1ncn2[C@@H]1C[C@H]2CC[C@@H]1C2 ZINC000072141369 FG Annotated Anodyne O/N=C(/c1ccc(Oc2cccc3c2CCCC3)nc1)N1CCOCC1 ZINC000072141434 FG Annotated Mild N[C@@H]1c2ccccc2C2(CCN(c3cc(C(F)(F)F)ccn3)CC2)[C@H]1O ZINC000072148010 FG Annotated Anodyne N[C@@H]1c2ccccc2C2(CCN(c3cccc(C(F)(F)F)n3)CC2)[C@H]1O ZINC000072165312 FG Annotated Anodyne CC(C)c1nc(N2CCC(N3CCCCCC3)CC2)c2cnn(C)c2n1 ZINC000072166720 FG Annotated Anodyne Cc1cc(C)nc(O[C@@H]2C(=O)OCC2(c2ccccc2)c2ccccc2)n1 ZINC000072172304 FG Annotated Anodyne Cc1cc(C)nc(O[C@H]2C(=O)OCC2(c2ccccc2)c2ccccc2)n1 ZINC000072172305 FG Annotated Anodyne COc1ccc(NNC(=S)Nc2ccc(-c3nnc(S)o3)cc2)cc1 ZINC000072173212 FG Annotated Clean Cc1ccc(C2OOC(c3ccc(COS(C)(=O)=O)cc3)OO2)cc1 ZINC000072173636 FG Annotated Reactive COc1cc(C(C)=O)cc(CNc2cc(C(C)=O)cc(OC)c2O)c1O ZINC000072174420 FG Annotated Clean O=C(c1ccc(O)cc1)c1cc2cc(Br)cc(O)c2oc1=O ZINC000072175128 FG Annotated Anodyne N#C/C(=C\c1ccc(OCC(N)=O)cc1)c1nc2c(Cl)cccc2[nH]1 ZINC000072175560 FG Annotated Reactive CC(C)(C)OC(=O)NCCc1nc(Br)[nH]c1Br ZINC000072175649 FG Annotated Anodyne O=[N+]([O-])c1ccc(-c2nnc3n2N=Cc2cc4ccccc4nc2N3)cc1 ZINC000072175661 FG Annotated Bother CC(C)(C)OC(=O)/C=C\[C@@H]1CC[C@@H](CC(=O)OCc2ccccc2)OO1 ZINC000072175714 FG Annotated Reactive CC(C)(C)OC(=O)/C=C/[C@@H]1CC[C@@H](CC(=O)OCc2ccccc2)OO1 ZINC000072175715 FG Annotated Reactive O=C1Oc2ccc3ccccc3c2C(=O)/C1=N/Nc1ccc([N+](=O)[O-])cc1 ZINC000072175848 FG Annotated Mild CC(C)Cc1nc2ccc(OCC(N)=O)cc2c(-c2ccccc2)c1CN ZINC000072175939 FG Annotated Anodyne COc1ccc(C(=O)c2coc3c2C(=O)C(=O)C(Cl)=C3Cl)cc1 ZINC000072176124 FG Annotated Mild Cc1cccc2c1c(Cn1c(=O)n(CCC(=O)O)c3ccccc31)cn2C ZINC000072176801 FG Annotated Anodyne Cc1cn(C)c2c(Cn3c(=O)n(CCC(=O)O)c4ccccc43)cccc12 ZINC000072176815 FG Annotated Anodyne C[C@]1([C@@H](O)c2ccc(F)cc2)NC(=S)N(c2ccc(Cl)cc2)C1=O ZINC000072177290 FG Annotated Anodyne CSc1nn(-c2ccccc2)c2cc(NC(=O)[C@@H]3CCNC3)ccc12 ZINC000072177376 FG Annotated Anodyne CSc1nn(-c2ccccc2)c2cc(NC(=O)[C@H]3CCNC3)ccc12 ZINC000072177377 FG Annotated Anodyne COc1cc2c(cc1OC)C1=NN(C(N)=S)[C@H](c3ccc(F)cc3)[C@@H]1C2 ZINC000072177380 FG Annotated Anodyne COc1cc2c(cc1OC)C1=NN(C(N)=S)[C@@H](c3ccc(F)cc3)[C@@H]1C2 ZINC000072177381 FG Annotated Anodyne COc1cc2c(cc1OC)C1=NN(C(N)=S)[C@H](c3ccc(F)cc3)[C@H]1C2 ZINC000072177382 FG Annotated Anodyne COc1cc2c(cc1OC)C1=NN(C(N)=S)[C@@H](c3ccc(F)cc3)[C@H]1C2 ZINC000072177383 FG Annotated Anodyne CCOC(=O)/C=C/c1c(O)ncnc1Oc1ccc(Cl)cc1OC ZINC000072177624 FG Annotated Anodyne C(#Cc1nc2ncccc2nc1OCCc1ccccn1)c1ccccc1 ZINC000072178038 FG Annotated Mild Brc1ncnc2c1ncn2C[C@H]1COc2ccccc2S1 ZINC000072178141 FG Annotated Anodyne Brc1ncnc2c1ncn2C[C@@H]1COc2ccccc2S1 ZINC000072178142 FG Annotated Anodyne CCCC(CCC)C(=O)OCN(CC(=O)OCC)C(=O)c1ccccc1 ZINC000072178223 FG Annotated Anodyne Cc1ccc(Cl)c2c1NC(=O)/C2=N\NC(=O)[C@@H](C)c1ccc(F)cc1 ZINC000072178812 FG Annotated Reactive Cc1ccc(Cl)c2c1NC(=O)/C2=N\NC(=O)[C@H](C)c1ccc(F)cc1 ZINC000072178813 FG Annotated Reactive N=C(N)NCCCCc1nccc2c1[nH]c1cc(Br)ccc12 ZINC000072179338 FG Annotated Anodyne Brc1ncnc2c1ncn2C[C@@H]1CSc2ccccc2O1 ZINC000072179360 FG Annotated Anodyne Brc1ncnc2c1ncn2C[C@H]1CSc2ccccc2O1 ZINC000072179361 FG Annotated Anodyne O=C(Cc1ccc(F)cc1)N/N=C1\C(=O)Nc2c(Cl)ccc(Cl)c21 ZINC000072179492 FG Annotated Reactive O=C(Cc1ccc(F)cc1)N/N=C1\C(=O)Nc2ccc(Cl)c(Cl)c21 ZINC000072180050 FG Annotated Reactive COc1ccc(Oc2ncccc2/C(=N/O)NCc2ccncc2)cc1 ZINC000072180095 FG Annotated Mild Cc1cc(NCCCN2CCCC2=O)n2nc(-c3cccc(F)c3)cc2n1 ZINC000072180195 FG Annotated Anodyne C=CCN1CCN(/C(=N\O)c2cccnc2Oc2ccc(Cl)cc2)CC1 ZINC000072180225 FG Annotated Mild Fc1cccc(C#Cc2nc3ncccc3nc2OCCN2CCCC2)c1 ZINC000072181144 FG Annotated Mild COc1ccccc1COc1nc(C)ccc1/C(=N/O)NCc1ccco1 ZINC000072181180 FG Annotated Mild CCc1nc(C)cn1Cc1coc(-c2cc(OC)c(OC)c(OC)c2)n1 ZINC000072181195 FG Annotated Anodyne CCOC(=O)c1nc(-c2ccc[nH]2)n(-c2ccc(C(F)(F)F)cc2)n1 ZINC000072181376 FG Annotated Anodyne COc1ccc(Oc2ncccc2/C(=N/O)NCc2ccccn2)cc1 ZINC000072181581 FG Annotated Mild CO[C@@H](C)CO[C@H](CC=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000072181819 FG Annotated Mild CO[C@H](C)CO[C@H](CC=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000072181820 FG Annotated Mild CCc1ccc(Oc2ncccc2/C(=N\O)N[C@@H]2CCCC[C@H]2N)cc1 ZINC000072181961 FG Annotated Mild CCc1ccc(Oc2ncccc2/C(=N\O)N[C@H]2CCCC[C@H]2N)cc1 ZINC000072181962 FG Annotated Mild COC[C@H](C)N/C(=N\O)c1ccnc(Oc2ccc(F)c(Cl)c2)c1 ZINC000072181974 FG Annotated Mild COC[C@@H](C)N/C(=N\O)c1ccnc(Oc2ccc(F)c(Cl)c2)c1 ZINC000072181975 FG Annotated Mild COCCN(/C(=N\O)c1ccc(C)nc1OCc1ccccc1)C(C)C ZINC000072182001 FG Annotated Mild CCc1ccc(Oc2ncccc2/C(=N\O)N[C@@H]2CCCC[C@@H]2N)cc1 ZINC000072182266 FG Annotated Mild CCc1ccc(Oc2ncccc2/C(=N\O)N[C@H]2CCCC[C@@H]2N)cc1 ZINC000072182267 FG Annotated Mild c1ccc(CCNc2nc(NCCc3ccccn3)c3cccnc3n2)nc1 ZINC000072182374 FG Annotated Anodyne COCCN(/C(=N\O)c1cccnc1Oc1ccc(OC)cc1)C(C)C ZINC000072182446 FG Annotated Mild O/N=C(\NCc1ccncc1)c1cccnc1OCc1ccccc1F ZINC000072182553 FG Annotated Mild CC(C)COc1ncccc1/C(=N/O)N1CCN(c2ccc(F)cc2)CC1 ZINC000072182719 FG Annotated Mild CC1(C)Cc2cccc(Oc3ccc(/C(=N/O)n4ccnc4)cn3)c2O1 ZINC000072183191 FG Annotated Mild Cc1ccc(/C(=N/O)N(C)C2CCN(C)CC2)c(Oc2cccc(F)c2)n1 ZINC000072183272 FG Annotated Mild Cc1ccc(Oc2nc(C)ccc2/C(=N/O)N2CC[C@H](N(C)C)C2)cc1 ZINC000072183345 FG Annotated Mild Cc1ccc(Oc2nc(C)ccc2/C(=N/O)N2CC[C@@H](N(C)C)C2)cc1 ZINC000072183346 FG Annotated Mild Cc1ccc(/C(=N/O)NC[C@@H]2CCCO2)c(OCc2ccccc2C)n1 ZINC000072183437 FG Annotated Mild Cc1ccc(/C(=N/O)NC[C@H]2CCCO2)c(OCc2ccccc2C)n1 ZINC000072183438 FG Annotated Mild C=CCN1CCN(/C(=N\O)c2ccc(C)nc2Oc2ccc(C)cc2)CC1 ZINC000072183596 FG Annotated Mild O/N=C(\NCc1cccnc1)c1cccnc1OCc1ccccc1F ZINC000072183607 FG Annotated Mild COc1ccc(Oc2nc(C)ccc2/C(=N/O)N2CCSCC2)cc1 ZINC000072183659 FG Annotated Mild COc1cc(-c2nc(CNCc3cccnc3)co2)cc(OC)c1OC ZINC000072183728 FG Annotated Anodyne c1ccc2c(-c3nc(CNCCCN4CCOCC4)co3)cccc2c1 ZINC000072183735 FG Annotated Anodyne COC[C@H](C)N/C(=N\O)c1cccnc1Oc1ccc(C)c2c1CCC2 ZINC000072183908 FG Annotated Mild COC[C@@H](C)N/C(=N\O)c1cccnc1Oc1ccc(C)c2c1CCC2 ZINC000072183909 FG Annotated Mild Cc1ccc(/C(=N/O)NC[C@@H]2CCCO2)c(Oc2ccc(F)c(F)c2)n1 ZINC000072183983 FG Annotated Mild Cc1ccc(/C(=N/O)NC[C@H]2CCCO2)c(Oc2ccc(F)c(F)c2)n1 ZINC000072183984 FG Annotated Mild COc1ccc(Oc2cc(/C(=N/O)NCc3ccncc3)ccn2)cc1 ZINC000072184262 FG Annotated Mild COCCN(/C(=N\O)c1cccnc1OCc1ccccc1F)C(C)C ZINC000072184385 FG Annotated Mild Cc1ccc(/C(=N/O)N2CCSCC2)c(OCc2ccccc2F)n1 ZINC000072184582 FG Annotated Mild Cc1ccc(/C(=N/O)NCC[C@@H]2CCCN2C)c(OCc2ccccc2)n1 ZINC000072184609 FG Annotated Mild Cc1ccc(/C(=N/O)NCC[C@H]2CCCN2C)c(OCc2ccccc2)n1 ZINC000072184610 FG Annotated Mild Cc1ccc(/C(=N/O)N2CCSCC2)c(OCc2cccc(F)c2)n1 ZINC000072184822 FG Annotated Mild CCCCc1ccc(-c2nc(CNCCCN3CCOCC3)co2)cc1 ZINC000072184929 FG Annotated Anodyne COC(=O)c1cn(Cc2coc(-c3ccc(Br)cc3)n2)cn1 ZINC000072184942 FG Annotated Anodyne COc1cc(-c2nc(CN(C)Cc3cccnc3)co2)cc(OC)c1OC ZINC000072184947 FG Annotated Anodyne Cc1ccc(/C(=N/O)NC[C@@H]2CCCO2)c(OCc2ccccc2F)n1 ZINC000072184985 FG Annotated Mild Cc1ccc(/C(=N/O)NC[C@H]2CCCO2)c(OCc2ccccc2F)n1 ZINC000072184986 FG Annotated Mild NC(=O)c1cccc([C@@](O)(c2ccc(C(F)(F)F)cc2)c2cccnc2)c1 ZINC000072185077 FG Annotated Anodyne NC(=O)c1cccc([C@](O)(c2ccc(C(F)(F)F)cc2)c2cccnc2)c1 ZINC000072185078 FG Annotated Anodyne CSc1ccc(Oc2nc(C)ccc2/C(=N/O)N2CCOCC2)cc1 ZINC000072185154 FG Annotated Mild Cc1ccc(Oc2ncccc2/C(=N/O)N2CCOCC2)c2c1CCC2 ZINC000072185673 FG Annotated Mild CSc1ccccc1Oc1ncccc1/C(=N/O)NCCN1CCCC1 ZINC000072185855 FG Annotated Mild CCC(C)(C)N/C(=N\O)c1cccnc1Oc1ccc(-n2cncn2)cc1 ZINC000072185861 FG Annotated Mild C=CCN1CCN(/C(=N\O)c2cccnc2Oc2cccc(C)c2C)CC1 ZINC000072185892 FG Annotated Mild CSc1ccc(Oc2nc(C)ccc2/C(=N/O)NCCN(C)C)cc1 ZINC000072185944 FG Annotated Mild O/N=C(/c1cccnc1OC1CCC1)N1CCN(c2ccc(F)cc2)CC1 ZINC000072186205 FG Annotated Mild CSc1ccc(Oc2nc(C)ccc2/C(=N/O)NCCN(C)C)cc1C ZINC000072186249 FG Annotated Mild CC(C)c1cccc(Oc2cc(/C(=N/O)N3CCN(C)CC3)ccn2)c1 ZINC000072186386 FG Annotated Mild C=CCN1CCN(/C(=N\O)c2ccc(Oc3cc(C)cc(C)c3)nc2)CC1 ZINC000072186448 FG Annotated Mild O=C1NCCN1C1CCN([C@H](c2ccc(Cl)cc2)c2cccnc2)CC1 ZINC000072186468 FG Annotated Anodyne O=C1NCCN1C1CCN([C@@H](c2ccc(Cl)cc2)c2cccnc2)CC1 ZINC000072186469 FG Annotated Anodyne COC(CN(C)Cc1coc(-c2ccc(Br)cc2)n1)OC ZINC000072186476 FG Annotated Anodyne CC(C)(C)c1cc(N2CCNCC2)n2nc(-c3ccc(F)cc3)cc2n1 ZINC000072186484 FG Annotated Anodyne COC[C@H](C)N/C(=N\O)c1ccnc(Oc2cccc3cnccc23)c1 ZINC000072186490 FG Annotated Mild COC[C@@H](C)N/C(=N\O)c1ccnc(Oc2cccc3cnccc23)c1 ZINC000072186491 FG Annotated Mild Cc1ccc(/C(=N/O)NCc2ccccn2)c(OCc2cccc(F)c2)n1 ZINC000072186616 FG Annotated Mild Cc1c([C@@H](C)OC(=O)CCC(=O)O)oc2cc(C3=CC(=O)OC3)ccc12 ZINC000072266764 FG Annotated Anodyne in-man C[C@@H]1CC[C@H]2[C@@H](C)[C@](O)(C(F)(F)F)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000072283849 FG Annotated Reactive O=c1[nH]ccc2c(Cc3nnc4ccc(-c5ccccc5)nn34)cccc12 ZINC000072318117 FG Annotated Anodyne O=c1[nH]ccc2c(Cc3nnc4ccc(-c5ccsc5)nn34)cccc12 ZINC000072318120 FG Annotated Anodyne N#CC1CCN(c2nccnc2C2CN(c3ccc4ccccc4n3)C2)CC1 ZINC000072318357 FG Annotated Anodyne CCOC(=O)Cc1csc(NC(=O)c2cnc3c(C)csc3c2)n1 ZINC000072322921 FG Annotated Anodyne CCOC(=O)[C@@H]1CCCN(C(=O)c2cn(C(C)(C)C)c3ncccc23)C1 ZINC000072322950 FG Annotated Anodyne CCOC(=O)[C@H]1CCCN(C(=O)c2cn(C(C)(C)C)c3ncccc23)C1 ZINC000072322951 FG Annotated Anodyne CC(=O)c1cc2ncc(C(=O)NCc3cc(-c4ccccc4)on3)cc2[nH]1 ZINC000072323401 FG Annotated Anodyne CC(=O)c1cc2ncc(C(=O)NCc3cc(-c4cccs4)on3)cc2[nH]1 ZINC000072323406 FG Annotated Anodyne CCc1ccc(NC(=O)c2cnc3cc(C(=O)N(C)C)n(C)c3c2)cc1 ZINC000072323415 FG Annotated Anodyne Cc1ccc(NC(=O)c2cnc3cc(C(=O)N(C)C)n(C)c3c2)cc1C ZINC000072323431 FG Annotated Anodyne CCOCCCNC(=O)c1cnc2c(c1)c(C#N)cn2Cc1ccccc1 ZINC000072323741 FG Annotated Mild N#Cc1cn(Cc2ccccc2)c2ncc(C(=O)NCc3ccccn3)cc12 ZINC000072323764 FG Annotated Mild N#Cc1cn(Cc2ccccc2)c2ncc(C(=O)NCc3ccco3)cc12 ZINC000072323765 FG Annotated Mild CC(=O)c1cc2cc(C(=O)NCc3cc(-c4ccccc4)on3)cnc2[nH]1 ZINC000072323919 FG Annotated Anodyne CC(=O)c1cc2cc(C(=O)NCc3cc(-c4cccs4)on3)cnc2[nH]1 ZINC000072323925 FG Annotated Anodyne Cc1nc(Nc2nnc(C)s2)cc([C@@H]2CCCN2c2ccncc2)n1 ZINC000072360143 FG Annotated Anodyne Cc1nc(Nc2nnc(C)s2)cc([C@H]2CCCN2c2ccncc2)n1 ZINC000072360144 FG Annotated Anodyne Fc1ccc(Nc2ccc(C3CCN(Cc4ncc[nH]4)CC3)nc2)nc1 ZINC000072374290 FG Annotated Anodyne C[C@H]1C[C@H]2C[C@@H](C)[C@@](C)(NC=O)[C@H]3CC[C@H]4[C@H]([C@H]23)[C@@H]1CC[C@]4(C)NC=O ZINC000072937885 FG Annotated Anodyne C[C@@H]1/C=C\CC(=O)NCc2cccc(c2)CNC(=O)N[C@@H]1c1ccccc1 ZINC000073105843 FG Annotated Anodyne C[C@H]1/C=C\CC(=O)NCc2cccc(c2)CNC(=O)N[C@@H]1c1ccccc1 ZINC000073105849 FG Annotated Anodyne COc1cccc(-n2ncc3c(N/N=C\c4cccc(F)c4)ncnc32)c1 ZINC000073113894 FG Annotated Mild CS(=O)(=O)c1ccccc1CSc1nc(O)c(C#N)c2c1CCCC2 ZINC000073129778 FG Annotated Mild COc1cc2c(cc1OC)C1=NN(C(N)=O)[C@H](c3ccccc3Cl)[C@@H]1C2 ZINC000073138191 FG Annotated Anodyne COc1cc2c(cc1OC)C1=NN(C(N)=O)[C@@H](c3ccccc3Cl)[C@@H]1C2 ZINC000073138194 FG Annotated Anodyne COc1cc2c(cc1OC)C1=NN(C(N)=O)[C@H](c3ccccc3Cl)[C@H]1C2 ZINC000073138198 FG Annotated Anodyne COc1cc2c(cc1OC)C1=NN(C(N)=O)[C@@H](c3ccccc3Cl)[C@H]1C2 ZINC000073138201 FG Annotated Anodyne CC(C)(C)CCNc1cc(N[C@@H]2CCN(Cc3ccc(CO)o3)C2)ncn1 ZINC000073157718 FG Annotated Anodyne CC(C)(C)CCNc1cc(N[C@H]2CCN(Cc3ccc(CO)o3)C2)ncn1 ZINC000073157721 FG Annotated Anodyne Cc1nc2c(cnn2-c2ccc(Cl)cc2)c(=O)n1/N=C/c1ccccc1 ZINC000073159207 FG Annotated Mild COC(=O)[C@@]1(Cc2ccc(OC)cc2)CC(=O)O[C@@H]1c1ccc(F)cc1 ZINC000073159572 FG Annotated Anodyne COC(=O)[C@]1(Cc2ccc(OC)cc2)CC(=O)O[C@@H]1c1ccc(F)cc1 ZINC000073159578 FG Annotated Anodyne COC(=O)[C@@]1(Cc2ccc(OC)cc2)CC(=O)O[C@H]1c1ccc(F)cc1 ZINC000073159582 FG Annotated Anodyne COC(=O)[C@]1(Cc2ccc(OC)cc2)CC(=O)O[C@H]1c1ccc(F)cc1 ZINC000073159584 FG Annotated Anodyne CC(=O)[C@@H](C)[C@H]1CC[C@H]2[C@H]3[C@H](C[C@H](O)[C@@]21C)[C@@]1(C)C=CC(=O)C=C1C[C@H]3O ZINC000073160197 FG Annotated Mild Cc1c(COc2cncc(OCCC(C)(C)O)c2)[nH]c2ccccc2c1=O ZINC000073160516 FG Annotated Anodyne C=CCO[C@H]1C=C2CCN3Cc4cc5c(cc4[C@H]([C@@H]1OCC=C)[C@@H]23)OCO5 ZINC000073163432 FG Annotated Mild Cc1c(NCc2nnc(-c3cccs3)o2)c(=O)n(-c2ccccc2)n1C ZINC000073163491 FG Annotated Anodyne COC1=C[C@]2(Oc3ccc(-c4ccccc4)cc3C2=O)C(OC)=C[C@@H]1O ZINC000073164802 FG Annotated Anodyne COC1=C[C@]2(Oc3ccc(-c4ccccc4)cc3C2=O)C(OC)=C[C@H]1O ZINC000073164804 FG Annotated Anodyne COC1=C[C@@]2(Oc3ccc(-c4ccccc4)cc3C2=O)C(OC)=C[C@@H]1O ZINC000073164809 FG Annotated Anodyne COC1=C[C@@]2(Oc3ccc(-c4ccccc4)cc3C2=O)C(OC)=C[C@H]1O ZINC000073164810 FG Annotated Anodyne NC[C@H](CC(=O)O)c1ccc(Cl)c(OCc2ccncc2Cl)c1 ZINC000073165889 FG Annotated Anodyne Nc1nc(N2CCCC2)sc1C(=O)c1ccc(Br)cc1 ZINC000073166867 FG Annotated Anodyne CCCSc1nc(NC(C)=O)c(N(CCC)CCC)c(=O)n1CC ZINC000073167073 FG Annotated Anodyne N#Cc1c(O)nc(S(=O)(=O)Cc2ccccc2Cl)c2c1CCCC2 ZINC000073168272 FG Annotated Mild Cc1nc(C)c(-c2csc(NCCCCCNS(C)(=O)=O)n2)s1 ZINC000073169481 FG Annotated Anodyne Cc1cc(NS(=O)(=O)c2cc3c(cc2F)NC(=O)CC3)ccc1Cl ZINC000073195746 FG Annotated Anodyne CCc1cc(=O)oc2nc(OCc3cccc(C(F)(F)F)c3)[nH]c(=O)c12 ZINC000073195806 FG Annotated Anodyne O=C(/C=C/c1ccc(OC(F)(F)F)cc1)/N=c1/[nH]nc(-c2ccccc2)[nH]1 ZINC000073195915 FG Annotated Anodyne O=c1[nH]ccc2c(Cc3nnc4ccc(-c5cccc(F)c5)nn34)cccc12 ZINC000073196196 FG Annotated Anodyne COCCNc1ccc(C(=O)COc2ccccc2Br)cn1 ZINC000073196668 FG Annotated Anodyne CCOc1ccc(C2=NN(C(C)=O)[C@H](c3ccc([N+](=O)[O-])s3)O2)cc1 ZINC000073196902 FG Annotated Bother CCOc1ccc(C2=NN(C(C)=O)[C@@H](c3ccc([N+](=O)[O-])s3)O2)cc1 ZINC000073196903 FG Annotated Bother CC(=O)NC[C@@H]1c2c(n(C)c3c(Cl)c(Cl)ccc23)C(=O)NC1(C)C ZINC000073197042 FG Annotated Anodyne CC(=O)NC[C@H]1c2c(n(C)c3c(Cl)c(Cl)ccc23)C(=O)NC1(C)C ZINC000073197043 FG Annotated Anodyne O=C(Nc1c(F)c(F)c(-c2ccccc2)c(F)c1F)c1nonc1O ZINC000073197355 FG Annotated Anodyne O=S(=O)(c1cc(F)cc(Cl)c1)c1ccc2c(c1)O[C@H]1CNCC[C@@H]21 ZINC000073197508 FG Annotated Anodyne Fc1ccccc1Cc1nc(-c2nc(C(F)(F)F)n[nH]2)n2cccnc12 ZINC000073197667 FG Annotated Anodyne Fc1ccccc1Cc1nc(-c2nc(C(F)(F)F)n[nH]2)c2cccnn12 ZINC000073197668 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4F)ccc31)[C@@H]1CC[C@H](C2)N1 ZINC000073198003 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4F)ccc31)[C@H]1CC[C@@H](C2)N1 ZINC000073198004 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc(F)cc4)ccc31)[C@@H]1CC[C@H](C2)N1 ZINC000073198007 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc(F)cc4)ccc31)[C@H]1CC[C@@H](C2)N1 ZINC000073198008 FG Annotated Anodyne COC(=O)[C@@]1(Cc2c[nH]c3ccccc23)C[C@H]2COc3ccccc3[C@H]2N1 ZINC000073198189 FG Annotated Anodyne CC(C)Oc1cccc(S(=O)(=O)c2ccc3c(c2)O[C@H]2CNCC[C@@H]32)c1 ZINC000073198221 FG Annotated Anodyne CC1(C)OC[C@H](Cn2cc(CSc3nc4ccccc4s3)nn2)O1 ZINC000073198457 FG Annotated Anodyne CC1(C)OC[C@@H](Cn2cc(CSc3nc4ccccc4s3)nn2)O1 ZINC000073198458 FG Annotated Anodyne O=C(CO[N+](=O)[O-])Nc1ccc(C(=O)/C=C/c2ccc(Cl)cc2)cc1 ZINC000073198622 FG Annotated Mild O=S(=O)(c1ccccc1)n1nc(-c2ccc(CO)o2)c2ccccc21 ZINC000073199132 FG Annotated Anodyne Cc1nc2ccccc2c2nc(Nc3ccc(Cl)cc3)n(N)c(=O)c12 ZINC000073199619 FG Annotated Bother CCCOc1ccc(-c2nnnn2-c2cc(OC)c(OC)c(OC)c2)cc1 ZINC000073199922 FG Annotated Anodyne O=C(NC1CCCCCC1)C1CCN(S(=O)(=O)C2CCCCC2)CC1 ZINC000073221553 FG Annotated Anodyne C=C[C@@]1(C)CC[C@@]2(O)C(=C1C)C(=O)C(=O)[C@H]1C(C)(C)CCC[C@@]12C(=O)OC ZINC000073222279 FG Annotated Mild CN1C(=O)N[C@]2(C[C@@H]2c2ccc3cccc(OCc4ccccc4)c3n2)C1=O ZINC000073223903 FG Annotated Anodyne CN1C(=O)N[C@@]2(C[C@@H]2c2ccc3cccc(OCc4ccccc4)c3n2)C1=O ZINC000073223906 FG Annotated Anodyne CN1C(=O)N[C@]2(C[C@H]2c2ccc3cccc(OCc4ccccc4)c3n2)C1=O ZINC000073223910 FG Annotated Anodyne CN1C(=O)N[C@@]2(C[C@H]2c2ccc3cccc(OCc4ccccc4)c3n2)C1=O ZINC000073223911 FG Annotated Anodyne COC(=O)c1c(C)nc(OC)c(C#N)c1-c1ccc(Br)cc1 ZINC000073224361 FG Annotated Mild O=C1[C@@H]2CCCN2C(=O)N1CCCCNCCc1ccc2ccccc2c1 ZINC000073258613 FG Annotated Anodyne O=C1[C@H]2CCCN2C(=O)N1CCCCNCCc1ccc2ccccc2c1 ZINC000073258615 FG Annotated Anodyne CCCOc1c(OC)ccc2c1[C@@]13CCN(C)[C@@H](C2)[C@H]1C=C(OC)C(=O)C3 ZINC000073258989 FG Annotated Mild CCOc1cccc(/C=N\N/C(S)=N/c2ccccc2[N+](=O)[O-])c1O ZINC000073285370 FG Annotated Mild COC[C@H](C)Nc1ccc(-c2cnnc3cc(OC)c(OC)cc23)cn1 ZINC000073295752 FG Annotated Anodyne CCOc1cc(OC)c2c(c1Cl)O[C@]1(C2=O)C(OC)=CC(=O)C[C@H]1C ZINC000073296250 FG Annotated Mild CCOC1=CC(=O)[C@@]2(Oc3c(Cl)c(OC)cc(OC)c3C2=O)[C@H](C)C1 ZINC000073296263 FG Annotated Mild Cc1cc(NC2=CC(=O)[C@H](C(=O)OC(C)(C)C)[C@H](C(F)(F)F)C2)no1 ZINC000073296414 FG Annotated Mild Cc1cc(NC2=CC(=O)[C@@H](C(=O)OC(C)(C)C)[C@H](C(F)(F)F)C2)no1 ZINC000073296416 FG Annotated Mild Cc1cc(NC2=CC(=O)[C@H](C(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C2)no1 ZINC000073296418 FG Annotated Mild Cc1cc(NC2=CC(=O)[C@@H](C(=O)OC(C)(C)C)[C@@H](C(F)(F)F)C2)no1 ZINC000073296420 FG Annotated Mild COc1cc2nncc(-c3cnc(NC(C)C)c(CO)c3)c2cc1OC ZINC000073296792 FG Annotated Anodyne C=C(C(=O)OCCCn1cncn1)[C@@H]1CC[C@H](C)[C@@H]2CC(=O)C(C)=C2C1 ZINC000073298818 FG Annotated Mild C=C(C(=O)OCCCCn1cncn1)[C@@H]1CC[C@H](C)[C@@H]2CC(=O)C(C)=C2C1 ZINC000073298823 FG Annotated Mild O=C(NCc1cccc(O)c1)c1ccc(O)c2[nH]c(Cc3ccccc3)nc12 ZINC000073314341 FG Annotated Anodyne N#CCN(Cc1ccccc1)[C@@H]1CCC[C@]1(O)C#Cc1ccc2c(c1)OCO2 ZINC000073314593 FG Annotated Mild CC/C(C)=N\N=C\c1c(O)n(CC)c2cc(C3=NNC(=O)CC3)ccc12 ZINC000073332606 FG Annotated Mild N#C/C(=C/c1ccc(OCC(N)=O)cc1)c1nc2c(Cl)cccc2[nH]1 ZINC000073366565 FG Annotated Reactive Cc1cc(C(N)=O)ccc1-n1c(CCC(=O)O)ccc1-c1ccc(O)cc1 ZINC000073385888 FG Annotated Clean O=C1NC(=S)N=C(O)/C1=C/c1c(-c2ccc(O)cc2)[nH]c2ccccc12 ZINC000073389817 FG Annotated Clean Cc1ccccc1C1=N[C@@](C)(CC(=O)NCc2ccccc2F)ON1C ZINC000074373216 FG Annotated Anodyne Cc1ccccc1C1=N[C@](C)(CC(=O)NCc2ccccc2F)ON1C ZINC000074373221 FG Annotated Anodyne COc1cccc(C2=N[C@@](C)(CC(=O)Nc3ccccc3C)ON2C)c1 ZINC000074373346 FG Annotated Anodyne COc1cccc(C2=N[C@](C)(CC(=O)Nc3ccccc3C)ON2C)c1 ZINC000074373349 FG Annotated Anodyne CN1O[C@@](C)(CC(=O)Nc2cccc(F)c2)N=C1c1cc(F)ccc1F ZINC000074373515 FG Annotated Anodyne CN1O[C@](C)(CC(=O)Nc2cccc(F)c2)N=C1c1cc(F)ccc1F ZINC000074373519 FG Annotated Anodyne COc1cc(NC(=O)C[C@@]2(C)N=C(c3ccccc3)N(C)O2)cc(OC)c1 ZINC000074373531 FG Annotated Anodyne COc1cc(NC(=O)C[C@]2(C)N=C(c3ccccc3)N(C)O2)cc(OC)c1 ZINC000074373538 FG Annotated Anodyne CN1O[C@@](C)(CC(=O)NCCc2ccccc2)N=C1c1cccc(Cl)c1 ZINC000074373568 FG Annotated Anodyne CN1O[C@](C)(CC(=O)NCCc2ccccc2)N=C1c1cccc(Cl)c1 ZINC000074373571 FG Annotated Anodyne CN1O[C@@](C)(CC(=O)Nc2cccc(O)c2)N=C1c1ccccc1Cl ZINC000074373592 FG Annotated Anodyne CN1O[C@](C)(CC(=O)Nc2cccc(O)c2)N=C1c1ccccc1Cl ZINC000074373594 FG Annotated Anodyne CN1O[C@@](C)(CC(=O)NCc2ccccc2F)N=C1c1ccccc1F ZINC000074373611 FG Annotated Anodyne CN1O[C@](C)(CC(=O)NCc2ccccc2F)N=C1c1ccccc1F ZINC000074373612 FG Annotated Anodyne COc1cccc(C2=N[C@](C)(CC(=O)Nc3cccc(F)c3)ON2C)c1 ZINC000074373618 FG Annotated Anodyne COc1cccc(C2=N[C@@](C)(CC(=O)Nc3cccc(F)c3)ON2C)c1 ZINC000074373620 FG Annotated Anodyne CN1O[C@@](C)(CC(=O)NCc2ccc(F)c(Cl)c2)N=C1c1ccco1 ZINC000074374081 FG Annotated Anodyne CN1O[C@](C)(CC(=O)NCc2ccc(F)c(Cl)c2)N=C1c1ccco1 ZINC000074374084 FG Annotated Anodyne CN1O[C@@](C)(CC(=O)Nc2ccccc2F)N=C1c1cc(F)ccc1F ZINC000074374088 FG Annotated Anodyne CN1O[C@](C)(CC(=O)Nc2ccccc2F)N=C1c1cc(F)ccc1F ZINC000074374091 FG Annotated Anodyne CN1O[C@@](C)(CC(=O)NCc2ccccc2)N=C1c1ccccc1Cl ZINC000074374206 FG Annotated Anodyne CN1O[C@](C)(CC(=O)NCc2ccccc2)N=C1c1ccccc1Cl ZINC000074374211 FG Annotated Anodyne CN1O[C@@](C)(CC(=O)Nc2cccc(N(C)C)c2)N=C1c1ccccc1F ZINC000074374215 FG Annotated Anodyne CN1O[C@](C)(CC(=O)Nc2cccc(N(C)C)c2)N=C1c1ccccc1F ZINC000074374220 FG Annotated Anodyne CN1O[C@@](C)(CC(=O)Nc2ccc(F)cc2F)N=C1c1ccccc1F ZINC000074374242 