O=C1N=C(N2CCN(c3ccccc3)CC2)S/C1=C\c1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000001074027 JJ Agent Clean Cc1[nH]n(-c2ccc(Br)cc2Br)c(=O)c1/C=N/Cc1ccc(F)cc1 ZINC000001090229 JJ Agent Mild CC(C)(C)N=C1c2nn(Cc3ccccc3)nc2C(=NC(C)(C)C)c2nn(Cc3ccccc3)nc21 ZINC000001232407 JJ Agent Mild O=C(CCCN1C(=O)/C(=C/c2ccco2)SC1=S)Nc1ccccc1Br ZINC000001264267 JJ Agent Clean O=C(CCCN1C(=O)/C(=C/c2ccco2)SC1=S)Nc1cccc(Br)c1 ZINC000001267201 JJ Agent Clean O=C(CCCN1C(=O)/C(=C/c2ccco2)SC1=S)Nc1ccc(Br)cc1 ZINC000001268972 JJ Agent Clean O=C1Nc2ccc(Br)cc2/C1=C1\SC(=S)N(c2cccc(Br)c2)C1=O ZINC000001300964 JJ Agent Clean Cc1ccc(Cn2nc(C)c(/C=C/C(=O)OCc3cc(=O)n4c(n3)sc3ccccc34)c2C)cc1 ZINC000010021869 JJ Agent Anodyne CC(C)CCn1c(=O)c2ccccc2n2c(S[C@@H](C)C(=O)N[C@@H](C)c3ccc(F)cc3)nnc12 ZINC000010058598 JJ Agent Anodyne CC(C)CCn1c(=O)c2ccccc2n2c(S[C@H](C)C(=O)N[C@@H](C)c3ccc(F)cc3)nnc12 ZINC000010058599 JJ Agent Anodyne CC(C)CCn1c(=O)c2ccccc2n2c(S[C@@H](C)C(=O)N[C@H](C)c3ccc(F)cc3)nnc12 ZINC000010058600 JJ Agent Anodyne CC(C)CCn1c(=O)c2ccccc2n2c(S[C@H](C)C(=O)N[C@H](C)c3ccc(F)cc3)nnc12 ZINC000010058601 JJ Agent Anodyne CC(C)CCn1c(=O)c2ccccc2n2c(SCC(=O)N(c3ccccc3)C(C)C)nnc12 ZINC000010058614 JJ Agent Anodyne Cc1ccc(Cl)cc1NC(=O)CSc1nnc2n(CCC(C)C)c(=O)c3ccccc3n12 ZINC000010058634 JJ Agent Anodyne Cc1ccc(NC(=O)CSc2nnc3n(CCC(C)C)c(=O)c4ccccc4n23)c(Cl)c1 ZINC000010058666 JJ Agent Anodyne C=CCN(C(=O)CSc1nnc2n(-c3ccccc3C)c(=O)c3ccccc3n12)c1ccccc1 ZINC000010144500 JJ Agent Mild O=C(/C=C/c1cn(-c2ccccc2)nc1-c1cccs1)N1CCN(C(=O)c2cccs2)CC1 ZINC000010276424 JJ Agent Anodyne C/C(CC(=O)Nc1ccc(Nc2ccccc2)cc1)=N\NC(=O)C(=O)Nc1cc(C)ccc1C ZINC000100090266 JJ Agent Reactive O=C(O)c1ccc(NC2=C[C@@H](c3ccc(Br)cc3)N(c3ccccc3)C2=O)cc1O ZINC000103558037 JJ Agent Anodyne O=C(O)c1ccc(NC2=C[C@H](c3ccc(Br)cc3)N(c3ccccc3)C2=O)cc1O ZINC000103558042 JJ Agent Anodyne CCCCCCCCCCCCSc1nc(N2CCOCC2)nc(N2CCOCC2)n1 ZINC000103600325 JJ Agent Mild CN(C)c1ccc([P+](C)(c2ccc(N(C)C)c3ccccc23)N2CCOCC2)c2ccccc12 ZINC000103614745 JJ Agent Reactive CCCCCCCc1c(C#N)c(N)nc2sc(C(=O)Nc3ccc(O)c(C(=O)O)c3)c(N)c12 ZINC000103616578 JJ Agent Mild O=C(CCc1ccc2c(c1)OCO2)NCCN1C(=O)S/C(=C\c2cccc(Cl)c2Cl)C1=O ZINC000010708479 JJ Agent Anodyne O=C(CCc1ccc2c(c1)OCO2)NCCN1C(=O)S/C(=C\c2ccc(Cl)cc2Cl)C1=O ZINC000010749741 JJ Agent Anodyne CN(C)S(=O)(=O)c1cccc(C(=O)N2/C(=N\c3ccccc3)SCc3ccccc32)c1 ZINC000105070506 JJ Agent Mild C=CCn1c(=O)c2ccccc2n2c(SCC(=O)N(C)C(c3ccccc3)c3ccccc3)nnc12 ZINC000011022730 JJ Agent Mild CC(C)CCn1c(=O)c2ccccc2n2c(S[C@@H](C)C(=O)NC34CC5CC(CC(C5)C3)C4)nnc12 ZINC000011023335 JJ Agent Anodyne CC(C)CCn1c(=O)c2ccccc2n2c(S[C@H](C)C(=O)NC34CC5CC(CC(C5)C3)C4)nnc12 ZINC000011023336 JJ Agent Anodyne N#CC1(NC(=O)COC(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccs2)CCCCC1 ZINC000011071611 JJ Agent Mild COc1ccccc1Cn1c(=O)c2ccccc2n2c(SCc3ccc(-n4cccn4)cc3)nnc12 ZINC000011144925 JJ Agent Anodyne CC(C)Nc1nnc(SCC(=O)N(C/C=C/c2ccccc2)c2ccc3c(c2)OCCO3)s1 ZINC000011151559 JJ Agent Anodyne O=C(COC(=O)/C=C/c1ccc(Br)o1)Nc1cc(C(F)(F)F)ccc1Cl ZINC000011194223 JJ Agent Anodyne C=CCN(CC=C)C(=O)CSc1nnc2n(-c3ccc([C@H](C)CC)cc3)c(=O)c3ccccc3n12 ZINC000011396144 JJ Agent Mild C=CCN(CC=C)C(=O)CSc1nnc2n(-c3ccc([C@@H](C)CC)cc3)c(=O)c3ccccc3n12 ZINC000011396145 JJ Agent Mild Cc1ccccc1-n1c(=O)c2ccccc2n2c(SCc3cc(-c4ccco4)on3)nnc12 ZINC000011596293 JJ Agent Anodyne CCN(C(=O)CSc1nnc2n(-c3ccccc3C)c(=O)c3ccccc3n12)c1ccccc1C ZINC000011596376 JJ Agent Anodyne Cc1ccc(S(=O)(=O)c2nnn(-c3ccc(C(=O)O)cc3)c2-c2ccc(Br)cc2)cc1 ZINC000011730464 JJ Agent Anodyne CCc1ccc(S(=O)(=O)c2nnn(-c3ccc(C(=O)O)cc3)c2-c2ccc(Cl)cc2)cc1 ZINC000011730495 JJ Agent Anodyne CCc1ccc(S(=O)(=O)c2nnn(-c3cccc(C(=O)O)c3)c2-c2ccc(Cl)cc2)cc1 ZINC000011730499 JJ Agent Anodyne CCOc1ccc(S(=O)(=O)c2nnn(-c3ccc(C(=O)O)cc3)c2-c2ccc(Cl)cc2)cc1 ZINC000011730563 JJ Agent Anodyne O=C(O)c1cccc(-n2nnc(S(=O)(=O)c3ccc(Cl)cc3)c2-c2ccc(Cl)cc2)c1 ZINC000011730631 JJ Agent Anodyne