FG Annotated Anodyne CN1O[C@](C)(CC(=O)Nc2ccc(F)cc2F)N=C1c1ccccc1F ZINC000074374247 FG Annotated Anodyne Cc1ccccc1C1=N[C@@](C)(CC(=O)N(C)Cc2ccccc2)ON1C ZINC000074374343 FG Annotated Anodyne Cc1ccccc1C1=N[C@](C)(CC(=O)N(C)Cc2ccccc2)ON1C ZINC000074374349 FG Annotated Anodyne CN1O[C@@](C)(CC(=O)Nc2cccc(O)c2)N=C1c1cccc(Cl)c1 ZINC000074374410 FG Annotated Anodyne CN1O[C@](C)(CC(=O)Nc2cccc(O)c2)N=C1c1cccc(Cl)c1 ZINC000074374414 FG Annotated Anodyne COc1ccccc1NC(=O)C[C@]1(C)N=C(c2ccccc2C)N(C)O1 ZINC000074374580 FG Annotated Anodyne COc1ccccc1NC(=O)C[C@@]1(C)N=C(c2ccccc2C)N(C)O1 ZINC000074374584 FG Annotated Anodyne Cc1ccccc1C1=N[C@@](C)(CC(=O)NCCc2ccccc2)ON1C ZINC000074374595 FG Annotated Anodyne Cc1ccccc1C1=N[C@](C)(CC(=O)NCCc2ccccc2)ON1C ZINC000074374600 FG Annotated Anodyne Cc1ccccc1C1=N[C@@](C)(CC(=O)N2CCc3ccccc3C2)ON1C ZINC000074374603 FG Annotated Anodyne Cc1ccccc1C1=N[C@](C)(CC(=O)N2CCc3ccccc3C2)ON1C ZINC000074374607 FG Annotated Anodyne CN1O[C@@](C)(CC(=O)N2CCc3ccccc3C2)N=C1c1ccccc1F ZINC000074374676 FG Annotated Anodyne CN1O[C@](C)(CC(=O)N2CCc3ccccc3C2)N=C1c1ccccc1F ZINC000074374683 FG Annotated Anodyne COC(=O)c1cccc(-c2ccc3c(c2)COCC(=O)N3CC2CC2)c1 ZINC000074374942 FG Annotated Anodyne O=C(c1ccccc1F)N1C[C@H]2ON=C(c3c(F)cccc3Cl)[C@@H]2C1 ZINC000074377420 FG Annotated Anodyne O=C(c1ccccc1F)N1C[C@H]2ON=C(c3c(F)cccc3Cl)[C@H]2C1 ZINC000074377426 FG Annotated Anodyne O=C(c1ccccc1F)N1C[C@H]2C(c3c(F)cccc3Cl)=NO[C@H]2C1 ZINC000074377437 FG Annotated Anodyne O=C(c1ccccc1F)N1C[C@@H]2ON=C(c3c(F)cccc3Cl)[C@H]2C1 ZINC000074377440 FG Annotated Anodyne Cc1ccccc1C1=NO[C@H]2CN(C(=O)c3cc(C)n(C(C)(C)C)n3)C[C@H]12 ZINC000074377504 FG Annotated Anodyne Cc1ccccc1C1=NO[C@@H]2CN(C(=O)c3cc(C)n(C(C)(C)C)n3)C[C@H]12 ZINC000074377507 FG Annotated Anodyne Cc1ccccc1C1=NO[C@H]2CN(C(=O)c3cc(C)n(C(C)(C)C)n3)C[C@@H]12 ZINC000074377512 FG Annotated Anodyne Cc1ccccc1C1=NO[C@@H]2CN(C(=O)c3cc(C)n(C(C)(C)C)n3)C[C@@H]12 ZINC000074377516 FG Annotated Anodyne CC(C)c1ccc(S(=O)(=O)N2C[C@H]3ON=C(c4ccccc4)[C@@H]3C2)cc1 ZINC000074378266 FG Annotated Anodyne CC(C)c1ccc(S(=O)(=O)N2C[C@H]3ON=C(c4ccccc4)[C@H]3C2)cc1 ZINC000074378270 FG Annotated Anodyne O=C(c1cccc(F)c1)N1C[C@H]2ON=C(c3c(F)cccc3Cl)[C@@H]2C1 ZINC000074378412 FG Annotated Anodyne O=C(c1cccc(F)c1)N1C[C@H]2ON=C(c3c(F)cccc3Cl)[C@H]2C1 ZINC000074378414 FG Annotated Anodyne O=C(c1cccc(F)c1)N1C[C@H]2C(c3c(F)cccc3Cl)=NO[C@H]2C1 ZINC000074378419 FG Annotated Anodyne O=C(c1cccc(F)c1)N1C[C@@H]2ON=C(c3c(F)cccc3Cl)[C@H]2C1 ZINC000074378426 FG Annotated Anodyne CCCc1ccc(S(=O)(=O)N2C[C@H]3ON=C(c4ccccc4)[C@@H]3C2)cc1 ZINC000074378654 FG Annotated Anodyne CCCc1ccc(S(=O)(=O)N2C[C@H]3ON=C(c4ccccc4)[C@H]3C2)cc1 ZINC000074378656 FG Annotated Anodyne O=C(c1ccc(F)c(Cl)c1)N1C[C@@H]2ON=C(c3ccc(F)cc3)[C@H]2C1 ZINC000074378657 FG Annotated Anodyne O=C(c1ccc(F)c(Cl)c1)N1C[C@H]2ON=C(c3ccc(F)cc3)[C@H]2C1 ZINC000074378664 FG Annotated Anodyne O=C(c1ccc(F)c(Cl)c1)N1C[C@H]2C(c3ccc(F)cc3)=NO[C@H]2C1 ZINC000074378669 FG Annotated Anodyne O=C(c1ccc(F)c(Cl)c1)N1C[C@H]2ON=C(c3ccc(F)cc3)[C@@H]2C1 ZINC000074378670 FG Annotated Anodyne Cc1ccccc1C1=NO[C@H]2CN(C(=O)c3c(F)ccc(C)c3F)C[C@H]12 ZINC000074379473 FG Annotated Anodyne Cc1ccccc1C1=NO[C@@H]2CN(C(=O)c3c(F)ccc(C)c3F)C[C@H]12 ZINC000074379477 FG Annotated Anodyne Cc1ccccc1C1=NO[C@H]2CN(C(=O)c3c(F)ccc(C)c3F)C[C@@H]12 ZINC000074379483 FG Annotated Anodyne Cc1ccccc1C1=NO[C@@H]2CN(C(=O)c3c(F)ccc(C)c3F)C[C@@H]12 ZINC000074379484 FG Annotated Anodyne OCC/N=C(\O)c1cccc(-c2ccc3ncc(-c4ccccc4)n3n2)c1 ZINC000074386049 FG Annotated Mild C/N=C(\O)c1cccc(-c2ccc3ncc(-c4ccc(CO)cc4)n3n2)c1 ZINC000074386204 FG Annotated Mild COCC/N=C(\O)c1cccc(-c2nc3c(NCC4CC4)nccc3[nH]2)c1 ZINC000074386553 FG Annotated Mild CC(C)c1cccc(-c2nc3c(NCCN4CCOCC4)nccc3[nH]2)c1 ZINC000074386632 FG Annotated Anodyne FC(F)(F)Oc1cccc(-c2nc3ccnc(N4CCOCC4)c3[nH]2)c1 ZINC000074386695 FG Annotated Anodyne COc1cccc(-c2cnn(C(C)(C)C(=O)NCc3cccs3)c2)n1 ZINC000074387565 FG Annotated Anodyne CC(C)(C(=O)Nc1ccccn1)n1cc(-c2ccc3c(c2)OCCO3)cn1 ZINC000074387582 FG Annotated Anodyne COc1ccc(-c2cnn(C(C)(C)C(=O)NCc3ccco3)c2)cc1OC ZINC000074387617 FG Annotated Anodyne CC(C)(C(=O)Nc1ccncc1)n1cc(-c2ccc3c(c2)OCCO3)cn1 ZINC000074387661 FG Annotated Anodyne COc1ccc(-c2nnc3ccc(C#Cc4ccncc4)cn23)cc1OC ZINC000074457230 FG Annotated Anodyne Cc1ccc(C(=O)COC(=O)C2C[C@@H]3CCC[C@H](C2)C3=O)cc1[N+](=O)[O-] ZINC000007973881 FG Annotated Bother C[C@H](NC(=O)COC(=O)CSc1ccc(F)cc1)c1ccc(F)cc1 ZINC000007985519 FG Annotated Anodyne C[C@@H](NC(=O)COC(=O)CSc1ccc(F)cc1)c1ccc(F)cc1 ZINC000007985520 FG Annotated Anodyne CO/C(O)=C1/C(C)=Nc2nc(SC(C)C)[nH]c(=O)c2[C@H]1c1cccnc1 ZINC000007990962 FG Annotated Anodyne COc1ccc(NC(=O)[C@H]2C(=O)N(C)[C@@]3(C)C[C@@H]2c2ccccc2O3)cc1 ZINC000007991261 FG Annotated Anodyne CN(c1ccccc1)[C@H](c1ccc(F)cc1)c1nnnn1C[C@H]1CCCO1 ZINC000007991642 FG Annotated Anodyne CCCn1c(-c2ccc(F)cc2)nc2c(NCCN(C)C)nc(C)nc21 ZINC000007991775 FG Annotated Anodyne CCCn1c(-c2ccc(F)cc2)nc2c(N3CCN(C)CC3)nc(C)nc21 ZINC000007991793 FG Annotated Anodyne CCCn1c(-c2ccc(F)cc2)nc2c(N(C)CCN(C)C)nc(C)nc21 ZINC000007991794 FG Annotated Anodyne CCCn1c(C)nc2c(N(CCN(C)C)Cc3ccccc3)nc(C)nc21 ZINC000007991908 FG Annotated Anodyne CCOC(=O)OC[C@@H]1O[C@@H](C#CC(C)(C)C)C=C[C@H]1OC(=O)OCC ZINC000007992123 FG Annotated Mild CCOC(=O)OC[C@H]1O[C@@H](C#CC(C)(C)C)C=C[C@@H]1OC(=O)OCC ZINC000007992124 FG Annotated Mild CCOC(=O)OC[C@@H]1O[C@@H](C#CC(C)(C)C)C=C[C@@H]1OC(=O)OCC ZINC000007992125 FG Annotated Mild COc1ccc(O[C@@H]2C=C[C@H](c3ccccc3)O[C@@H]2CO)c(C(C)=O)c1 ZINC000007992142 FG Annotated Anodyne COc1ccc(O[C@H]2C=C[C@H](c3ccccc3)O[C@@H]2CO)c(C(C)=O)c1 ZINC000007992143 FG Annotated Anodyne COc1ccc(O[C@@H]2C=C[C@@H](c3ccccc3)O[C@@H]2CO)c(C(C)=O)c1 ZINC000007992144 FG Annotated Anodyne COc1ccc(O[C@H]2C=C[C@@H](c3ccccc3)O[C@@H]2CO)c(C(C)=O)c1 ZINC000007992145 FG Annotated Anodyne C[C@]1(O)C(=O)C=C2C=C(CCCCOCc3ccccc3)OC=C2C1=O ZINC000007992338 FG Annotated Mild C[C@@]1(O)C(=O)C=C2C=C(CCCCOCc3ccccc3)OC=C2C1=O ZINC000007992339 FG Annotated Mild CCOC(=O)OC[C@@H]1O[C@@H](C#Cc2ccccc2)C=C[C@H]1OC(=O)OCC ZINC000007992513 FG Annotated Mild CCOC(=O)OC[C@H]1O[C@@H](C#Cc2ccccc2)C=C[C@@H]1OC(=O)OCC ZINC000007992514 FG Annotated Mild CCOC(=O)OC[C@@H]1O[C@@H](C#Cc2ccccc2)C=C[C@@H]1OC(=O)OCC ZINC000007992515 FG Annotated Mild CCOC(=O)OC[C@@H]1O[C@@H](c2ccccc2)C=C[C@H]1OC(=O)OCC ZINC000007992517 FG Annotated Anodyne CCOC(=O)OC[C@H]1O[C@@H](c2ccccc2)C=C[C@@H]1OC(=O)OCC ZINC000007992518 FG Annotated Anodyne CCOC(=O)OC[C@@H]1O[C@@H](c2ccccc2)C=C[C@@H]1OC(=O)OCC ZINC000007992519 FG Annotated Anodyne CC(=O)OC[C@@H]1O[C@@H](C#Cc2ccc(C(C)(C)C)cc2)C=C[C@H]1OC(C)=O ZINC000007992533 FG Annotated Mild CC(=O)OC[C@H]1O[C@@H](C#Cc2ccc(C(C)(C)C)cc2)C=C[C@@H]1OC(C)=O ZINC000007992534 FG Annotated Mild CC(=O)OC[C@@H]1O[C@@H](C#Cc2ccc(C(C)(C)C)cc2)C=C[C@@H]1OC(C)=O ZINC000007992535 FG Annotated Mild COc1ccc(O[C@@H]2C=C[C@H](C#Cc3ccc(F)cc3F)O[C@@H]2CO)cc1 ZINC000007992568 FG Annotated Mild COc1ccc(O[C@H]2C=C[C@H](C#Cc3ccc(F)cc3F)O[C@@H]2CO)cc1 ZINC000007992569 FG Annotated Mild COc1ccc(O[C@@H]2C=C[C@@H](C#Cc3ccc(F)cc3F)O[C@@H]2CO)cc1 ZINC000007992570 FG Annotated Mild COc1ccc(O[C@H]2C=C[C@@H](C#Cc3ccc(F)cc3F)O[C@@H]2CO)cc1 ZINC000007992571 FG Annotated Mild COc1ccc(O[C@@H]2[C@H](O)CO[C@@H]2/C=C/C#Cc2ccc(F)cc2F)cc1 ZINC000007992592 FG Annotated Mild COc1ccc(O[C@H]2[C@H](O)CO[C@@H]2/C=C/C#Cc2ccc(F)cc2F)cc1 ZINC000007992593 FG Annotated Mild COc1ccc(O[C@@H]2[C@@H](O)CO[C@@H]2/C=C/C#Cc2ccc(F)cc2F)cc1 ZINC000007992594 FG Annotated Mild COc1ccc(O[C@H]2[C@@H](O)CO[C@@H]2/C=C/C#Cc2ccc(F)cc2F)cc1 ZINC000007992595 FG Annotated Mild Cc1cc(F)ccc1O[C@@H]1C=C[C@H](c2ccc3c(c2)OCO3)O[C@@H]1CO ZINC000007992608 FG Annotated Anodyne Cc1cc(F)ccc1O[C@H]1C=C[C@H](c2ccc3c(c2)OCO3)O[C@@H]1CO ZINC000007992609 FG Annotated Anodyne Cc1cc(F)ccc1O[C@@H]1C=C[C@@H](c2ccc3c(c2)OCO3)O[C@@H]1CO ZINC000007992610 FG Annotated Anodyne Cc1cc(F)ccc1O[C@H]1C=C[C@@H](c2ccc3c(c2)OCO3)O[C@@H]1CO ZINC000007992611 FG Annotated Anodyne COc1ccc(C#C[C@H]2C=C[C@@H](Oc3cc(C)cc(C)c3)[C@@H](CO)O2)cc1 ZINC000007992612 FG Annotated Mild COc1ccc(C#C[C@H]2C=C[C@H](Oc3cc(C)cc(C)c3)[C@@H](CO)O2)cc1 ZINC000007992613 FG Annotated Mild COc1ccc(C#C[C@@H]2C=C[C@@H](Oc3cc(C)cc(C)c3)[C@@H](CO)O2)cc1 ZINC000007992614 FG Annotated Mild COc1ccc(C#C[C@@H]2C=C[C@H](Oc3cc(C)cc(C)c3)[C@@H](CO)O2)cc1 ZINC000007992615 FG Annotated Mild OC[C@@H]1O[C@H](/C=C\c2ccccc2)C=C[C@@H]1Oc1ccc2c(c1)OCO2 ZINC000007992640 FG Annotated Anodyne OC[C@@H]1O[C@@H](/C=C\c2ccccc2)C=C[C@@H]1Oc1ccc2c(c1)OCO2 ZINC000007992641 FG Annotated Anodyne OC[C@@H]1O[C@H](/C=C\c2ccccc2)C=C[C@H]1Oc1ccc2c(c1)OCO2 ZINC000007992642 FG Annotated Anodyne OC[C@@H]1O[C@@H](/C=C\c2ccccc2)C=C[C@H]1Oc1ccc2c(c1)OCO2 ZINC000007992643 FG Annotated Anodyne CC(C)C[C@]1(C(=O)NCc2ccccn2)C=CCN1C(=O)c1ccccc1 ZINC000007992724 FG Annotated Anodyne CC(C)C[C@@]1(C(=O)NCc2ccccn2)C=CCN1C(=O)c1ccccc1 ZINC000007992725 FG Annotated Anodyne COC(=O)N1[C@H](C)C=C[C@]1(Cc1ccccc1)C(=O)NCc1ccc(C)o1 ZINC000007992826 FG Annotated Anodyne CC[C@@]12CCCN3CC[C@@]4(c5ccc(OC)c(O)c5N(C(C)=O)[C@H]4CC1)[C@H]32 ZINC000007998065 FG Annotated Anodyne CCO[C@H](c1cc(OC)cc([N+](=O)[O-])c1OC)[C@H](C)/C=C\CC(=O)OC ZINC000007998468 FG Annotated Bother Cc1cc(N2C(=O)[C@@H]3CCCN3[C@H]2c2cccc(Br)c2)no1 ZINC000075403055 FG Annotated Anodyne O=C(COc1ccc2ccccc2c1O)NCCc1nc2ccccc2[nH]1 ZINC000075830263 FG Annotated Anodyne O=C(Nc1ccc(N2CCOCC2)cc1)c1cc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000077679291 FG Annotated Anodyne CC(=O)Nc1cc(NC(C)=O)cc(C(=O)N2CCC[C@H]3CCCC[C@@H]32)c1 ZINC000008071259 FG Annotated Anodyne CC(=O)Nc1cc(NC(C)=O)cc(C(=O)N2CCC[C@@H]3CCCC[C@H]32)c1 ZINC000008071266 FG Annotated Anodyne O=C(N/N=C/c1ccncc1)c1nc(-c2ccccc2)n2c1CCCCC2 ZINC000008311133 FG Annotated Reactive COc1cc(C[S@](=O)c2nc3cscc3[nH]2)ncc1Br ZINC000008462259 FG Annotated Anodyne N#Cc1cccc(-c2cn(-c3cccc(I)c3)nn2)c1 ZINC000081425778 FG Annotated Anodyne CCCn1cc(-c2ccnc(N3CC(N4CCCC[C@@H]4C)C3)n2)c(C)n1 ZINC000082039527 FG Annotated Anodyne CCCn1cc(-c2ccnc(N3CC(N4CCCC[C@H]4C)C3)n2)c(C)n1 ZINC000082039528 FG Annotated Anodyne Clc1cccc(-n2cc(-c3ccnc(NCCc4c[nH]cn4)n3)cn2)c1 ZINC000082039612 FG Annotated Anodyne C[C@]12CCC[C@]3(CO3)[C@@H]1C[C@@H]1[C@@H](CNCc3ccccc3)C(=O)O[C@@H]1C2 ZINC000082051902 FG Annotated Anodyne C[C@]12CCC[C@]3(CO3)[C@H]1C[C@@H]1[C@@H](CNCc3ccccc3)C(=O)O[C@@H]1C2 ZINC000082051903 FG Annotated Anodyne C[C@]12CCC[C@]3(CO3)[C@@H]1C[C@H]1[C@@H](C2)OC(=O)[C@H]1CNCc1ccccc1 ZINC000082051905 FG Annotated Anodyne C[C@]12CCC[C@]3(CO3)[C@H]1C[C@H]1[C@@H](C2)OC(=O)[C@H]1CNCc1ccccc1 ZINC000082051907 FG Annotated Anodyne CN(CCc1ccoc1)C[C@H]1C(=O)O[C@@H]2C[C@@]3(C)CCC[C@]4(CO4)[C@@H]3C[C@H]12 ZINC000082052155 FG Annotated Anodyne CN(CCc1ccoc1)C[C@H]1C(=O)O[C@@H]2C[C@@]3(C)CCC[C@]4(CO4)[C@H]3C[C@H]12 ZINC000082052158 FG Annotated Anodyne CN(CCc1ccoc1)C[C@@H]1C(=O)O[C@@H]2C[C@@]3(C)CCC[C@]4(CO4)[C@@H]3C[C@@H]21 ZINC000082052160 FG Annotated Anodyne CN(CCc1ccoc1)C[C@@H]1C(=O)O[C@@H]2C[C@@]3(C)CCC[C@]4(CO4)[C@H]3C[C@@H]21 ZINC000082052161 FG Annotated Anodyne CN(C)c1ccc(-c2nnc3ccc(-c4ccc(C(=O)O)cc4)nn23)cc1 ZINC000082060526 FG Annotated Anodyne COc1ccc(Oc2nc(NCc3ccco3)nc(N3CCCC3)n2)cc1 ZINC000082066770 FG Annotated Anodyne COc1ccc(Oc2nc(N[C@@H](C)CC#N)nc(N3CC=CCC3)n2)cc1 ZINC000082066887 FG Annotated Mild COc1ccc(Oc2nc(N[C@H](C)CC#N)nc(N3CC=CCC3)n2)cc1 ZINC000082066888 FG Annotated Mild CCN(CC)c1nc(N[C@@H](C)CC#N)nc(Oc2ccc(OC)cc2)n1 ZINC000082067005 FG Annotated Mild CCN(CC)c1nc(N[C@H](C)CC#N)nc(Oc2ccc(OC)cc2)n1 ZINC000082067006 FG Annotated Mild C=CCN(C)c1nc(NCc2ccco2)nc(Oc2ccc(OC)cc2)n1 ZINC000082067156 FG Annotated Mild C=CCN(C)c1nc(N[C@@H](C)CC#N)nc(Oc2ccc(OC)cc2)n1 ZINC000082067191 FG Annotated Mild C=CCN(C)c1nc(N[C@H](C)CC#N)nc(Oc2ccc(OC)cc2)n1 ZINC000082067192 FG Annotated Mild COc1ccc(Oc2nc(N[C@@H](C)CC#N)nc(N(C)C(C)C)n2)cc1 ZINC000082067291 FG Annotated Mild COc1ccc(Oc2nc(N[C@H](C)CC#N)nc(N(C)C(C)C)n2)cc1 ZINC000082067292 FG Annotated Mild COc1ccccc1Oc1cc(N(CCO)Cc2ccccc2)ncn1 ZINC000082067312 FG Annotated Anodyne COc1ccc(Oc2cc(N(CCO)Cc3ccccc3)ncn2)cc1 ZINC000082067317 FG Annotated Anodyne O=C1CCCN1CCCNc1cc(Oc2cccc3cccnc23)ncn1 ZINC000082067573 FG Annotated Anodyne COc1cc(OC)cc(Oc2cc(NCCc3ccccn3)ncn2)c1 ZINC000082067723 FG Annotated Anodyne CC(C)(CO)CCCNc1cncc(Oc2ccc(-n3cncn3)cc2)n1 ZINC000082068451 FG Annotated Anodyne OCCOCCNc1cncc(Oc2cccc(Nc3ccccc3)c2)n1 ZINC000082068476 FG Annotated Anodyne CC(=O)Nc1cccc(Oc2cncc(NCCCC(C)(C)CO)n2)c1 ZINC000082068515 FG Annotated Anodyne CCCCOCCCNc1cncc(Oc2ccc(-n3cncn3)cc2)n1 ZINC000082068568 FG Annotated Anodyne c1cc(Oc2cncc(NCc3ccco3)n2)cc(N2CCOCC2)c1 ZINC000082068748 FG Annotated Anodyne COc1ccc(CNc2cncc(Oc3ccc(-n4cncn4)cc3)n2)cc1 ZINC000082068754 FG Annotated Anodyne COC(=O)c1ccc(CNC(=O)c2coc(-c3ccccc3C)n2)cc1 ZINC000082069893 FG Annotated Anodyne CCc1nc(C(=O)N[C@H](C(=O)NCCC2=CCCCC2)C(C)C)cs1 ZINC000082070020 FG Annotated Anodyne CCc1nc(C(=O)N[C@@H](C(=O)NCCC2=CCCCC2)C(C)C)cs1 ZINC000082070021 FG Annotated Anodyne CCc1nc(C(=O)N[C@H](C(=O)NCC2CCCCC2)C(C)C)cs1 ZINC000082070034 FG Annotated Anodyne CCc1nc(C(=O)N[C@@H](C(=O)NCC2CCCCC2)C(C)C)cs1 ZINC000082070035 FG Annotated Anodyne CCC#CCOC(=O)[C@H](NC(=O)c1coc(-c2ccc(C)cc2)n1)C(C)C ZINC000082070298 FG Annotated Mild CCC#CCOC(=O)[C@@H](NC(=O)c1coc(-c2ccc(C)cc2)n1)C(C)C ZINC000082070299 FG Annotated Mild CCC#CCOC(=O)[C@H](NC(=O)c1coc(-c2ccccc2C)n1)C(C)C ZINC000082070322 FG Annotated Mild CCC#CCOC(=O)[C@@H](NC(=O)c1coc(-c2ccccc2C)n1)C(C)C ZINC000082070323 FG Annotated Mild CCCCOCCOC(=O)[C@@H](C)NC(=O)c1coc(-c2ccc(C)cc2)n1 ZINC000082070819 FG Annotated Anodyne CCCCOCCOC(=O)[C@H](C)NC(=O)c1coc(-c2ccc(C)cc2)n1 ZINC000082070820 FG Annotated Anodyne CCCCOCCOC(=O)[C@@H](C)NC(=O)c1coc(-c2ccccc2C)n1 ZINC000082070844 FG Annotated Anodyne CCCCOCCOC(=O)[C@H](C)NC(=O)c1coc(-c2ccccc2C)n1 ZINC000082070845 FG Annotated Anodyne O=C(CNC(=O)c1csc(-c2ccccc2)n1)NCC1CCCCC1 ZINC000082071899 FG Annotated Anodyne Cc1ccc(-c2nc(C(=O)NCC(=O)NCCC3=CCCCC3)co2)cc1 ZINC000082071933 FG Annotated Anodyne Cc1ccccc1-c1nc(C(=O)NCC(=O)NCCC2=CCCCC2)co1 ZINC000082071957 FG Annotated Anodyne Cc1ccccc1-c1nc(C(=O)NCC(=O)NCC2CCCCC2)co1 ZINC000082071974 FG Annotated Anodyne O=C(NCCO)c1coc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1 ZINC000082072028 FG Annotated Anodyne CCc1nc(C(=O)N2CCC[C@@H]2C(=O)NCCC2=CCCCC2)cs1 ZINC000082072834 FG Annotated Anodyne CCc1nc(C(=O)N2CCC[C@H]2C(=O)NCCC2=CCCCC2)cs1 ZINC000082072835 FG Annotated Anodyne CCC#CCOC(=O)[C@@H]1CCCN1C(=O)c1coc(-c2ccc(C)cc2)n1 ZINC000082073385 FG Annotated Mild CCC#CCOC(=O)[C@H]1CCCN1C(=O)c1coc(-c2ccc(C)cc2)n1 ZINC000082073388 FG Annotated Mild CCC#CCOC(=O)[C@@H]1CCCN1C(=O)c1coc(-c2ccccc2C)n1 ZINC000082073443 FG Annotated Mild CCC#CCOC(=O)[C@H]1CCCN1C(=O)c1coc(-c2ccccc2C)n1 ZINC000082073445 FG Annotated Mild Cc1ccc(-c2nc(C(=O)N(C)CC(=O)NCC3CCCCC3)co2)cc1 ZINC000082073727 FG Annotated Anodyne Cc1ccccc1-c1nc(C(=O)N(C)CC(=O)NCC2CCCCC2)co1 ZINC000082073749 FG Annotated Anodyne CCCCOCCOC(=O)CN(C)C(=O)c1coc(-c2ccc(C)cc2)n1 ZINC000082074037 FG Annotated Anodyne O=C(N[C@H](CO)COCc1ccccc1)c1csc(-c2ccccc2)n1 ZINC000082074174 FG Annotated Anodyne O=C(N[C@@H](CO)COCc1ccccc1)c1csc(-c2ccccc2)n1 ZINC000082074176 FG Annotated Anodyne NCCOC(=O)c1coc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1 ZINC000082074913 FG Annotated Anodyne COc1ncccc1-c1cc2c(cn1)[nH]/c(=N\Cc1cccc(C)c1)n2C ZINC000082078174 FG Annotated Anodyne COc1cccc(Nc2nnc([C@@H](O)c3cccc(N(C)C)c3)s2)c1 ZINC000082078444 FG Annotated Anodyne COc1cccc(Nc2nnc([C@H](O)c3cccc(N(C)C)c3)s2)c1 ZINC000082078445 FG Annotated Anodyne O/C(=N\Cc1ccccc1)c1csc([C@H](O)c2ccc3c(c2)OCO3)n1 ZINC000082078746 FG Annotated Mild O/C(=N\Cc1ccccc1)c1csc([C@@H](O)c2ccc3c(c2)OCO3)n1 ZINC000082078748 FG Annotated Mild O[C@@H](c1nnc(N2CCCCC2)s1)c1c(F)c(F)c(F)c(F)c1F ZINC000082079046 FG Annotated Anodyne O[C@H](c1nnc(N2CCCCC2)s1)c1c(F)c(F)c(F)c(F)c1F ZINC000082079047 FG Annotated Anodyne CCCCNC(=O)[C@@H]1CCCN(C(=O)c2coc(-c3cccs3)n2)C1 ZINC000082081406 FG Annotated Anodyne CCCCNC(=O)[C@H]1CCCN(C(=O)c2coc(-c3cccs3)n2)C1 ZINC000082081407 FG Annotated Anodyne O=C(c1coc(-c2cccs2)n1)N1CCC[C@H](C(=O)N2CCCCC2)C1 ZINC000082081418 FG Annotated Anodyne O=C(c1coc(-c2cccs2)n1)N1CCC[C@@H](C(=O)N2CCCCC2)C1 ZINC000082081419 FG Annotated Anodyne CCC#CCOC(=O)[C@@H]1CCCN(C(=O)c2coc(-c3cccs3)n2)C1 ZINC000082081568 FG Annotated Mild CCC#CCOC(=O)[C@H]1CCCN(C(=O)c2coc(-c3cccs3)n2)C1 ZINC000082081569 FG Annotated Mild O=C(NCc1ccc(CO)cc1)c1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000082081672 FG Annotated Bother O=C(NCc1ccc(CO)cc1)c1csc(-c2ccccc2[N+](=O)[O-])n1 ZINC000082081732 FG Annotated Bother O=S(=O)(Nc1ccc2nc(-c3cccc(Cl)c3)nn2c1)c1ccoc1 ZINC000082081766 FG Annotated Anodyne O=S(=O)(Nc1ccc2nc(-c3cccc(Cl)c3)nn2c1)c1ccco1 ZINC000082081806 FG Annotated Anodyne C/N=c1\[nH]c2cnc(Nc3ccc(C(=O)OC)cc3)cc2n1-c1ccccc1 ZINC000082081821 FG Annotated Anodyne O=S(=O)(Nc1ccc2nc(-c3cccc(F)c3)nn2c1)c1ccccc1 ZINC000082081991 FG Annotated Anodyne CC(C)[C@H](NC(=O)c1coc(-c2cccs2)n1)C(=O)NCc1ccco1 ZINC000082082113 FG Annotated Anodyne CC(C)[C@@H](NC(=O)c1coc(-c2cccs2)n1)C(=O)NCc1ccco1 ZINC000082082114 FG Annotated Anodyne CC(C)[C@H](NC(=O)c1coc(-c2cccs2)n1)C(=O)N1CCCCC1 ZINC000082082378 FG Annotated Anodyne CC(C)[C@@H](NC(=O)c1coc(-c2cccs2)n1)C(=O)N1CCCCC1 ZINC000082082379 FG Annotated Anodyne CCC#CCOC(=O)[C@H](NC(=O)c1coc(-c2cccs2)n1)C(C)C ZINC000082082634 FG Annotated Mild CCC#CCOC(=O)[C@@H](NC(=O)c1coc(-c2cccs2)n1)C(C)C ZINC000082082636 FG Annotated Mild COC(=O)[C@@H](NC(=O)c1coc(-c2ccc3ccccc3c2)n1)C(C)C ZINC000082082744 FG Annotated Anodyne COC(=O)[C@H](NC(=O)c1coc(-c2ccc3ccccc3c2)n1)C(C)C ZINC000082082747 FG Annotated Anodyne C[C@H](NC(=O)c1coc(-c2cccs2)n1)C(=O)NCC1CCCCC1 ZINC000082083010 FG Annotated Anodyne C[C@@H](NC(=O)c1coc(-c2cccs2)n1)C(=O)NCC1CCCCC1 ZINC000082083011 FG Annotated Anodyne C/N=c1\[nH]c2cnc(Nc3cccc(N(C)C)c3)cc2n1Cc1ccco1 ZINC000082083148 FG Annotated Anodyne CCCCNC(=O)[C@H](C)NC(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000082083283 FG Annotated Anodyne Cc1ccccc1-c1cnc([C@H](O)c2cccc(CN3CCOCC3)c2)[nH]1 ZINC000082083993 FG Annotated Anodyne Cc1ccccc1-c1cnc([C@@H](O)c2cccc(CN3CCOCC3)c2)[nH]1 ZINC000082083994 FG Annotated Anodyne O=C(N[C@H](CO)CSCc1ccccc1)c1coc(-c2cccs2)n1 ZINC000082084515 FG Annotated Anodyne O=C(N[C@@H](CO)CSCc1ccccc1)c1coc(-c2cccs2)n1 ZINC000082084516 FG Annotated Anodyne O=C(CNC(=O)c1coc(-c2cccs2)n1)NCCC1=CCCCC1 ZINC000082084794 FG Annotated Anodyne CN(CC(=O)NCCC1=CCCCC1)C(=O)c1coc(-c2cccs2)n1 ZINC000082085657 FG Annotated Anodyne CN(CC(=O)NCC1CCCCC1)C(=O)c1coc(-c2cccs2)n1 ZINC000082085664 FG Annotated Anodyne COc1cc(OC)cc(-c2nc(C(=O)NCc3ccccc3N)cs2)c1 ZINC000082086256 FG Annotated Anodyne COc1cc(OC)cc(-c2nc(C(=O)OCC(C)(C)N(C)C)cs2)c1 ZINC000082086400 FG Annotated Anodyne COc1cc(OC)cc(-c2nc(C(=O)OCCCCN(C)C)cs2)c1 ZINC000082086401 FG Annotated Anodyne CCCCOC(=O)COC(=O)c1csc(-c2ccccc2[N+](=O)[O-])n1 ZINC000082086426 FG Annotated Bother CN(C)CCOCCOC(=O)c1coc(-c2ccc3ccccc3c2)n1 ZINC000082086433 FG Annotated Anodyne CCCCOCCOC(=O)CN(C)C(=O)c1coc(-c2ccccc2C)n1 ZINC000082088104 FG Annotated Anodyne CCCCNC(=O)[C@@H](C)NC(=O)c1csc(-c2ccc(Cl)cc2)n1 ZINC000082088153 FG Annotated Anodyne COc1cc2nc(NCCCCO)nc(NCCC(C)C)c2cc1OC ZINC000082130568 FG Annotated Anodyne N#CCCN(CCC#N)C(=O)c1cnc(N2CCCC2)nc1-c1ccccc1 ZINC000082132881 FG Annotated Mild CCCCNC(=O)c1cnc(N2CCCC2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000082134522 FG Annotated Bother CCN(C)c1ncc(C(=O)N(C)CC(C)C)c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000082134961 FG Annotated Bother CC[C@@H](C)Nc1ncc(C(=O)N2CCCC2)c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000082135491 FG Annotated Bother CC[C@H](C)Nc1ncc(C(=O)N2CCCC2)c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000082135492 FG Annotated Bother CC[C@@H](C)NC(=O)c1cnc(N2CCCC2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000082135731 FG Annotated Bother CC[C@H](C)NC(=O)c1cnc(N2CCCC2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000082135732 FG Annotated Bother CC[C@@H](C)NC(=O)c1cnc(N(C)CC)nc1-c1cccc([N+](=O)[O-])c1 ZINC000082135885 FG Annotated Bother CC[C@H](C)NC(=O)c1cnc(N(C)CC)nc1-c1cccc([N+](=O)[O-])c1 ZINC000082135886 FG Annotated Bother CCN(C)C(=O)c1cnc(NC2CCCC2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000082135972 FG Annotated Bother CCN(C)C(=O)c1cnc(N(C)CC(C)C)nc1-c1cccc([N+](=O)[O-])c1 ZINC000082135977 FG Annotated Bother CCN(C)C(=O)c1cnc(N2CCCCC2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000082136079 FG Annotated Bother CC[C@@H](C)Nc1ncc(C(=O)N(C)CC)c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000082136189 FG Annotated Bother CC[C@H](C)Nc1ncc(C(=O)N(C)CC)c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000082136190 FG Annotated Bother COCCCNc1ncc(C(=O)N(C)CC(C)C)c(-c2ccc(F)cc2)n1 ZINC000082136289 FG Annotated Anodyne COCCCNC(=O)c1cnc(N2CCCCC2)nc1-c1ccc(F)cc1 ZINC000082136361 FG Annotated Anodyne COCCNc1ncc(C(=O)N(C)CC(C)C)c(-c2ccc(F)cc2)n1 ZINC000082139447 FG Annotated Anodyne C[C@H]1C[C@@H](C)CN(c2ncc(C(=O)NCC3CC3)c(-c3ccco3)n2)C1 ZINC000082142409 FG Annotated Anodyne C[C@H]1C[C@H](C)CN(c2ncc(C(=O)NCC3CC3)c(-c3ccco3)n2)C1 ZINC000082142412 FG Annotated Anodyne C[C@@H]1C[C@@H](C)CN(c2ncc(C(=O)NCC3CC3)c(-c3ccco3)n2)C1 ZINC000082142414 FG Annotated Anodyne C[C@H]1C[C@@H](C)CN(c2ncc(C(=O)N3CCCC3)c(-c3ccco3)n2)C1 ZINC000082142530 FG Annotated Anodyne C[C@H]1C[C@H](C)CN(c2ncc(C(=O)N3CCCC3)c(-c3ccco3)n2)C1 ZINC000082142532 FG Annotated Anodyne C[C@@H]1C[C@@H](C)CN(c2ncc(C(=O)N3CCCC3)c(-c3ccco3)n2)C1 ZINC000082142534 FG Annotated Anodyne CC[C@@H](C)Nc1ncc(C(=O)N(CCC#N)CCC#N)c(-c2ccco2)n1 ZINC000082142579 FG Annotated Mild CC[C@H](C)Nc1ncc(C(=O)N(CCC#N)CCC#N)c(-c2ccco2)n1 ZINC000082142582 FG Annotated Mild COCCNc1ncc(C(=O)N(C)CC(C)C)c(-c2cccc(C)c2)n1 ZINC000082145371 FG Annotated Anodyne COCCNC(=O)c1cnc(N2CCC(C)CC2)nc1-c1cccc(C)c1 ZINC000082147298 FG Annotated Anodyne CCCCNC(=O)c1cnc(N(C)CC)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000082148146 FG Annotated Bother CCCCNC(=O)c1cnc(N2CCCC2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000082148220 FG Annotated Bother CCN(C)c1ncc(C(=O)N(C)CC(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000082148626 FG Annotated Bother CC[C@@H](C)Nc1ncc(C(=O)N2CCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000082149235 FG Annotated Bother CC[C@H](C)Nc1ncc(C(=O)N2CCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000082149238 FG Annotated Bother O=C1COc2ccc(C3=Nn4ccnc4S[C@@H]3c3ccccc3)cc2N1 ZINC000082149487 FG Annotated Anodyne O=C1COc2ccc(C3=Nn4ccnc4S[C@H]3c3ccccc3)cc2N1 ZINC000082149490 FG Annotated Anodyne CCN(C)C(=O)c1cnc(NC2CCCC2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000082149994 FG Annotated Bother CC[C@@H](C)NC(=O)c1cnc(N2CCCC2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000082150047 FG Annotated Bother CC[C@H](C)NC(=O)c1cnc(N2CCCC2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000082150051 FG Annotated Bother CCN(C)C(=O)c1cnc(N2CCCCC2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000082150142 FG Annotated Bother CC[C@@H](C)Nc1ncc(C(=O)N(C)CC)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000082150181 FG Annotated Bother CC[C@H](C)Nc1ncc(C(=O)N(C)CC)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000082150185 FG Annotated Bother CC(C)n1nc(-c2ccc(OC3CCN(C4CCC4)CC3)nc2)ccc1=O ZINC000082151250 FG Annotated Anodyne CCOC(=O)/C(CCCC(=O)O)=N\Nc1ccc(Br)cc1 ZINC000082153272 FG Annotated Mild Cc1cc(C(N)=O)ccc1-n1c(CCC(=O)O)ccc1-c1ccc(C#N)cc1 ZINC000082153283 FG Annotated Mild Cn1c2c(c3cc(S(=O)(=O)c4cccc(O)c4)ccc31)[C@@H]1CC[C@H](C2)N1 ZINC000082153368 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4cccc(O)c4)ccc31)[C@H]1CC[C@@H](C2)N1 ZINC000082153370 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccsc4)ccc31)[C@@H]1CC[C@H](C2)N1 ZINC000082154304 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccsc4)ccc31)[C@H]1CC[C@@H](C2)N1 ZINC000082154307 FG Annotated Anodyne O=C(NNC(=O)c1ncc(Cc2ccsc2)s1)Nc1ccccc1 ZINC000082155607 FG Annotated Reactive CCN(C)c1ncc(C(=O)NCc2ccccc2)c(-c2ccc(C#N)cc2)n1 ZINC000082158847 FG Annotated Mild CCN(C)C(=O)c1cnc(N2CCC(C)CC2)nc1-c1ccc(C#N)cc1 ZINC000082158996 FG Annotated Mild CCN(C)c1ncc(C(=O)N(C)CC(C)C)c(-c2ccc(C#N)cc2)n1 ZINC000082159551 FG Annotated Mild CC1(C)CC(c2ccc(OC3CCN(C4CCC4)CC3)c(F)c2)=NNC1=O ZINC000082159703 FG Annotated Anodyne COc1ccc(-c2cc(NCCc3ccccn3)ncn2)c(OC)c1OC ZINC000082161751 FG Annotated Anodyne Cc1nc(-c2cnc(N3CCC(O)CC3)nc2-c2ccccc2)oc1C ZINC000082163036 FG Annotated Anodyne CCc1cnc(-c2cnc(NCCNC(C)=O)nc2-c2ccccc2)s1 ZINC000082163327 FG Annotated Anodyne CC(=O)NCCNc1ncc(-c2nc(C)c(C)s2)c(-c2ccccc2)n1 ZINC000082163328 FG Annotated Anodyne COCCCNc1ncc(-c2ncc(C)o2)c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000082163454 FG Annotated Bother Cc1nc(-c2cnc(N3CCOCC3)nc2-c2ccc(F)cc2)oc1C ZINC000082164509 FG Annotated Anodyne Cc1cnc(-c2cnc(N3CCC(O)CC3)nc2-c2ccc(F)cc2)o1 ZINC000082164637 FG Annotated Anodyne CC(=O)NCCNc1ncc(-c2nc(C)c(C)o2)c(-c2ccc(F)cc2)n1 ZINC000082164989 FG Annotated Anodyne CCc1cnc(-c2cnc(N3CCC(O)CC3)nc2-c2ccco2)s1 ZINC000082165886 FG Annotated Anodyne Cc1nc(-c2cnc(N3CCC(O)CC3)nc2-c2ccco2)sc1C ZINC000082165888 FG Annotated Anodyne CC(=O)NCCNc1ncc(-c2nc(C)c(C)s2)c(-c2ccco2)n1 ZINC000082166268 FG Annotated Anodyne Cc1cccc(-c2nc(N3CCC(O)CC3)ncc2-c2ncc(C)o2)c1 ZINC000082173449 FG Annotated Anodyne CC(=O)NCCNc1ncc(-c2nc(C)c(C)o2)c(-c2cccc(C)c2)n1 ZINC000082173858 FG Annotated Anodyne COCCCNc1ncc(-c2ncc(C)o2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000082174131 FG Annotated Bother Cc1nc(-c2cnc(N3CCOCC3)nc2-c2ccccc2F)oc1C ZINC000082175651 FG Annotated Anodyne Cc1cnc(-c2cnc(N3CCC(O)CC3)nc2-c2ccccc2F)o1 ZINC000082175798 FG Annotated Anodyne CC(=O)NCCNc1ncc(-c2nc(C)c(C)o2)c(-c2ccccc2F)n1 ZINC000082176080 FG Annotated Anodyne Cc1cnc(-c2cnc(N3CCC(O)CC3)nc2-c2ccccc2C)o1 ZINC000082177489 FG Annotated Anodyne CC(=O)NCCNc1ncc(-c2nc(C)c(C)o2)c(-c2ccccc2C)n1 ZINC000082177674 FG Annotated Anodyne CC(=O)NCCn1c(C2CCCCC2)nc2c(NCC(C)C)ncnc21 ZINC000082177991 FG Annotated Anodyne CC(C)CNc1ncnc2c1nc(CC(C)C)n2CCCN1CCCC1=O ZINC000082178064 FG Annotated Anodyne CC(C)CNc1ncnc2c1nc(C(C)C)n2CCCN1CCCC1=O ZINC000082178137 FG Annotated Anodyne COCCn1c(-c2cccnc2)nc2c(NCc3ccccc3)ncnc21 ZINC000082178378 FG Annotated Anodyne COCCn1c(-c2cccnc2)nc2c(NCc3ccc(C)cc3)ncnc21 ZINC000082179193 FG Annotated Anodyne COCCn1c(CC(C)C)nc2c(NCCc3cccc(F)c3)ncnc21 ZINC000082179639 FG Annotated Anodyne COCCn1c(C(C)C)nc2c(NCCc3cccc(F)c3)ncnc21 ZINC000082179681 FG Annotated Anodyne CCCc1nc2c(NCCc3cccc(F)c3)ncnc2n1CCOC ZINC000082179699 FG Annotated Anodyne COCCn1c(C2CC2)nc2c(NCCc3cccc(F)c3)ncnc21 ZINC000082179729 FG Annotated Anodyne COCCn1c(-c2cccnc2)nc2c(NCc3ccccc3C)ncnc21 ZINC000082180221 FG Annotated Anodyne c1nc(NCC2CC2)c2nc(-c3ccoc3)n(CCN3CCCCC3)c2n1 ZINC000082180394 FG Annotated Anodyne CC(=O)NCCn1c(C(C)C)nc2c(NCc3ccccc3C)ncnc21 ZINC000082180453 FG Annotated Anodyne COCCn1c(CC(C)C)nc2c(NCCc3ccccc3F)ncnc21 ZINC000082180874 FG Annotated Anodyne c1ccc(CCn2c(-c3cccnc3)nc3c(NCC4CC4)ncnc32)nc1 ZINC000082180894 FG Annotated Anodyne COCCn1c(C(C)C)nc2c(NCCc3ccccc3F)ncnc21 ZINC000082180953 FG Annotated Anodyne CCCc1nc2c(NCCc3ccccc3F)ncnc2n1CCOC ZINC000082180975 FG Annotated Anodyne COCCn1c(C2CC2)nc2c(NCCc3ccccc3F)ncnc21 ZINC000082181020 FG Annotated Anodyne COCCn1c(C2CC2)nc2c(NCCCc3ccccc3)ncnc21 ZINC000082181823 FG Annotated Anodyne CC(C)Cc1nc2c(NCC3CC3)ncnc2n1CCN1CCCCC1 ZINC000082184764 FG Annotated Anodyne COCCn1c(CCc2ccccc2)nc2c(NCC3CC3)ncnc21 ZINC000082184955 FG Annotated Anodyne CC(C)Cc1nc2c(NCC3CC3)ncnc2n1CCc1ccccn1 ZINC000082185338 FG Annotated Anodyne COCCn1c(-c2ccoc2)nc2c(NCc3ccc(F)cc3)ncnc21 ZINC000082185534 FG Annotated Anodyne CC(C)Cc1nc2c(NCC3CC3)ncnc2n1CC[C@@H]1CCCN1C ZINC000082186111 FG Annotated Anodyne CC(C)Cc1nc2c(NCC3CC3)ncnc2n1CC[C@H]1CCCN1C ZINC000082186113 FG Annotated Anodyne CCCCCNc1ncnc2c1nc(-c1ccccc1)n2CCNC(C)=O ZINC000082186133 FG Annotated Anodyne CCCCCNc1ncnc2c1nc(-c1ccsc1)n2CCNC(C)=O ZINC000082186474 FG Annotated Anodyne CCCCCNc1ncnc2c1nc(-c1ccc(C)o1)n2CCNC(C)=O ZINC000082186586 FG Annotated Anodyne CCCCCNc1ncnc2c1nc(CCC)n2CCCN1CCCC1=O ZINC000082186877 FG Annotated Anodyne CCCCCNc1ncnc2c1nc(C(CC)CC)n2CCNC(C)=O ZINC000082186901 FG Annotated Anodyne CCCCCNc1ncnc2c1nc(C1CC1)n2CCCN1CCCC1=O ZINC000082186923 FG Annotated Anodyne CCCCCNc1ncnc2c1nc(CC(C)(C)C)n2CCNC(C)=O ZINC000082186956 FG Annotated Anodyne COCCn1c(CC(C)C)nc2c(NCCc3ccc(F)cc3)ncnc21 ZINC000082187406 FG Annotated Anodyne COCCn1c(C(C)C)nc2c(NCCc3ccc(F)cc3)ncnc21 ZINC000082187525 FG Annotated Anodyne CCCc1nc2c(NCCc3ccc(F)cc3)ncnc2n1CCOC ZINC000082187555 FG Annotated Anodyne COCCn1c(C2CC2)nc2c(NCCc3ccc(F)cc3)ncnc21 ZINC000082187609 FG Annotated Anodyne CC(C)CNC(=O)[C@@H]1CCCN1c1nc(-c2cccc([N+](=O)[O-])c2)cs1 ZINC000082192387 FG Annotated Bother O=C(CNc1nc(-c2cc3ccccc3o2)cs1)NC[C@@H]1CCCO1 ZINC000082193711 FG Annotated Anodyne O=C(CNc1nc(-c2cc3ccccc3o2)cs1)NC[C@H]1CCCO1 ZINC000082193713 FG Annotated Anodyne COCCCNC(=O)[C@@H]1CCCN1c1nc(-c2ccc(F)cc2)cs1 ZINC000082195415 FG Annotated Anodyne O=C(NCC(F)(F)F)[C@@H]1CCCN1c1nc(-c2ccc(O)cc2)cs1 ZINC000082195574 FG Annotated Anodyne O=C(CNc1nc(-c2ccc(Cl)s2)cs1)NC[C@@H]1CCCO1 ZINC000082195823 FG Annotated Anodyne O=C(CNc1nc(-c2ccc(Cl)s2)cs1)NC[C@H]1CCCO1 ZINC000082195824 FG Annotated Anodyne CCCCC(=O)N1CCc2c(c(=O)[nH]c3c2c(-c2ccccc2)nn3C)C1 ZINC000082196183 FG Annotated Anodyne CO[C@H]1CCC[C@@H]([C@H](C)Nc2nc(N3CCSCC3)ncc2C)C1 ZINC000082202606 FG Annotated Anodyne CO[C@H]1CCC[C@H]([C@H](C)Nc2nc(N3CCSCC3)ncc2C)C1 ZINC000082202608 FG Annotated Anodyne CO[C@@H]1CCC[C@@H]([C@H](C)Nc2nc(N3CCSCC3)ncc2C)C1 ZINC000082202610 FG Annotated Anodyne CO[C@@H]1CCC[C@H]([C@H](C)Nc2nc(N3CCSCC3)ncc2C)C1 ZINC000082202612 FG Annotated Anodyne COC1CCC([C@H](C)Nc2nc(N3CCSCC3)ncc2C)CC1 ZINC000082202614 FG Annotated Anodyne Cc1cnc(N2CCSCC2)nc1NCCCN(C)c1ccccc1 ZINC000082202619 FG Annotated Anodyne CCOc1ccc(CCNc2nc(N3CCSCC3)ncc2C)cc1 ZINC000082202621 FG Annotated Anodyne COc1ccc(OC)c(CCNc2nc(N3CCC[C@@H]3C)ncc2C)c1 ZINC000082202730 FG Annotated Anodyne COc1ccc(OC)c(CCNc2nc(N3CCC[C@H]3C)ncc2C)c1 ZINC000082202732 FG Annotated Anodyne COc1cc(CNc2nc(N3CCC[C@@H]3C)ncc2C)cc(OC)c1OC ZINC000082202741 FG Annotated Anodyne COc1cc(CNc2nc(N3CCC[C@H]3C)ncc2C)cc(OC)c1OC ZINC000082202743 FG Annotated Anodyne Cc1cnc(N(C)CCN(C)C)nc1NCc1cccc(C(F)(F)F)c1 ZINC000082202804 FG Annotated Anodyne COc1ccc(OC)c(CCNc2nc(N3CCSCC3)ncc2C)c1 ZINC000082202825 FG Annotated Anodyne COC[C@H](Cc1ccccc1)Nc1nc(N2CCSCC2)ncc1C ZINC000082202832 FG Annotated Anodyne Cc1cnc(N2CCN(c3ccccn3)CC2)nc1NCc1cccs1 ZINC000082203564 FG Annotated Anodyne COc1ccc(CCNc2nc(N3C[C@H](C)O[C@H](C)C3)ncc2C)cc1 ZINC000082203911 FG Annotated Anodyne COc1ccc(CCNc2nc(N3C[C@@H](C)O[C@H](C)C3)ncc2C)cc1 ZINC000082203913 FG Annotated Anodyne COc1ccc(CCNc2nc(N3C[C@H](C)O[C@@H](C)C3)ncc2C)cc1 ZINC000082203916 FG Annotated Anodyne CO[C@H]1CCC[C@@H]([C@H](C)Nc2nc(N3C[C@H](C)O[C@H](C)C3)ncc2C)C1 ZINC000082203918 FG Annotated Anodyne CO[C@H]1CCC[C@H]([C@H](C)Nc2nc(N3C[C@H](C)O[C@H](C)C3)ncc2C)C1 ZINC000082203919 FG Annotated Anodyne CO[C@@H]1CCC[C@@H]([C@H](C)Nc2nc(N3C[C@H](C)O[C@H](C)C3)ncc2C)C1 ZINC000082203921 FG Annotated Anodyne CO[C@@H]1CCC[C@H]([C@H](C)Nc2nc(N3C[C@H](C)O[C@H](C)C3)ncc2C)C1 ZINC000082203923 FG Annotated Anodyne COC1CCC([C@H](C)Nc2nc(N3C[C@H](C)O[C@H](C)C3)ncc2C)CC1 ZINC000082203924 FG Annotated Anodyne COC1CCC([C@H](C)Nc2nc(N3C[C@@H](C)O[C@H](C)C3)ncc2C)CC1 ZINC000082203926 FG Annotated Anodyne COC1CCC([C@H](C)Nc2nc(N3C[C@H](C)O[C@@H](C)C3)ncc2C)CC1 ZINC000082203927 FG Annotated Anodyne Cc1cnc(N2C[C@H](C)O[C@H](C)C2)nc1NCCCN(C)c1ccccc1 ZINC000082203944 FG Annotated Anodyne Cc1cnc(N2C[C@@H](C)O[C@H](C)C2)nc1NCCCN(C)c1ccccc1 ZINC000082203946 FG Annotated Anodyne CCOc1ccc(CCNc2nc(N3C[C@H](C)O[C@H](C)C3)ncc2C)cc1 ZINC000082203948 FG Annotated Anodyne CCOc1ccc(CCNc2nc(N3C[C@@H](C)O[C@H](C)C3)ncc2C)cc1 ZINC000082203949 FG Annotated Anodyne CCOc1ccc(CCNc2nc(N3C[C@H](C)O[C@@H](C)C3)ncc2C)cc1 ZINC000082203951 FG Annotated Anodyne Cc1cnc(N2CCC(C(N)=O)CC2)nc1N[C@@H]1C[C@H](C)CC(C)(C)C1 ZINC000082203956 FG Annotated Anodyne Cc1cnc(N2CCC(C(N)=O)CC2)nc1N[C@H]1C[C@H](C)CC(C)(C)C1 ZINC000082203958 FG Annotated Anodyne Cc1cnc(N2CCC(C(N)=O)CC2)nc1N[C@@H]1C[C@@H](C)CC(C)(C)C1 ZINC000082203960 FG Annotated Anodyne Cc1cnc(N2CCC(C(N)=O)CC2)nc1N[C@H]1C[C@@H](C)CC(C)(C)C1 ZINC000082203962 FG Annotated Anodyne CC(=O)N[C@H]1CCN(c2ncc(C)c(N[C@@H]3C[C@H](C)CC(C)(C)C3)n2)C1 ZINC000082203990 FG Annotated Anodyne CC(=O)N[C@H]1CCN(c2ncc(C)c(N[C@H]3C[C@H](C)CC(C)(C)C3)n2)C1 ZINC000082203992 FG Annotated Anodyne CC(=O)N[C@H]1CCN(c2ncc(C)c(N[C@@H]3C[C@@H](C)CC(C)(C)C3)n2)C1 ZINC000082203994 FG Annotated Anodyne CC(=O)N[C@H]1CCN(c2ncc(C)c(N[C@H]3C[C@@H](C)CC(C)(C)C3)n2)C1 ZINC000082203995 FG Annotated Anodyne Cc1cnc(N2CCC[C@H](C(N)=O)C2)nc1N[C@@H]1C[C@H](C)CC(C)(C)C1 ZINC000082204018 FG Annotated Anodyne Cc1cnc(N2CCC[C@H](C(N)=O)C2)nc1N[C@H]1C[C@H](C)CC(C)(C)C1 ZINC000082204020 FG Annotated Anodyne Cc1cnc(N2CCC[C@H](C(N)=O)C2)nc1N[C@@H]1C[C@@H](C)CC(C)(C)C1 ZINC000082204022 FG Annotated Anodyne Cc1cnc(N2CCC[C@H](C(N)=O)C2)nc1N[C@H]1C[C@@H](C)CC(C)(C)C1 ZINC000082204024 FG Annotated Anodyne COc1cccc(CNc2nc(N3C[C@H](C)O[C@H](C)C3)ncc2C)c1OC ZINC000082204196 FG Annotated Anodyne COc1cccc(CNc2nc(N3C[C@@H](C)O[C@H](C)C3)ncc2C)c1OC ZINC000082204197 FG Annotated Anodyne COc1cccc(CNc2nc(N3C[C@H](C)O[C@@H](C)C3)ncc2C)c1OC ZINC000082204199 FG Annotated Anodyne COc1cc(CNc2nc(N3C[C@H](C)O[C@H](C)C3)ncc2C)cc(OC)c1 ZINC000082204200 FG Annotated Anodyne COc1cc(CNc2nc(N3C[C@@H](C)O[C@H](C)C3)ncc2C)cc(OC)c1 ZINC000082204201 FG Annotated Anodyne COc1cc(CNc2nc(N3C[C@H](C)O[C@@H](C)C3)ncc2C)cc(OC)c1 ZINC000082204203 FG Annotated Anodyne COC[C@H](Cc1ccccc1)Nc1nc(N2C[C@H](C)O[C@H](C)C2)ncc1C ZINC000082204251 FG Annotated Anodyne COC[C@H](Cc1ccccc1)Nc1nc(N2C[C@@H](C)O[C@H](C)C2)ncc1C ZINC000082204253 FG Annotated Anodyne COC[C@H](Cc1ccccc1)Nc1nc(N2C[C@H](C)O[C@@H](C)C2)ncc1C ZINC000082204254 FG Annotated Anodyne Cc1cnc(N2C[C@H](C)O[C@H](C)C2)nc1NCc1ccc(N(C)C)cc1 ZINC000082204256 FG Annotated Clean Cc1cnc(N2C[C@@H](C)O[C@H](C)C2)nc1NCc1ccc(N(C)C)cc1 ZINC000082204258 FG Annotated Clean Cc1cnc(N2C[C@H](C)O[C@@H](C)C2)nc1NCc1ccc(N(C)C)cc1 ZINC000082204260 FG Annotated Clean CC(C)CCNc1c2n(c(=O)n(C(C)C)c1=O)C[C@H](Cc1ccccc1)N2 ZINC000082205257 FG Annotated Anodyne CCCn1c(=O)c(NCc2ccsc2)c2n(c1=O)[C@@H]1CCCC[C@H]1N2 ZINC000082205706 FG Annotated Anodyne CCCn1c(=O)c(NCc2ccccc2F)c2n(c1=O)[C@@H]1CCCC[C@H]1N2 ZINC000082205709 FG Annotated Anodyne CC(C)n1c(=O)c(NCc2ccccc2)c2n(c1=O)[C@@H]1CCCC[C@H]1N2 ZINC000082205759 FG Annotated Anodyne CC(C)n1c(=O)c(NCc2ccsc2)c2n(c1=O)[C@@H]1CCCC[C@H]1N2 ZINC000082205768 FG Annotated Anodyne CC(C)n1c(=O)c(NCc2ccccc2F)c2n(c1=O)[C@@H]1CCCC[C@H]1N2 ZINC000082205770 FG Annotated Anodyne CCCn1c(=O)c(NCC2CCCCC2)c2n(c1=O)[C@@H]1CCCC[C@H]1N2 ZINC000082205832 FG Annotated Anodyne CC[C@@H]1Cn2c(c(NCc3cc4ccccc4o3)c(=O)n(C(C)C)c2=O)N1 ZINC000082207532 FG Annotated Anodyne CC[C@H]1Cn2c(c(NCc3cc4ccccc4o3)c(=O)n(C(C)C)c2=O)N1 ZINC000082207534 FG Annotated Anodyne CCCn1c(=O)c(NCC(C)C)c2n(c1=O)C[C@H](CC1CCCCC1)N2 ZINC000082207765 FG Annotated Anodyne CCCn1c(=O)c(NCC2CC2)c2n(c1=O)C[C@H](CC1CCCCC1)N2 ZINC000082208516 FG Annotated Anodyne CC(C)n1c(=O)c(NCC2CC2)c2n(c1=O)C[C@H](CC1CCCCC1)N2 ZINC000082208678 FG Annotated Anodyne C=CCn1c(=O)c(NCC(CC)CC)c2n(c1=O)[C@H](c1ccccc1)CN2 ZINC000082209181 FG Annotated Mild C=CCn1c(=O)c(NCC(CC)CC)c2n(c1=O)[C@@H](c1ccccc1)CN2 ZINC000082209184 FG Annotated Mild C=CCn1c(=O)c(NCCC(C)(C)C)c2n(c1=O)[C@H](c1ccccc1)CN2 ZINC000082209191 FG Annotated Mild C=CCn1c(=O)c(NCCC(C)(C)C)c2n(c1=O)[C@@H](c1ccccc1)CN2 ZINC000082209193 FG Annotated Mild CCCn1c(=O)c(NCC(CC)CC)c2n(c1=O)[C@H](c1ccccc1)CN2 ZINC000082209701 FG Annotated Anodyne CCCn1c(=O)c(NCC(CC)CC)c2n(c1=O)[C@@H](c1ccccc1)CN2 ZINC000082209703 FG Annotated Anodyne CCCn1c(=O)c(NCCC(C)(C)C)c2n(c1=O)[C@H](c1ccccc1)CN2 ZINC000082209712 FG Annotated Anodyne CCCn1c(=O)c(NCCC(C)(C)C)c2n(c1=O)[C@@H](c1ccccc1)CN2 ZINC000082209714 FG Annotated Anodyne C/C=C(\C)C(=O)N1C[C@@H](OCC2CCCCC2)C[C@H]1C(=O)NCCCC ZINC000082210761 FG Annotated Anodyne C/C=C(\C)C(=O)N1C[C@@H](OCC2CCCCC2)C[C@@H]1C(=O)NCCCC ZINC000082210762 FG Annotated Anodyne C/C=C(\C)C(=O)N1C[C@H](OCC2CCCCC2)C[C@H]1C(=O)NCCCC ZINC000082210765 FG Annotated Anodyne C/C=C(\C)C(=O)N1C[C@H](OCC2CCCCC2)C[C@@H]1C(=O)NCCCC ZINC000082210768 FG Annotated Anodyne C[C@@H]1CNc2c(NCc3ccccc3)c(=O)n(CC3CCCCC3)c(=O)n21 ZINC000082211030 FG Annotated Anodyne C[C@H]1CNc2c(NCc3ccccc3)c(=O)n(CC3CCCCC3)c(=O)n21 ZINC000082211033 FG Annotated Anodyne C[C@@H]1CNc2c(NCc3ccsc3)c(=O)n(CC3CCCCC3)c(=O)n21 ZINC000082211064 FG Annotated Anodyne C[C@H]1CNc2c(NCc3ccsc3)c(=O)n(CC3CCCCC3)c(=O)n21 ZINC000082211067 FG Annotated Anodyne C[C@@H]1CNc2c(NCC3CCCCC3)c(=O)n(Cc3ccccc3)c(=O)n21 ZINC000082211535 FG Annotated Anodyne C[C@H]1CNc2c(NCC3CCCCC3)c(=O)n(Cc3ccccc3)c(=O)n21 ZINC000082211536 FG Annotated Anodyne C[C@@H]1CNc2c(NCC3CCCCC3)c(=O)n(Cc3ccsc3)c(=O)n21 ZINC000082211757 FG Annotated Anodyne C[C@H]1CNc2c(NCC3CCCCC3)c(=O)n(Cc3ccsc3)c(=O)n21 ZINC000082211758 FG Annotated Anodyne CCC(CC)CNc1c2n(c(=O)n(CC3CCCCC3)c1=O)[C@H](C)CN2 ZINC000082211837 FG Annotated Anodyne CCC(CC)CNc1c2n(c(=O)n(CC3CCCCC3)c1=O)[C@@H](C)CN2 ZINC000082211841 FG Annotated Anodyne C[C@@H]1CNc2c(NCCC(C)(C)C)c(=O)n(CC3CCCCC3)c(=O)n21 ZINC000082211850 FG Annotated Anodyne C[C@H]1CNc2c(NCCC(C)(C)C)c(=O)n(CC3CCCCC3)c(=O)n21 ZINC000082211853 FG Annotated Anodyne CCC(CC)CNc1c2n(c(=O)n(Cc3ccc(F)cc3)c1=O)[C@H](C)CN2 ZINC000082212276 FG Annotated Anodyne CCC(CC)CNc1c2n(c(=O)n(Cc3ccc(F)cc3)c1=O)[C@@H](C)CN2 ZINC000082212277 FG Annotated Anodyne C[C@@H]1CNc2c(NCCC(C)(C)C)c(=O)n(Cc3ccc(F)cc3)c(=O)n21 ZINC000082212283 FG Annotated Anodyne C[C@H]1CNc2c(NCCC(C)(C)C)c(=O)n(Cc3ccc(F)cc3)c(=O)n21 ZINC000082212285 FG Annotated Anodyne CCCCNC(=O)c1cnc(N(C)CC)nc1-c1cccc([N+](=O)[O-])c1 ZINC000082214812 FG Annotated Bother CCN(C)c1ncc(C(=O)N2CCCCC2)c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000082214864 FG Annotated Bother COCCCNC(=O)c1cnc(N2CCCCC2)nc1-c1cccc(C)c1 ZINC000082216743 FG Annotated Anodyne O=C(NCC1CC1)c1cnc(N2CCCCC2)nc1-c1ccccc1F ZINC000082217056 FG Annotated Anodyne COCCNc1ncc(-c2ncc(C)o2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000082221451 FG Annotated Bother COCCNc1ncc(-c2nc(C)c(C)o2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000082221454 FG Annotated Bother COCCn1c(CCc2ccccc2)nc2c(NCC(C)C)ncnc21 ZINC000082221618 FG Annotated Anodyne CC(C)n1c(=O)c(NCC2CCCCC2)c2n(c1=O)[C@@H]1CCCC[C@H]1N2 ZINC000082224131 FG Annotated Anodyne CC(C)CNc1c2n(c(=O)n(C(C)C)c1=O)C[C@H](CC1CCCCC1)N2 ZINC000082224331 FG Annotated Anodyne CCCCCNc1ncnc2c1nc(-c1cccc(O)c1)n2CCOC ZINC000082226278 FG Annotated Anodyne C=C1C(=O)C2=C[C@@H]1CCC(=O)[C@]1(C)CC[C@H](OC(C)=O)C(C)(C)[C@@H]1C[C@@H]2O ZINC000082230513 FG Annotated Mild CC[C@@H](C)c1nc2nc(N(C)[C@@H](C)[C@H](O)c3ccccc3)ccc2[nH]c1=O ZINC000082231316 FG Annotated Anodyne CC[C@H](C)c1nc2nc(N(C)[C@@H](C)[C@H](O)c3ccccc3)ccc2[nH]c1=O ZINC000082231317 FG Annotated Anodyne CC(C)Cc1nc2nc(N(C)[C@@H](C)[C@H](O)c3ccccc3)ccc2[nH]c1=O ZINC000082231331 FG Annotated Anodyne CC(C)Cc1nc2nc(N(C)[C@H](C)[C@H](O)c3ccccc3)ccc2[nH]c1=O ZINC000082231332 FG Annotated Anodyne CCCCc1nc2nc(N(C)[C@@H](C)[C@H](O)c3ccccc3)ccc2[nH]c1=O ZINC000082231358 FG Annotated Anodyne CCCCc1nc2nc(N(C)[C@H](C)[C@H](O)c3ccccc3)ccc2[nH]c1=O ZINC000082231359 FG Annotated Anodyne CSCCc1nc2nc(N3CCC[C@H]4CCCC[C@@H]43)ccc2[nH]c1=O ZINC000082231720 FG Annotated Anodyne CSCCc1nc2nc(N3CCC[C@@H]4CCCC[C@@H]43)ccc2[nH]c1=O ZINC000082231721 FG Annotated Anodyne C[C@@H]1C(=O)O[C@H](C)C[C@@H]2CC[C@@H](O2)[C@H](C)C(=O)O[C@H](C)C[C@@H]2CC[C@H]1O2 ZINC000083923602 FG Annotated Anodyne in-vitro C[C@H]1C[C@@H]2CC[C@@H](O2)[C@H](C)C(=O)O[C@H](C)C[C@@H]2CC[C@@H](O2)[C@H](C)C(=O)O1 ZINC000083923606 FG Annotated Anodyne in-vitro C[C@@H]1C(=O)O[C@H](C)C[C@H]2CC[C@@H](O2)[C@H](C)C(=O)O[C@H](C)C[C@@H]2CC[C@H]1O2 ZINC000083923608 FG Annotated Anodyne in-vitro C[C@H]1C[C@H]2CC[C@@H](O2)[C@H](C)C(=O)O[C@H](C)C[C@@H]2CC[C@@H](O2)[C@H](C)C(=O)O1 ZINC000083923611 FG Annotated Anodyne in-vitro C=CC[C@@]12C=C(OC)C(=O)[C@@H]([C@H](c3ccc(OC)c(OC)c3)[C@H]1C)[C@H]2O ZINC000084153951 FG Annotated Mild in-vitro biogenic C/C=C(/CO)[C@@H]1C[C@H]2c3[nH]c4ccccc4c3CCN2C=C1C(=O)OC ZINC000084154710 FG Annotated Anodyne in-vitro biogenic CSCCNC(=O)[C@H]1C(=O)N2c3ccccc3CCc3cccc1c32 ZINC000084462548 FG Annotated Anodyne O=c1[nH]c2ccccc2cc1-c1nc2c([nH]1)CN(Cc1ccccc1)CC2 ZINC000084586509 FG Annotated Anodyne O=C1O/C(=C\c2ccc(O)c(Br)c2)C(=O)N1c1ccccn1 ZINC000084586537 FG Annotated Anodyne CCOc1cc2[nH]c(-c3n[nH]cc3NC(=O)N(CC)CC)nc2cc1F ZINC000084587050 FG Annotated Anodyne CCN1C(=O)N([C@H](C)c2ccccc2)[C@]2(OC(=O)c3ccccc32)C1=O ZINC000084596185 FG Annotated Anodyne COc1ccc(N2C(=O)/C(=C/c3cc(F)c(O)c(F)c3)OC2=S)cc1 ZINC000084596591 FG Annotated Anodyne CNC(=O)/C=C\c1cnc(N)c2c(-c3ccc4c(c3)OCO4)csc12 ZINC000084596666 FG Annotated Anodyne CC(C)=CCC[C@](C)(O[C@@H]1O[C@H](C)[C@H](O)[C@H](O)[C@H]1O)[C@@H]1CC=C(C)CC1 ZINC000084596759 FG Annotated Anodyne CC1CCN(CCn2c3ccccc3c3nc4n(c(=O)c32)CCS4)CC1 ZINC000084596866 FG Annotated Anodyne COc1ccccc1/C=C/S(=O)(=O)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000084601987 FG Annotated Bother CCCNC(=O)c1c(NC(=O)[C@@H]2C[C@H]3CC[C@@H]2C3)sc2c1CCOC2 ZINC000084602109 FG Annotated Anodyne CCCNC(=O)c1c(NC(=O)[C@H]2C[C@H]3CC[C@@H]2C3)sc2c1CCOC2 ZINC000084602113 FG Annotated Anodyne CC[C@]12C=CCN3CC[C@]4(C(=C(C(=O)OC)C1)Nc1cc(O)c(C)cc14)[C@@H]32 ZINC000084603244 FG Annotated Anodyne CC1=NN(C(=O)CN2CCC(C(F)(F)F)CC2)[C@H](c2ccccc2O)C1 ZINC000084605237 FG Annotated Clean CC1=NN(C(=O)CN2CCC(C(F)(F)F)CC2)[C@@H](c2ccccc2O)C1 ZINC000084605239 FG Annotated Clean CCN1Cc2cc(OC)c3c(c2-c2c(cc(OC)c4c2OCO4)C1)OCO3 ZINC000084605434 FG Annotated Anodyne COc1ccc(CS(=O)(=O)/C=C/c2cc(F)c(F)cc2F)cc1N ZINC000084614519 FG Annotated Anodyne COc1cc2c(c(OC)c1OC)[C@H](c1ccccc1)C1=C(COC1=O)O2 ZINC000084615308 FG Annotated Anodyne COc1cc2c(c(OC)c1OC)[C@@H](c1ccccc1)C1=C(COC1=O)O2 ZINC000084615310 FG Annotated Anodyne CCNC(=O)c1c(NC(=O)C23C[C@@H]4CC2C[C@@H](C4)C3)sc2c1CCOC2 ZINC000084615406 FG Annotated Anodyne CCN1C(=O)N([C@H](C)c2ccccc2)[C@@]2(OC(=O)c3ccccc32)C1=O ZINC000084615474 FG Annotated Anodyne CCN1C(=O)N([C@@H](C)c2ccccc2)[C@@]2(OC(=O)c3ccccc32)C1=O ZINC000084615857 FG Annotated Anodyne CCN1C(=O)N([C@@H](C)c2ccccc2)[C@]2(OC(=O)c3ccccc32)C1=O ZINC000084615860 FG Annotated Anodyne Clc1ccc2c(c1)N/C(=N\CCN1CCOCC1)c1cccnc1O2 ZINC000084616993 FG Annotated Mild CC(=O)Oc1ccc(/C=C/C=C/C(=O)N2CCCCC2)cc1OC(C)=O ZINC000084617818 FG Annotated Anodyne CCOC(=O)c1c[nH]c2ccn3cc(-c4cccc(OC)c4)nc3c2c1=O ZINC000084617868 FG Annotated Anodyne COc1cc(C(=O)N[C@@H]2COc3ccc(F)cc32)ccc1-n1cnc(C)c1 ZINC000084619067 FG Annotated Anodyne COc1cc(C(=O)N[C@H]2COc3ccc(F)cc32)ccc1-n1cnc(C)c1 ZINC000084619068 FG Annotated Anodyne COc1ccc(CS(=O)(=O)/C=C/c2c(F)cc(F)cc2F)cc1N ZINC000084633455 FG Annotated Anodyne O=C1Nc2ccc(F)cc2[C@@]12CC(c1ccc(Br)cc1)=NN2 ZINC000084633931 FG Annotated Anodyne O=C1Nc2ccc(F)cc2[C@]12CC(c1ccc(Br)cc1)=NN2 ZINC000084633933 FG Annotated Anodyne CCCS(=O)(=O)Nc1ccc(F)c(-c2ccc3nc(N)ncc3c2)c1 ZINC000084635591 FG Annotated Anodyne COCON1C(=O)/C(=C\C(C)C)N(Cc2ccccc2)[C@@H](CC(C)C)C1=O ZINC000084651985 FG Annotated Anodyne c1cc(-c2nnc(N3CCC(N4CCCCC4)CC3)s2)n2nccc2c1 ZINC000084652322 FG Annotated Anodyne C/C1=C\CC[C@@]2(C)O[C@@H]2[C@H]2OC(=O)[C@@H](CN3CCC(F)(F)C3)[C@@H]2CC1 ZINC000084652732 FG Annotated Anodyne O=C(Nc1cccc(-c2nnn[nH]2)c1)c1cc(C(F)(F)F)cc2[nH]cnc12 ZINC000084654073 FG Annotated Anodyne C[C@H]1CCCC[C@H]1Oc1nc(N)c2c(=O)ccn(CC3CC=CC3)c2n1 ZINC000084654184 FG Annotated Anodyne CN1C(=O)CN(CCCCCN2CCCCC2)c2ccc([N+](=O)[O-])cc21 ZINC000084654728 FG Annotated Bother COc1ccc(/C=C2\SC(c3ccc([N+](=O)[O-])c(O)c3)=NC2=O)cc1 ZINC000084654875 FG Annotated Clean C[C@H](c1ccccc1)N1CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1ccccc1 ZINC000084655370 FG Annotated Reactive COC(=O)c1ccccc1CSc1nc2ccccc2n1CC(=O)O ZINC000084655490 FG Annotated Anodyne O=C(NCCc1cccnc1Cl)c1ccnc2nc(-c3ccoc3)[nH]c12 ZINC000084655531 FG Annotated Anodyne O=C(O)CCCCNc1nc(-c2c(O)c3ccccc3oc2=O)cs1 ZINC000084668367 FG Annotated Anodyne Cc1ccc(C)c(CSc2nc(O)c(C#N)c(C3CCNCC3)n2)c1 ZINC000084668764 FG Annotated Mild COc1ccc2c(CS(=O)(=O)C3CCCCC3)cc(=O)oc2c1OC ZINC000084669040 FG Annotated Anodyne CNCc1cc(-c2ccccc2Cl)n(S(=O)(=O)c2cccnc2)c1 ZINC000084669274 FG Annotated Anodyne COc1cc(OC)c(OC)cc1/C=C/n1ncc(Cl)c(Cl)c1=O ZINC000084669390 FG Annotated Anodyne CCOCn1c(Sc2c(Cl)cccc2Cl)c(C)c(=O)[nH]c1=O ZINC000084670430 FG Annotated Anodyne COc1c(Br)cc(N2CCC(=O)NC2=O)cc1C(C)(C)C ZINC000084671245 FG Annotated Anodyne C[C@H](c1ccccc1)N1CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccccc1 ZINC000084671383 FG Annotated Reactive O=C(O)[C@@H]1CSc2c(C3CC3)c(Cn3ccc4ccccc43)cc(=O)n21 ZINC000084671423 FG Annotated Anodyne CCN(CC)[C@@H]1[C@@H]2[C@@H](CN(Cc3ccccc3)[C@H]2c2ccccn2)[C@H]1CO ZINC000084671462 FG Annotated Anodyne COc1c(Cc2cccc3ccccc23)cc(=O)n2c1SC[C@H]2C(=O)O ZINC000084672585 FG Annotated Anodyne COC(=O)c1cc2c(s1)C(=O)c1c(C(C)=O)c3ccc(C)cn3c1C2=O ZINC000084687721 FG Annotated Clean c1ccc(-c2cn(-c3ccc4nc(N5CCOCC5)sc4c3)nn2)cc1 ZINC000084689707 FG Annotated Anodyne CCOC(=O)c1cc(Cc2ccc(Br)cc2)c(=O)[nH]c1C ZINC000084689983 FG Annotated Anodyne NCCCCCCC(=O)/N=c1/[nH]c2ccc(C(=O)c3ccccc3)cc2[nH]1 ZINC000084690577 FG Annotated Anodyne Cn1c2ccccc2c2c3c(=O)[nH]c(N)nc3c3c4cccnc4n(C)c3c21 ZINC000084690621 FG Annotated Bother CC(C)c1ccc(-n2nc(C(=O)NC3CC3)c3csc(N)c3c2=O)cc1 ZINC000084690838 FG Annotated Anodyne CCOC(=O)c1nn(-c2ccc(Cl)cc2)c(=O)c2c(NC)scc12 ZINC000084690978 FG Annotated Anodyne C[C@@H](c1ccccc1)N1CC(=O)C2=C(C1)OC(N)=C(C#N)[C@H]2c1ccccc1 ZINC000084704715 FG Annotated Reactive C[C@@H](c1ccccc1)N1CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccccc1 ZINC000084704718 FG Annotated Reactive CN1CC[C@@H](NC(=O)Nc2cccc(C#N)c2)C[C@@H]1c1nc2ccccc2[nH]1 ZINC000084705579 FG Annotated Mild COCON1C(=O)/C(=C/C(C)C)N(Cc2ccccc2)[C@@H](CC(C)C)C1=O ZINC000084705593 FG Annotated Anodyne Cc1ccc(C)c(Cn2c(Sc3cccc(N)c3)c(C)c(=O)[nH]c2=O)c1 ZINC000084708088 FG Annotated Anodyne CCc1nnc(SCc2ccccc2)n1N1C(=O)c2ccccc2C1=O ZINC000084708925 FG Annotated Anodyne CN(C)CCNc1nc(N/N=C/c2ccc(F)cc2)nc2ccccc12 ZINC000084709065 FG Annotated Mild Cn1ccnc1CN1CCC2(CC1)C(=O)N(c1cccnc1)c1ccccc12 ZINC000084711532 FG Annotated Anodyne COC(=O)[C@H](c1ccccc1F)N1CCc2sc(OC(C)=O)cc2C1 ZINC000084711591 FG Annotated Anodyne CC(=O)Oc1cccc2c1C(=O)c1c(-c3ccc(F)cc3)noc1C2=O ZINC000084711671 FG Annotated Clean C/C1=C\CC[C@@]2(C)O[C@@H]2[C@H]2OC(=O)[C@@H](CN3CCC[C@H](F)C3)[C@@H]2CC1 ZINC000084711977 FG Annotated Anodyne C/C1=C\CC[C@@]2(C)O[C@@H]2[C@H]2OC(=O)[C@@H](CN3CCC[C@@H](F)C3)[C@@H]2CC1 ZINC000084711980 FG Annotated Anodyne CC[C@@H]1Nc2c(-c3ccc(C(=O)O)cc3)cc(Cl)cc2S(=O)(=O)N1 ZINC000084712072 FG Annotated Anodyne CC[C@H]1Nc2c(-c3ccc(C(=O)O)cc3)cc(Cl)cc2S(=O)(=O)N1 ZINC000084712074 FG Annotated Anodyne COc1c(Cc2csc3ccccc23)cc(=O)n2c1SC[C@H]2C(=O)O ZINC000084712856 FG Annotated Anodyne CCN1CCN(c2nc(C)nc3c2nc(-c2ccccc2Cl)n3C)CC1 ZINC000084713785 FG Annotated Anodyne CCN1CCN(c2nc(C)nc3[nH]c(-c4ccccc4Cl)nc23)CC1 ZINC000084713786 FG Annotated Anodyne O=C1c2ccccc2C(=O)c2c(-c3cc[n+](Cc4ccccc4)cc3)noc21 ZINC000084714047 FG Annotated Clean O=C1c2ccccc2C(=O)c2c(-c3cccc[n+]3Cc3ccccc3)noc21 ZINC000084714050 FG Annotated Clean O=C1c2ccccc2C(=O)c2c(-c3ccc[n+](Cc4ccccc4)c3)noc21 ZINC000084714111 FG Annotated Clean COc1ccc(-c2cn(CC/C(C)=C/CSCCC(=O)O)nn2)cc1 ZINC000084714558 FG Annotated Anodyne O=c1sn(-c2cccc(C(F)(F)F)c2)c(=O)n1Cc1ccccc1 ZINC000084723446 FG Annotated Anodyne C/C1=C\CC[C@@]2(C)O[C@@H]2[C@H]2OC(=O)[C@@H](CN3CCC(F)CC3)[C@@H]2CC1 ZINC000084723630 FG Annotated Anodyne C/C(=C\CSCCC(=O)O)CCn1cc(COc2ccccc2)nn1 ZINC000084724346 FG Annotated Anodyne O=c1sn(-c2cccc(C(F)(F)F)c2)c(=O)n1Cc1ccc(F)cc1 ZINC000084727065 FG Annotated Anodyne CCN(CC)[C@@H]1[C@@H](CO)[C@H]2CN(Cc3ccccc3)[C@H](c3ccccn3)[C@H]21 ZINC000084729030 FG Annotated Anodyne Cc1n[nH]c(=O)c2c1c1cc(F)ccc1n2Cc1ccc([N+](=O)[O-])cc1 ZINC000084731679 FG Annotated Bother Cc1n[nH]c(=O)c2c1c1cc(F)ccc1n2Cc1cccc([N+](=O)[O-])c1 ZINC000084731682 FG Annotated Bother COc1ccc2nccc([C@H](c3nnnn3C(C)(C)C)N3CCCC3)c2c1 ZINC000084739273 FG Annotated Anodyne COc1ccc2nccc([C@@H](c3nnnn3C(C)(C)C)N3CCCC3)c2c1 ZINC000084739275 FG Annotated Anodyne COc1ccc2c(c1)c1c(C)n[nH]c(=O)c1n2Cc1ccc([N+](=O)[O-])cc1 ZINC000084740927 FG Annotated Bother COc1ccc2c(c1)c1c(C)n[nH]c(=O)c1n2Cc1cccc([N+](=O)[O-])c1 ZINC000084740929 FG Annotated Bother CCN(CC)[C@@H](c1ccnc2ccc(OC)cc12)c1nnnn1C(C)(C)C ZINC000084742383 FG Annotated Anodyne CCN(CC)[C@H](c1ccnc2ccc(OC)cc12)c1nnnn1C(C)(C)C ZINC000084742385 FG Annotated Anodyne O=C1c2c(nnn2Cc2ccc3ncccc3c2)CCN1c1ccccc1 ZINC000084758185 FG Annotated Anodyne CCOc1ccncc1NC(=O)c1ccnc2nc(-c3cccnc3)[nH]c12 ZINC000084759403 FG Annotated Anodyne CC(C)CNC(=O)c1coc(NC(=O)c2ccccc2Br)n1 ZINC000084759512 FG Annotated Anodyne CCN(CC)/N=N\c1ccc(S(=O)(=O)Nc2nc(C)cc(C)n2)cc1 ZINC000008576162 FG Annotated Clean O=C(Cc1nc2ncc(Br)cc2nc1O)c1ccc(F)cc1 ZINC000008578278 FG Annotated Anodyne CCSc1nc(O)c2c(n1)N=C(C)/C(=C(/O)OC)[C@@H]2c1ccncc1 ZINC000008578817 FG Annotated Anodyne CCc1ccc(CNC(=O)c2c(C)oc3ncn(CC(C)C)c(=O)c23)cc1 ZINC000008596698 FG Annotated Anodyne CC[C@@H](C)NC(=O)CCC(=O)N1Cc2ccccc2Oc2ncccc21 ZINC000008598901 FG Annotated Anodyne CC[C@H](C)NC(=O)CCC(=O)N1Cc2ccccc2Oc2ncccc21 ZINC000008598905 FG Annotated Anodyne COc1ccc(Br)cc1CNC(=O)c1cc2ccccn2n1 ZINC000008600097 FG Annotated Anodyne CCOC(=O)c1c(C)oc2ncnc(Nc3ccc(OC)cc3OC)c12 ZINC000008603668 FG Annotated Anodyne CC(C)CCNC(=O)CN1C(=O)c2cccnc2Sc2ccccc21 ZINC000008605739 FG Annotated Anodyne O=C(Nc1ccccc1Br)c1cc(CN2CCCC2)on1 ZINC000008605906 FG Annotated Anodyne CC1=C(C(=O)Nc2ccc(C)cc2C)[C@@H](c2cccn2C)n2ncnc2N1 ZINC000008609907 FG Annotated Anodyne CC1=C(C(=O)Nc2ccc(C)cc2C)[C@H](c2cccn2C)n2ncnc2N1 ZINC000008609908 FG Annotated Anodyne C=CCN1C(=O)[C@@H](Cc2ccc(OC)cc2)S/C1=N/N=C\c1ccco1 ZINC000008624976 FG Annotated Mild CC(=N)[C@@H](C#N)C(=O)CSc1nnc(COc2ccccc2Cl)o1 ZINC000008656272 FG Annotated Mild CCCCNC(=O)c1onc(CSc2ccc(F)cc2)c1C(=O)O ZINC000008672359 FG Annotated Anodyne CCCCNC(=O)c1onc(CSc2cccc(F)c2)c1C(=O)O ZINC000008672369 FG Annotated Anodyne C=CCNC(=O)c1onc(CSc2cccc(Cl)c2)c1C(=O)O ZINC000008672382 FG Annotated Mild CC(C)NC(=O)c1onc(CSc2ccc(F)c(F)c2)c1C(=O)O ZINC000008672383 FG Annotated Anodyne CC(C)NC(=O)c1onc(CSc2cccc(Cl)c2)c1C(=O)O ZINC000008672392 FG Annotated Anodyne CC(C)NC(=O)c1onc(CSc2ccc(Cl)cc2)c1C(=O)O ZINC000008672400 FG Annotated Anodyne C=CCNC(=O)c1onc(CSc2ccc(Cl)cc2)c1C(=O)O ZINC000008672424 FG Annotated Mild O=C(N/N=C\c1ccc([N+](=O)[O-])s1)c1ccccc1Br ZINC000008672637 FG Annotated Reactive CC(C)C[C@@H](CO)N1CCN(C(=O)c2ccc(C(C)(C)C)cc2)CCC1=O ZINC000008680066 FG Annotated Anodyne CC(C)C[C@H](CO)N1CCN(C(=O)c2ccc(C(C)(C)C)cc2)CCC1=O ZINC000008680067 FG Annotated Anodyne Cc1ccc(S(=O)(=O)/N=C(\O)c2ccc(Br)o2)c(C)c1 ZINC000008680101 FG Annotated Mild COCCN1C(=O)N[C@@H](c2ccc(Br)cc2)C(C(C)=O)=C1C ZINC000008682078 FG Annotated Mild CC(C)OC(=O)[C@@H]1CC[C@H](C)[C@@H](CCC[C@@H]2C[C@@H](O)C[C@H](CC#N)O2)O1 ZINC000008682221 FG Annotated Mild CCN(CC)c1ccc(/C=N/NC(=S)NCc2ccccc2)c(O)c1 ZINC000008687882 FG Annotated Mild CCCCNC(=O)c1onc(CSc2ccc(OC)cc2)c1C(=O)O ZINC000008691321 FG Annotated Anodyne CCCCNC(=O)c1onc(CSc2ccc(F)c(F)c2)c1C(=O)O ZINC000008691323 FG Annotated Anodyne CCCCNC(=O)c1onc(CSc2ccccc2F)c1C(=O)O ZINC000008691325 FG Annotated Anodyne CCNC(=S)N/N=C/c1c(C)nn(-c2cccc(Cl)c2)c1Cl ZINC000008693867 FG Annotated Mild CCOc1c2ccc(C(=O)NCc3ccc(C)cc3)cc2nn1CCOC ZINC000008762991 FG Annotated Anodyne C[C@H]1/C=C\CC(=O)NCc2cccc(c2)CNC(=O)N[C@H]1c1ccccc1 ZINC000008860534 FG Annotated Anodyne C[C@]1(OC(=O)CCc2ccccc2)C(=O)C=C2C=C(C3CC3)OC=C2C1=O ZINC000008860656 FG Annotated Mild C[C@@]1(OC(=O)CCc2ccccc2)C(=O)C=C2C=C(C3CC3)OC=C2C1=O ZINC000008860657 FG Annotated Mild COCc1ccc(O)cc1CCN1CCCC[C@H]1[C@H](O)c1cccc(O)c1 ZINC000085486937 FG Annotated Anodyne in-vitro biogenic C[C@@H]1N[C@H](C2CCC(CCCCC[C@@H](O)CC(=O)O)CC2)CC[C@H]1O ZINC000085488291 FG Annotated Anodyne in-vitro biogenic C[C@H]1[C@H](O)CC[C@H]2C[C@@H](CCCCCCC[C@@H](O)CC(=O)O)CCN21 ZINC000085488296 FG Annotated Anodyne in-vitro biogenic C=CC[C@@]12C=C(OC)[C@](C)(O)[C@@H](C1=O)[C@@H](c1ccc(OC)c(OC)c1)[C@@H]2C ZINC000085507895 FG Annotated Mild in-vitro biogenic NC(N)=NC/C(=C\C(=O)O)CCCCCCCCCCCCCCO ZINC000085510474 FG Annotated Mild in-vitro biogenic CNC[C@H](O)c1ccc(O)c2c1C[C@@H](Cc1cccnc1)CC(C)(C)C2 ZINC000085510726 FG Annotated Anodyne in-vitro biogenic C=C1[C@H]2[C@H](CO)[C@H]3CCC[C@]1(C)[C@@]3(C(=O)CCc1ccccc1)[C@]2(O)OC ZINC000085546352 FG Annotated Mild in-vitro biogenic C=C1[C@H]2CC[C@@](C(=O)CCc3cccc(CCCO)c3)(C1(C)C)[C@]2(O)OC ZINC000085546416 FG Annotated Mild in-vitro biogenic C[C@]12C[C@@H]3C=C(Cc4ccccc4)[C@H]1[C@H](O)[C@@]1(CO)CC[C@H]1[C@@](O)(C3)C2 ZINC000085547437 FG Annotated Anodyne in-vitro biogenic CN[C@@H]1[C@@H]2C=C[C@@]34[C@H](O)C[C@]5(C)CCC[C@@](O)(C5)[C@]3(C2)C[C@]42CCC[C@@H]12 ZINC000085547441 FG Annotated Anodyne in-vitro biogenic CN[C@@H]1CC[C@@]23[C@@H](O)[C@@H]4C=C[C@H]5C[C@]4(C)C[C@](O)(C5)[C@@H]2C[C@@]32CCC[C@@H]12 ZINC000085547478 FG Annotated Anodyne in-vitro biogenic C[C@H](c1ccc(C=O)cc1)[C@H]1[C@@H]2C=C[C@@H]3N1[C@]3(O)[C@H]2CNC1CCCCC1 ZINC000085547844 FG Annotated Anodyne in-vitro biogenic CCOC[C@]1(O)C(C(=O)O)=C2C[C@H]3CC[C@@H](C)[C@@]24[C@@H]1c1[cH-]cnc1C[C@@]34C ZINC000085548982 FG Annotated Anodyne in-vitro biogenic COC1(OC)C(=O)[C@H]2C(C)(C)CCC[C@]2(C)C2=C1C(=O)C(C(C)C)=CC2=O ZINC000085558131 FG Annotated Mild COc1ccc2c3c(n(C)c2c1)[C@@H]1C[C@H]2C(C=O)=C(C)OC[C@H]2[C@H](C3)N1C ZINC000085569981 FG Annotated Reactive CCCCCCCCCCCC[C@H](O)[C@@]1(O)C(=O)C=C[C@H]1OC(C)=O ZINC000085584394 FG Annotated Mild CCCCCCCCCCCC[C@@H](O)[C@@]1(O)C(=O)C=C[C@H]1OC(C)=O ZINC000085584398 FG Annotated Mild in-vitro biogenic COC(=O)[C@]12O[C@@]1(CC=C(C)C)C(=O)c1cccc(CC(C)C)c1C2=O ZINC000085592766 FG Annotated Clean in-vitro biogenic CC(C)=CC[C@@]12O[C@]1(C(=O)OC1CCCC1)C(=O)c1ccccc1C2=O ZINC000085592769 FG Annotated Clean in-vitro biogenic C[C@@]1(CC2CCCCC2)Oc2cc3oc(CO)cc(=O)c3c(O)c2C[C@H]1O ZINC000085593587 FG Annotated Anodyne in-vitro biogenic CCCCCC[C@]1(C)Oc2cc3oc(CO)cc(=O)c3c(O)c2C[C@H]1O ZINC000085593591 FG Annotated Anodyne in-vitro biogenic C=C1C=C(C(=O)OCC)Oc2cc3c(c(OC)c21)[C@H]1CCC[C@@](C)(O)[C@H]1O3 ZINC000085595072 FG Annotated Anodyne in-vitro biogenic C=C1C=C(C(=O)OCC)Oc2cc3c(c(OC)c21)[C@@H]1C=CC[C@@](C)(O)[C@H]1O3 ZINC000085595074 FG Annotated Anodyne in-vitro biogenic CC/C=C1\C=C(C(=O)OCC)Oc2cc3c(c(OC)c21)C[C@@H](C(C)(C)O)O3 ZINC000085595076 FG Annotated Anodyne in-vitro biogenic C=C1CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1C[C@]12O[C@H]1[C@@H](O)C(CO)=CC2=O ZINC000085597714 FG Annotated Mild CC[C@H]1C#CC[C@@H](Cc2ccc(O)c(OC)c2)[C@@H](OC(C)=O)C[C@@H](O)CC1 ZINC000085628489 FG Annotated Mild in-vitro biogenic CCCCC[C@H](O)C[C@@H](CCc1cc(OC)c(O)cc1CO)OC(C)=O ZINC000085628502 FG Annotated Anodyne in-vitro biogenic CC[C@H]1CN2CCC3=C4C=CC=C[C+]4N=C3[C@H]2C[C@@H]1/C(=C\OC)C(=O)OC ZINC000085643650 FG Annotated Mild in-vitro biogenic COC1=CC(=O)C(Cc2ccc(O)cc2)=C(CCc2cccc(O)c2)C1=O ZINC000085645030 FG Annotated Mild in-vitro biogenic C=CC(C)(C)[C@@]12C[C@H]3C(=O)N[C@H](CC(C)C)C(=O)N3[C@@H]1Nc1ccccc12 ZINC000085646094 FG Annotated Mild CC[C@@H](C)C(=O)OC[C@H]1O[C@H]1c1ccc(OC(=O)C(C)C)c(OC)c1 ZINC000085671167 FG Annotated Anodyne COC1=C(C(C)C)C(=O)C2=C(C[C@@]34CCCC(C)(C)[C@H]3C[C@]2(O)O4)C1=O ZINC000085689833 FG Annotated Mild C=C(C)[C@@H]1Cc2oc(cc2C(=O)OC)/C=C(\C)C[C@@H]2C=C(CC1=O)C(=O)O2 ZINC000085720896 FG Annotated Mild C=C[C@@]1(C)C[C@@](O)([C@H]2OC2(C)C)Oc2c1c(=O)oc1cccc(CC)c21 ZINC000085733909 FG Annotated Mild CC1=C[C@@H]2OC(=O)C[C@H]3[C@](C)(CC(=O)O)[C@@H](C(C)(C)C(=O)O)CC[C@@]23C1 ZINC000085759570 FG Annotated Anodyne CC(=O)c1c(C)cc2c(c1O)C(=O)C1=C(C2=O)C(C)(C)C(=O)C(C)=C1O ZINC000085798427 FG Annotated Mild C[C@@H]1Cc2c(c(O)cc3cc4c(c(O)c23)C(=O)[C@H](C)C(=O)C4(C)C)C(=O)O1 ZINC000085798433 FG Annotated Anodyne C[C@H](CC[C@@]1(C)[C@H](C)CC[C@@]23COC(=O)C2=C[C@H](O)C[C@@H]31)CC(=O)O ZINC000085842377 FG Annotated Anodyne C[C@H](CC[C@@]1(C)[C@H](C)CC[C@@]23COC(=O)[C@]2(O)C=CC[C@H]13)CC(=O)O ZINC000085842392 FG Annotated Anodyne COc1ccc2c(c1OC)Oc1c(OC)ccc3c1[C@H](C2)N(C)C[C@@H]3O ZINC000085846006 FG Annotated Anodyne C=C(C)[C@@H]1C[C@]2(C)C(=CC1=O)CC[C@@H](OC(=O)/C=C/[S@](C)=O)[C@H]2C ZINC000085847668 FG Annotated Mild in-man endogenous C=C(C)[C@@H]1C[C@]2(C)C(=CC1=O)CC[C@H](OC(=O)/C=C/[S@](C)=O)[C@H]2C ZINC000085847674 FG Annotated Mild in-man endogenous C=C(C)[C@@H]1C[C@]2(C)C(=CC1=O)CC[C@H](OC(=O)/C=C/[S@](C)=O)[C@@H]2C ZINC000085847680 FG Annotated Mild in-man endogenous CC1=CC(=O)c2c(O)ccc(C3=C(C)C(=O)c4cccc(O)c4C3=O)c2C1=O ZINC000085850673 FG Annotated Mild in-vitro biogenic CC1=C(c2c(C)cc(O)c3c2C(=O)C=CC3=O)C(=O)c2c(O)cccc2C1=O ZINC000085861233 FG Annotated Mild COc1cc2c(c3c1OCO3)[C@@](O)(c1ccc3c(c1)OCO3)[C@H](C)[C@H](C)C2 ZINC000085879748 FG Annotated Anodyne CC[C@@]12C=CCN3CC[C@@]4(C(=C(C(=O)OC)C1)Nc1cc(OC)ccc14)[C@H]32 ZINC000085901815 FG Annotated Anodyne C=C1[C@@H]2CC[C@H]3[C@](C)(CC(=O)O)[C@@H](C(C)(C)C(=O)O)CC[C@]3(C2)[C@@H]1O ZINC000085912285 FG Annotated Mild in-man C=C1[C@@H]2CC[C@H]3[C@@](C)(CC(=O)O)[C@@H](C(C)(C)C(=O)O)CC[C@]3(C2)[C@@H]1O ZINC000085912287 FG Annotated Mild in-man C=C1[C@@H]2CC[C@@H]3[C@](C)(CC(=O)O)[C@@H](C(C)(C)C(=O)O)CC[C@]3(C2)[C@@H]1O ZINC000085912289 FG Annotated Mild in-man C=C1[C@@H]2CC[C@@H]3[C@@](C)(CC(=O)O)[C@@H](C(C)(C)C(=O)O)CC[C@]3(C2)[C@@H]1O ZINC000085912291 FG Annotated Mild in-man COc1ccc2c(c1)c1c(n2C)[C@@H]2C[C@H]3C(C=O)=C(C)OC[C@H]3[C@H](C1)N2C ZINC000085916530 FG Annotated Reactive CC(C)c1c(O)c(O)c2c(c1O)C(=O)C(O)=C1C(C)(C)[C@@H](O)CC[C@@]12C ZINC000085925738 FG Annotated Mild C=C(C)[C@@H]1CC(=O)C2=C(C(=O)C(O)=C(C(C)C)C2=O)[C@@]1(C)CCC(=O)OC ZINC000085943778 FG Annotated Mild CC1=C(CC2=CC(=O)c3c(O)cccc3C2=O)C(=O)c2c(O)cccc2C1=O ZINC000085950180 FG Annotated Mild in-vitro biogenic C/C(=C\C[C@@H](O)[C@](C)(Br)CCl)C(=O)CBr ZINC000085951672 FG Annotated Reactive Cc1cc2c(o1)C(=O)C1=C(C(=O)C(O)=C3C(C)(C)C(=O)CC[C@]13C)C2=O ZINC000085976678 FG Annotated Mild O=C1[C@@H]2CCCN2[C@@H](c2cccc(Br)c2)N1c1nccs1 ZINC000085988262 FG Annotated Anodyne COc1ccc2c(c1OC)C(=O)c1nccc3c(OC)c4c(c-2c13)OCO4 ZINC000085991315 FG Annotated Anodyne COc1cccc2c1C(=O)C1=C(OC3=C(C1)C(=O)c1ccccc1C3=O)C2=O ZINC000085996127 FG Annotated Mild COC(=O)c1c(O)cc2c(c1C)Oc1cc(O)c(Cl)c(C)c1C(=O)O2 ZINC000085996180 FG Annotated Anodyne C=C(CC(=O)C=C(C)C)[C@@H](COc1ccc(C(=O)OC)cc1OC)OO ZINC000085999512 FG Annotated Reactive C=C(C)[C@H](O)Cc1c(O)cc2oc3oc4cc(O)ccc4c3c(=O)c2c1O ZINC000085999598 FG Annotated Mild C=C1CC[C@@H]2C(C)(C)CCC[C@@]2(C)[C@H]1C[C@]12O[C@H]1[C@H](O)C(CO)=CC2=O ZINC000086023333 FG Annotated Mild in-man C=C1CC[C@@H]2C(C)(C)CCC[C@]2(C)[C@H]1C[C@]12O[C@H]1[C@H](O)C(CO)=CC2=O ZINC000086023338 FG Annotated Mild in-man C=C1CC[C@H]2C(C)(C)CCC[C@@]2(C)[C@H]1C[C@]12O[C@H]1[C@H](O)C(CO)=CC2=O ZINC000086023345 FG Annotated Mild in-man C=C1CC[C@H]2C(C)(C)CCC[C@]2(C)[C@H]1C[C@]12O[C@H]1[C@H](O)C(CO)=CC2=O ZINC000086023348 FG Annotated Mild in-man C=CC[C@@]12C[C@]3(OCOC3=CC1=O)[C@H](C)[C@@H]2c1cc(OC)c2c(c1)OCO2 ZINC000086050655 FG Annotated Mild Cc1c(O)cc2oc(=O)c(C3=CC(=O)C[C@H](C)O3)cc2c1[C@@H](C)[C@H](C)O ZINC000086053302 FG Annotated Mild C/C=C\C1=CC2=C(CO1)C(=O)[C@]1(C)OC(=O)[C@@H](C(=O)CCCCC)[C@@H]1C2 ZINC000086053306 FG Annotated Mild in-man endogenous C/C=C\C1=CC2=C(CO1)C(=O)[C@]1(C)OC(=O)[C@@H](C(=O)CCCCC)[C@H]1C2 ZINC000086053308 FG Annotated Mild in-man endogenous