Nc1ccc(-n2nnc(S(=O)(=O)c3ccc(Br)cc3)c2-c2ccc(Cl)cc2)cc1 ZINC000011730659 JJ Agent Clean Cc1ccc(-c2c(S(=O)(=O)c3ccc(Br)cc3)nnn2-c2ccc(C(=O)O)cc2)cc1 ZINC000011730661 JJ Agent Anodyne O=C(O)c1ccc(-n2nnc(S(=O)(=O)c3cccc(Cl)c3)c2-c2ccc(Cl)cc2)cc1 ZINC000011730695 JJ Agent Anodyne O=C(O)c1cccc(-n2nnc(S(=O)(=O)c3cccc(Cl)c3)c2-c2ccc(Cl)cc2)c1 ZINC000011730697 JJ Agent Anodyne Nc1ccc(-n2nnc(S(=O)(=O)c3cccc(Br)c3)c2-c2ccc(Cl)cc2)cc1 ZINC000011730726 JJ Agent Clean Cc1ccc(-c2c(S(=O)(=O)c3cccc(Br)c3)nnn2-c2ccc(C(=O)O)cc2)cc1 ZINC000011730728 JJ Agent Anodyne Nc1ccc(-n2nnc(S(=O)(=O)c3ccccc3Br)c2-c2ccc(Cl)cc2)cc1 ZINC000011730782 JJ Agent Clean Cc1ccc(-c2c(S(=O)(=O)c3cccc(C(F)(F)F)c3)nnn2-c2ccc(N)cc2)cc1 ZINC000011730792 JJ Agent Clean Nc1ccc(-n2nnc(S(=O)(=O)c3cccc(C(F)(F)F)c3)c2-c2ccc(F)cc2)cc1 ZINC000011730793 JJ Agent Clean Cc1ccc(-c2c(S(=O)(=O)c3cc(Cl)ccc3Cl)nnn2-c2ccc(N)cc2)cc1 ZINC000011730798 JJ Agent Clean Nc1ccc(-n2nnc(S(=O)(=O)c3cc(Cl)ccc3Cl)c2-c2ccc(F)cc2)cc1 ZINC000011730799 JJ Agent Clean Cc1ccc(-c2c(S(=O)(=O)c3ccc(Cl)cc3Cl)nnn2-c2ccc(N)cc2)cc1 ZINC000011730804 JJ Agent Clean Nc1ccc(-n2nnc(S(=O)(=O)c3ccc(Cl)cc3Cl)c2-c2ccc(F)cc2)cc1 ZINC000011730805 JJ Agent Clean C/C=C/c1ccc(OCC(=O)OCC(=O)Nc2c(C#N)c(C)c(C)n2C2CCCC2)c(OC)c1 ZINC000011745376 JJ Agent Mild O=C(O)c1ccc(-n2nnc(S(=O)(=O)c3ccccc3Cl)c2-c2ccc(Cl)cc2)cc1 ZINC000011759028 JJ Agent Anodyne O=C(O)c1cccc(-n2nnc(S(=O)(=O)c3ccccc3Cl)c2-c2ccc(Cl)cc2)c1 ZINC000011759033 JJ Agent Anodyne Cc1ccc(-c2c(S(=O)(=O)c3ccccc3Br)nnn2-c2ccc(C(=O)O)cc2)cc1 ZINC000011759205 JJ Agent Anodyne Cc1ccc(S(=O)(=O)c2nnn(-c3ccc(C(=O)O)cc3)c2-c2ccc(Cl)cc2)cc1C ZINC000011759398 JJ Agent Anodyne Cc1ccc(S(=O)(=O)c2nnn(-c3cccc(C(=O)O)c3)c2-c2ccc(Cl)cc2)cc1C ZINC000011759419 JJ Agent Anodyne O=C(O)c1cccc(-n2nnc(S(=O)(=O)c3cccc(C(F)(F)F)c3)c2-c2ccc(F)cc2)c1 ZINC000011759610 JJ Agent Anodyne O=C(O)c1ccc(-n2nnc(S(=O)(=O)c3cccc(C(F)(F)F)c3)c2-c2ccc(F)cc2)cc1 ZINC000011759614 JJ Agent Anodyne O=C(O)c1cccc(-n2nnc(S(=O)(=O)c3cc(Cl)ccc3Cl)c2-c2ccccc2)c1 ZINC000011759820 JJ Agent Anodyne O=C(O)c1cccc(-n2nnc(S(=O)(=O)c3cc(Cl)ccc3Cl)c2-c2ccc(F)cc2)c1 ZINC000011759835 JJ Agent Anodyne O=C(O)c1ccc(-n2nnc(S(=O)(=O)c3ccc(Cl)cc3Cl)c2-c2ccccc2)cc1 ZINC000011760003 JJ Agent Anodyne O=C(O)c1cccc(-n2nnc(S(=O)(=O)c3ccc(Cl)cc3Cl)c2-c2ccccc2)c1 ZINC000011760022 JJ Agent Anodyne O=C(O)c1cccc(-n2nnc(S(=O)(=O)c3ccc(Cl)cc3Cl)c2-c2ccc(F)cc2)c1 ZINC000011760031 JJ Agent Anodyne O=C(O)c1ccc(-n2nnc(S(=O)(=O)c3ccc(Cl)cc3Cl)c2-c2ccc(F)cc2)cc1 ZINC000011760039 JJ Agent Anodyne Cc1ccc(-c2c(S(=O)(=O)c3ccc(C(C)C)cc3)nnn2-c2ccc(C(=O)O)cc2)cc1 ZINC000011760195 JJ Agent Anodyne CC(C)c1ccc(S(=O)(=O)c2nnn(-c3cccc(C(=O)O)c3)c2-c2ccc(F)cc2)cc1 ZINC000011760217 JJ Agent Anodyne CC(C)c1ccc(S(=O)(=O)c2nnn(-c3ccc(C(=O)O)cc3)c2-c2ccc(F)cc2)cc1 ZINC000011760223 JJ Agent Anodyne CCOC(=O)/C=C/c1ccc(NC(=O)CSc2nnc3c(Cl)cc(C(F)(F)F)cn23)cc1 ZINC000011871997 JJ Agent Anodyne N=C1/C(=C/c2cccn2Cc2cccc3ccccc23)C(=O)N=C2SC(C(F)(F)F)=NN12 ZINC000012285387 JJ Agent Clean CC(=O)N(c1cc2sc(=O)oc2c2ccccc12)S(=O)(=O)c1c(C)c(C)cc(C)c1C ZINC000012293441 JJ Agent Anodyne O=[N+]([O-])c1ccc(N/N=C/c2c[nH]c3ccccc23)c(S(=O)(=O)Nc2ccccc2Cl)c1 ZINC000012311544 JJ Agent Mild O=[N+]([O-])c1ccc(-c2cs/c(=N\C3CCCCC3)n2/N=C/c2cc3c(cc2[N+](=O)[O-])OCO3)cc1 ZINC000012311846 JJ Agent Mild O=C(NN/C=C1\C(=O)N(c2cccc(Cl)c2)C(=O)c2ccccc21)c1cccc(Br)c1 ZINC000012312248 JJ Agent Reactive COc1ccc(C(=O)/C=C\c2cn(CCC(=O)O)nc2-c2ccc(Br)cc2)cc1 ZINC000012377787 JJ Agent Mild COC(=O)c1ccc(NC(=O)[C@H]2CC(=O)N(Cc3ccccc3)C(=Nc3ccc(F)cc3)S2)cc1 ZINC000012417824 JJ Agent Anodyne N#C/C(=C\c1ccc(-c2ccc(S(=O)(=O)N3CCOCC3)cc2)o1)c1nc2ccccc2s1 ZINC000012498006 JJ Agent Reactive CCOc1cc(/C=C(\c2nc(C)cs2)c2nc3ccccc3n2C)ccc1OCC(=O)N(C)C ZINC000012506472 JJ Agent Anodyne CCOc1ccc(CN(C)C(=O)/C=C/c2ccc(OCc3cn4ccccc4n3)cc2)cc1OC ZINC000012506928 JJ Agent Anodyne Cc1noc(CSC2=N/C(=C\c3ccc(N(C)C)cc3)C(=O)N2c2ccc(OC(F)F)cc2)n1 ZINC000012515331 JJ Agent Clean CCCn1c(=O)c2ccccc2n2c(SCC(=O)N(C)C(c3ccccc3)c3ccccc3)nnc12 ZINC000012521662 JJ Agent Anodyne CCOC(=O)C1=C(Nc2ccccc2)O/C(=C\c2cn(Cc3ccccc3)nc2-c2cccnc2)C1=O ZINC000012522195 JJ Agent Mild COc1ccc(C)cc1CN(C)Cn1nc2n(-c3ccccc3C)c(=O)c3ccccc3n2c1=S ZINC000012522775 JJ Agent Anodyne Cc1ccc(/C=N/Nc2ccc(S(=O)(=O)Nc3cccc(Cl)c3)cc2[N+](=O)[O-])s1 ZINC000012529326 JJ Agent Mild CN(Cc1ccccc1)C(=O)CN1C(=O)CS/C1=C\c1nc(-c2ccc(Cl)cc2)cs1 ZINC000012530874 JJ Agent Anodyne O=C(CN1C(=O)CS/C1=C\c1nc(-c2ccc(F)cc2)cs1)NCCc1ccc(Cl)cc1 ZINC000012531952 JJ Agent Anodyne Cc1ccc(-c2nc(C)sc2CC(=O)Nc2ccc(S(=O)(=O)/N=C3\CCCCCN3)cc2)cc1 ZINC000012533041 JJ Agent Mild Cc1c(C#N)c(NC(=O)COC(=O)/C=C/c2cccc3cccnc23)n(-c2ccccc2)c1C ZINC000012537477 JJ Agent Mild CCOC(=O)C1=C(Nc2ccccc2)O/C(=C\c2c(C)nn(Cc3ccccc3)c2Cl)C1=O ZINC000012542731 JJ Agent Mild CCOC(=O)C1=C(Nc2ccccc2)O/C(=C\c2ccc(OC(F)F)cc2OC(F)F)C1=O ZINC000012543590 JJ Agent Mild Cc1nc2ccccc2c2c(NC(=O)[C@H]3CC(=O)N(CCc4ccccc4)C3)c3ccccc3n12 ZINC000012546813 JJ Agent Bother Cc1nc2ccccc2c2c(NC(=O)[C@@H]3CC(=O)N(CCc4ccccc4)C3)c3ccccc3n12 ZINC000012546814 JJ Agent Bother CCn1c(/C(Cl)=C/c2ccc(C(F)(F)F)cc2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 ZINC000012551587 JJ Agent Anodyne C=CCn1c(=O)c2ccccc2n2c(=S)n(CN(C)Cc3ccc(Cl)c(Cl)c3)nc12 ZINC000012554242 JJ Agent Mild CC(=O)N(c1ccccc1)c1nc(/C=C2\C(=O)N(Cc3ccccn3)C(=O)c3ccccc32)cs1 ZINC000012554493 JJ Agent Anodyne O=C(NCc1ccco1)/C(=C/c1cn(-c2ccccc2)nc1-c1cccnc1)NC(=O)c1ccccc1 ZINC000012558419 JJ Agent Anodyne CN/C(=N/c1c(C(O)(C(F)(F)F)C(F)(F)F)c(C)nn1-c1ccccc1)c1ccc(F)cc1 ZINC000012559758 JJ Agent Mild COc1cc(/C=C/C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)cc(Cl)c1OC(C)C ZINC000012559818 JJ Agent Anodyne COc1ccccc1Cn1c(=O)c2ccccc2n2c(=S)n(CN(C)[C@@H](C)c3cccs3)nc12 ZINC000012561917 JJ Agent Anodyne COc1ccccc1Cn1c(=O)c2ccccc2n2c(=S)n(CN(C)[C@H](C)c3cccs3)nc12 ZINC000012561920 JJ Agent Anodyne CN(C)S(=O)(=O)c1cc(NC(=O)/C(=C/c2cccs2)c2ccc(F)cc2)ccc1Cl ZINC000012563214 JJ Agent Anodyne CC(=O)Nc1ccc(/C=N/Nc2ccc(C(=O)c3c(C)cc4ccccn34)cc2[N+](=O)[O-])cc1 ZINC000012563551 JJ Agent Mild CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)/C=C/c1cccc(OC)c1OC(F)F ZINC000012564252 JJ Agent Anodyne O=C(/C=C/c1cn(Cc2ccccc2)nc1-c1cccs1)N1CCN(c2ccccc2O)CC1 ZINC000012564369 JJ Agent Anodyne Cc1ccsc1/C=N/Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(Cl)cc1 ZINC000012564425 JJ Agent Mild COC(=O)c1ccc(COc2ccc(/C=C(\C#N)C(=O)NCc3ccc(Cl)cc3)cc2)cc1 ZINC000012564931 JJ Agent Reactive CNC(=O)c1ccc(CN(C)C(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2ccccc2)cc1 ZINC000012567871 JJ Agent Anodyne CCOC(=O)C1=NN(c2ccccc2)C(=O)/C1=C\c1cn(-c2ccccc2)nc1-c1cccs1 ZINC000012572594 JJ Agent Clean O=C(Cc1cccs1)OCC(=O)N1N=C2/C(=C/c3ccco3)CCC[C@@H]2[C@@H]1c1ccco1 ZINC000012581391 JJ Agent Anodyne O=C(Cc1cccs1)OCC(=O)N1N=C2/C(=C/c3ccco3)CCC[C@@H]2[C@H]1c1ccco1 ZINC000012581403 JJ Agent Anodyne CCOC(=O)c1c(-c2ccccc2)csc1NC(=O)/C(C#N)=C/c1ccc(C(=O)OC)cc1 ZINC000012584450 JJ Agent Reactive O=C(/C=C/Nc1ccc(S(=O)(=O)c2ccc(N/C=C/C(=O)C(F)(F)F)cc2)cc1)C(F)(F)F ZINC000012584473 JJ Agent Mild C/C(=N\Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1Cl)c1ccc(C#N)cc1 ZINC000012586258 JJ Agent Mild Cc1ccc(NS(=O)(=O)c2ccc(N/N=C/c3ccc(N(C)C)cc3)c([N+](=O)[O-])c2)c(C)c1 ZINC000012587617 JJ Agent Mild COC(=O)c1cc(CSc2nnc3n(-c4cc(C)ccc4C)c(=O)c4ccccc4n23)oc1C ZINC000012589160 JJ Agent Anodyne C=CCn1c(=O)c2ccccc2n2c(=S)n(CN(C)Cc3ccc(Cl)cc3Cl)nc12 ZINC000012590244 JJ Agent Mild CCN(Cc1ccccc1)C(=O)CSc1nnc2n(-c3cc(C)ccc3C)c(=O)c3ccccc3n12 ZINC000012590358 JJ Agent Anodyne Cc1ccc(C)c(-n2c(=O)c3ccccc3n3c(S[C@H](C)C(=O)N4C[C@H](C)C[C@@H](C)C4)nnc23)c1 ZINC000012592785 JJ Agent Anodyne Cc1ccc(C)c(-n2c(=O)c3ccccc3n3c(S[C@H](C)C(=O)N4C[C@@H](C)C[C@@H](C)C4)nnc23)c1 ZINC000012592792 JJ Agent Anodyne Cc1ccc(C)c(-n2c(=O)c3ccccc3n3c(S[C@H](C)C(=O)N4C[C@@H](C)C[C@H](C)C4)nnc23)c1 ZINC000012592797 JJ Agent Anodyne Cc1ccccc1-n1c(=O)c2ccccc2n2c(SCC(=O)N[C@@H](C)CCc3ccccc3)nnc12 ZINC000012592946 JJ Agent Anodyne Cc1ccccc1-n1c(=O)c2ccccc2n2c(SCC(=O)N[C@H](C)CCc3ccccc3)nnc12 ZINC000012592950 JJ Agent Anodyne O=C(CCCSc1nnc2n(Cc3ccccc3)c(=O)c3ccccc3n12)c1ccccc1 ZINC000012597902 JJ Agent Anodyne C/C(=N\Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc(Cl)cc1)c1ccc(C#N)cc1 ZINC000012599702 JJ Agent Mild CC(=O)c1ccc(/N=c2\scc(-c3ccc([N+](=O)[O-])cc3)n2CCCN2CCCC2=O)cc1 ZINC000012600485 JJ Agent Bother COc1ccc(-c2nn(-c3ccccc3)cc2/C=C(\C#N)c2nnc3n2CCCCC3)cc1OC ZINC000012600552 JJ Agent Reactive O=C(COc1ccccc1)OCC(=O)N1N=C2/C(=C/c3ccco3)CCC[C@@H]2[C@@H]1c1ccco1 ZINC000012600601 JJ Agent Anodyne O=C(OCC(=O)N1N=C2/C(=C/c3ccco3)CCC[C@@H]2[C@@H]1c1ccco1)c1cc2ccccc2oc1=O ZINC000012600637 JJ Agent Anodyne CC(C)/N=c1\scc(-c2ccc(OC(F)F)cc2)n1/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000012601999 JJ Agent Mild Cc1cc(C)c2c(c1)C(=NNC(=O)c1ccc(NS(=O)(=O)c3cccs3)cc1)CCC2 ZINC000012602132 JJ Agent Anodyne CCCn1c(/C(Cl)=C/c2cccc(C)c2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 ZINC000012602351 JJ Agent Anodyne C=CC/N=c1\scc(-c2cccc(Br)c2)n1/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000012603037 JJ Agent Mild CCn1c(/C(Cl)=C/c2ccc(SC)cc2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 ZINC000012603565 JJ Agent Anodyne COc1ccccc1Nc1nnc(SCC(=O)/C(C#N)=C2\Nc3ccccc3S2)s1 ZINC000012603996 JJ Agent Reactive CC(C)Cn1c(-c2ccc(F)cc2)cnc1SCc1nnc2n(C)c(=O)c3ccccc3n12 ZINC000012604125 JJ Agent Clean COCCn1c(SCC(=O)/C(C#N)=C2\Sc3ccccc3N2C)nnc1-c1cccc(C)c1 ZINC000012609288 JJ Agent Reactive Cc1ccc(C)c(-n2c(=O)c3ccccc3n3c(SCC(=O)N[C@H](C)CCC(C)C)nnc23)c1 ZINC000012609925 JJ Agent Anodyne Cc1ccc(C)c(-n2c(=O)c3ccccc3n3c(SCC(=O)N[C@@H](C)CCC(C)C)nnc23)c1 ZINC000012609927 JJ Agent Anodyne C/C(=N\Nc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccc(C#N)cc1 ZINC000012614034 JJ Agent Mild C=CCN1C(c2ccc(F)cc2)=CS/C1=C(/C#N)c1nnc(N2CCOCC2)n1-c1ccccc1 ZINC000012618486 JJ Agent Reactive O=C(/C=C/N1CCC(CCCC2CCN(/C=C/C(=O)C(F)(F)F)CC2)CC1)C(F)(F)F ZINC000012620393 JJ Agent Mild O=S(=O)(/C=C/c1ccccc1)N1CCC(/C(O)=N/Cc2ccc(C(F)(F)F)cc2)CC1 ZINC000012624530 JJ Agent Mild Cc1nc(COc2ccccc2/C=C/C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)cs1 ZINC000012627528 JJ Agent Anodyne COc1cc(/C=C(/C(=O)NCc2ccccc2)c2nc3ccccc3[nH]2)cc(Br)c1O ZINC000012627543 JJ Agent Anodyne CC[C@H](C)N(C(=O)CSc1nnc2n(-c3cccc(OC)c3)c(=O)c3ccccc3n12)[C@@H](C)CC ZINC000012631935 JJ Agent Anodyne CC[C@@H](C)N(C(=O)CSc1nnc2n(-c3cccc(OC)c3)c(=O)c3ccccc3n12)[C@H](C)CC ZINC000012631937 JJ Agent Anodyne CC[C@H](C)N(C(=O)CSc1nnc2n(-c3cccc(OC)c3)c(=O)c3ccccc3n12)[C@H](C)CC ZINC000012631939 JJ Agent Anodyne COCCCn1c(=O)c2ccccc2n2c(SCc3nc4ccccc4c(C)c3Cl)nnc12 ZINC000012633159 JJ Agent Anodyne CCN(CC)c1ccc(-c2nnc(SCC(=O)N3CCN(C/C=C/c4ccccc4)CC3)o2)cc1 ZINC000012634360 JJ Agent Anodyne Cc1ccc(-c2nn(-c3ccccc3)cc2/C=C/C(=O)OCC(=O)Nc2sccc2C#N)o1 ZINC000012635048 JJ Agent Mild Cc1ccc(CN(C)C(=O)CSc2nnc3n(-c4cccc(C)c4C)c(=O)c4ccccc4n23)cc1 ZINC000012635380 JJ Agent Anodyne C=CCc1ccccc1OC[C@H](O)CSc1nnc2n(-c3ccc(C)cc3)c(=O)c3ccccc3n12 ZINC000012635930 JJ Agent Mild C=CCc1ccccc1OC[C@@H](O)CSc1nnc2n(-c3ccc(C)cc3)c(=O)c3ccccc3n12 ZINC000012635940 JJ Agent Mild Cc1cc(NC(=O)/C=C/c2cc(C)n(-c3ccnn3C(C)C)c2C)ccc1N1CCN(C)CC1 ZINC000012638793 JJ Agent Anodyne COCCCn1c(=O)c2ccccc2n2c(SCc3cc(-c4ccc(Cl)cc4)no3)nnc12 ZINC000012639587 JJ Agent Anodyne Cc1ccc(C)c(-n2c(=O)c3ccccc3n3c(S[C@H](C)C(=O)N(C)C4CCCCC4)nnc23)c1 ZINC000012643583 JJ Agent Anodyne Cc1ccc(C)c(-n2c(=O)c3ccccc3n3c(S[C@@H](C)C(=O)N(C)C4CCCCC4)nnc23)c1 ZINC000012643585 JJ Agent Anodyne O=C1/C(=C\NNC(=O)C23CC4CC(CC(C4)C2)C3)c2ccccc2C(=O)N1c1ccccc1Cl ZINC000012649599 JJ Agent Reactive CCN(CC)S(=O)(=O)c1cc([N+](=O)[O-])ccc1N/N=C(\C)c1cc(Cl)ccc1Cl ZINC000012650597 JJ Agent Mild C=CCN(C(=O)/C=C/c1nc2ccccc2o1)c1nc(-c2ccc(S(C)(=O)=O)cc2)cs1 