NC(=O)N1CCC(c2ccccc2)(c2nccn2Cc2ccccc2)CC1 ZINC000087657504 FG Annotated Anodyne CC(C)(C)c1ccc(S(=O)(=O)N2C[C@@H]3C[C@H]2CN3C2CCCC2)cc1 ZINC000087690224 FG Annotated Anodyne Cc1ncccc1-n1c(/C=C/[C@@H]2CS[C@H](C)N2)nc2ccccc2c1=O ZINC000087723042 FG Annotated Anodyne Cc1ncccc1-n1c(/C=C/[C@H]2CS[C@H](C)N2)nc2ccccc2c1=O ZINC000087723046 FG Annotated Anodyne CCCS(=O)(=O)NCc1ccc2c(c1)[C@H](Cc1ccccc1)[C@H](N)CC2 ZINC000088260828 FG Annotated Anodyne CCCS(=O)(=O)NCc1ccc2c(c1)[C@@H](Cc1ccccc1)[C@H](N)CC2 ZINC000088260829 FG Annotated Anodyne CCCS(=O)(=O)NCc1ccc2c(c1)[C@H](Cc1ccccc1)[C@@H](N)CC2 ZINC000088260830 FG Annotated Anodyne CCCS(=O)(=O)NCc1ccc2c(c1)[C@@H](Cc1ccccc1)[C@@H](N)CC2 ZINC000088260831 FG Annotated Anodyne COC(=O)c1nc(-c2ccccc2)n2c1CN(C(=O)OC(C)(C)C)CC2 ZINC000089195559 FG Annotated Anodyne O=C(CCc1ccccc1)Cn1nc(Br)nc1Br ZINC000089455785 FG Annotated Anodyne Cc1ccc(S(=O)(=O)N2C(=O)c3cc4ccccc4n3C2=O)cc1C ZINC000089456527 FG Annotated Anodyne Cc1ncccc1-n1c(/C=C/[C@@H]2CS[C@@H](C)N2)nc2ccccc2c1=O ZINC000089456638 FG Annotated Anodyne Cc1ncccc1-n1c(/C=C/[C@H]2CS[C@@H](C)N2)nc2ccccc2c1=O ZINC000089456640 FG Annotated Anodyne COC(=O)/C=C1/CN2[C@H]3CC[C@@H]2[C@@H]1[C@H](c1ccc(Br)cc1)C3 ZINC000089774808 FG Annotated Anodyne O=c1[nH]sc2c1c(=O)c1cc(F)c(-c3cccnc3)cc1n2C1CC1 ZINC000009132754 FG Annotated Anodyne CC(C)(C)c1cc(CN2C[C@@H]3CC[C@H](C2)N(Cc2ccccn2)C3)n[nH]1 ZINC000091270518 FG Annotated Anodyne CC(C)(C)CCN1CCC(c2nnc(Cn3cccn3)n2C2CC2)CC1 ZINC000091745522 FG Annotated Anodyne Cc1ccc(F)c(C(=O)N2C[C@@H](C(=O)O)[C@H](c3ccncc3)C2)c1Cl ZINC000091915197 FG Annotated Anodyne CCCCN(C)C(=O)c1cnn2c(O)c(Cc3ccc(F)cc3)c(C)nc12 ZINC000009597712 FG Annotated Clean C=Cc1ccc(CN2CCCN(Cc3ccc(F)cc3)S2(=O)=O)cc1 ZINC000009726151 FG Annotated Anodyne CN(CCCNC(=O)c1n[nH]c2c1COc1ccccc1-2)C1CCCCC1 ZINC000009728812 FG Annotated Anodyne COc1ccc2sc(Nc3nc(C)n(-c4ccccc4)c(=O)n3)nc2c1 ZINC000009775231 FG Annotated Anodyne CCOC(=O)/C(=N\Nc1ncnc2ccccc12)c1ccc(OC)cc1 ZINC000009960958 FG Annotated Mild CN1CCc2c(sc(-n3cccc3)c2CNC(=O)NCc2ccco2)C1 ZINC000009963682 FG Annotated Anodyne COc1cc2c(cc1OC)[C@H]1[C@@H](CO2)Oc2c(ccc3occc23)[C@@H]1O ZINC000095099615 FG Annotated Anodyne in-vitro biogenic C/C(=N\NC(=O)c1cc(Br)ccc1O)c1nc2ccccc2[nH]1 ZINC000095101421 FG Annotated Reactive in-vitro COc1cc2c(cc1[C@@H]1C(=O)Oc3cc4occc4cc3C1=O)OCO2 ZINC000095486068 FG Annotated Anodyne in-vitro biogenic CC(=O)c1c(C)cc(OC(=O)c2c(C)cc(O)c(C(C)=O)c2O)c(C)c1O ZINC000095486194 FG Annotated Anodyne in-vitro biogenic C=C1C(=O)C[C@H]2C[C@H]3O[C@]3(C)CC[C@@H]3O[C@H]3C[C@@H](OC(C)=O)[C@H]1C2(C)C ZINC000095486363 FG Annotated Mild in-vitro biogenic CCCc1nn(-c2ccc([N+](=O)[O-])cc2)c(O)c1/C=N/Cc1cccnc1 ZINC000095543835 FG Annotated Mild COc1ccc2c(=O)c3cc(C(=O)N[C@H](CO)CC(C)C)ccc3oc2c1 ZINC000095552217 FG Annotated Bother CCOc1ccc(Nc2c(C)c(N[C@@H]3CCCNC3)nc3ccnn23)cc1 ZINC000095552504 FG Annotated Anodyne Fc1ccc(Nc2cc(N[C@@H]3CCCNC3)nc3ccnn23)cc1Cl ZINC000095552605 FG Annotated Anodyne Fc1ccc(Nc2cc(N[C@H]3CCCNC3)nc3ccnn23)cc1Cl ZINC000095552606 FG Annotated Anodyne C#CCOc1ccc2[nH]c3c(c2c1)CCN1C(=O)c2ccccc2N(C)[C@@H]31 ZINC000095553069 FG Annotated Mild C#CCOc1ccc2[nH]c3c(c2c1)CCN1C(=O)c2ccccc2N(C)[C@H]31 ZINC000095553070 FG Annotated Mild CCOc1ccc(N2CCN(C(=O)c3noc4c3CCCCC4)CC2)cc1 ZINC000095553734 FG Annotated Clean O=C(NC1CCCCC1)c1cn2c3c(cccc3c1=O)OC[C@@H]2C1CC1 ZINC000095553959 FG Annotated Anodyne O=C(NC1CCCCC1)c1cn2c3c(cccc3c1=O)OC[C@H]2C1CC1 ZINC000095553960 FG Annotated Anodyne Oc1ccc(Cc2nnc3ncc(-c4ccc(F)cc4)nn23)cc1Cl ZINC000095554605 FG Annotated Anodyne Cc1ncsc1[C@H](NC(=O)OCCCCO[N+](=O)[O-])c1ccccc1 ZINC000095554778 FG Annotated Anodyne Cc1ncsc1[C@@H](NC(=O)OCCCCO[N+](=O)[O-])c1ccccc1 ZINC000095554779 FG Annotated Anodyne Cn1c(N)nc([C@H]2C[C@H]2c2ccc(-c3cccc(CC#N)c3)cc2)cc1=O ZINC000095554869 FG Annotated Mild COCc1cccc(-c2ccc([C@@H]3C[C@@H]3c3cc(=O)n(C)c(N)n3)cc2)c1 ZINC000095554945 FG Annotated Anodyne Clc1ccc(-n2ccc(OCCCN3CCOCC3)n2)cc1Cl ZINC000095555507 FG Annotated Anodyne Fc1ccc(-c2cnc3nnc(Cc4ccc5ncccc5c4)n3n2)cc1 ZINC000095555509 FG Annotated Anodyne Cc1n[nH]c(C(=O)O)c1Cc1cccc(-c2ccc(CC(=O)O)cc2)c1 ZINC000095555636 FG Annotated Anodyne Cc1cc(OC(=O)OCCCCCCO[N+](=O)[O-])n(-c2ccccc2)n1 ZINC000095555663 FG Annotated Anodyne NC(=O)c1cc2cc(CCc3ccccc3)c(C(F)(F)F)nc2nc1N ZINC000095555702 FG Annotated Anodyne CN1CCN(CCCOc2ccn(-c3ccc(Cl)c(Cl)c3)n2)CC1 ZINC000095556215 FG Annotated Anodyne Cc1cc(OC(=O)C(C)(C)CCCCO[N+](=O)[O-])n(-c2ccccc2)n1 ZINC000095557021 FG Annotated Anodyne O=C(c1cccnc1)n1[nH]c(COc2cc(Cl)cc(Cl)c2)cc1=O ZINC000095557493 FG Annotated Anodyne CCC(=O)Oc1cc(O)c2c(c1)O[C@H](c1ccc(OC)c(OC)c1)CC2=O ZINC000095558164 FG Annotated Anodyne CCC(=O)Oc1cc(O)c2c(c1)O[C@@H](c1ccc(OC)c(OC)c1)CC2=O ZINC000095558165 FG Annotated Anodyne N#CC1(n2cc([C@@H](NC(=O)c3ccsc3)C3CCCCC3)nn2)CC1 ZINC000095558201 FG Annotated Mild N#Cc1ccc2c(c1)S(=O)(=O)N=[S@@]2c1ccc(Br)cc1 ZINC000095558240 FG Annotated Mild N#Cc1ccc2c(c1)S(=O)(=O)N=[S@]2c1ccc(Br)cc1 ZINC000095558241 FG Annotated Mild O=C1/C(=C/c2c[nH]c3ccccc23)Oc2c(CN3CCNCC3)cccc21 ZINC000095558338 FG Annotated Mild O=C(Nc1ncc([N+](=O)[O-])s1)c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000095559139 FG Annotated Bother COc1nc(NCCOC(C)=O)nc(Nc2cccc(Cl)c2)c1N=O ZINC000095559289 FG Annotated Anodyne Cc1cc(C#N)ccc1-c1ccnc(NCc2n[nH]c3nc(N)ccc23)c1 ZINC000095559697 FG Annotated Mild Cc1nn(C(=O)c2ccc(N)cc2)c2c1nnc1cc(Cl)c(F)cc12 ZINC000095559884 FG Annotated Anodyne COCCn1ccc2cc(-c3cc(-c4ccccc4)cc(=O)n3O)cnc21 ZINC000095559957 FG Annotated Anodyne O=C1C=C[C@@H](OC(=O)/C=C/c2ccccc2)[C@@H]([C@H]2O[C@@H]2c2ccccc2)O1 ZINC000095560298 FG Annotated Anodyne COC(=O)[C@]12CCCC3=C1[C@@H](C[C@H](C)[C@@]31C[C@H](c3ccoc3)OC1=O)OC2 ZINC000095561346 FG Annotated Anodyne CN1CCC[C@@H]1Cn1nc(Cc2ccc(Cl)cc2)c2cnccc2c1=O ZINC000095561631 FG Annotated Anodyne CCC(=O)Oc1cc(O)c2c(c1)O[C@H](c1ccc(OC)c(O)c1)CC2=O ZINC000095561783 FG Annotated Anodyne CCC(=O)Oc1cc(O)c2c(c1)O[C@@H](c1ccc(OC)c(O)c1)CC2=O ZINC000095561784 FG Annotated Anodyne N#CC1(n2cc([C@@H](NC(=O)c3cccs3)C3CCCCC3)nn2)CC1 ZINC000095562144 FG Annotated Mild O=C(CSc1nncnc1-c1ccccc1Cl)Nc1ccccn1 ZINC000095562686 FG Annotated Anodyne C/C=C/C(=O)OC[C@H](OC(=O)CCC)c1cc(OC)c(OC)c(OC)c1 ZINC000095562745 FG Annotated Anodyne C/C=C/C(=O)OC[C@@H](OC(=O)CCC)c1cc(OC)c(OC)c(OC)c1 ZINC000095562746 FG Annotated Anodyne O=[N+]([O-])c1ccc(C2=NO[C@H](c3ccc(N4CCOCC4)c(F)c3)C2)o1 ZINC000095562832 FG Annotated Bother O=[N+]([O-])c1ccc(C2=NO[C@@H](c3ccc(N4CCOCC4)c(F)c3)C2)o1 ZINC000095562833 FG Annotated Bother CCOC(=O)C[C@H]1C(C(=O)OCC)=C(N)Oc2ccc(-c3ccco3)cc21 ZINC000095563208 FG Annotated Anodyne CCOC(=O)C[C@@H]1C(C(=O)OCC)=C(N)Oc2ccc(-c3ccco3)cc21 ZINC000095563209 FG Annotated Anodyne CCCCCCCCC1(Cc2ccc(OC)cc2)C(=O)NC(=O)NC1=O ZINC000095563222 FG Annotated Mild N=C(Nc1ccc2c(c1)CCN2C(=O)CN1CCCC1)c1cccs1 ZINC000095563796 FG Annotated Anodyne Cc1ccc(C)c(N2CCN(Cc3ccc(F)cc3Cl)C(=O)C2=O)c1 ZINC000095565191 FG Annotated Anodyne O=C1C(=O)N(c2cccc3[nH]ccc23)CCN1Cc1ccc(F)cc1Cl ZINC000095565222 FG Annotated Anodyne Cc1cccc(Cl)c1CNC(=O)Cc1c(C)nn(CC(C)(C)O)c1C ZINC000095565231 FG Annotated Anodyne Cc1ccc(N2CCN(Cc3ccc(F)cc3Cl)C(=O)C2=O)c(C)c1 ZINC000095565243 FG Annotated Anodyne Cc1cccc(N2CCN(Cc3ccc(F)cc3Cl)C(=O)C2=O)c1C ZINC000095565358 FG Annotated Anodyne Cc1cccc(C)c1N1CCN(Cc2ccc(F)c(F)c2F)C(=O)C1=O ZINC000095565704 FG Annotated Anodyne Cc1nn(CC(C)(C)O)c(C)c1CC(=O)NCc1cccc(Cl)c1C ZINC000095565840 FG Annotated Anodyne O=C(c1cccc(Cl)c1Cl)N1CCn2c(nnc2-c2ccc[nH]2)C1 ZINC000095565843 FG Annotated Anodyne Cc1cccc(C)c1N1CCN(Cc2ccc(F)cc2Cl)C(=O)C1=O ZINC000095565865 FG Annotated Anodyne Cc1ccc(N2CCN(Cc3ccc(F)cc3Cl)C(=O)C2=O)cc1C ZINC000095565888 FG Annotated Anodyne C=CCC[C@H](CCCCC)OC(=O)/C=C/[C@H](O)[C@@H](O)C[C@H](O)CC=C ZINC000095566619 FG Annotated Mild C=CCC[C@@H](CCCCC)OC(=O)/C=C/[C@@H](O)[C@H](O)C[C@@H](O)CC=C ZINC000095566830 FG Annotated Mild CCCCNC(=O)c1c(N)[nH]c(C(=O)c2ccccc2)c1-c1ccccn1 ZINC000095567043 FG Annotated Anodyne Cc1cc(C)nc(NC(=S)N2CCN(c3ccccc3C#N)CC2)c1 ZINC000095567615 FG Annotated Mild Cc1cc(C)nc(NC(=S)N2CCN(c3nccc4occc34)CC2)c1 ZINC000095567987 FG Annotated Anodyne C=CCC[C@@H](CCCCC)OC(=O)/C=C/[C@@H](O)[C@H](O)C[C@H](O)CC=C ZINC000095568102 FG Annotated Mild C=CCC[C@H](CCCCC)OC(=O)/C=C/[C@@H](O)[C@H](O)C[C@H](O)CC=C ZINC000095568328 FG Annotated Mild Cc1cc(C)nc(NC(=S)N2CCN(c3cc(F)cc(F)c3)CC2)c1 ZINC000095568396 FG Annotated Anodyne O=C(NC1CCCCC1)[C@H]1c2ccccc2OCC(=O)N1Cc1ccco1 ZINC000095568398 FG Annotated Anodyne O=C(NC1CCCCC1)[C@@H]1c2ccccc2OCC(=O)N1Cc1ccco1 ZINC000095568399 FG Annotated Anodyne C=CCC[C@@H](CCCCC)OC(=O)/C=C/[C@H](O)[C@@H](O)C[C@H](O)CC=C ZINC000095568412 FG Annotated Mild COc1ccc(-c2oc3c(c2C#CCCCCO)[C@@H](OCCO)CC3)cc1 ZINC000095568429 FG Annotated Mild COc1ccc(-c2oc3c(c2C#CCCCCO)[C@H](OCCO)CC3)cc1 ZINC000095568430 FG Annotated Mild C[C@]1(c2nnnn2Cc2ccccc2)CCC(=O)N1CC1CCCCC1 ZINC000095568691 FG Annotated Anodyne C[C@@]1(c2nnnn2Cc2ccccc2)CCC(=O)N1CC1CCCCC1 ZINC000095568692 FG Annotated Anodyne CC(=O)N(C[C@H]1N[C@H](CO)[C@@H]1c1ccc(-c2ccccc2)cc1)C(C)C ZINC000095568795 FG Annotated Anodyne FC(F)(F)c1cccc(N2CCN(C(=S)Nc3cnccn3)CC2)c1 ZINC000095569234 FG Annotated Anodyne CC(=O)N1CC[C@@H]2[C@@H](CO)N(C)c3ccc(-c4cccc(F)c4)cc3[C@@H]21 ZINC000095569429 FG Annotated Anodyne C=CCC[C@H](CCCCC)OC(=O)/C=C/[C@@H](O)[C@H](O)C[C@@H](O)CC=C ZINC000095569538 FG Annotated Mild CCOC(=O)[C@]12Cc3cc(C)ccc3[C@H]1N(C)C(=O)c1cc(OC)ccc12 ZINC000095569610 FG Annotated Anodyne Cc1cccc(C)c1-n1nnnc1-c1nc2cc3ccccc3cc2[nH]c1=O ZINC000095570111 FG Annotated Bother COc1ccc([C@H]2CC(=O)C[C@@H](CCn3nnc4ccccc43)O2)cc1 ZINC000095570597 FG Annotated Anodyne COC(=O)CCCC[C@@H]1O[C@H](CCc2ccccc2)Cc2[nH]nc(O)c21 ZINC000095570751 FG Annotated Anodyne Cc1cc(C)nc(NC(=S)N2CCN(c3ccc(F)cc3F)CC2)c1 ZINC000095570874 FG Annotated Anodyne Cc1cc(C)nc(NC(=S)N2CCN(c3cccc(C#N)c3)CC2)c1 ZINC000095570926 FG Annotated Mild C=CCC[C@@H](CCCCC)OC(=O)/C=C/[C@H](O)[C@@H](O)C[C@@H](O)CC=C ZINC000095571149 FG Annotated Mild Cc1cc(C)nc(NC(=S)N2CCN(c3ccc(F)c(F)c3)CC2)c1 ZINC000095571226 FG Annotated Anodyne C=CCC[C@H](CCCCC)OC(=O)/C=C/[C@H](O)[C@@H](O)C[C@@H](O)CC=C ZINC000095571243 FG Annotated Mild O=C(C[C@H](c1ccc(Cl)cc1)C(C(=O)O)C(=O)O)c1ccc(O)cc1 ZINC000095571759 FG Annotated Anodyne O=C(C[C@@H](c1ccc(Cl)cc1)C(C(=O)O)C(=O)O)c1ccc(O)cc1 ZINC000095571760 FG Annotated Anodyne COc1nc2c(cc1S(=O)(=O)c1ccccc1)CCc1cn(C)cc1-2 ZINC000095571825 FG Annotated Anodyne CC#Cc1cncc(-c2cc(Cl)c([C@]3(C)CC(=O)N(C)C(=N)N3)s2)c1 ZINC000095571882 FG Annotated Mild in-vitro O=C(N1CCN(Cc2cccc3ccccc23)CC1)n1nnc2ccccc21 ZINC000095572040 FG Annotated Anodyne Cc1c(C2=C[C@H](c3ccccc3)NC(=S)N2)nnn1Cc1ccccc1 ZINC000095572359 FG Annotated Anodyne Cc1c(C2=C[C@@H](c3ccccc3)NC(=S)N2)nnn1Cc1ccccc1 ZINC000095572360 FG Annotated Anodyne Fc1cc(-c2nc3c(c(N4CCOCC4)n2)CCC3)c(F)cc1Cl ZINC000095572594 FG Annotated Anodyne CN1C(=O)CN(/N=C/c2ccc(-c3cc(Cl)cc(Cl)c3)o2)C1=O ZINC000095572603 FG Annotated Mild Cc1ccnc(SCc2cc(=O)c(OC(=O)c3ccsc3)co2)n1 ZINC000095572645 FG Annotated Anodyne CC1(C)Oc2cc(NS(C)(=O)=O)ccc2N(c2ccc(F)cc2)C1=O ZINC000095573844 FG Annotated Anodyne CC#Cc1cncc(-c2cc([C@]3(C)CC(=O)N(C)C(=N)N3)c(Cl)s2)c1 ZINC000095574205 FG Annotated Mild Cc1ccnc(SCc2cc(=O)c(NC(=O)c3ccccc3)co2)n1 ZINC000095574889 FG Annotated Anodyne Cc1c(O)c(C(=O)CC(C)C)c2c(c1O)C(=O)c1cccc(O)c1C2=O ZINC000095575365 FG Annotated Clean Cc1ccc(S(=O)(=O)N2CC(c3nc(-c4cccc(C)c4)no3)C2)cc1 ZINC000095576705 FG Annotated Anodyne N=C1Sc2cc(Br)ccc2C2=NCC3(CCOCC3)CN12 ZINC000095577300 FG Annotated Anodyne O=C(C[C@H](c1ccccc1)C(C(=O)O)C(=O)O)c1c[nH]c2ccccc12 ZINC000095578563 FG Annotated Anodyne O=C(C[C@@H](c1ccccc1)C(C(=O)O)C(=O)O)c1c[nH]c2ccccc12 ZINC000095578564 FG Annotated Anodyne O=C(NCc1ccccc1Cn1cccc1C(=O)O)NC1CCCCC1 ZINC000095579142 FG Annotated Anodyne Cc1cccc(-c2noc(C3CN(S(=O)(=O)c4cccc(C)c4)C3)n2)c1 ZINC000095579381 FG Annotated Anodyne COc1cn(-c2ccccc2F)nc(-c2ccnn2-c2ccccc2)c1=O ZINC000095579691 FG Annotated Anodyne COc1cccc(OC)c1-c1cnnc(N(C)Cc2nc(C)c(C)s2)n1 ZINC000095581022 FG Annotated Anodyne COc1cccc(OC)c1-c1cnnc(NCc2nc3ccccc3[nH]2)n1 ZINC000095581683 FG Annotated Anodyne C[n+]1c(C#CCOc2ccccc2)cccc1C#CCOc1ccccc1 ZINC000095582176 FG Annotated Mild C[C@H](NC1=NS(=O)(=O)c2cc([N+](=O)[O-])ccc2S1)c1ccccc1 ZINC000095582206 FG Annotated Bother C[C@@H](NC1=NS(=O)(=O)c2cc([N+](=O)[O-])ccc2S1)c1ccccc1 ZINC000095582207 FG Annotated Bother COc1ccc(C#Cc2cccc(C#Cc3ccc(OC)cc3)[n+]2C)cc1 ZINC000095582283 FG Annotated Mild COc1cccc(OC)c1-c1cnnc(OCc2nc(C)c(C)s2)n1 ZINC000095582285 FG Annotated Anodyne O=S1(=O)N=C(NC2CCCC2)Sc2ccc(C(F)(F)F)cc21 ZINC000095583186 FG Annotated Anodyne C=CCCNC(=O)[C@@H](C#N)c1nc2ccccc2nc1N1CCCCCC1 ZINC000095583348 FG Annotated Mild C=CCCNC(=O)[C@H](C#N)c1nc2ccccc2nc1N1CCCCCC1 ZINC000095583349 FG Annotated Mild CC(C)=CCC/C(C)=C/C(=O)NCCCOCCCCOCCCN ZINC000095583488 FG Annotated Anodyne Cc1nn2c(O)cc(N3CCOCC3)nc2c1Cc1cccc2ccccc12 ZINC000095583603 FG Annotated Anodyne CCCn1c(-c2ccccc2OC)nc2ccc(N3CCN(C)CC3)nc21 ZINC000095584082 FG Annotated Anodyne C=C(c1cc(OC)c(OC)c(OC)c1)c1ccc2c(c1)c(C(N)=O)cn2C ZINC000095585185 FG Annotated Anodyne CC1=NN2C(=O)COc3c(Br)cc(Br)cc3[C@@H]2C1 ZINC000095585668 FG Annotated Anodyne CC1=NN2C(=O)COc3c(Br)cc(Br)cc3[C@H]2C1 ZINC000095585669 FG Annotated Anodyne COc1cccc(OC)c1-c1cnnc(NCc2nc3ccccc3o2)n1 ZINC000095585672 FG Annotated Anodyne COc1ccc2c(c1)C=C[C@@H](c1ccc(O)c(C(=O)CCO)c1OC)O2 ZINC000095586438 FG Annotated Anodyne COc1c([N+](=O)[O-])c2c3c(nccc3c1[N+](=O)[O-])-c1ccccc1C2=O ZINC000095586465 FG Annotated Bother O=C(N[C@@H](CO)c1ccc(OC2CCC2)nc1)[C@H]1C[C@@H]1c1ccc(F)cc1 ZINC000095586667 FG Annotated Anodyne CCc1ccc(-c2ccc3c(c2)-c2c(cnn2C)S(=O)(=O)N3C)cc1 ZINC000095586966 FG Annotated Anodyne COc1cccc(COC(=O)C2=C(C)N(C)C(=O)N[C@H]2c2ccco2)c1 ZINC000095587169 FG Annotated Anodyne COc1cccc(COC(=O)C2=C(C)N(C)C(=O)N[C@@H]2c2ccco2)c1 ZINC000095587170 FG Annotated Anodyne C=CCSc1nc(-c2ccc(OC)cc2)c(C#N)c(N2CCOCC2)n1 ZINC000095587602 FG Annotated Mild CCCCCC[S@@](=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O ZINC000095588825 FG Annotated Mild CCCCCC[S@](=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O ZINC000095588826 FG Annotated Mild O=c1ccn(C/C=C/c2ccccc2)c(=O)n1Cc1cc(F)cc(F)c1 ZINC000095588889 FG Annotated Anodyne CCOC(=O)C1=C(C)N/C(=C/c2cc(C)n(-c3cccc(O)c3)c2C)C1=O ZINC000095589078 FG Annotated Mild CCC[C@H](NC(=O)OC)C(=O)N[C@H](C)c1nc2ccc(F)cc2s1 ZINC000095589347 FG Annotated Anodyne CCOP(=O)(OCC)[C@H]1C[C@H](C(=O)Nc2ccc(C)cc2)ON1C ZINC000095589724 FG Annotated Anodyne COc1cccc(-n2nnc(C3CC3)c2C(=O)N(C)c2ccc(C#N)cc2)c1 ZINC000095589932 FG Annotated Mild CNC(=O)c1ccc([C@]2(O)CCN(c3ccc(C#N)c(Cl)c3)[C@H]2C)cc1 ZINC000095590055 FG Annotated Mild CCOC(=O)C1=C(C)N/C(=C/c2c(C)nn(-c3ccccc3)c2Cl)C1=O ZINC000095590110 FG Annotated Mild CN1c2ccc(Nc3ccc(F)cc3)cc2-c2c(cnn2C)S1(=O)=O ZINC000095590286 FG Annotated Anodyne Cc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2N2CCN(C)CC2)ccc1F ZINC000095590501 FG Annotated Bother COc1ccc(C#C/C=C\C#Cc2cc(OC)c(OC)c(OC)c2)c(N)c1 ZINC000095591159 FG Annotated Mild C#Cc1cccc(Nc2nc(N)nc3[nH]c(CCc4ccccn4)cc23)c1 ZINC000095591257 FG Annotated Mild COc1cccc(COC(=O)C2=C(C)N(C)C(=O)N(C)[C@H]2c2ccco2)c1 ZINC000095591377 FG Annotated Anodyne COc1cccc(COC(=O)C2=C(C)N(C)C(=O)N(C)[C@@H]2c2ccco2)c1 ZINC000095591378 FG Annotated Anodyne Cc1n(C)c(Br)c(Br)[n+]1CC(=O)c1ccccc1 ZINC000095592123 FG Annotated Mild Oc1c(Cl)cc(Cl)cc1CN1CCC(N2CCC(O)CC2)CC1 ZINC000095592477 FG Annotated Clean CCOP(=O)(OCC)[C@@H]1C[C@H](C(=O)Nc2ccc(C)cc2)ON1C ZINC000095592585 FG Annotated Anodyne CCOC(=O)[C@@H]1CCCC[C@@H]1NCc1cc([N+](=O)[O-])c2cccnc2c1O ZINC000095593030 FG Annotated Clean O=C(O)[C@H]1CCCN(CCN/N=C/c2ccccc2-c2ccccc2)C1 ZINC000095593217 FG Annotated Mild O=C(O)[C@@H]1CCCN(CCN/N=C/c2ccccc2-c2ccccc2)C1 ZINC000095593218 FG Annotated Mild COc1cc(N(C)c2nc(Cl)ccc2[N+](=O)[O-])cc(OC)c1OC ZINC000095593273 FG Annotated Bother COc1ccc(C(=O)c2c(OC)cc(OC)c(-c3ccnn3C)c2O)cc1 ZINC000095593407 FG Annotated Anodyne Cn1c(=O)c2c(cc(/C=C/c3ccc(Cl)c(Cl)c3)n2C)n(C)c1=O ZINC000095593461 FG Annotated Anodyne CCCC(=O)OCc1ccc2oc3cc(=O)c(NC(C)=O)cc-3nc2c1 ZINC000095593964 FG Annotated Bother C#CCN1C(=O)c2cccc3c(C#Cc4ccc(C#N)cc4)ccc(c23)C1=O ZINC000095594593 FG Annotated Mild CCn1c(=O)c2c(cc(/C=C/c3ccc(Cl)cc3)n2C)n(CC)c1=O ZINC000095594848 FG Annotated Anodyne COc1cc(OC)c(-c2ccnn2C)c(O)c1C(=O)c1ccc(F)cc1F ZINC000095594889 FG Annotated Anodyne Cc1ccc(-c2ccccc2/C=N/NCCN2CCC[C@H](C(=O)O)C2)cc1 ZINC000095595030 FG Annotated Mild Cc1ccc(-c2ccccc2/C=N/NCCN2CCC[C@@H](C(=O)O)C2)cc1 ZINC000095595031 FG Annotated Mild COc1cc(OC)c(-c2ccnn2C)c(O)c1C(=O)c1cccc(F)c1 ZINC000095596116 FG Annotated Anodyne O=C(O)[C@H]1CCCN(CCN/N=C/c2ccccc2-c2ccc(F)cc2)C1 ZINC000095596279 FG Annotated Mild O=C(O)[C@@H]1CCCN(CCN/N=C/c2ccccc2-c2ccc(F)cc2)C1 ZINC000095596280 FG Annotated Mild COc1cc(OC)c(-c2ccnn2C)c(O)c1C(=O)c1ccccc1F ZINC000095596453 FG Annotated Anodyne CCN(CC)C(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000095596736 FG Annotated Bother CCN(CC)C(=O)[C@H]1CCCN(c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000095596737 FG Annotated Bother C[C@H]1C=C[C@H]2C[C@@H](C)[C@H](O)[C@@H](C)[C@@H]2[C@H]1/C=C/C(=O)NCc1cccnc1 ZINC000095597028 FG Annotated Anodyne Cc1ccccc1-c1ccccc1/C=N/NCCN1CCC[C@H](C(=O)O)C1 ZINC000095597029 FG Annotated Mild Cc1ccccc1-c1ccccc1/C=N/NCCN1CCC[C@@H](C(=O)O)C1 ZINC000095597030 FG Annotated Mild Cc1nc2sc(C(=O)NCC[C@@H]3CCCN3C)c(N)c2c(C)c1Cl ZINC000095597589 FG Annotated Anodyne Cc1nc2sc(C(=O)NCC[C@H]3CCCN3C)c(N)c2c(C)c1Cl ZINC000095597591 FG Annotated Anodyne Cc1ccc2[nH]c(=O)c(/C=N/Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])cc2c1 ZINC000095598427 FG Annotated Mild COc1ccc(-c2oc3c(c2C#CC(C)(C)O)[C@@H](OCCO)CC3)cc1 ZINC000095599169 FG Annotated Mild COc1ccc(-c2oc3c(c2C#CC(C)(C)O)[C@H](OCCO)CC3)cc1 ZINC000095599170 FG Annotated Mild COc1ccc(CN2C(=O)CC[C@]2(C)c2nnnn2C2CCCCC2)cc1 ZINC000095599282 FG Annotated Anodyne COc1ccc(CN2C(=O)CC[C@@]2(C)c2nnnn2C2CCCCC2)cc1 ZINC000095599283 FG Annotated Anodyne Cc1ccc(CN2C(=O)CSC[C@@]2(C)C(=O)NCc2ccccc2)cc1 ZINC000095599576 FG Annotated Anodyne Cc1ccc(CN2C(=O)CSC[C@]2(C)C(=O)NCc2ccccc2)cc1 ZINC000095599577 FG Annotated Anodyne COc1cccc(-c2oc3c(c2C(=O)OCCN(C)C)[C@@H](O)CCC3)c1 ZINC000095599607 FG Annotated Anodyne COc1cccc(-c2oc3c(c2C(=O)OCCN(C)C)[C@H](O)CCC3)c1 ZINC000095599608 FG Annotated Anodyne Cc1ccc(S(=O)(=O)N2[C@@H](C)CO[C@H]2CC(=O)c2ccccc2)cc1 ZINC000095599813 FG Annotated Anodyne COC(=O)C1=CN(c2ccc(C)cc2)C(N)=C(C#N)[C@H]1c1ccccc1F ZINC000095600057 FG Annotated Reactive COC(=O)C1=CN(c2ccc(C)cc2)C(N)=C(C#N)[C@@H]1c1ccccc1F ZINC000095600058 FG Annotated Reactive CC(C)CCN1C(=O)c2ccccc2[C@H]1c1nnnn1Cc1ccccc1 ZINC000095600097 FG Annotated Anodyne CC(C)CCN1C(=O)c2ccccc2[C@@H]1c1nnnn1Cc1ccccc1 ZINC000095600098 FG Annotated Anodyne CCCNC(=O)N(C)C[C@H]1N[C@@H](CO)[C@@H]1c1ccc(C2=CCCCC2)cc1 ZINC000095600202 FG Annotated Anodyne Cc1ccc(S(=O)(=O)N2[C@@H](C)CO[C@H]2CC(=O)c2cccs2)cc1 ZINC000095600250 FG Annotated Anodyne CC[C@@H](c1nnnn1C(C)(C)C)N1CCN(C/C=C/c2ccccc2)CC1 ZINC000095600300 FG Annotated Anodyne CC[C@H](c1nnnn1C(C)(C)C)N1CCN(C/C=C/c2ccccc2)CC1 ZINC000095600301 FG Annotated Anodyne CC(C)n1nnnc1[C@@H]1c2ccccc2C(=O)N1Cc1ccc(F)cc1 ZINC000095600512 FG Annotated Anodyne CC(C)n1nnnc1[C@H]1c2ccccc2C(=O)N1Cc1ccc(F)cc1 ZINC000095600513 FG Annotated Anodyne CC(C)n1nnnc1[C@@H]1c2ccccc2C(=O)N1CCc1ccccc1F ZINC000095600678 FG Annotated Anodyne CC(C)n1nnnc1[C@H]1c2ccccc2C(=O)N1CCc1ccccc1F ZINC000095600679 FG Annotated Anodyne O=C1NC[C@@H](Cc2ccc(O)cc2)N(CCCCC2CCCCC2)C1=O ZINC000095600960 FG Annotated Anodyne CCCCn1nnnc1[C@]1(C)CCC(=O)N1CCc1c[nH]c2ccccc12 ZINC000095601259 FG Annotated Anodyne CCCCn1nnnc1[C@@]1(C)CCC(=O)N1CCc1c[nH]c2ccccc12 ZINC000095601260 FG Annotated Anodyne CCOC(=O)C1=CC[C@H](c2ccccc2)N(S(=O)(=O)c2ccccc2)C1 ZINC000095601296 FG Annotated Anodyne CCOC(=O)C1=CC[C@@H](c2ccccc2)N(S(=O)(=O)c2ccccc2)C1 