ZINC000012691547 JJ Agent Mild CC(=O)N(c1ccccc1)c1nc(/C=C/C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cs1 ZINC000012691944 JJ Agent Anodyne Cc1ccc(OCc2nc(C(=O)Nc3cccc(S(=O)(=O)/N=C4/CCCCCN4)c3)cs2)cc1 ZINC000012699751 JJ Agent Mild C=CCN(Cc1ccc(Cl)s1)C(=O)/C=C/c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000012749177 JJ Agent Mild Cc1cc(C(=O)NCCN2C(=O)S/C(=C\c3cccs3)C2=O)c(C)n1Cc1cccs1 ZINC000012752300 JJ Agent Anodyne CCOc1cc(/C=C2\N=C(C34CC5CC(CC(C5)C3)C4)OC2=O)cc(Cl)c1OCC(=O)N(C)C ZINC000012761428 JJ Agent Anodyne Cc1nn2c(C(F)(F)F)ccnc2c1/C=C/C(=O)N[C@H](C)c1ccc(Br)cc1 ZINC000012762517 JJ Agent Anodyne Cc1nn2c(C(F)(F)F)ccnc2c1/C=C/C(=O)N[C@@H](C)c1ccc(Br)cc1 ZINC000012762522 JJ Agent Anodyne O=S(=O)(/C=C/c1ccccc1)N1CCC(/C(O)=N/Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000012766042 JJ Agent Mild CCOC(=O)/C=C/c1ccc(NC(=O)C2(S(=O)(=O)c3ccc(C)c(C)c3)CCCC2)cc1 ZINC000012772721 JJ Agent Anodyne CC(=O)N(c1nc(/C=C2\SC(=S)N(CCCC(=O)O)C2=O)cs1)c1c(C)cccc1C ZINC000012773536 JJ Agent Clean CCCN(Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C(=O)/C=C/c1cccc(Br)c1 ZINC000012777270 JJ Agent Anodyne CCOC(=O)/C(=C\c1cccc(Br)c1)C1=Nn2c(nnc2-c2ccc(OC)cc2)SC1 ZINC000012782821 JJ Agent Anodyne O=C(Nc1ccc(S(=O)(=O)/N=C2\CCCCCN2)cc1)C1(c2ccc(Cl)cc2)CCC1 ZINC000012785463 JJ Agent Mild COc1ccc(/N=C2/S[C@@H](CC(=O)NCc3ccccc3)C(=O)N2Cc2ccc(F)cc2)cc1 ZINC000012786196 JJ Agent Mild COc1ccc(/N=C2/S[C@H](CC(=O)NCc3ccccc3)C(=O)N2Cc2ccc(F)cc2)cc1 ZINC000012786202 JJ Agent Mild CCOc1cc(/C=C/C(=O)NCc2ccc(Cn3cncn3)cc2)ccc1OCCOc1ccccc1 ZINC000012790058 JJ Agent Anodyne C[C@@H](OC(=O)/C=C/c1cc(Br)ccc1F)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000012791470 JJ Agent Bother C[C@H](OC(=O)/C=C/c1cc(Br)ccc1F)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000012791473 JJ Agent Bother C/C=C/c1ccc(OCC(=O)Nc2ccnn2Cc2cc(Br)cs2)c(OC)c1 ZINC000012796213 JJ Agent Anodyne CCOC(=O)/C=C/c1ccc(NC(=O)C2(S(=O)(=O)c3cc(C)ccc3C)CCCC2)cc1 ZINC000012797795 JJ Agent Anodyne CCN(CC)S(=O)(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2c2nc3ccccc3s2)cc1 ZINC000012802947 JJ Agent Anodyne CCN(CC)S(=O)(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2c2nc3ccccc3s2)cc1 ZINC000012802953 JJ Agent Anodyne COc1ccc(-c2nn(CCC#N)cc2/C=C(\C#N)C(=O)N(C)CCOc2cc(C)cc(C)c2)cc1 ZINC000012807793 JJ Agent Reactive CCN(C(=O)/C=C/c1cc(OC)c(OC)c(S(=O)(=O)N2CCc3ccccc32)c1)C1CCCCC1 ZINC000012811269 JJ Agent Anodyne CC(=O)N(c1nc(/C=C2/SC(=S)N(CCCN(C)C)C2=O)cs1)c1cccc(C)c1C ZINC000012818269 JJ Agent Clean CC[C@@H](NC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)c1ccc(Br)cc1 ZINC000012820761 JJ Agent Anodyne CC[C@H](NC(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1)c1ccc(Br)cc1 ZINC000012820764 JJ Agent Anodyne COc1cccc(/C=C/C(=O)Nc2ccnn2Cc2ccc(Br)cc2)c1OC(F)F ZINC000012820999 JJ Agent Anodyne CCOC(=O)/C(=C\c1ccc(Br)cc1)C1=Nn2c(nnc2-c2ccc(OC)cc2)SC1 ZINC000012821275 JJ Agent Anodyne Cc1ccccc1/C=C/c1nc(SCC(=O)Nc2ccc(I)cc2C)n[nH]1 ZINC000012844751 JJ Agent Anodyne Cc1ccc(-n2nc(C)c(/C=C3\CCn4c3nc3cc(C(=O)O)ccc3c4=O)c2Cl)c(C)c1 ZINC000012848934 JJ Agent Clean CC(=O)N(c1nc(/C=C2\N=C(c3ccc4c(c3)OCO4)OC2=O)cs1)c1c(C)cccc1C ZINC000012849797 JJ Agent Anodyne N#C/C(=C\c1ccc(-n2cccn2)cc1)S(=O)(=O)c1cc(Br)ccc1Br ZINC000012852483 JJ Agent Reactive Cc1nn(-c2ccccc2Cl)c(Cl)c1/C=C1\CCn2c1nc1cc(C(=O)O)ccc1c2=O ZINC000012862189 JJ Agent Clean Cc1nn(-c2cccc(Cl)c2)c(Cl)c1/C=C1\CCn2c1nc1cc(C(=O)O)ccc1c2=O ZINC000012862196 JJ Agent Clean Cc1ccc(C)c(-n2nc(C)c(/C=C3\CCn4c3nc3cc(C(=O)O)ccc3c4=O)c2Cl)c1 ZINC000012862206 JJ Agent Clean CC(=O)N(c1nc(/C=C2\SC(=S)N(CCCC(=O)O)C2=O)cs1)c1cccc(C)c1C ZINC000012863034 JJ Agent Clean COC(=O)c1cccc(C#Cc2cccc(NC(=O)/C=C/c3cc(F)cc4c3OCOC4)c2)c1 ZINC000012868646 JJ Agent Mild C/C=C/c1ccc(OC[C@H](O)Cn2cnc3scc(-c4ccc(OC)cc4)c3c2=O)c(OC)c1 ZINC000012871467 JJ Agent Anodyne C/C=C/c1ccc(OC[C@@H](O)Cn2cnc3scc(-c4ccc(OC)cc4)c3c2=O)c(OC)c1 