ZINC000095601297 FG Annotated Anodyne CN(CCc1ccccc1)[C@H](C(=O)Nc1ccc2c(c1)OCCO2)C1CC1 ZINC000095601638 FG Annotated Anodyne CN(CCc1ccccc1)[C@@H](C(=O)Nc1ccc2c(c1)OCCO2)C1CC1 ZINC000095601639 FG Annotated Anodyne N#C[C@@H]1[C@@H](c2ccc(-c3ccccc3F)cc2)[C@@H](CO)N1C(=O)C1CCC1 ZINC000095602047 FG Annotated Mild CC(C)(C)C(=O)N1Cc2cc(N3CCCCC3)ccc2-n2nncc2C1 ZINC000095603033 FG Annotated Clean Cc1cccc(CN2[C@H](COC(=O)Nc3ccccc3)C=CS2(=O)=O)c1 ZINC000095603082 FG Annotated Anodyne Cc1cccc(C)c1-n1nnnc1[C@]1(C)CCC(=O)N1Cc1cccs1 ZINC000095603119 FG Annotated Anodyne Cc1cccc(C)c1-n1nnnc1[C@@]1(C)CCC(=O)N1Cc1cccs1 ZINC000095603120 FG Annotated Anodyne CC(C)N(Cc1nc(-c2cccnc2)no1)C(=O)COc1ccc(F)cc1 ZINC000095603264 FG Annotated Anodyne COc1cccc(OC)c1-c1nnc(CN2CCc3ccsc3C2)o1 ZINC000095603539 FG Annotated Anodyne CCOC(CNC(=O)c1[nH]c(C(F)(F)F)nc1-c1ccccc1)OCC ZINC000095603714 FG Annotated Anodyne Cc1ccc(OCC(=O)N(Cc2nc(-c3ccccc3)no2)C(C)C)cn1 ZINC000095603832 FG Annotated Anodyne COC(=O)c1c(C)nc(C)c2c1C(=O)C=C(Sc1ccc(O)cc1)C2=O ZINC000095603909 FG Annotated Mild Cc1ccc(OCC(=O)N(Cc2nc(-c3cccnc3)no2)C(C)C)cc1 ZINC000095603961 FG Annotated Anodyne O=C(O)CCCc1sc(/C=C2\NC(=O)CS2)nc1-c1ccccc1 ZINC000095603990 FG Annotated Anodyne CCCCNC(=O)[C@@H]1c2ccccc2OCC(=O)N1CCc1ccccc1 ZINC000095604061 FG Annotated Anodyne CCCCNC(=O)[C@H]1c2ccccc2OCC(=O)N1CCc1ccccc1 ZINC000095604062 FG Annotated Anodyne CC(=O)NC1=CC(=O)c2ccc(-c3ccc(C(F)(F)F)cc3)nc2C1=O ZINC000095604447 FG Annotated Mild CCCCCn1nnnc1[C@@H]1c2ccccc2C(=O)N1Cc1ccco1 ZINC000095604550 FG Annotated Anodyne CCCCCn1nnnc1[C@H]1c2ccccc2C(=O)N1Cc1ccco1 ZINC000095604551 FG Annotated Anodyne CC(C)n1nnnc1[C@@H]1c2ccccc2C(=O)N1Cc1cccc(F)c1 ZINC000095605486 FG Annotated Anodyne CC(C)n1nnnc1[C@H]1c2ccccc2C(=O)N1Cc1cccc(F)c1 ZINC000095605487 FG Annotated Anodyne CCCCCCNC(=O)[C@@H]1COC(c2ccc(OC(F)(F)F)cc2)=N1 ZINC000095607145 FG Annotated Anodyne CC(=O)C[C@@H](c1ccc([N+](=O)[O-])cc1)c1c(O)c2cccc(O)c2oc1=O ZINC000095618750 FG Annotated Bother in-man C[C@@H]1[C@@H](C(=O)O)O[C@@H](Oc2cccc(C[C@@H]3CCC(=O)O3)c2)[C@H](C)[C@H]1C ZINC000095626103 FG Annotated Anodyne in-man C[C@@H]1[C@@H](C(=O)O)O[C@@H](Oc2cccc(C[C@H]3CCC(=O)O3)c2)[C@H](C)[C@H]1C ZINC000095626104 FG Annotated Anodyne in-man NCCc1nnn(C(c2ccccc2)(c2ccccc2)c2ccccc2)n1 ZINC000095642086 FG Annotated Anodyne CCC(=O)NC[C@H]1[C@@H](c2ccc(C3=CCCC3)cc2)[C@@H](CO)N1CC1CC1 ZINC000095661192 FG Annotated Anodyne CC[C@@H]1C/C=C\C[C@H](c2ccc(OC)cc2OC)NC(=O)[C@H](C)CC(=O)N1 ZINC000095661496 FG Annotated Anodyne CC[C@H]1C/C=C\C[C@H](c2ccc(OC)cc2OC)NC(=O)[C@H](C)CC(=O)N1 ZINC000095661587 FG Annotated Anodyne CC[C@@H]1C/C=C\C[C@H](c2ccc(OC)cc2OC)NC(=O)[C@@H](C)CC(=O)N1 ZINC000095661919 FG Annotated Anodyne CC[C@@H]1C/C=C\C[C@@H](c2ccc(OC)cc2OC)NC(=O)[C@H](C)CC(=O)N1 ZINC000095661938 FG Annotated Anodyne COc1ccc([C@@H]2C/C=C\C[C@H](C(C)C)NC(=O)CCC(=O)N2)c(OC)c1 ZINC000095662287 FG Annotated Anodyne CC[C@@H]1C/C=C\C[C@@H](c2ccc(OC)cc2OC)NC(=O)[C@@H](C)CC(=O)N1 ZINC000095663630 FG Annotated Anodyne N#C[C@@H]1[C@H](c2ccccc2C2=CCCC2)[C@@H](CO)N1C(=O)c1ccccn1 ZINC000095663776 FG Annotated Mild CCCC#Cc1ccc2c(c1)[C@@H]1[C@@H](CCN1C(=O)C1CCC1)[C@@H](CO)N2 ZINC000095664197 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@H](c2ccc(-c3ccccc3F)cc2)[C@@H]1CO ZINC000095664630 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@H](c2ccc(C3=CCCCC3)cc2)[C@@H]1CO ZINC000095664806 FG Annotated Mild Fc1ccc(Cn2nnnc2NCc2ccc(N3CCCC3)cc2)cc1 ZINC000095665649 FG Annotated Clean N#C[C@@H]1[C@@H](c2ccccc2-c2cccc(F)c2)[C@@H](CO)N1C(=O)C1CCC1 ZINC000095666858 FG Annotated Mild N#C[C@H]1[C@H](c2ccccc2-c2cccc(F)c2)[C@H](CO)N1C(=O)C1CCC1 ZINC000095666863 FG Annotated Mild N#C[C@H]1[C@H](c2ccccc2-c2cccc(F)c2)[C@@H](CO)N1C(=O)C1CCC1 ZINC000095666866 FG Annotated Mild N#C[C@H]1[C@@H](c2ccccc2-c2cccc(F)c2)[C@H](CO)N1C(=O)C1CCC1 ZINC000095666870 FG Annotated Mild N#C[C@@H]1[C@H](c2ccccc2-c2cccc(F)c2)[C@@H](CO)N1C(=O)C1CCC1 ZINC000095666984 FG Annotated Mild O=C(NC[C@H]1N[C@H](CO)[C@@H]1c1ccc(C2=CCCCC2)cc1)C1CCCC1 ZINC000095667080 FG Annotated Anodyne N#C[C@@H]1[C@@H](c2ccccc2-c2ccccc2F)[C@@H](CO)N1C(=O)C1CC1 ZINC000095667083 FG Annotated Mild N#C[C@@H]1[C@@H](c2ccccc2-c2ccccc2F)[C@H](CO)N1C(=O)C1CC1 ZINC000095667091 FG Annotated Mild N#C[C@@H]1[C@H](c2ccccc2-c2ccccc2F)[C@H](CO)N1C(=O)C1CC1 ZINC000095667095 FG Annotated Mild N#C[C@H]1[C@@H](c2ccccc2-c2ccccc2F)[C@@H](CO)N1C(=O)C1CC1 ZINC000095667098 FG Annotated Mild N#C[C@H]1[C@H](c2ccccc2-c2ccccc2F)[C@H](CO)N1C(=O)C1CC1 ZINC000095667103 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@H](c2ccccc2-c2cccc(C)c2)[C@@H]1CO ZINC000095667117 FG Annotated Mild CCCNC(=O)N1[C@H](CO)[C@@H](c2ccccc2-c2cccc(C)c2)[C@@H]1C#N ZINC000095667124 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@@H](c2ccccc2-c2cccc(C)c2)[C@@H]1CO ZINC000095667128 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@H](c2ccccc2-c2ccc(F)cc2)[C@@H]1CO ZINC000095667206 FG Annotated Mild CCCNC(=O)N1[C@H](CO)[C@H](c2ccccc2-c2cccc(C)c2)[C@@H]1C#N ZINC000095667215 FG Annotated Mild CCCNC(=O)N1[C@H](CO)[C@H](c2ccccc2-c2ccc(F)cc2)[C@@H]1C#N ZINC000095667343 FG Annotated Mild CCCNC(=O)N1[C@H](CO)[C@@H](c2ccccc2-c2ccc(F)cc2)[C@@H]1C#N ZINC000095667347 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@@H](c2ccccc2-c2ccc(F)cc2)[C@@H]1CO ZINC000095667355 FG Annotated Mild CC(C)N(C[C@H]1[C@@H](c2ccccc2)[C@@H](CO)N1CC1CC1)C(=O)C1CCC1 ZINC000095667636 FG Annotated Anodyne N#C[C@@H]1[C@H](c2ccccc2-c2cccc(F)c2)[C@H](CO)N1C(=O)C1CCC1 ZINC000095667720 FG Annotated Mild N#C[C@H]1[C@@H](c2ccccc2-c2cccc(F)c2)[C@@H](CO)N1C(=O)C1CCC1 ZINC000095667728 FG Annotated Mild N#C[C@@H]1[C@@H](c2ccccc2-c2cccc(F)c2)[C@H](CO)N1C(=O)C1CCC1 ZINC000095667733 FG Annotated Mild N#C[C@H]1[C@@H](c2ccccc2-c2ccccc2F)[C@H](CO)N1C(=O)C1CC1 ZINC000095668656 FG Annotated Mild N#C[C@@H]1[C@H](c2ccccc2-c2ccccc2F)[C@@H](CO)N1C(=O)C1CC1 ZINC000095668659 FG Annotated Mild N#C[C@H]1[C@H](c2ccccc2-c2ccccc2F)[C@@H](CO)N1C(=O)C1CC1 ZINC000095668667 FG Annotated Mild CC(C)(C)OC(=O)N1CCNC[C@@H]1Cc1ccccc1Br ZINC000095752407 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCNC[C@H]1Cc1ccccc1Br ZINC000095752409 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCNC[C@@H]1Cc1cccc(Br)c1 ZINC000095752417 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCNC[C@H]1Cc1cccc(Br)c1 ZINC000095752419 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCN[C@H](Cc2ccc(Br)cc2)C1 ZINC000095752421 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCN[C@@H](Cc2ccc(Br)cc2)C1 ZINC000095752424 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCNC[C@@H]1Cc1ccc(Br)cc1 ZINC000095752426 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCNC[C@H]1Cc1ccc(Br)cc1 ZINC000095752429 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCNC[C@@H]1Cc1ccccc1OC(F)(F)F ZINC000095752478 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCNC[C@H]1Cc1ccccc1OC(F)(F)F ZINC000095752480 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCN[C@H](Cc2ccc(OC(F)(F)F)cc2)C1 ZINC000095752490 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCN[C@@H](Cc2ccc(OC(F)(F)F)cc2)C1 ZINC000095752492 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCNC[C@@H]1Cc1ccc(OC(F)(F)F)cc1 ZINC000095752494 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCNC[C@H]1Cc1ccc(OC(F)(F)F)cc1 ZINC000095752496 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](CC(F)(F)F)NC[C@H]1CC(F)(F)F ZINC000095752844 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](CC(F)(F)F)NC[C@@H]1CC(F)(F)F ZINC000095752846 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](CC(F)(F)F)NC[C@@H]1CC(F)(F)F ZINC000095752848 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](CC(F)(F)F)NC[C@H]1CC(F)(F)F ZINC000095752851 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](CC(F)(F)F)N[C@H](CC(F)(F)F)C1 ZINC000095752882 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](CC(F)(F)F)N[C@@H](CC(F)(F)F)C1 ZINC000095752885 FG Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](CC(F)(F)F)N[C@H](CC(F)(F)F)C1 ZINC000095752887 FG Annotated Anodyne CC(C)(C)OC(=O)n1nc(I)c2ccc(C=O)cc21 ZINC000095757026 FG Annotated Anodyne CC(C)(C)OC(=O)n1nc(I)c2cccc(C=O)c21 ZINC000095757028 FG Annotated Anodyne CC(C)(C)OC(=O)NCc1cc(I)cc(C=O)c1 ZINC000095764617 FG Annotated Anodyne CC(C)(C)OC(=O)N1CCc2c(nc(SCc3ccccc3)[nH]c2=O)C1 ZINC000095774493 FG Annotated Anodyne COc1ccc([C@@H]2CN(Cc3ccccc3)C(=O)[C@@]23CCCNC3)cc1 ZINC000095775165 FG Annotated Anodyne COc1ccc([C@H]2CN(Cc3ccccc3)C(=O)[C@@]23CCCNC3)cc1 ZINC000095775167 FG Annotated Anodyne COc1ccc([C@@H]2CN(Cc3ccccc3)C(=O)[C@]23CCCNC3)cc1 ZINC000095775168 FG Annotated Anodyne COc1ccc([C@H]2CN(Cc3ccccc3)C(=O)[C@]23CCCNC3)cc1 ZINC000095775170 FG Annotated Anodyne COc1cccc([C@@H]2CN(Cc3ccccc3)C(=O)[C@@]23CCCNC3)c1 ZINC000095775172 FG Annotated Anodyne COc1cccc([C@H]2CN(Cc3ccccc3)C(=O)[C@@]23CCCNC3)c1 ZINC000095775173 FG Annotated Anodyne COc1cccc([C@@H]2CN(Cc3ccccc3)C(=O)[C@]23CCCNC3)c1 ZINC000095775175 FG Annotated Anodyne COc1cccc([C@H]2CN(Cc3ccccc3)C(=O)[C@]23CCCNC3)c1 ZINC000095775177 FG Annotated Anodyne CCO[C@@H]1OC(C(=O)N2CCCC2)=C[C@H](c2ccccc2)[C@H]1CCCO ZINC000095783961 FG Annotated Anodyne CCO[C@H]1OC(C(=O)N2CCCCCCC2)=C[C@@H](C2CC2)[C@@H]1CCCO ZINC000095783971 FG Annotated Anodyne CNC(=O)C1=C[C@H](c2csc3ccccc23)C[C@H](OCCCCO)O1 ZINC000095784134 FG Annotated Anodyne CCO[C@@H]1OC(C(=O)N2CCCC2)=C[C@H](C2CCCCC2)[C@H]1CCCO ZINC000095784286 FG Annotated Anodyne COc1ccc([C@@H]2C=C(C(=O)O)O[C@H](OCc3ccc(CO)cc3)C2)cc1 ZINC000095784642 FG Annotated Anodyne COc1ccc([C@H]2C[C@H]3C(Br)=C[C@@H]2C(=O)[C@]32CO2)cc1OC ZINC000095784994 FG Annotated Anodyne O=C(C1=C[C@@H](C2CC2)C[C@@H](OCCCCO)O1)N1CCCCCCC1 ZINC000095785247 FG Annotated Anodyne N#C[C@@H]1[C@@H](c2ccccc2-c2ccccc2F)[C@H](CO)N1C(=O)C1CCC1 ZINC000095797227 FG Annotated Mild O=C(NC[C@@H]1CC[C@H]2[C@H](CN2Cc2ccccc2F)O1)C1CCCCC1 ZINC000095797584 FG Annotated Anodyne C/C=C/c1ccc([C@H]2[C@@H](CO)N(C(=O)CC3CC3)[C@H]2CNC(C)C)cc1 ZINC000095798284 FG Annotated Anodyne CCO[C@@H]1OC(C(=O)N2CCCCCCC2)=C[C@H](C2CC2)[C@H]1CCCO ZINC000095798331 FG Annotated Anodyne N#C[C@H]1[C@@H](c2ccccc2C2=CCCC2)[C@H](CO)N1C(=O)c1ccccn1 ZINC000095798368 FG Annotated Mild O=C(CCCCCC(=O)Nc1ccccc1O)N/N=C/c1cccs1 ZINC000095808343 FG Annotated Reactive O=C(CCCCCCC(=O)Nc1ccccc1O)N/N=C/c1ccco1 ZINC000095808486 FG Annotated Reactive COC(=O)CCCCCCC(=O)N/N=C/CCCC1OCC(C)(C)CO1 ZINC000095808699 FG Annotated Reactive CC1(C)COC(CCC/C=N/NC(=O)CCCCCCC(=O)O)OC1 ZINC000095809005 FG Annotated Reactive O=C(CCCCCCC(=O)Nc1ccccc1O)N/N=C/c1ccoc1 ZINC000095809027 FG Annotated Reactive O=C(O)CCCCCCC(=O)N/N=C/c1cc(Br)cs1 ZINC000095809739 FG Annotated Reactive O=C(O)CCCCCCC(=O)N/N=C/c1ccc(Br)s1 ZINC000095809742 FG Annotated Reactive Cc1ccc(/C=N/NC(=O)CCCCCC(=O)Nc2ccccc2O)o1 ZINC000095809772 FG Annotated Reactive N#C[C@@H]1[C@H](c2ccccc2C2=CCCC2)[C@@H](CO)N1C(=O)Cc1ccncc1 ZINC000095867930 FG Annotated Mild N#C[C@H]1[C@H](c2ccccc2C2=CCCC2)[C@@H](CO)N1C(=O)Cc1ccncc1 ZINC000095867934 FG Annotated Mild N#C[C@@H]1[C@H](c2ccccc2C2=CCCC2)[C@H](CO)N1C(=O)Cc1ccncc1 ZINC000095867936 FG Annotated Mild N#C[C@@H]1[C@@H](c2ccccc2C2=CCCC2)[C@H](CO)N1C(=O)Cc1ccncc1 ZINC000095867938 FG Annotated Mild O=C(NC[C@H]1N[C@H](CO)[C@@H]1c1ccc(C2=CCCC2)cc1)C1CCCCC1 ZINC000095867939 FG Annotated Anodyne N#C[C@H]1[C@@H](c2ccccc2C2=CCCC2)[C@H](CO)N1C(=O)Cc1ccncc1 ZINC000095867940 FG Annotated Mild N#C[C@H]1[C@@H](c2ccccc2C2=CCCC2)[C@@H](CO)N1C(=O)Cc1ccncc1 ZINC000095867944 FG Annotated Mild CC(C)[C@@H](CO)NC(=O)[C@H]1[C@@H](c2ccccc2)N(c2ccccc2)O[C@@H]1C ZINC000095868001 FG Annotated Anodyne O=C(NC[C@@H]1CC[C@@H]2[C@@H](CN2Cc2ccccc2F)O1)C1CCCCC1 ZINC000095869156 FG Annotated Anodyne O=C(NC[C@H]1CC[C@H]2[C@H](CN2Cc2ccccc2F)O1)C1CCCCC1 ZINC000095869398 FG Annotated Anodyne CCC(=O)NC[C@@H]1[C@@H](c2ccc(C3=CCCC3)cc2)[C@@H](CO)N1CC1CC1 ZINC000095871666 FG Annotated Anodyne C/C=C/c1ccc([C@H]2[C@@H](CO)N(CC3CCCC3)[C@H]2CNC(C)=O)cc1 ZINC000095871681 FG Annotated Anodyne Cc1nc(N2[C@H](CO)[C@H](c3ccccc3)[C@H]2CNCC2CCC2)sc1C ZINC000095871692 FG Annotated Anodyne CC(C)CN(C[C@H]1N[C@H](CO)[C@@H]1c1ccccc1)C(=O)C1CCCCC1 ZINC000095871699 FG Annotated Anodyne CCCNC(=O)N1[C@H](CO)[C@H](c2ccccc2-c2ccc(C)cc2)[C@@H]1C#N ZINC000095871715 FG Annotated Mild CCCNC(=O)N1[C@H](CO)[C@@H](c2ccccc2-c2ccc(C)cc2)[C@@H]1C#N ZINC000095871717 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@H](c2ccccc2-c2ccc(C)cc2)[C@@H]1CO ZINC000095871735 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@@H](c2ccccc2-c2ccc(C)cc2)[C@@H]1CO ZINC000095871737 FG Annotated Mild CN(C[C@@H]1N[C@H](CO)[C@@H]1c1ccc(-c2ccccc2)cc1)C(=O)C1CCC1 ZINC000095871772 FG Annotated Anodyne CCCNC(=O)N1[C@H](C#N)[C@H](c2ccccc2-c2ccccc2F)[C@@H]1CO ZINC000095871786 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@@H](c2ccccc2-c2ccccc2F)[C@@H]1CO ZINC000095871788 FG Annotated Mild CCCNC(=O)N1[C@H](CO)[C@@H](c2ccccc2-c2ccccc2F)[C@@H]1C#N ZINC000095871790 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@@H](c2ccccc2-c2ccccc2F)[C@H]1CO ZINC000095871799 FG Annotated Mild CCCNC(=O)N1[C@H](CO)[C@H](c2ccccc2-c2ccccc2F)[C@@H]1C#N ZINC000095871801 FG Annotated Mild CCCNC(=O)N1[C@@H](C#N)[C@H](c2ccccc2-c2ccccc2F)[C@@H]1CO ZINC000095871803 FG Annotated Mild CC(=O)N1[C@H](CO)[C@H](c2ccc(-c3ccccc3F)cc2)[C@@H]1CNC(C)C ZINC000095871822 FG Annotated Anodyne CC(C)CNC[C@@H]1[C@@H](c2ccccc2)[C@@H](CO)N1Cc1ccc(F)cc1 ZINC000095871844 FG Annotated Anodyne CCCC#Cc1ccc([C@H]2[C@@H](CO)N[C@@H]2CN(C(C)=O)C2CCCC2)cc1 ZINC000095871881 FG Annotated Mild CC(C)N(C[C@@H]1N[C@H](CO)[C@@H]1c1ccc(C2=CCCC2)cc1)C(=O)C1CC1 ZINC000095871894 FG Annotated Anodyne C/C=C/c1ccc([C@H]2[C@@H](CO)N(C(=O)C3CCCC3)[C@H]2CNCC)cc1 ZINC000095871905 FG Annotated Anodyne CC(C)NC(=O)N1[C@H](CO)[C@H](c2ccccc2-c2ccc(F)cc2)[C@@H]1C#N ZINC000095871919 FG Annotated Mild CC(C)NC(=O)N1[C@H](C#N)[C@@H](c2ccccc2-c2ccc(F)cc2)[C@@H]1CO ZINC000095871920 FG Annotated Mild CC(C)NC(=O)N1[C@H](CO)[C@@H](c2ccccc2-c2ccc(F)cc2)[C@@H]1C#N ZINC000095871922 FG Annotated Mild CC(C)NC(=O)N1[C@H](C#N)[C@H](c2ccccc2-c2ccc(F)cc2)[C@@H]1CO ZINC000095871924 FG Annotated Mild N#C[C@H]1[C@H](c2ccccc2-c2ccccc2F)[C@@H](CO)N1C(=O)C1CCC1 ZINC000095871931 FG Annotated Mild N#C[C@H]1[C@@H](c2ccccc2-c2ccccc2F)[C@@H](CO)N1C(=O)C1CCC1 ZINC000095871933 FG Annotated Mild N#C[C@H]1[C@@H](c2ccccc2-c2ccccc2F)[C@H](CO)N1C(=O)C1CCC1 ZINC000095871935 FG Annotated Mild N#C[C@@H]1[C@H](c2ccccc2-c2ccccc2F)[C@H](CO)N1C(=O)C1CCC1 ZINC000095871937 FG Annotated Mild N#C[C@@H]1[C@@H](c2ccccc2-c2ccccc2F)[C@@H](CO)N1C(=O)C1CCC1 ZINC000095871939 FG Annotated Mild N#C[C@@H]1[C@H](c2ccccc2-c2ccccc2F)[C@@H](CO)N1C(=O)C1CCC1 ZINC000095871941 FG Annotated Mild N#C[C@H]1[C@H](c2ccccc2-c2ccccc2F)[C@H](CO)N1C(=O)C1CCC1 ZINC000095871942 FG Annotated Mild C/C=C/c1ccccc1[C@H]1[C@@H](C#N)N(C(=O)NC2CCCCC2)[C@H]1CO ZINC000095871968 FG Annotated Mild C/C=C/c1ccccc1[C@@H]1[C@@H](C#N)N(C(=O)NC2CCCCC2)[C@H]1CO ZINC000095871969 FG Annotated Mild C/C=C/c1ccccc1[C@H]1[C@@H](CO)N(C(=O)NC2CCCCC2)[C@H]1C#N ZINC000095871971 FG Annotated Mild CCCNC(=O)N1[C@H](CO)[C@@H](c2ccccc2C2=CCCCC2)[C@@H]1C#N ZINC000095871975 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@@H](c2ccccc2C2=CCCCC2)[C@@H]1CO ZINC000095871977 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@H](c2ccccc2C2=CCCCC2)[C@@H]1CO ZINC000095871979 FG Annotated Mild CCCNC(=O)N1[C@H](CO)[C@H](c2ccccc2C2=CCCCC2)[C@@H]1C#N ZINC000095871981 FG Annotated Mild C/C=C/c1ccccc1[C@@H]1[C@@H](CO)N(C(=O)NC2CCCCC2)[C@H]1C#N ZINC000095871992 FG Annotated Mild CCC(=O)N1CC[C@@H]2[C@H]1c1cc(-c3ccccc3)ccc1N(C)[C@@H]2CO ZINC000095872120 FG Annotated Anodyne Cc1cc(C)c(S(=O)(=O)Nc2nc(N(C)C)nc3ccccc23)c(C)c1 ZINC000095872212 FG Annotated Anodyne CCOC(=O)N1C(=O)C2(CCCCC2)N(c2cccc(OC)c2)C1=S ZINC000095872343 FG Annotated Anodyne CCOC(=O)N1C(=O)C2(CCCCC2)N(c2ccc(C#N)cc2)C1=S ZINC000095872945 FG Annotated Mild CCOC(=O)N1C(=O)C2(CCCCC2)N(c2ccc(OC)cc2)C1=S ZINC000095872981 FG Annotated Anodyne CCCC#Cc1ccc([C@H]2[C@@H](CO)N3CCCCN(CC4CC4)C[C@H]23)cc1 ZINC000095873388 FG Annotated Mild CCCC#Cc1ccc([C@H]2[C@H](CO)N3CCCCN(CC4CC4)C[C@@H]23)cc1 ZINC000095873389 FG Annotated Mild CCCC#Cc1ccc([C@@H]2[C@@H](CO)N3CCCCN(CC4CC4)C[C@@H]23)cc1 ZINC000095873390 FG Annotated Mild CCCC#Cc1ccc([C@@H]2[C@H]3CN(CC4CC4)CCCCN3[C@H]2CO)cc1 ZINC000095873391 FG Annotated Mild CCCC#Cc1ccc([C@H]2[C@H]3CN(CC4CC4)CCCCN3[C@H]2CO)cc1 ZINC000095873392 FG Annotated Mild CCCC#Cc1ccc([C@H]2[C@@H](CO)N3CCCCN(CC4CC4)C[C@@H]23)cc1 ZINC000095873393 FG Annotated Mild CCCC#Cc1ccc([C@@H]2[C@@H](CO)N3CCCCN(CC4CC4)C[C@H]23)cc1 ZINC000095873394 FG Annotated Mild CCCC#Cc1ccc([C@@H]2[C@H](CO)N3CCCCN(CC4CC4)C[C@@H]23)cc1 ZINC000095873395 FG Annotated Mild CC(C)C#Cc1ccc([C@H]2[C@H]3CN(CC4CC4)CCCCN3[C@H]2CO)cc1 ZINC000095873554 FG Annotated Mild CC(C)C#Cc1ccc([C@@H]2[C@H](CO)N3CCCCN(CC4CC4)C[C@@H]23)cc1 ZINC000095873555 FG Annotated Mild CC(C)C#Cc1ccc([C@H]2[C@@H](CO)N3CCCCN(CC4CC4)C[C@H]23)cc1 ZINC000095873556 FG Annotated Mild CC(C)C#Cc1ccc([C@@H]2[C@@H](CO)N3CCCCN(CC4CC4)C[C@@H]23)cc1 ZINC000095873557 FG Annotated Mild CC(C)C#Cc1ccc([C@@H]2[C@@H](CO)N3CCCCN(CC4CC4)C[C@H]23)cc1 ZINC000095873558 FG Annotated Mild CC(C)C#Cc1ccc([C@H]2[C@H](CO)N3CCCCN(CC4CC4)C[C@@H]23)cc1 ZINC000095873559 FG Annotated Mild CC(C)C#Cc1ccc([C@@H]2[C@H]3CN(CC4CC4)CCCCN3[C@H]2CO)cc1 ZINC000095873560 FG Annotated Mild CC(C)C#Cc1ccc([C@H]2[C@@H](CO)N3CCCCN(CC4CC4)C[C@@H]23)cc1 ZINC000095873561 FG Annotated Mild CN1CCCCN2[C@H](CO)[C@@H](c3ccc(-c4ccc(F)cc4)cc3)[C@H]2C1 ZINC000095877041 FG Annotated Anodyne CN1CCCCN2[C@H](CO)[C@H](c3ccc(-c4ccc(F)cc4)cc3)[C@@H]2C1 ZINC000095877042 FG Annotated Anodyne CN1CCCCN2[C@@H](CO)[C@@H](c3ccc(-c4ccc(F)cc4)cc3)[C@@H]2C1 ZINC000095877043 FG Annotated Anodyne CN1CCCCN2[C@H](CO)[C@H](c3ccc(-c4ccc(F)cc4)cc3)[C@H]2C1 ZINC000095877044 FG Annotated Anodyne CN1CCCCN2[C@@H](CO)[C@H](c3ccc(-c4ccc(F)cc4)cc3)[C@@H]2C1 ZINC000095877045 FG Annotated Anodyne CN1CCCCN2[C@H](CO)[C@@H](c3ccc(-c4ccc(F)cc4)cc3)[C@@H]2C1 ZINC000095877046 FG Annotated Anodyne CN1CCCCN2[C@H](C1)[C@@H](c1ccc(-c3ccc(F)cc3)cc1)[C@@H]2CO ZINC000095877047 FG Annotated Anodyne CN1CCCCN2[C@H](C1)[C@H](c1ccc(-c3ccc(F)cc3)cc1)[C@@H]2CO ZINC000095877048 FG Annotated Anodyne CCCC#Cc1ccc([C@@H]2[C@@H](CO)N3CCCCN(CCC)C[C@@H]23)cc1 ZINC000095877228 FG Annotated Mild CCCC#Cc1ccc([C@@H]2[C@H]3CN(CCC)CCCCN3[C@H]2CO)cc1 ZINC000095877229 FG Annotated Mild CC(=O)N1CCCCN2[C@@H](CO)[C@@H](c3ccc(-c4ccccc4)cc3)[C@@H]2C1 ZINC000095877321 FG Annotated Anodyne CC(=O)N1CCCCN2[C@H](C1)[C@H](c1ccc(-c3ccccc3)cc1)[C@@H]2CO ZINC000095877322 FG Annotated Anodyne CC(=O)N1CCCCN2[C@@H](CO)[C@H](c3ccc(-c4ccccc4)cc3)[C@@H]2C1 ZINC000095877323 FG Annotated Anodyne CC(=O)N1CCCCN2[C@H](CO)[C@@H](c3ccc(-c4ccccc4)cc3)[C@H]2C1 ZINC000095877324 FG Annotated Anodyne CC(=O)N1CCCCN2[C@H](CO)[C@H](c3ccc(-c4ccccc4)cc3)[C@H]2C1 ZINC000095877325 FG Annotated Anodyne CC(=O)N1CCCCN2[C@H](CO)[C@H](c3ccc(-c4ccccc4)cc3)[C@@H]2C1 ZINC000095877326 FG Annotated Anodyne N#Cc1ccc(-c2ccc3c(c2)[C@@H]2[C@@H](CCN2C(=O)C2CC2)[C@H](CO)N3)cc1 ZINC000095877444 FG Annotated Mild N#Cc1ccc(-c2ccc3c(c2)[C@@H]2[C@@H](CCN2C(=O)C2CC2)[C@@H](CO)N3)cc1 ZINC000095877445 FG Annotated Mild N#Cc1ccc(-c2ccc3c(c2)[C@H]2[C@H](CCN2C(=O)C2CC2)[C@H](CO)N3)cc1 ZINC000095877446 FG Annotated Mild N#Cc1ccc(-c2ccc3c(c2)[C@H]2[C@H](CCN2C(=O)C2CC2)[C@@H](CO)N3)cc1 ZINC000095877447 FG Annotated Mild CCC(=O)N1CC[C@@H]2[C@@H](CO)N(C)c3ccc(-c4ccccc4)cc3[C@@H]21 ZINC000095877994 FG Annotated Anodyne CCC(=O)N1CC[C@H]2[C@@H]1c1cc(-c3ccccc3)ccc1N(C)[C@H]2CO ZINC000095877996 FG Annotated Anodyne CCC(=O)N1CC[C@@H]2[C@H]1c1cc(-c3ccccc3)ccc1N(C)[C@H]2CO ZINC000095877997 FG Annotated Anodyne CC(=O)N1CC[C@@H]2[C@H]1c1cc(-c3cccc(F)c3)ccc1N(C)[C@@H]2CO ZINC000095878086 FG Annotated Anodyne CC(=O)N1CC[C@@H]2[C@H]1c1cc(-c3cccc(F)c3)ccc1N(C)[C@H]2CO ZINC000095878088 FG Annotated Anodyne CC(=O)N1CC[C@H]2[C@@H]1c1cc(-c3cccc(F)c3)ccc1N(C)[C@H]2CO ZINC000095878089 FG Annotated Anodyne CCC(=O)N1CC[C@@H]2[C@@H](CO)Nc3ccc(-c4ccc(OC)cc4)cc3[C@@H]21 ZINC000095878354 FG Annotated Anodyne CCC(=O)N1CC[C@@H]2[C@H]1c1cc(-c3ccc(OC)cc3)ccc1N[C@H]2CO ZINC000095878355 FG Annotated Anodyne CCC(=O)N1CC[C@H]2[C@@H](CO)Nc3ccc(-c4ccc(OC)cc4)cc3[C@H]21 ZINC000095878356 FG Annotated Anodyne CCC(=O)N1CC[C@H]2[C@@H](CO)Nc3ccc(C#Cc4ccccc4)cc3[C@H]21 ZINC000095878667 FG Annotated Mild CCC(=O)N1CC[C@@H]2[C@H](CO)Nc3ccc(C#Cc4ccccc4)cc3[C@@H]21 ZINC000095878668 FG Annotated Mild CCC(=O)N1CC[C@@H]2[C@@H](CO)Nc3ccc(C#Cc4ccccc4)cc3[C@@H]21 ZINC000095878669 FG Annotated Mild CCCC#Cc1ccc2c(c1)[C@@H]1[C@@H](CCN1C(=O)CC1CC1)[C@@H](CO)N2C ZINC000095878851 FG Annotated Mild CCC(=O)N1C[C@@H]2[C@H](c3ccccc31)[C@H](CO)N2Cc1cc(F)ccc1F ZINC000095893818 FG Annotated Anodyne CCC(=O)N1C[C@H]2[C@@H](c3ccccc31)[C@H](CO)N2Cc1cc(F)ccc1F ZINC000095893819 FG Annotated Anodyne CCC(=O)N1C[C@H]2[C@@H](c3ccccc31)[C@@H](CO)N2Cc1cc(F)ccc1F ZINC000095893820 FG Annotated Anodyne CCC(=O)N1C[C@@H]2[C@H](c3ccccc31)[C@@H](CO)N2Cc1cc(F)ccc1F ZINC000095893821 FG Annotated Anodyne CC(=O)N1C[C@@H]2[C@H](c3ccccc31)[C@H](CO)N2Cc1ccc(Cl)cc1 ZINC000095894135 FG Annotated Anodyne CC(=O)N1C[C@H]2[C@@H](c3ccccc31)[C@@H](CO)N2Cc1ccc(Cl)cc1 ZINC000095894136 FG Annotated Anodyne O=C(C1CCC1)N1C[C@@H]2[C@H](c3ccccc31)[C@H](CO)N2Cc1ccccc1 ZINC000095894475 FG Annotated Anodyne O=C(C1CCC1)N1C[C@H]2[C@@H](c3ccccc31)[C@@H](CO)N2Cc1ccccc1 ZINC000095894476 FG Annotated Anodyne CCC(=O)N1C[C@@H]2[C@H](c3ccccc31)[C@H](CO)N2Cc1ccccc1Cl ZINC000095894477 FG Annotated Anodyne CCC(=O)N1C[C@H]2[C@@H](c3ccccc31)[C@H](CO)N2Cc1ccccc1Cl ZINC000095894478 FG Annotated Anodyne CCC(=O)N1C[C@H]2[C@@H](c3ccccc31)[C@@H](CO)N2Cc1ccccc1Cl ZINC000095894479 FG Annotated Anodyne CCC(=O)N1C[C@@H]2[C@H](c3ccccc31)[C@@H](CO)N2Cc1ccccc1Cl ZINC000095894480 FG Annotated Anodyne CCCNC(=O)N1C[C@H]2[C@@H](c3ccccc31)[C@@H](CO)N2CC1CCCCC1 ZINC000095894592 FG Annotated Anodyne CCCNC(=O)N1C[C@@H]2[C@H](c3ccccc31)[C@@H](CO)N2CC1CCCCC1 ZINC000095894593 FG Annotated Anodyne CCCNC(=O)N1C[C@@H]2[C@H](c3ccccc31)[C@H](CO)N2CC1CCCCC1 ZINC000095894594 FG Annotated Anodyne CCCNC(=O)N1C[C@H]2[C@@H](c3ccccc31)[C@H](CO)N2CC1CCCCC1 ZINC000095894595 FG Annotated Anodyne CC(=O)N(C)C[C@H]1[C@H](c2ccc(C3=CCCC3)cc2)[C@H](CO)N1CC1CC1 ZINC000095894876 FG Annotated Anodyne CC(=O)N(C)C[C@@H]1[C@@H](c2ccc(C3=CCCC3)cc2)[C@@H](CO)N1CC1CC1 ZINC000095894877 FG Annotated Anodyne CN(C[C@H]1N[C@@H](CO)[C@H]1c1ccc(-c2ccccc2)cc1)C(=O)C1CCC1 ZINC000095895142 FG Annotated Anodyne CC(=O)N(C[C@H]1N[C@H](CO)[C@@H]1c1ccc(-c2ccc(F)cc2)cc1)C(C)C ZINC000095895200 FG Annotated Anodyne CC(=O)N(C[C@H]1N[C@H](CO)[C@H]1c1ccc(-c2ccc(F)cc2)cc1)C(C)C ZINC000095895201 FG Annotated Anodyne CC(=O)N(C[C@@H]1N[C@@H](CO)[C@H]1c1ccc(-c2ccc(F)cc2)cc1)C(C)C ZINC000095895202 FG Annotated Anodyne CC(=O)N(C[C@@H]1N[C@@H](CO)[C@@H]1c1ccc(-c2ccc(F)cc2)cc1)C(C)C ZINC000095895203 FG Annotated Anodyne O=C(NC[C@H]1N[C@H](CO)[C@@H]1c1ccc(C2=CCCC2)cc1)c1ccccc1 ZINC000095895538 FG Annotated Anodyne O=C(NC[C@@H]1N[C@@H](CO)[C@H]1c1ccc(C2=CCCC2)cc1)c1ccccc1 ZINC000095895539 FG Annotated Anodyne O=C(NC[C@@H]1N[C@@H](CO)[C@@H]1c1ccc(C2=CCCC2)cc1)c1ccccc1 ZINC000095895540 FG Annotated Anodyne C/C=C/c1ccc([C@H]2[C@@H](CNC(C)C)N(Cc3cccnc3)[C@H]2CO)cc1 ZINC000095895720 FG Annotated Anodyne C/C=C/c1ccc([C@@H]2[C@@H](CO)N[C@@H]2CN(C(=O)C2CCC2)C(C)C)cc1 ZINC000095895722 FG Annotated Anodyne C/C=C/c1ccc([C@H]2[C@H](CO)N[C@H]2CN(C(=O)C2CCC2)C(C)C)cc1 ZINC000095895723 FG Annotated Anodyne CC(=O)N(CC1CCC1)C[C@@H]1N[C@@H](CO)[C@H]1c1ccc(C2=CCCC2)cc1 ZINC000095895761 FG Annotated Anodyne CC(=O)N(CC1CCC1)C[C@H]1N[C@H](CO)[C@@H]1c1ccc(C2=CCCC2)cc1 ZINC000095895762 FG Annotated Anodyne CC(=O)N(C[C@@H]1N[C@@H](CO)[C@H]1c1ccc(-c2ccccc2)cc1)C(C)C ZINC000095895802 FG Annotated Anodyne CC(=O)N(C[C@@H]1N[C@@H](CO)[C@@H]1c1ccc(-c2ccccc2)cc1)C(C)C ZINC000095895803 FG Annotated Anodyne CC(=O)N(C[C@H]1N[C@H](CO)[C@H]1c1ccc(-c2ccccc2)cc1)C(C)C ZINC000095895804 FG Annotated Anodyne CCCC#Cc1ccc([C@H]2[C@@H](C#N)N(C(=O)C3CCCC3)[C@H]2CO)cc1 ZINC000095896014 FG Annotated Mild CCCC#Cc1ccc([C@@H]2[C@@H](C#N)N(C(=O)C3CCCC3)[C@H]2CO)cc1 ZINC000095896015 FG Annotated Mild CCCC#Cc1ccc([C@H]2[C@@H](C#N)N(C(=O)C3CCCC3)[C@@H]2CO)cc1 ZINC000095896016 FG Annotated Mild CCCC#Cc1ccc([C@@H]2[C@@H](CO)N(C(=O)C3CCCC3)[C@H]2C#N)cc1 ZINC000095896017 FG Annotated Mild CCCC#Cc1ccc([C@@H]2[C@H](C#N)N(C(=O)C3CCCC3)[C@H]2CO)cc1 ZINC000095896018 FG Annotated Mild CCCC#Cc1ccc([C@@H]2[C@@H](C#N)N(C(=O)C3CCCC3)[C@@H]2CO)cc1 ZINC000095896019 FG Annotated Mild CCCC#Cc1ccc([C@H]2[C@@H](CO)N(C(=O)C3CCCC3)[C@H]2C#N)cc1 ZINC000095896020 FG Annotated Mild C/C=C/c1ccc([C@@H]2[C@H](C#N)N(C(=O)NC3CCCCC3)[C@H]2CO)cc1 ZINC000095896021 FG Annotated Mild C/C=C/c1ccc([C@H]2[C@@H](C#N)N(C(=O)NC3CCCCC3)[C@H]2CO)cc1 ZINC000095896022 FG Annotated Mild C/C=C/c1ccc([C@H]2[C@@H](CO)N(C(=O)NC3CCCCC3)[C@H]2C#N)cc1 ZINC000095896023 FG Annotated Mild C/C=C/c1ccc([C@@H]2[C@@H](C#N)N(C(=O)NC3CCCCC3)[C@@H]2CO)cc1 ZINC000095896024 FG Annotated Mild N#C[C@@H]1[C@@H](c2ccc(-c3ccncc3)cc2)[C@@H](CO)N1C(=O)C1CCCC1 ZINC000095896052 FG Annotated Mild N#C[C@H]1[C@@H](c2ccc(-c3ccncc3)cc2)[C@@H](CO)N1C(=O)C1CCCC1 ZINC000095896053 FG Annotated Mild N#C[C@@H]1[C@H](c2ccc(C3=CCCC3)cc2)[C@@H](CO)N1C(=O)Cc1ccncc1 ZINC000095896134 FG Annotated Mild N#C[C@@H]1[C@H](c2ccc(C3=CCCC3)cc2)[C@H](CO)N1C(=O)Cc1ccncc1 ZINC000095896135 FG Annotated Mild N#C[C@H]1[C@@H](c2ccc(C3=CCCC3)cc2)[C@H](CO)N1C(=O)Cc1ccncc1 ZINC000095896136 FG Annotated Mild N#C[C@@H]1[C@@H](c2ccc(C3=CCCC3)cc2)[C@@H](CO)N1C(=O)Cc1ccncc1 ZINC000095896137 FG Annotated Mild N#C[C@H]1[C@H](c2ccc(-c3ccccc3F)cc2)[C@H](CO)N1C(=O)C1CC1 ZINC000095896232 FG Annotated Mild N#C[C@@H]1[C@H](c2ccc(-c3ccccc3F)cc2)[C@@H](CO)N1C(=O)C1CC1 ZINC000095896233 FG Annotated Mild N#C[C@@H]1[C@H](c2ccc(-c3ccccc3F)cc2)[C@H](CO)N1C(=O)C1CC1 ZINC000095896234 FG Annotated Mild N#C[C@H]1[C@@H](c2ccc(-c3ccccc3F)cc2)[C@H](CO)N1C(=O)C1CC1 ZINC000095896235 FG Annotated Mild N#C[C@H]1[C@H](c2ccc(-c3ccccc3F)cc2)[C@@H](CO)N1C(=O)C1CC1 ZINC000095896236 FG Annotated Mild N#C[C@@H]1[C@@H](c2ccc(-c3ccccc3F)cc2)[C@H](CO)N1C(=O)C1CC1 ZINC000095896237 FG Annotated Mild N#C[C@@H]1[C@@H](c2ccc(-c3ccccc3F)cc2)[C@@H](CO)N1C(=O)C1CC1 ZINC000095896238 FG Annotated Mild N#C[C@H]1[C@@H](c2ccc(-c3ccccc3F)cc2)[C@@H](CO)N1C(=O)C1CC1 ZINC000095896239 FG Annotated Mild N#C[C@@H]1[C@@H](c2ccc(C#CC3CC3)cc2)[C@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095896270 FG Annotated Mild N#C[C@H]1[C@@H](c2ccc(C#CC3CC3)cc2)[C@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095896271 FG Annotated Mild N#C[C@H]1[C@H](c2ccc(C#CC3CC3)cc2)[C@@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095896272 FG Annotated Mild N#C[C@H]1[C@@H](c2ccc(C#CC3CC3)cc2)[C@@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095896273 FG Annotated Mild N#C[C@@H]1[C@@H](c2ccc(/C=C/c3ccccc3)cc2)[C@@H](CO)N1C(=O)C1CC1 ZINC000095897458 FG Annotated Mild N#C[C@H]1[C@@H](c2ccc(/C=C/c3ccccc3)cc2)[C@@H](CO)N1C(=O)C1CC1 ZINC000095897459 FG Annotated Mild N#C[C@H]1[C@H](c2ccc(-c3ccccc3F)cc2)[C@H](CO)N1C(=O)C1CCC1 ZINC000095897530 FG Annotated Mild N#C[C@@H]1[C@H](c2ccc(-c3ccccc3F)cc2)[C@H](CO)N1C(=O)C1CCC1 ZINC000095897531 FG Annotated Mild N#C[C@@H]1[C@@H](c2ccc(-c3ccccc3F)cc2)[C@H](CO)N1C(=O)C1CCC1 ZINC000095897532 FG Annotated Mild N#C[C@@H]1[C@H](c2ccc(-c3ccccc3F)cc2)[C@@H](CO)N1C(=O)C1CCC1 ZINC000095897533 FG Annotated Mild N#C[C@H]1[C@H](c2ccc(-c3ccccc3F)cc2)[C@@H](CO)N1C(=O)C1CCC1 ZINC000095897534 FG Annotated Mild N#C[C@H]1[C@@H](c2ccc(-c3ccccc3F)cc2)[C@H](CO)N1C(=O)C1CCC1 ZINC000095897535 FG Annotated Mild N#C[C@H]1[C@@H](c2ccc(-c3ccccc3F)cc2)[C@@H](CO)N1C(=O)C1CCC1 ZINC000095897536 FG Annotated Mild N#C[C@H]1[C@H](c2ccccc2)[C@H](CO)N1C(=O)c1cc(Cl)cc(Cl)c1 ZINC000095897931 FG Annotated Mild N#C[C@@H]1[C@H](c2ccccc2)[C@H](CO)N1C(=O)c1cc(Cl)cc(Cl)c1 ZINC000095897932 FG Annotated Mild N#C[C@H]1[C@@H](c2ccccc2)[C@H](CO)N1C(=O)c1cc(Cl)cc(Cl)c1 ZINC000095897933 FG Annotated Mild N#C[C@@H]1[C@@H](c2ccccc2)[C@H](CO)N1C(=O)c1cc(Cl)cc(Cl)c1 ZINC000095897934 FG Annotated Mild N#C[C@H]1[C@H](c2ccccc2)[C@@H](CO)N1C(=O)c1cc(Cl)cc(Cl)c1 ZINC000095897935 FG Annotated Mild N#C[C@@H]1[C@H](c2ccccc2)[C@@H](CO)N1C(=O)c1cc(Cl)cc(Cl)c1 ZINC000095897936 FG Annotated Mild N#C[C@@H]1[C@@H](c2ccccc2)[C@@H](CO)N1C(=O)c1cc(Cl)cc(Cl)c1 ZINC000095897937 FG Annotated Mild N#C[C@H]1[C@@H](c2ccccc2)[C@@H](CO)N1C(=O)c1cc(Cl)cc(Cl)c1 ZINC000095897938 FG Annotated Mild CCCNC(=O)N1[C@H](CO)[C@@H](c2ccc(C3=CCCCC3)cc2)[C@@H]1C#N ZINC000095898050 FG Annotated Mild CCCNC(=O)N1[C@@H](C#N)[C@@H](c2ccc(C3=CCCCC3)cc2)[C@@H]1CO ZINC000095898051 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@H](c2ccc(C3=CCCCC3)cc2)[C@H]1CO ZINC000095898052 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@@H](c2ccc(C3=CCCCC3)cc2)[C@@H]1CO ZINC000095898053 FG Annotated Mild CCCNC(=O)N1[C@@H](C#N)[C@H](c2ccc(C3=CCCCC3)cc2)[C@@H]1CO ZINC000095898054 FG Annotated Mild CCCNC(=O)N1[C@H](CO)[C@H](c2ccc(C3=CCCCC3)cc2)[C@@H]1C#N ZINC000095898055 FG Annotated Mild N#C[C@@H]1[C@H](c2ccc(C3=CCCC3)cc2)[C@@H](CO)N1C(=O)c1ccccn1 ZINC000095898067 FG Annotated Mild N#C[C@H]1[C@H](c2ccc(C3=CCCC3)cc2)[C@@H](CO)N1C(=O)c1ccccn1 ZINC000095898068 FG Annotated Mild N#C[C@H]1[C@@H](c2ccc(C3=CCCC3)cc2)[C@H](CO)N1C(=O)c1ccccn1 ZINC000095898069 FG Annotated Mild N#C[C@@H]1[C@H](c2ccc(C3=CCCC3)cc2)[C@H](CO)N1C(=O)c1ccccn1 ZINC000095898070 FG Annotated Mild N#C[C@H]1[C@@H](c2ccc(C3=CCCC3)cc2)[C@@H](CO)N1C(=O)c1ccccn1 ZINC000095898071 FG Annotated Mild CC(C)NC(=O)N1[C@H](C#N)[C@H](c2ccc(-c3ccc(F)cc3)cc2)[C@H]1CO ZINC000095898138 FG Annotated Mild CC(C)NC(=O)N1[C@H](C#N)[C@H](c2ccc(-c3ccc(F)cc3)cc2)[C@@H]1CO ZINC000095898139 FG Annotated Mild CC(C)NC(=O)N1[C@@H](C#N)[C@H](c2ccc(-c3ccc(F)cc3)cc2)[C@@H]1CO ZINC000095898140 FG Annotated Mild CC(C)NC(=O)N1[C@H](CO)[C@@H](c2ccc(-c3ccc(F)cc3)cc2)[C@@H]1C#N ZINC000095898141 FG Annotated Mild CC(C)NC(=O)N1[C@H](C#N)[C@@H](c2ccc(-c3ccc(F)cc3)cc2)[C@@H]1CO ZINC000095898142 FG Annotated Mild CC(C)NC(=O)N1[C@@H](C#N)[C@@H](c2ccc(-c3ccc(F)cc3)cc2)[C@@H]1CO ZINC000095898143 FG Annotated Mild CC(C)NC(=O)N1[C@H](C#N)[C@@H](c2ccc(-c3ccc(F)cc3)cc2)[C@H]1CO ZINC000095898144 FG Annotated Mild CC(C)NC(=O)N1[C@H](CO)[C@H](c2ccc(-c3ccc(F)cc3)cc2)[C@@H]1C#N ZINC000095898145 FG Annotated Mild CCCNC(=O)N1[C@H](CO)[C@@H](c2ccc(-c3ccccc3F)cc2)[C@@H]1C#N ZINC000095898265 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@H](c2ccc(-c3ccccc3F)cc2)[C@H]1CO ZINC000095898266 FG Annotated Mild CCCNC(=O)N1[C@@H](C#N)[C@H](c2ccc(-c3ccccc3F)cc2)[C@@H]1CO ZINC000095898267 FG Annotated Mild CCCNC(=O)N1[C@@H](C#N)[C@@H](c2ccc(-c3ccccc3F)cc2)[C@@H]1CO ZINC000095898268 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@@H](c2ccc(-c3ccccc3F)cc2)[C@@H]1CO ZINC000095898269 FG Annotated Mild CCCNC(=O)N1[C@H](CO)[C@H](c2ccc(-c3ccccc3F)cc2)[C@@H]1C#N ZINC000095898270 FG Annotated Mild CCCNC(=O)N1[C@H](C#N)[C@@H](c2ccc(-c3ccccc3F)cc2)[C@H]1CO ZINC000095898271 FG Annotated Mild CC(=O)O[C@H]1C[C@@H]2[C@@](C)(CO)CCC[C@@]2(C)[C@@]2(O)C[C@@H]3[C@@H]4C[C@]12C[C@@]43C ZINC000095909225 FG Annotated Anodyne in-vitro biogenic CC(=O)O[C@@]12C=C(C)C(=O)/C1=C/[C@@](C)(O)CC[C@H]1[C@@H](C[C@@H](C)C2=O)C1(C)C ZINC000095909260 FG Annotated Mild in-vitro biogenic COC(=O)c1cc2c(c3c1c([N+](=O)[O-])cc1c(OC)cc(O)cc13)OCO2 ZINC000095909648 FG Annotated Bother in-vitro biogenic CC(=O)O[C@@H]1C[C@@]2(C)[C@@H]3O[C@@H]3CC[C@@H]2[C@@](C=O)(CC(=O)c2ccoc2)[C@@H]1C ZINC000095910024 FG Annotated Mild in-vitro biogenic CO[C@H]1C[C@@]2(CC[C@@]3(O2)[C@H](C)C(=O)[C@@H](O)[C@H]2C(C)(C)CCC[C@@]23C)CO1 ZINC000095911268 FG Annotated Anodyne in-vitro biogenic C=C[C@]1(C)O[C@@]2(C)CC[C@H](C(C)(C)C(=O)O)[C@@](C)(CC(=O)O)[C@@H]2C[C@@H]1O ZINC000095911469 FG Annotated Mild in-vitro biogenic CC(C)(C(=O)O)[C@H]1CC[C@]2(C)O[C@@](C)([C@@H]3CO3)CC[C@H]2[C@]1(C)CC(=O)O ZINC000095911470 FG Annotated Anodyne in-vitro biogenic CC(C)(C(=O)O)[C@H]1CC[C@]2(C)O[C@@](C)([C@H]3CO3)CC[C@H]2[C@]1(C)CC(=O)O ZINC000095911471 FG Annotated Anodyne in-vitro biogenic CC(C)=CC[N+]12CCO[C@]13[C@@H]1OC(=O)[C@@H]([C@@H]1C(C)C)[C@@H]1CC[C@H](C2)[C@@]13C ZINC000095912459 FG Annotated Bother in-vitro biogenic COC(=O)[C@@]12CC[C@]3(C=CCN4CC[C@]5(C1=Nc1c(OC)cccc15)[C@@H]43)C2 ZINC000095912649 FG Annotated Anodyne in-vitro biogenic CC1=C[C@H](OC(=O)c2ccc(O)cc2)[C@@H]2[C@](C)(CC[C@@]2(O)C(C)C)C[C@H]1O ZINC000095912662 FG Annotated Anodyne in-vitro biogenic CC(C)[C@]1(O)CC[C@@]2(C)C=C[C@](C)(O)C[C@H](OC(=O)c3ccc(O)cc3)[C@H]21 ZINC000095912663 FG Annotated Anodyne in-vitro biogenic CC1=C[C@H](OC(=O)c2ccc(O)cc2)[C@@H]2[C@@](C)(CC[C@@]2(O)C(C)C)C[C@@H]1O ZINC000095912714 FG Annotated Anodyne in-vitro biogenic CO[C@H]1C[C@H](CC[C@H]2C(=O)CC[C@H]3[C@@](C)(C(=O)O)CCC[C@]23C)C(=O)O1 ZINC000095913560 FG Annotated Anodyne in-vitro biogenic C=C1C(=O)O[C@@H]2[C@H]1CCC(C)=C1[C@@H]3O[C@@](C)([C@H]3OC(=O)[C@H](C)CC)[C@@]12C ZINC000095913590 FG Annotated Mild in-vitro biogenic CO[C@H]1OC[C@H](Cc2ccc3c(c2)OCO3)[C@H]1Cc1ccc2c(c1)OCO2 ZINC000095913604 FG Annotated Anodyne in-vitro biogenic COC(=O)[C@]1(C)CCC[C@@]2(C)[C@H]3CC[C@@H]4C[C@@]3(CC[C@@H]21)C[C@]4(O)CO ZINC000095913615 FG Annotated Anodyne in-vitro biogenic CC(=O)[C@]12C[C@@H](C)[C@](CO)(CC/C(=C/CO)CO)[C@H]1CCCCC2(C)C ZINC000095914509 FG Annotated Anodyne in-vitro biogenic C=C1C(=O)C2=C[C@H]1C[C@H](O)C(=O)[C@]1(C)CCCC(C)(C)[C@H]1C[C@H]2OC(C)=O ZINC000095918580 FG Annotated Mild in-vitro biogenic CO[C@@H]1C[C@@]2(CC[C@@]3(O2)[C@H](C)C(=O)[C@@H](O)[C@H]2C(C)(C)CCC[C@@]23C)CO1 ZINC000095918654 FG Annotated Anodyne in-vitro biogenic C=C1C[C@]23C[C@H]1CC[C@H]2[C@]1(C)CC[C@@H](OC(C)=O)[C@](C)(CO)[C@H]1C[C@@H]3O ZINC000095918656 FG Annotated Mild in-vitro biogenic C[C@@H]1C(=O)[C@]23CC[C@H]1C[C@@H]2[C@@]12CCC[C@@]4(C)[C@H]5OCCN5[C@@H]1O[C@@H]3C[C@@H]24 ZINC000095918724 FG Annotated Anodyne in-vitro biogenic COc1cc2c(cc1O)C(=O)c1nccc3c(OC)c(OC)c(OC)c-2c13 ZINC000095919009 FG Annotated Anodyne in-vitro biogenic CC#Cc1cncc(-c2cc(Cl)c([C@@]3(C)CC(=O)N(C)C(=N)N3)s2)c1 ZINC000095920509 FG Annotated Mild in-vitro NC(=O)c1cc([N+](=O)[O-])c(Cl)cc1NCc1cc(F)c(F)c(F)c1 ZINC000095920646 FG Annotated Bother COc1cc(-c2ncn(CCC(=O)OC(C)C)n2)cc(C(F)(F)F)c1 ZINC000095921015 FG Annotated Anodyne CN1CCC/C=C\CCCC(=O)Cc2c(Cl)c(O)cc(O)c2C1=O ZINC000095921418 FG Annotated Anodyne CCN(CC)C(=O)CC[C@@H]1CC[C@]2(CCCN(Cc3nccs3)C2)O1 ZINC000096018795 FG Annotated Anodyne CCN(CC)C(=O)CC[C@@H]1CC[C@]2(CCCN(Cc3ccncc3)C2)O1 ZINC000096018796 FG Annotated Anodyne CCN(CC)C(=O)CC[C@@H]1CC[C@]2(CCCN(Cc3cccnc3)C2)O1 ZINC000096018797 FG Annotated Anodyne CCN(CC)C(=O)CC[C@@H]1CC[C@]2(CCCN(Cc3ccccn3)C2)O1 ZINC000096018798 FG Annotated Anodyne CCN(CC)C(=O)CC[C@H]1CC[C@]2(CCCN(Cc3nccs3)C2)O1 ZINC000096018805 FG Annotated Anodyne CCN(CC)C(=O)CC[C@H]1CC[C@]2(CCCN(Cc3ccncc3)C2)O1 ZINC000096018807 FG Annotated Anodyne CCN(CC)C(=O)CC[C@H]1CC[C@]2(CCCN(Cc3cccnc3)C2)O1 ZINC000096018808 FG Annotated Anodyne CCN(CC)C(=O)CC[C@H]1CC[C@]2(CCCN(Cc3ccccn3)C2)O1 ZINC000096018809 FG Annotated Anodyne CC(=O)CC[C@@H]1CC[C@]2(CCCN(S(=O)(=O)C3CCCCC3)C2)O1 ZINC000096018984 FG Annotated Anodyne CC(=O)CC[C@H]1CC[C@]2(CCCN(S(=O)(=O)C3CCCCC3)C2)O1 ZINC000096018989 FG Annotated Anodyne CCN(CC)C(=O)CC[C@H]1CC[C@]2(CCCN(C(=O)c3ccccc3)C2)O1 ZINC000096019009 FG Annotated Anodyne CCN(CC)C(=O)CC[C@H]1CC[C@]2(CCCN(C(=O)C(C)(C)C)C2)O1 ZINC000096019010 FG Annotated Anodyne CCN(CC)C(=O)CC[C@@H]1CC[C@]2(CCCN(C(=O)C(C)(C)C)C2)O1 ZINC000096019025 FG Annotated Anodyne CCN(CC)C(=O)CC[C@@H]1CC[C@]2(CCCN(C(=O)c3ccccc3)C2)O1 ZINC000096019027 FG Annotated Anodyne CCN(CC)C(=O)CC[C@@H]1CC[C@]2(CCCN(C(=O)c3ccco3)C2)O1 ZINC000096019028 FG Annotated Anodyne CCOC(=O)CC[C@@H]1CC[C@]2(CCCN(C(=O)C3CCCCC3)C2)O1 ZINC000096019039 FG Annotated Anodyne CCN(CC)C(=O)CC[C@H]1CC[C@]2(CCCN(C(=O)c3ccco3)C2)O1 ZINC000096019053 FG Annotated Anodyne CCN(CC)C(=O)CC[C@H]1CC[C@]2(CCCN(C(=O)C3CCCC3)C2)O1 ZINC000096019054 FG Annotated Anodyne CCCCN1CC[C@@H](C)Oc2cc(Br)ccc2S1(=O)=O ZINC000096019167 FG Annotated Anodyne CCCCN1CC[C@H](C)Oc2cc(Br)ccc2S1(=O)=O ZINC000096019169 FG Annotated Anodyne O=S1(=O)c2ccccc2-c2c(nnn2CC2CCCCC2)CN1C1CC1 ZINC000096019385 FG Annotated Anodyne CCN1Cc2nnn(CC3CCCCC3)c2-c2ccccc2S1(=O)=O ZINC000096019390 FG Annotated Anodyne CCCCCCCCNS(=O)(=O)C[C@H]1NCc2cc(OC)ccc21 ZINC000096020226 FG Annotated Anodyne CCCCCCCCNS(=O)(=O)C[C@@H]1NCc2cc(OC)ccc21 ZINC000096020227 FG Annotated Anodyne CC(C)CNS(=O)(=O)/C=C/c1ccccc1CNC(=O)OC(C)(C)C ZINC000096020300 FG Annotated Anodyne CCCCNS(=O)(=O)/C=C/c1ccccc1CNC(=O)OC(C)(C)C ZINC000096020301 FG Annotated Anodyne C=CCN1[C@H](CC(C)C)COc2cccc(N3CCCC3)c2S1(=O)=O ZINC000096020495 FG Annotated Anodyne C=CCN1[C@H](CC(C)C)COc2cc(N3CCCC3)ccc2S1(=O)=O ZINC000096020496 FG Annotated Anodyne C=CCN1[C@@H](CC(C)C)COc2cccc(N3CCCC3)c2S1(=O)=O ZINC000096020499 FG Annotated Anodyne CCCCNc1ccc2c(c1)OC[C@@H](Cc1ccccc1)NS2(=O)=O ZINC000096021147 FG Annotated Anodyne CCCCNc1cccc2c1S(=O)(=O)N[C@@H](Cc1ccccc1)CO2 ZINC000096021149 FG Annotated Anodyne CC(C)CNc1cccc2c1S(=O)(=O)N[C@@H](Cc1ccccc1)CO2 ZINC000096021153 FG Annotated Anodyne CCCCNc1ccc2c(c1)OC[C@H](Cc1ccccc1)NS2(=O)=O ZINC000096021155 FG Annotated Anodyne CCCCNc1cccc2c1S(=O)(=O)N[C@H](Cc1ccccc1)CO2 ZINC000096021159 FG Annotated Anodyne C=CCN1C[C@@H](COCCCC)Oc2ccc(Cl)cc2S1(=O)=O ZINC000096021263 FG Annotated Anodyne C=CCN1C[C@H](COCCCC)Oc2ccc(Cl)cc2S1(=O)=O ZINC000096021264 FG Annotated Anodyne Cc1ccc([C@H]2C[C@]34CN(Cc5ccccc5)S(=O)(=O)[C@H]3C[C@H]2O4)cc1 ZINC000096021278 FG Annotated Anodyne CC(=O)O[C@@H]1C=CC(C)(C)[C@H]2CC[C@@]34O[C@@H]3C3=C(C)C(=O)O[C@@H]3C[C@H]4[C@]12C ZINC000096085459 FG Annotated Anodyne in-vitro CC1(C)CCc2c(O)ccc([C@@H]3COc4cc(O)cc(O)c4C3=O)c2O1 ZINC000096086117 FG Annotated Anodyne in-vitro CC1(C)CCc2c(O)ccc([C@H]3COc4cc(O)cc(O)c4C3=O)c2O1 ZINC000096086118 FG Annotated Anodyne in-vitro COc1ccc2c(c1O)COc1c-2oc2c(OC)c(OC)ccc2c1=O ZINC000096086176 FG Annotated Anodyne in-vitro C/C=C(/C)C(=O)OCc1c2c(c(OC)c3cccc(C)c13)OC(=O)[C@]2(C)O ZINC000096086440 FG Annotated Anodyne CC/N=C1\Cn2c(nc3scc(-c4ccccc4)c3c2=O)CN1CC ZINC000096129598 FG Annotated Mild CCOC(=O)C1=C(C)/C(=C2/CSC(Nc3ccccc3)=NN2)N=C1C ZINC000096129933 FG Annotated Anodyne CCCN1CCC(c2nc3ccc(NCc4cccnc4)cn3n2)CC1 ZINC000096155821 FG Annotated Anodyne c1ccc2nc(N3CC(Oc4nccnc4N4C[C@H]5CC[C@@H]4C5)C3)ccc2c1 ZINC000096168709 FG Annotated Anodyne c1ccc2nc(N3CC(Oc4nccnc4-c4ccncc4)C3)ccc2c1 ZINC000096168795 FG Annotated Anodyne c1ccc(-c2nccnc2OC2CN(c3ccc4ccccc4n3)C2)nc1 ZINC000096168796 FG Annotated Anodyne Fc1cc(-c2nccnc2OC2CN(c3ccc4ccccc4n3)C2)ccn1 ZINC000096168797 FG Annotated Anodyne C1=C(c2nccnc2OC2CN(c3ccc4ccccc4n3)C2)CCOC1 ZINC000096168822 FG Annotated Anodyne c1cncc(-c2nccnc2OC2CN(c3ccc4ccccc4n3)C2)c1 ZINC000096168833 FG Annotated Anodyne c1ccc(-c2nccc(OC3CN(c4ccc5ccccc5n4)C3)n2)nc1 ZINC000096168857 FG Annotated Anodyne c1ccc2cc(N3CC(Oc4nccnc4C4CCOCC4)C3)ncc2c1 ZINC000096168953 FG Annotated Anodyne c1ccc2c(N3CC(Oc4nccnc4C4CCOCC4)C3)nccc2c1 ZINC000096168954 FG Annotated Anodyne c1ccc2nc(N3CC(Oc4nccnc4C4CCOCC4)C3)ccc2c1 ZINC000096168956 FG Annotated Anodyne Cc1cccnc1N1CCC(Oc2nccnc2C2CCOCC2)CC1 ZINC000096168958 FG Annotated Anodyne Cc1ccnc(N2CCC(Oc3nccnc3C3CCOCC3)CC2)c1 ZINC000096168959 FG Annotated Anodyne Cc1cccc(N2CCC(Oc3nccnc3C3CCOCC3)CC2)n1 ZINC000096168961 FG Annotated Anodyne O=Cc1ccc(N2CCC(Oc3ncccc3C3CCOCC3)CC2)nc1 ZINC000096169009 FG Annotated Anodyne Oc1ccc(N2CCC(Oc3ncccc3C3CCOCC3)CC2)nc1 ZINC000096169011 FG Annotated Anodyne CCN/N=C(\C)c1ccc2ncc(Cc3cc4cccnc4cc3F)n2n1 ZINC000096169110 FG Annotated Mild CCCOC[C@@]1(O)C[C@@H]2C(=O)N(c3ccc(OC(F)(F)F)cc3)C[C@@H]2C1 ZINC000096169533 FG Annotated Anodyne c1cncc(-c2cccn3nc(Cc4ccc(N5CCOCC5)cc4)nc23)c1 ZINC000096169536 FG Annotated Anodyne c1cc(-c2ccncc2)c2nc(Cc3ccc(N4CCOCC4)cc3)nn2c1 ZINC000096169539 FG Annotated Anodyne CNC(=O)c1ccc(-c2cccn3nc(Cc4ccccc4OC)nc23)cc1 ZINC000096169550 FG Annotated Anodyne O=c1[nH]cccc1-c1cccn2nc(Nc3ccc4ncccc4c3)nc12 ZINC000096169781 FG Annotated Anodyne