ZINC000012871471 JJ Agent Anodyne Cn1nccc1/C=C/C(=O)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 ZINC000012898883 JJ Agent Anodyne Cn1nccc1/C=C/C(=O)N(C[C@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 ZINC000012898891 JJ Agent Anodyne Nc1nc(N)nc(COC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc(Cl)c(Cl)c2)CC3)n1 ZINC000012907558 JJ Agent Anodyne CN(Cc1cccc(Cl)c1Cl)C(=O)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1 ZINC000012908207 JJ Agent Anodyne CC(=O)N(c1ccccc1)c1nc(/C=C2\N=C(c3ccccc3Br)OC2=O)cs1 ZINC000012922374 JJ Agent Anodyne COc1cc(/C=C/C(=O)Nn2c(S)nnc2-c2ccccc2F)cc(Cl)c1OC(C)C ZINC000012926655 JJ Agent Anodyne Cc1c(C#N)c(NC(=O)COC(=O)/C=C/c2cccc3cccnc23)n(Cc2ccc(F)cc2)c1C ZINC000012937909 JJ Agent Mild O=C1/C(=C\c2c(N3CCCCC3)nc3ccccn3c2=O)SC(=S)N1CCCc1ccccc1 ZINC000012940365 JJ Agent Clean Cc1nc(CN2CCN(C(=O)/C=C/c3cn(Cc4ccccc4)nc3-c3ccccc3)CC2)cs1 ZINC000012945092 JJ Agent Anodyne Cc1nc(CN2CCN(C(=O)/C=C/c3cn(-c4ccccc4)nc3-c3cccs3)CC2)cs1 ZINC000012948297 JJ Agent Anodyne CC(C)n1ncc2c(C(=O)N3CCN(C/C=C/c4ccccc4)CC3)cc(-c3ccco3)nc21 ZINC000012950241 JJ Agent Anodyne CCCOc1c(Cl)cc(/C=C/C(=O)N2CCC[C@@H]2c2nnc3n2CCCCC3)cc1OC ZINC000012975755 JJ Agent Anodyne CCCOc1c(Cl)cc(/C=C/C(=O)N2CCC[C@H]2c2nnc3n2CCCCC3)cc1OC ZINC000012975757 JJ Agent Anodyne CC[C@@H](C)N1C(=O)[C@@H](CC(=O)Nc2cccc([N+](=O)[O-])c2)S/C1=N\c1ccc(F)cc1F ZINC000012976019 JJ Agent Mild CC[C@H](C)N1C(=O)[C@@H](CC(=O)Nc2cccc([N+](=O)[O-])c2)S/C1=N\c1ccc(F)cc1F ZINC000012976021 JJ Agent Mild CC[C@@H](C)N1C(=O)[C@H](CC(=O)Nc2cccc([N+](=O)[O-])c2)S/C1=N\c1ccc(F)cc1F ZINC000012976023 JJ Agent Mild CC[C@H](C)N1C(=O)[C@H](CC(=O)Nc2cccc([N+](=O)[O-])c2)S/C1=N\c1ccc(F)cc1F ZINC000012976025 JJ Agent Mild CC(=O)N1CCc2cc(C(=O)[C@@H](C)OC(=O)/C=C/c3c(C)nn(-c4ccccc4)c3Cl)ccc21 ZINC000012978676 JJ Agent Anodyne CC(=O)N1CCc2cc(C(=O)[C@H](C)OC(=O)/C=C/c3c(C)nn(-c4ccccc4)c3Cl)ccc21 ZINC000012978678 JJ Agent Anodyne CC1(C)NC(=O)N(CCOC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccc(F)cc2)CCC3)C1=O ZINC000012979747 JJ Agent Anodyne CC(C)n1nccc1NC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2 ZINC000012980064 JJ Agent Anodyne CCNC(=O)COc1ccc(/C=C/c2nc(-c3ccccc3)c(C(=O)O)s2)cc1OCC ZINC000012985658 JJ Agent Anodyne COc1ccc(N(C(C)=O)c2nc(/C=C3\N=C(c4ccccc4Br)OC3=O)cs2)cc1 ZINC000012985995 JJ Agent Anodyne COc1ccccc1/N=C1\NC(=O)[C@@H](CC(=O)Nc2cc(Cl)c(Cl)cc2Cl)S1 ZINC000012995488 JJ Agent Mild COc1ccccc1/N=C1\NC(=O)[C@H](CC(=O)Nc2cc(Cl)c(Cl)cc2Cl)S1 ZINC000012995489 JJ Agent Mild CCn1c(SCC(=O)N2CCN(C/C=C/c3ccccc3)CC2)nnc1-c1cccc(Cl)c1 ZINC000012997707 JJ Agent Anodyne O=C(/N=C1/N=C2C=CC(Br)=CN2Cc2ccccc21)c1cc([N+](=O)[O-])ccc1Cl ZINC000013011340 JJ Agent Mild CCCCN1CN(CCN2C(=O)S/C(=C\c3ccc(C)cc3)C2=O)Cn2c1nc1ccccc12 ZINC000013015962 JJ Agent Anodyne Cc1csc(N(C(=O)C2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)c2ccccc2)n1 ZINC000013018035 JJ Agent Anodyne O=C(Nc1nc(-c2c[nH]c3ccccc23)cs1)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1 ZINC000013028577 JJ Agent Anodyne COc1ccccc1NC(=O)CN(Cc1ccco1)C(=O)/C=C/c1cc(C)n(-c2cc(C)on2)c1C ZINC000013037842 JJ Agent Anodyne Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C/C(=O)O[C@H](C)C(=O)N1CCc2ccccc21 ZINC000013038787 JJ Agent Anodyne Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C/C(=O)O[C@@H](C)C(=O)N1CCc2ccccc21 ZINC000013038788 JJ Agent Anodyne CCCn1c(C)cc(C(=O)/C(C#N)=C/c2ccc(O[C@@H](C)C(=O)N(C)C)c(OCC)c2)c1C ZINC000013039146 JJ Agent Reactive CCCn1c(C)cc(C(=O)/C(C#N)=C/c2ccc(O[C@H](C)C(=O)N(C)C)c(OCC)c2)c1C ZINC000013039147 JJ Agent Reactive O=C1/C(=C\Nc2nc(CN3CCCCC3)cs2)c2ccccc2C(=O)N1c1ccc(Cl)cn1 ZINC000013042063 JJ Agent Anodyne COc1cc(/C=C/C(=O)OCC(=O)c2ccc(NC(=O)CC(C)C)cc2)cc(Cl)c1OC ZINC000013055905 JJ Agent Anodyne Cc1cccc(-n2c(C)cc(/C=C(\C#N)c3nnc(N4CCOCC4)n3-c3ccccc3)c2C)c1 ZINC000013058434 JJ Agent Reactive Cc1cccc2c1N=C(O)/C2=N\NC(=O)c1ccc(CN2c3cccc4cccc(c34)S2(=O)=O)cc1 ZINC000013062616 JJ Agent Reactive CCOC(=O)Nc1ccc2c(COC(=O)/C=C/c3c(C)nn(-c4ccccc4)c3C)cc(=O)oc2c1 ZINC000013068236 JJ Agent Anodyne Cc1ccc(Cn2nc(C)c(/C=C/C(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)c2Cl)cc1 ZINC000013068648 JJ Agent Mild CCOC(=O)c1ccc(N2C(=O)/C(=C/Nc3ccnn3C3CCCC3)c3ccccc3C2=O)cc1 ZINC000013069953 JJ Agent Anodyne Cc1ccc(CN(C)Cn2nc3n(-c4ccccc4C)c(=O)c4ccccc4n3c2=S)cc1 ZINC000013070146 JJ Agent Anodyne COc1ccccc1Cn1c(=O)c2ccccc2n2c(=S)n(CN(C)Cc3ccc(C)cc3)nc12 ZINC000013070150 JJ Agent Anodyne O=C(/C=C/c1cn(-c2ccccc2)nc1-c1cccs1)OCC(=O)N1CCC(c2ccccc2)=N1 ZINC000013070952 JJ Agent Anodyne CCOc1ccc(CN(C)Cn2nc3n(Cc4ccccc4)c(=O)c4ccccc4n3c2=S)cc1 ZINC000013071900 JJ Agent Anodyne CCOc1cc(/C=C/C(=O)c2cccc([N+](=O)[O-])c2)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000013071977 JJ Agent Mild Cc1ccccc1CN(C)Cn1nc2n(-c3ccccc3C)c(=O)c3ccccc3n2c1=S ZINC000013073529 JJ Agent Anodyne CCOc1ccc(CN(C)Cn2nc3n(-c4ccccc4)c(=O)c4ccccc4n3c2=S)cc1 ZINC000013073728 JJ Agent Anodyne COc1ccc(N2C(=O)/C(=C\c3ccco3)N=C2SCc2cc(=O)n3ccsc3n2)cc1Cl ZINC000013074524 JJ Agent Anodyne CCOc1cc(/C=C(\C#N)c2nnc(N3CCOCC3)n2-c2ccccc2)ccc1OCC(C)C ZINC000013076155 JJ Agent Reactive CCOc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)O[C@@H](C)C(=O)N(C)c3ccccc3)c2C)cc1 ZINC000013095543 JJ Agent Reactive CCOc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)O[C@H](C)C(=O)N(C)c3ccccc3)c2C)cc1 ZINC000013095544 JJ Agent Reactive Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C/C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000013102253 JJ Agent Bother CC(C)c1ccc(-c2nnc(NC(=O)C3CCN(S(=O)(=O)/C=C/c4ccccc4)CC3)s2)cc1 ZINC000013102399 JJ Agent Anodyne O=C(/C=C/c1cc(Br)ccc1OC(F)F)OCC(=O)c1c[nH]c2ccccc12 ZINC000013109908 JJ Agent Anodyne Cn1c(=O)c2ccccc2n2c(CSCc3cc(F)cc4c3O[C@H](c3ccccc3)OC4)nnc12 ZINC000013112485 JJ Agent Anodyne Cn1c(=O)c2ccccc2n2c(CSCc3cc(F)cc4c3O[C@@H](c3ccccc3)OC4)nnc12 ZINC000013112486 JJ Agent Anodyne O=C1O[C@@H](c2ccccc2)Cc2cc(C(=O)N3CCN(C/C=C/c4ccccc4)CC3)ccc21 ZINC000013112978 JJ Agent Anodyne O=C1O[C@H](c2ccccc2)Cc2cc(C(=O)N3CCN(C/C=C/c4ccccc4)CC3)ccc21 ZINC000013112979 JJ Agent Anodyne CCOc1ccc(N2C(=O)/C(=C/Nc3ccccc3)c3ccc(OC)cc3C2=O)c([N+](=O)[O-])c1 ZINC000013113410 JJ Agent Bother Cc1ccc(/C=C/C2=Cc3c(sc(NC(=O)CSc4nnnn4C)c3C#N)C(C)(C)C2)o1 ZINC000013115710 JJ Agent Mild O=C(O)c1ccc(/C=C(/C(=O)N2CCCC2)c2nc3sc(-c4ccccc4)cc3c(=O)[nH]2)cc1 ZINC000013117679 JJ Agent Anodyne O=C(O)c1ccc(/C=C(/C(=O)N2CCCC2)c2nc3scc(-c4ccccc4)c3c(=O)[nH]2)cc1 ZINC000013117682 JJ Agent Anodyne N#Cc1ccc(/C=C(/C(=O)N2CCCC2)c2nc3scc(-c4ccccc4)c3c(=O)[nH]2)cc1 ZINC000013117683 JJ Agent Mild Cc1cc(N/C(=N\S(=O)(=O)c2cc(F)ccc2F)c2ccccc2)n(-c2ccccc2)n1 ZINC000013120438 JJ Agent Mild COc1cc(/C=C/C(=O)N2CCN(Cc3cccc(C)c3)CC2)ccc1OCc1c(C)noc1C ZINC000013126914 JJ Agent Anodyne CC(=O)N(c1nc(/C=C/C(=O)N(C)Cc2cnn(-c3ccccc3)c2)cs1)c1ccccc1F ZINC000013128307 JJ Agent Anodyne CCCCNC(=S)N(C)N=Cc1ccc(OCC(=O)Nc2c(C)cc(C)cc2C)c(OC)c1 ZINC000013133293 JJ Agent Anodyne Cc1nn(-c2ccccc2)c(Cl)c1/C=C/C(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 ZINC000013133776 JJ Agent Mild CCOc1ccc(/C=C/C(=O)O[C@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1OC ZINC000013134157 JJ Agent Bother COc1cc(C=NNc2ccc(Cl)c(C(=O)O)c2)ccc1OCC(=O)N1[C@@H](C)CCC[C@@H]1C ZINC000013136251 JJ Agent Anodyne COc1cc(C=NNc2ccc(Cl)c(C(=O)O)c2)ccc1OCC(=O)N1[C@@H](C)CCC[C@H]1C ZINC000013136253 JJ Agent Anodyne Cc1ccc(-c2nnn(CC(=O)N3N=C4/C(=C/c5ccco5)CCC[C@@H]4[C@@H]3c3ccco3)n2)cc1 ZINC000013140174 JJ Agent Anodyne Cc1ccc(-c2nnn(CC(=O)N3N=C4/C(=C/c5ccco5)CCC[C@@H]4[C@H]3c3ccco3)n2)cc1 ZINC000013140189 JJ Agent Anodyne C/N=C1/S[C@@H](C(=O)Nc2ccccc2Cl)CC(=O)N1c1ccc(OC(F)(F)Cl)cc1 ZINC000013140323 JJ Agent Mild C/N=C1/S[C@H](C(=O)Nc2ccccc2Cl)CC(=O)N1c1ccc(OC(F)(F)Cl)cc1 ZINC000013140324 JJ Agent Mild Cn1c(SCC(=O)N2N=C3/C(=C/c4ccco4)CCC[C@@H]3[C@@H]2c2ccco2)nnc1C(F)(F)F