COCCN(C)[C@@H](c1ccccc1)C(O)(c1cccnc1)c1cccnc1 ZINC000096171511 FG Annotated Anodyne COCCN(C)[C@H](c1ccccc1)C(O)(c1cccnc1)c1cccnc1 ZINC000096171512 FG Annotated Anodyne CC1(C)C[C@@](C)(c2cc(CC(=O)c3ncccc3F)ccn2)N=C(N)S1 ZINC000096172063 FG Annotated Anodyne CCNc1ncc(N2CC(Oc3ccc([C@@H](C)CC(C)=O)cc3)C2)cn1 ZINC000096172835 FG Annotated Anodyne CCNc1ncc(N2CC(Oc3ccc([C@H](C)CC(C)=O)cc3)C2)cn1 ZINC000096172836 FG Annotated Anodyne CCOc1ccc(N2CC(Oc3ccc([C@H](C)CC(=O)CO)cc3)C2)cc1 ZINC000096172988 FG Annotated Clean COC(=O)C[C@@H](C)c1ccc(OC2CN(c3ncc(C4CC4)cn3)C2)cc1 ZINC000096173026 FG Annotated Anodyne CCOc1cc(N2CC(Oc3ccc([C@H](C)CC(C)=O)cc3)C2)ncn1 ZINC000096173030 FG Annotated Anodyne CN1CCN(C2=NC(=O)/C(=C/c3cc(Cl)cc(Cl)c3)S2)CC1 ZINC000096174734 FG Annotated Clean c1cc(OC[C@@H]2CCCNC2)c2nc(-c3nnc4ccccn34)ccc2c1 ZINC000096174961 FG Annotated Anodyne c1cc(OC[C@H]2CCCNC2)c2nc(-c3nnc4ccccn34)ccc2c1 ZINC000096174962 FG Annotated Anodyne F[C@H]1CNCC[C@@H]1Oc1cccc2ccc(-c3nnc4ccccn34)nc12 ZINC000096174971 FG Annotated Anodyne F[C@@H]1CNCC[C@H]1Oc1cccc2ccc(-c3nnc4ccccn34)nc12 ZINC000096174972 FG Annotated Anodyne F[C@@H]1CNCC[C@@H]1Oc1cccc2ccc(-c3nnc4ccccn34)nc12 ZINC000096174973 FG Annotated Anodyne CC(C)(CN)COc1cc(F)cc2ccc(-c3nnc4ccccn34)nc12 ZINC000096174992 FG Annotated Anodyne CC(C)(CN)COc1ccc(F)c2ccc(-c3nnc4ccccn34)nc12 ZINC000096174995 FG Annotated Anodyne c1cc(O[C@@H]2CCCNCC2)c2nc(-c3nnc4ccccn34)ccc2c1 ZINC000096175006 FG Annotated Anodyne c1cc(O[C@H]2CCCNCC2)c2nc(-c3nnc4ccccn34)ccc2c1 ZINC000096175007 FG Annotated Anodyne Nc1nccc(Oc2cccc3ccc(-c4nnc5ccccn45)nc23)n1 ZINC000096175043 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc(O)cc4)ccc31)[C@@H]1CC[C@H](C2)N1 ZINC000096175134 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc(O)cc4)ccc31)[C@H]1CC[C@@H](C2)N1 ZINC000096175135 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4)cc(F)c31)[C@H]1CC[C@@H](C2)N1 ZINC000096175200 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4)cc(F)c31)[C@@H]1CC[C@H](C2)N1 ZINC000096175201 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4O)ccc31)[C@@H]1CC[C@H](C2)N1 ZINC000096175238 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4O)ccc31)[C@H]1CC[C@@H](C2)N1 ZINC000096175239 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4)cc(O)c31)[C@H]1CC[C@@H](C2)N1 ZINC000096175309 FG Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4)cc(O)c31)[C@@H]1CC[C@H](C2)N1 ZINC000096175310 FG Annotated Anodyne O=C(Nc1cncc(Oc2cncnc2)c1)c1csc(C(F)(F)F)n1 ZINC000096175666 FG Annotated Anodyne C[C@H]1CCCN(C(=O)CCC2=NCc3ccnc(NC4CCOCC4)c32)C1 ZINC000096175962 FG Annotated Anodyne c1cc2c(c(OC3CCOCC3)n1)C(c1cnn(C3CCCC3)c1)=NC2 ZINC000096175974 FG Annotated Anodyne CC(C)Oc1nccc2c1C(c1cc(C(=O)N(C)C)n(C(C)C)c1)=NC2 ZINC000096175976 FG Annotated Anodyne c1cncc(-c2cc(C3=NCc4ccnc(OC5CCOCC5)c43)ccn2)c1 ZINC000096176070 FG Annotated Anodyne c1cc(-c2cc(C3=NCc4ccnc(OC5CCOCC5)c43)ccn2)ccn1 ZINC000096176071 FG Annotated Anodyne CC(C)(C)c1ccccc1S(=O)(=O)C1CN(C(=O)c2ccccc2)C1 ZINC000096177566 FG Annotated Anodyne O=C(Cc1cc(Br)ccn1)c1cc(Oc2cncnc2)ccn1 ZINC000096178199 FG Annotated Anodyne Cc1cc(NC(=O)[C@H]2C(=O)N3c4ccc(F)cc4Cc4cccc2c43)no1 ZINC000096178941 FG Annotated Anodyne O=C(NCc1cccc(F)c1)N1CC[C@]2(CC(=O)N(c3ccsc3)C2)C1 ZINC000096239241 FG Annotated Anodyne O=C(NCc1cccc(F)c1)N1CC[C@@]2(CC(=O)N(c3ccsc3)C2)C1 ZINC000096239242 FG Annotated Anodyne Nn1c(SCc2cccc([N+](=O)[O-])c2)nnc1-c1c[nH]c2ccccc12 ZINC000096258166 FG Annotated Bother Cc1cc/c(=N/S(=O)(=O)c2ccc(-c3ccc(C#N)cc3)cc2)[nH]c1C ZINC000096258214 FG Annotated Mild Cc1cc(C)[nH]/c(=N\S(=O)(=O)c2ccc(-c3ccc(C#N)cc3)cc2)c1 ZINC000096258215 FG Annotated Mild C#Cc1c(C2CCNCC2)cc(-c2c(O)cccc2OCC2CC2)nc1N ZINC000096258288 FG Annotated Mild NC(=O)c1cnc(Nc2cccnc2)c2nc(-c3ccc(Cl)cc3)cn12 ZINC000096269922 FG Annotated Anodyne OC[C@H](O)CN1[C@@H](CCc2ccccc2)CC[C@H]1CCc1ccccc1 ZINC000096269935 FG Annotated Anodyne CC(C)(Cn1c(O)cc(=O)n(C2CCCC2)c1=O)c1cccc(Cl)c1 ZINC000096270094 FG Annotated Anodyne O=c1cc(O)n(CC2(c3ccc(Cl)cc3)CC2)c(=O)n1C1CCCC1 ZINC000096270097 FG Annotated Anodyne O=c1cc(O)n(CCc2ccc(Cl)c(Cl)c2)c(=O)n1C1CCCC1 ZINC000096270108 FG Annotated Anodyne O=c1cc(O)n(CCc2cc(Cl)cc(Cl)c2)c(=O)n1C1CCCC1 ZINC000096270109 FG Annotated Anodyne O=C1NC2=C(CNC/C2=C\c2ccccc2F)[C@@H](c2ccccc2F)N1 ZINC000096270600 FG Annotated Anodyne O=C1NC2=C(CNC/C2=C\c2ccccc2F)[C@H](c2ccccc2F)N1 ZINC000096270601 FG Annotated Anodyne C[C@@H]1[C@@H](NC(=O)CN2CCN(C3CCCCC3)CC2)C[C@H]2C[C@@H]1C2(C)C ZINC000096271331 FG Annotated Anodyne O=[N+]([O-])c1cccc(CSc2nnc(Cn3nnc4ccccc43)o2)c1 ZINC000096271743 FG Annotated Bother O=[N+]([O-])c1ccccc1CSc1nnc(Cn2nnc3ccccc32)o1 ZINC000096271749 FG Annotated Bother COc1ccccc1CSc1nnc(Cn2nnc3ccccc32)o1 ZINC000096271750 FG Annotated Anodyne COc1ccc(C(=O)Nc2cc(Cl)cc3c(=O)cc(C(=O)O)oc23)cc1 ZINC000096271888 FG Annotated Anodyne C[C@@H]1CN(c2cccc(F)n2)CCN1C(=O)C12CC3CC(CC(C3)C1)C2 ZINC000096272412 FG Annotated Anodyne C[C@@H]1CN(c2ccncc2C#N)CCN1C(=O)C12CC3CC(CC(C3)C1)C2 ZINC000096272420 FG Annotated Mild Cc1ccccc1Nc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)C ZINC000096272704 FG Annotated Mild Cc1ccccc1Oc1ccc(C#N)cc1S(=O)(=O)NC(=O)NC(C)C ZINC000096272713 FG Annotated Mild OCCn1cc(-c2ccc3cn(Cc4ccc5ncccc5c4)nc3c2)cn1 ZINC000096272718 FG Annotated Anodyne OCCn1cc(-c2ccc3cnn(Cc4ccc5ncccc5c4)c3c2)cn1 ZINC000096272723 FG Annotated Anodyne O=C(C1CC(F)(F)C1)N1CCc2nc(C#Cc3ccccc3)sc2C1 ZINC000096272970 FG Annotated Mild O=C(N1CCc2nc(C#Cc3ccccc3)sc2C1)N1CCC(F)(F)C1 ZINC000096273034 FG Annotated Mild COc1cccc(CCc2nnc(-c3ccc4nc[nH]c4c3)o2)c1OC ZINC000096282994 FG Annotated Anodyne COc1ccc(CCc2nnc(-c3ccc4nc[nH]c4c3)o2)c(OC)c1 ZINC000096282995 FG Annotated Anodyne COc1ccc(CCc2nnc(-c3ccc4nc[nH]c4c3)o2)cc1OC ZINC000096282996 FG Annotated Anodyne O=C(N1CCC2(CCCC2)CC1)N1C[C@@H]2CN(c3ccccn3)C[C@@H]2C1 ZINC000096283269 FG Annotated Anodyne O=C(N1C[C@@H]2CN(c3ncccc3F)C[C@@H]2C1)C12CC3CC(CC(C3)C1)C2 ZINC000096283277 FG Annotated Anodyne O=C(N1C[C@@H]2CN(c3ccc(F)cn3)C[C@@H]2C1)C12CC3CC(CC(C3)C1)C2 ZINC000096283278 FG Annotated Anodyne O=C(N1C[C@@H]2CN(c3cccc(F)n3)C[C@@H]2C1)C12CC3CC(CC(C3)C1)C2 ZINC000096283279 FG Annotated Anodyne O=C1c2sc(COc3ccccc3)nc2CCN1c1ccc(F)cn1 ZINC000096283910 FG Annotated Anodyne O=C1c2sc(COc3ccccc3)nc2CCN1c1ncccc1F ZINC000096283912 FG Annotated Anodyne c1cc2c(cc1CC[C@H]1C[C@@H](CCc3ccc4c(c3)OCO4)N1)OCO2 ZINC000096285967 FG Annotated Anodyne c1cc2c(cc1CC[C@@H]1C[C@@H](CCc3ccc4c(c3)OCO4)N1)OCO2 ZINC000096285970 FG Annotated Anodyne Cc1cc(N2CC[C@H](N3CCC[C@@H]3C)C2)ccc1NC(=O)[C@@H]1CCCO1 ZINC000096286305 FG Annotated Anodyne Cc1cc(N2CC[C@H](N3CCC[C@@H]3C)C2)ccc1NC(=O)[C@H]1CCCO1 ZINC000096286307 FG Annotated Anodyne Cc1cc(NC(=O)[C@@H]2CCCO2)ccc1N1CC[C@H](N2CCC[C@@H]2C)C1 ZINC000096286315 FG Annotated Anodyne Cc1cc(NC(=O)[C@@H]2CCCO2)ccc1N1CC[C@@H](N2CCC[C@@H]2C)C1 ZINC000096286316 FG Annotated Anodyne NCCNc1ccn2ncc(-c3cccc(OCc4ccccc4)c3)c2n1 ZINC000096286354 FG Annotated Anodyne CCC(=O)N1[C@H]2CC[C@@H]1[C@H]1CC[C@@H]2N1C/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000096299326 FG Annotated Bother COc1cc([C@@H]2CC(=O)c3cc(OC)c(OC)c(OC)c32)cc2c1OCO2 ZINC000096335771 FG Annotated Anodyne COc1cc([C@H]2CC(=O)c3cc(OC)c(OC)c(OC)c32)cc2c1OCO2 ZINC000096335772 FG Annotated Anodyne NC1=C(C(=O)c2cccs2)[C@@H](c2ccccc2)N(c2nccs2)C1=O ZINC000096336420 FG Annotated Mild NC1=C(C(=O)c2cccs2)[C@H](c2ccccc2)N(c2nccs2)C1=O ZINC000096336422 FG Annotated Mild CO[C@@]12CCCC[C@@H]1[C@]1(C#N)C(O)=NC(=N)[C@]1(C#N)[C@H](c1ccccc1)O2 ZINC000096336647 FG Annotated Mild CO[C@]12CCCC[C@@H]1[C@]1(C#N)C(O)=NC(=N)[C@]1(C#N)[C@H](c1ccccc1)O2 ZINC000096336648 FG Annotated Mild CC(=O)/N=C1\O[C@@]23CCCC[C@H]2[C@]1(C#N)C(C#N)(C#N)[C@@H](c1ccccc1)O3 ZINC000096336710 FG Annotated Mild CC(=O)/N=C1\O[C@@]23CCCC[C@@H]2[C@]1(C#N)C(C#N)(C#N)[C@@H](c1ccccc1)O3 ZINC000096336711 FG Annotated Mild Cc1cnc(NCc2ccc(-n3ccnc3C)cc2)nc1-c1cnn(C)c1 ZINC000096879128 FG Annotated Anodyne CCn1c(=O)n([C@@H]2CCN(CC3CCCCC3)C[C@H]2CO)c2ccccc21 ZINC000096902434 FG Annotated Anodyne N#Cc1ccc(-n2ccnc2)c(NC(=O)c2cnc(-c3ccccc3)nc2)c1 ZINC000096903454 FG Annotated Mild CCCc1cn([C@@H]2CC(C)(C)OC3=C2C(=O)c2ccccc2C3=O)nn1 ZINC000096904268 FG Annotated Mild CCCc1cn([C@H]2CC(C)(C)OC3=C2C(=O)c2ccccc2C3=O)nn1 ZINC000096904269 FG Annotated Mild Cc1cc(=O)[nH]c2cc(N3C(=O)CS[C@H]3c3ccccc3O)ccc12 ZINC000096905449 FG Annotated Clean Cc1cc(=O)[nH]c2cc(N3C(=O)CS[C@@H]3c3ccccc3O)ccc12 ZINC000096905450 FG Annotated Clean Cc1cc(=O)[nH]c2cc(N3C(=O)CS[C@H]3c3cccc(O)c3)ccc12 ZINC000096905451 FG Annotated Anodyne Cc1cc(=O)[nH]c2cc(N3C(=O)CS[C@@H]3c3cccc(O)c3)ccc12 ZINC000096905452 FG Annotated Anodyne Cc1cc(=O)[nH]c2cc(N3C(=O)CS[C@H]3c3ccc(O)cc3)ccc12 ZINC000096905453 FG Annotated Anodyne Cc1cc(=O)[nH]c2cc(N3C(=O)CS[C@@H]3c3ccc(O)cc3)ccc12 ZINC000096905454 FG Annotated Anodyne COc1ccc(CSc2nnc(-c3c[nH]c4ccccc34)n2N)cc1 ZINC000096905653 FG Annotated Anodyne Nn1c(SCc2ccccc2[N+](=O)[O-])nnc1-c1c[nH]c2ccccc12 ZINC000096906212 FG Annotated Bother COc1cccc(CSc2nnc(-c3c[nH]c4ccccc34)n2N)c1 ZINC000096906216 FG Annotated Anodyne CN(C)c1cccc(-c2cccc([C@@H]3C[C@@H]3c3cc(=O)n(C)c(N)n3)c2)c1 ZINC000096906574 FG Annotated Anodyne CC1=C2[C@H]3OC(=O)[C@]4(CC(c5ccccc5)=NO4)[C@@H]3CC[C@@]2(C)C=CC1=O ZINC000096906627 FG Annotated Mild CC1=C2[C@H]3OC(=O)[C@@]4(CC(c5ccccc5)=NO4)[C@@H]3CC[C@@]2(C)C=CC1=O ZINC000096906628 FG Annotated Mild COc1ccc(Cn2cc(C(=O)N(C)C)c(=O)c3c(F)ccc(F)c32)cc1 ZINC000096906844 FG Annotated Anodyne CCOc1nc(-c2ccccn2)nc(CN(CC)C(=O)OC)c1CC1CC1 ZINC000096907604 FG Annotated Anodyne CCCCCn1cc(C(=O)NC2CCCCC2)c(=O)n2nc(CC)cc12 ZINC000096908243 FG Annotated Anodyne COc1ccc(-c2c(CO)c(CO)cc3ccc4c(c23)OCO4)cc1OC ZINC000096909758 FG Annotated Anodyne O=c1cc(C(F)(F)F)n(C/C=C/CN2CCOCC2)c2ccc(F)cc12 ZINC000096909951 FG Annotated Anodyne O=c1cc(C(F)(F)F)n(CCCCN2CCOCC2)c2ccc(F)cc12 ZINC000096910141 FG Annotated Anodyne Cc1[nH]c2ccc(OS(=O)(=O)C(F)(F)F)cc2c1C1=CCNCC1 ZINC000096910225 FG Annotated Unstable Cc1ccc2oc(CSc3nc4nc(C)cc(C)n4n3)cc(=O)c2c1 ZINC000096910575 FG Annotated Anodyne COc1ccc(N/N=C2/C(=O)c3cccc([N+](=O)[O-])c3N=C2O)c(C)c1 ZINC000096910612 FG Annotated Mild CC(=O)c1ccc(N/N=C2/C(=O)c3cccc([N+](=O)[O-])c3N=C2O)cc1 ZINC000096910638 FG Annotated Mild CC1=C2C[C@H]3O[C@@]3(C)[C@@H]2[C@H]2OC(=O)[C@@H](CNCc3ccc(F)cc3)[C@@H]2CC1 ZINC000096910782 FG Annotated Anodyne On1cc(C2CCNCC2)c(-c2cn(Cc3ccccc3)c(Cl)n2)n1 ZINC000096910960 FG Annotated Anodyne On1ncc(C2CCNCC2)c1-c1cn(Cc2ccccc2)c(Cl)n1 ZINC000096910965 FG Annotated Anodyne O=c1c2cnn(Cc3ccccc3)c2ncn1/N=C/c1ccc(Cl)cc1 ZINC000096913355 FG Annotated Mild CC(=O)N1N=C(c2ccc(C(F)(F)F)cc2)O[C@H]1c1ccc([N+](=O)[O-])o1 ZINC000096913478 FG Annotated Bother CC(=O)N1N=C(c2ccc(C(F)(F)F)cc2)O[C@@H]1c1ccc([N+](=O)[O-])o1 ZINC000096913479 FG Annotated Bother COc1cccc(-c2ccc(-n3ccc4[nH]c(=O)c(C#N)c(O)c43)cc2)c1O ZINC000096913623 FG Annotated Mild O=C1OCC(OCCOC(=O)c2ccccc2Cl)=C1c1ccccc1 ZINC000096914276 FG Annotated Anodyne O=C1OCC(OCCOC(=O)c2ccc(Cl)cc2)=C1c1ccccc1 ZINC000096914286 FG Annotated Anodyne C#CCOc1cc(OC)ccc1C(=O)c1ccc(=O)n(-c2ccccc2C)c1 ZINC000096915045 FG Annotated Mild Cc1cc(C)cc(Cn2c(=O)cc(N=[N+]=[N-])n(Cc3ccncc3)c2=O)c1 ZINC000096915397 FG Annotated Mild O=S(=O)(/C=C/c1ccc(O)c(O)c1)NCc1ccc(C(F)(F)F)cc1 ZINC000096917384 FG Annotated Clean CCN1CCc2c(c(C)nn2C(=O)Nc2ccc(Br)cc2)C1 ZINC000096917450 FG Annotated Anodyne O=C1C(=O)c2c(nc3ncnn3c2-c2ccc(Cl)cc2)-c2ccccc21 ZINC000096917770 FG Annotated Clean CC1(C)O[C@@H]2Oc3ccc(C(=O)/C=C/c4ccccc4)c(O)c3[C@@H]2[C@H]1O ZINC000096917817 FG Annotated Mild COc1c(O)c(C)c(O)c2c(=O)c3c(oc12)[C@H](OC)Oc1ccccc1-3 ZINC000096917841 FG Annotated Anodyne COc1c(O)c(C)c(O)c2c(=O)c3c(oc12)[C@@H](OC)Oc1ccccc1-3 ZINC000096917843 FG Annotated Anodyne COc1ccc(-c2c(N)n[nH]c2-c2cc(OC)c3c(c2OC)OCO3)cc1 ZINC000096917863 FG Annotated Anodyne COc1ccc(-c2[nH]nc(N)c2-c2cc3c(c(OC)c2OC)OCO3)cc1 ZINC000096921442 FG Annotated Anodyne CN(C)CCNC(=O)c1cc2c3cc(F)ccc3n(C)c2c2cccnc12 ZINC000096921553 FG Annotated Bother N#CC1(c2ccccc2)CCN(Cc2oc(CCl)cc(=O)c2O)CC1 ZINC000096922493 FG Annotated Reactive CCCCN1CCC[C@@H]1C(=O)Nc1ccccc1I ZINC000096927322 FG Annotated Anodyne CCCCN1CCC[C@H]1C(=O)Nc1ccccc1I ZINC000096927323 FG Annotated Anodyne COc1ccc(CNCCN2C(=O)c3cccc4cccc(c34)C2=O)cc1 ZINC000096928008 FG Annotated Anodyne COc1cccc(CNCCN2C(=O)c3cccc4cccc(c34)C2=O)c1 ZINC000096928009 FG Annotated Anodyne CCC(CC)c1nn(CC)c2c1N=C(c1ccc(C(=O)O)cc1)CNC2=O ZINC000096928080 FG Annotated Anodyne CCC(CC)c1nn(CCCO)c2c1N=C(c1ccccc1)CNC2=O ZINC000096928708 FG Annotated Anodyne COc1cc(-c2c(-c3ccc4cc[nH]c4c3)c(=O)c2=O)cc(OC)c1OC ZINC000096928905 FG Annotated Anodyne O=C(NO)n1c(/C=C/c2ccccc2)nc2sc3c(c2c1=O)CCCC3 ZINC000096928936 FG Annotated Anodyne O=C(O)CCNCCOCCN1c2ccccc2CCc2ccccc21 ZINC000096929374 FG Annotated Anodyne O=C(O)CCNCCOCCN1c2ccccc2C=Cc2ccccc21 ZINC000096929375 FG Annotated Anodyne C[C@@H](CC(=O)O)NCCOCCN1c2ccccc2CCc2ccccc21 ZINC000096929381 FG Annotated Anodyne C[C@H](CC(=O)O)NCCOCCN1c2ccccc2CCc2ccccc21 ZINC000096929382 FG Annotated Anodyne Cn1cc(C=C2C(=O)OC(C)(C)OC2=O)c2cc(Br)ccc21 ZINC000096929601 FG Annotated Clean Cc1nc2ccccc2n1CCC(=O)NNCc1c(O)ccc2ccccc12 ZINC000096929703 FG Annotated Reactive COc1cc2c(c(OC)c1)C(=O)N(c1ccc(C(F)(F)F)cc1)C(=O)C2 ZINC000096929799 FG Annotated Anodyne COc1ccc([C@@H]2NC(=O)Nc3c2c(=O)oc2ccc(C)cc32)cc1OC ZINC000096931698 FG Annotated Anodyne COc1ccc([C@H]2NC(=O)Nc3c2c(=O)oc2ccc(C)cc32)cc1OC ZINC000096931699 FG Annotated Anodyne COc1ccc([C@@H]2NC(=S)Nc3c2c(=O)oc2ccc(C)cc32)cc1 ZINC000096931719 FG Annotated Anodyne COc1ccc([C@H]2NC(=S)Nc3c2c(=O)oc2ccc(C)cc32)cc1 ZINC000096931720 FG Annotated Anodyne N#Cc1c(-c2ccc(Br)cc2)nc(S)n2c(S)nnc12 ZINC000096932748 FG Annotated Mild COc1nc(C)nc(/N=C/c2cc(Cl)cc(Br)c2O)n1 ZINC000096932899 FG Annotated Mild CO[C@@H]1C(=O)Nc2ccc(CC=C(C)C)c(O)c2[C@@]1(O)c1ccccc1 ZINC000096933101 FG Annotated Anodyne COc1ccc(-c2cnn3c2nc(OCCN(C)C)c2ccccc23)cc1 ZINC000096933159 FG Annotated Anodyne COc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2cc(C#N)nn12 ZINC000096933196 FG Annotated Mild C=CCn1c(=O)c(N/N=C/c2c(OC)cccc2OC)nc2ccccc21 ZINC000096933306 FG Annotated Mild C[C@H]1O[C@]23C[C@@H](c4ccc(Br)cc4)OC(=O)C2=C[C@@]1(C)OO3 ZINC000096934005 FG Annotated Reactive C[C@@H]1O[C@]23C[C@@H](c4ccc(Br)cc4)OC(=O)C2=C[C@@]1(C)OO3 ZINC000096934006 FG Annotated Reactive C[C@H]1O[C@]23C[C@H](c4ccc(Br)cc4)OC(=O)C2=C[C@@]1(C)OO3 ZINC000096934007 FG Annotated Reactive C[C@@H]1O[C@]23C[C@H](c4ccc(Br)cc4)OC(=O)C2=C[C@@]1(C)OO3 ZINC000096934008 FG Annotated Reactive C[C@H]1O[C@]23C[C@@H](c4ccc(C(F)(F)F)cc4)OC(=O)C2=C[C@@]1(C)OO3 ZINC000096934025 FG Annotated Reactive C[C@@H]1O[C@]23C[C@@H](c4ccc(C(F)(F)F)cc4)OC(=O)C2=C[C@@]1(C)OO3 ZINC000096934026 FG Annotated Reactive C[C@H]1O[C@]23C[C@H](c4ccc(C(F)(F)F)cc4)OC(=O)C2=C[C@@]1(C)OO3 ZINC000096934027 FG Annotated Reactive C[C@@H]1O[C@]23C[C@H](c4ccc(C(F)(F)F)cc4)OC(=O)C2=C[C@@]1(C)OO3 ZINC000096934028 FG Annotated Reactive CO[C@@]12C=C(c3ccc(O)c4ncccc34)[C@@H]1C(=O)c1ccccc1C2=O ZINC000096934675 FG Annotated Clean CO[C@]12C=C(c3ccc(O)c4ncccc34)[C@@H]1C(=O)c1ccccc1C2=O ZINC000096934676 FG Annotated Clean CO[C@@]12C=C(c3ccc(O)c4ncccc34)[C@H]1C(=O)c1ccccc1C2=O ZINC000096934677 FG Annotated Clean CO[C@]12C=C(c3ccc(O)c4ncccc34)[C@H]1C(=O)c1ccccc1C2=O ZINC000096934678 FG Annotated Clean CO[C@]12C(=O)c3ccccc3C(=O)[C@H]1C(c1cnccn1)=C2c1ccccc1 ZINC000096934701 FG Annotated Clean CO[C@@]12C(=O)c3ccccc3C(=O)[C@H]1C(c1cnccn1)=C2c1ccccc1 ZINC000096934702 FG Annotated Clean CO[C@]12C(=O)c3ccccc3C(=O)[C@@H]1C(c1cnccn1)=C2c1ccccc1 ZINC000096934703 FG Annotated Clean CO[C@@]12C(=O)c3ccccc3C(=O)[C@@H]1C(c1cnccn1)=C2c1ccccc1 ZINC000096934704 FG Annotated Clean Cc1cc(C)c(C#N)c(SCC(=O)NCc2cc(F)c(F)cc2F)n1 ZINC000096934902 FG Annotated Mild CC(=O)N1N=C(c2ccc(C)nc2)O[C@H]1c1ccc(Br)cc1 ZINC000096935255 FG Annotated Anodyne CC(=O)N1N=C(c2ccc(C)nc2)O[C@@H]1c1ccc(Br)cc1 ZINC000096935256 FG Annotated Anodyne Fc1ccc(-n2cc(-c3cnn4ccc([C@@H]5CCCNC5)nc34)cn2)cc1 ZINC000096937446 FG Annotated Anodyne Fc1ccc(-n2cc(-c3cnn4ccc([C@H]5CCCNC5)nc34)cn2)cc1 ZINC000096937447 FG Annotated Anodyne CSC1=NC[C@]2(S1)c1ccccc1N(C(=O)OC(C)(C)C)[C@@H]2O ZINC000096938426 FG Annotated Anodyne CSC1=NC[C@]2(S1)c1ccccc1N(C(=O)OC(C)(C)C)[C@H]2O ZINC000096938427 FG Annotated Anodyne O=[N+]([O-])c1ncn(CCCCNc2nc3ccc(Cl)cc3s2)n1 ZINC000096938751 FG Annotated Bother COc1cccc(CCCCCCCCc2cccc(OC)[n+]2C)[n+]1C ZINC000096938824 FG Annotated Anodyne Cc1ccc(S(=O)(=O)Cc2nc3ccc(Cl)cn3c2[N+](=O)[O-])cc1 ZINC000096939359 FG Annotated Bother CN(C)CCN1C(=O)c2cccc3cc(-c4cccc(O)c4)cc(c23)C1=O ZINC000096939902 FG Annotated Anodyne CN(C)CCN1C(=O)c2cccc3cc(-c4cccc(N)c4)cc(c23)C1=O ZINC000096939905 FG Annotated Anodyne c1ccc([C@]2(CCNCc3cnccn3)CCOC3(CCCC3)C2)nc1 ZINC000096940348 FG Annotated Anodyne c1ccc([C@]2(CCNCc3ccncn3)CCOC3(CCCC3)C2)nc1 ZINC000096940349 FG Annotated Anodyne COc1ccc(S(=O)(=O)n2ccc3ccnc(-c4ccncc4)c32)cc1 ZINC000096940442 FG Annotated Anodyne Cc1cnc(NCc2nccn2Cc2ccccc2)nc1-c1cnn(C)c1 ZINC000097579086 FG Annotated Anodyne CCc1c(Sc2ccccc2)n(OCC2CCCCC2)c(=O)[nH]c1=O ZINC000098081868 FG Annotated Anodyne N#C/C(=C\c1ccccc1)Cn1nnn(-c2ccc(C(F)(F)F)cc2)c1=O ZINC000098082582 FG Annotated Reactive CC(=O)NC1=NN(C(C)=O)[C@@H](c2cc3cc(C)ccc3nc2Cl)S1 ZINC000098083279 FG Annotated Anodyne CC(=O)NC1=NN(C(C)=O)[C@H](c2cc3cc(C)ccc3nc2Cl)S1 ZINC000098083280 FG Annotated Anodyne COc1cccc(/C=N/c2c(O)cc(S(=O)(=O)O)c3ccccc23)c1O ZINC000098083299 FG Annotated Mild COc1cc(/C=N/c2c(O)cc(S(=O)(=O)O)c3ccccc23)ccc1O ZINC000098083301 FG Annotated Mild COc1cc(OC)c2c(c1)O[C@@H](c1cc(OC)c(O)c(OC)c1)CC2=O ZINC000098083394 FG Annotated Anodyne COc1cc(OC)c2c(c1)O[C@H](c1cc(OC)c(O)c(OC)c1)CC2=O ZINC000098083395 FG Annotated Anodyne O=C1[C@@H]2C3c4ccccc4C(c4ccccc43)[C@H]2C(=O)N1Nc1ccccn1 ZINC000098083682 FG Annotated Anodyne O=C1[C@H]2C3c4ccccc4C(c4ccccc43)[C@H]2C(=O)N1Nc1ccccn1 ZINC000098083683 FG Annotated Anodyne O=C1[C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2C(=O)N1Nc1ccccn1 ZINC000098083684 FG Annotated Anodyne O=C1CS[C@@H](c2ccccn2)N1c1nnc2c3ccccc3nc-2s1 ZINC000098083748 FG Annotated Anodyne O=C1CS[C@H](c2ccccn2)N1c1nnc2c3ccccc3nc-2s1 ZINC000098083749 FG Annotated Anodyne CCCCN1C(=O)[C@@H](Oc2ccccc2)[C@H]1c1ccc(S(C)(=O)=O)cc1 ZINC000098083992 FG Annotated Anodyne CCOn1c(Sc2cc(Cl)cc(Cl)c2)c(CC)c(=O)[nH]c1=O ZINC000098084077 FG Annotated Anodyne Cc1cc(C)cc(Sc2c(C(C)C)c(=O)[nH]c(=S)n2OCCO)c1 ZINC000098084080 FG Annotated Anodyne CC(C)c1c(Sc2ccccc2)n(OCc2ccccc2)c(=O)[nH]c1=O ZINC000098084081 FG Annotated Anodyne O=C1[C@@H]2C3c4ccccc4C(c4ccccc43)[C@H]2C(=O)N1Cc1ccncc1 ZINC000098084139 FG Annotated Anodyne O=C1[C@H]2C3c4ccccc4C(c4ccccc43)[C@H]2C(=O)N1Cc1ccncc1 ZINC000098084140 FG Annotated Anodyne O=C1[C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2C(=O)N1Cc1ccncc1 ZINC000098084141 FG Annotated Anodyne CC(=O)NC1=NN(C(C)=O)[C@@H](c2cc3ccc(C)cc3nc2Cl)S1 ZINC000098084826 FG Annotated Anodyne CC(=O)NC1=NN(C(C)=O)[C@H](c2cc3ccc(C)cc3nc2Cl)S1 ZINC000098084827 FG Annotated Anodyne COc1ccc(OC)c([C@@H]2CC(c3ccc([N+](=O)[O-])cc3)=NC(=S)N2)c1 ZINC000098085143 FG Annotated Bother COc1ccc(OC)c([C@H]2CC(c3ccc([N+](=O)[O-])cc3)=NC(=S)N2)c1 ZINC000098085144 FG Annotated Bother COc1ccc(N2C=C(c3ccccc3)[C@@H]3c4nnc(C)n4C=N[C@H]32)cc1 ZINC000098085186 FG Annotated Anodyne COc1ccc(N2C=C(c3ccccc3)[C@@H]3c4nnc(C)n4C=N[C@@H]32)cc1 ZINC000098085187 FG Annotated Anodyne COc1ccc(N2C=C(c3ccccc3)[C@H]3c4nnc(C)n4C=N[C@H]32)cc1 ZINC000098085188 FG Annotated Anodyne COc1ccc(N2C=C(c3ccccc3)[C@H]3c4nnc(C)n4C=N[C@@H]32)cc1 ZINC000098085189 FG Annotated Anodyne FC(F)(F)c1nc2c(-[n+]3cc[n+](Cc4ccccc4)cc3)cccc2[nH]1 ZINC000098085495 FG Annotated Anodyne CC[C@@]12C[C@@](C)(O)[C@](O)(c3nccs3)C[C@H]1CCc1cc(O)ccc12 ZINC000098203616 FG Annotated Anodyne CO/C=C/C[C@@H](N)P(O)(O)(Oc1ccccc1)Oc1ccccc1 ZINC000098207742 FG Annotated Anodyne COc1ccccc1[C@@H]1N(c2cccc(S(C)(=O)=O)c2)C(=O)C1(C)C ZINC000098208189 FG Annotated Anodyne