ZINC000013141219 JJ Agent Anodyne Cn1c(SCC(=O)N2N=C3/C(=C/c4ccco4)CCC[C@@H]3[C@H]2c2ccco2)nnc1C(F)(F)F ZINC000013141221 JJ Agent Anodyne Cc1cc(SCC(=O)Nc2cccc(S(=O)(=O)/N=C3/CCCCCN3)c2)nc2ccccc12 ZINC000013146769 JJ Agent Mild N#Cc1ccsc1NC(=O)COC(=O)/C=C/c1cn(Cc2ccccc2)nc1-c1cccs1 ZINC000013147535 JJ Agent Mild CC(=O)Nc1ccc(/C=C(\C#N)S(=O)(=O)c2cc(Br)ccc2Br)cc1 ZINC000013147884 JJ Agent Reactive COc1cccc(/C=C(\C#N)S(=O)(=O)c2cc(Br)ccc2Br)c1OC ZINC000013147917 JJ Agent Reactive COc1cc(/C=C(\C#N)S(=O)(=O)c2cc(Br)ccc2Br)cc(OC)c1 ZINC000013148645 JJ Agent Reactive COc1cc(/C=C2\N=C3CCCCCN3C2=O)ccc1OCC(=O)Nc1c(C)cc(C)cc1C ZINC000013149153 JJ Agent Anodyne Cc1cc(NC(=O)COC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc4c(c2)OCO4)CCC3)no1 ZINC000013150061 JJ Agent Anodyne O=C(COC(=O)c1ccccc1N/C=C/C(=O)C(F)(F)F)c1ccc(Br)s1 ZINC000013150141 JJ Agent Mild CCn1c(/C(Cl)=C/c2ccc(C(=O)OC)cc2)nc2cc(S(=O)(=O)N3CCCCC3)ccc21 ZINC000013150341 JJ Agent Anodyne CCOC(=O)NC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(OC)cc1)C[C@@H](C)C2 ZINC000013150520 JJ Agent Anodyne O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccccc1)CCC2)NCC(F)(F)F ZINC000013150530 JJ Agent Anodyne COc1cc(C)c(NC(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccnc2)cc1OC ZINC000013163541 JJ Agent Anodyne O=[N+]([O-])c1ccc2c(c1)/C(=N/Nc1nc(C(Cl)(Cl)Cl)nc3ccccc13)C(O)=N2 ZINC000013301587 JJ Agent Mild CN(C)c1ccc(/[N+]([O-])=C/C(=O)c2ccc(-n3nncc3C34CC5CC(CC(C5)C3)C4)cc2)cc1 ZINC000013301645 JJ Agent Mild O=C(/N=C1\N=C2C=CC(Br)=CN2Cc2ccccc21)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000013301997 JJ Agent Mild N#C/C(=C1/C(=O)Nc2ccc([N+](=O)[O-])cc21)c1nc(-c2ccc(Br)cc2)cs1 ZINC000013302354 JJ Agent Reactive O=C(/C=C/c1ccc([N+](=O)[O-])cc1)/N=C1\N=C2C=CC(Br)=CN2Cc2ccccc21 ZINC000013306556 JJ Agent Mild C[C@@H](Oc1ccc(C(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccnc2)cc1)C(=O)O ZINC000013365740 JJ Agent Mild C[C@H](Oc1ccc(C(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccnc2)cc1)C(=O)O ZINC000013365742 JJ Agent Mild O=C(NCc1ccccc1)c1ccccc1N/N=C1/C(=O)N(c2ccccc2)N=C1c1ccccc1 ZINC000013574629 JJ Agent Mild COc1cc(CC(=O)NC[C@@H](COC(=O)C(C)(C)C)Cc2ccc(C(C)(C)C)cc2)ccc1O ZINC000013836608 JJ Agent Anodyne COc1cc(CC(=O)NC[C@H](COC(=O)C(C)(C)C)Cc2ccc(C(C)(C)C)cc2)ccc1O ZINC000013836609 JJ Agent Anodyne CCN(CC)S(=O)(=O)c1ccc(C(=O)/C=C/c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cc1 ZINC000013878620 JJ Agent Mild CCOc1cc(/C=C2\S/C(=N/c3ccccc3C)NC2=O)cc(Br)c1OC(C)=O ZINC000013914262 JJ Agent Mild C=CCOc1ccc(Br)c(/C=C2/C(=O)N(c3ccc(C(=O)OC)cc3)N=C2C)c1 ZINC000013914754 JJ Agent Mild CCOC(=O)COc1ccc(/C=C2\C(=O)N(c3cccc(C(F)(F)F)c3)N=C2C)cc1OCC ZINC000013914837 JJ Agent Clean C=CCOc1cc(Br)c(/C=C2\C(=O)N(c3ccc(C(=O)O)cc3)N=C2C)cc1OCC ZINC000013914935 JJ Agent Mild CCOc1cc(/C=C2\C(=O)N(c3ccccc3)N=C2C)cc(I)c1OC ZINC000013914954 JJ Agent Clean CCOc1cc(/C=C2\C(=O)N(c3cccc(C)c3)N=C2C)cc(I)c1OC ZINC000013914962 JJ Agent Clean CCOC(=O)c1ccc(-c2ccc(/C=C3/S/C(=N\c4ccc(C(=O)O)cc4)NC3=O)o2)cc1 ZINC000013915244 JJ Agent Mild COc1cc(/C=C2/C(=O)N(c3cccc(C(=O)O)c3)N=C2C)cc(Br)c1OC(C)C ZINC000013915472 JJ Agent Clean CCOc1cc(/C=C2/C(=O)N(c3ccccc3)N=C2C)ccc1OCC(=O)NCc1ccccc1 ZINC000013915575 JJ Agent Clean CCOc1cc(/C=C(\C#N)C(=O)NCc2ccco2)ccc1OCCOc1c(C)cccc1C ZINC000013940140 JJ Agent Reactive Cc1cccc(C)c1NC(=O)C1(N(Cc2ccccc2)C(=O)CSc2ncn[nH]2)CCCCC1 ZINC000013940395 JJ Agent Anodyne O=C1NN(c2ccccc2)C(=O)/C1=C\c1cc([N+](=O)[O-])ccc1OCCCOc1ccc(Cl)cc1 ZINC000013940420 JJ Agent Clean CCN(CC)C(=O)c1sc(NC(=O)C(F)(F)C(F)(F)C(F)(F)F)c(C(=O)OC(C)C)c1C ZINC000013950623 JJ Agent Mild CCOC(=O)c1c(NC(=O)COC(=O)/C=C/c2csc(C)n2)sc(C)c1-c1ccccc1 ZINC000014019389 JJ Agent Anodyne Cc1nc(/C=C/C(=O)OCC(=O)N(C)Cc2ccc(-c3ccc(Br)cc3)o2)cs1 ZINC000014019793 JJ Agent Anodyne CCOc1cc(/C=C(\CC(=O)O)c2nc3ccccc3s2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000014022778 JJ Agent Anodyne CCOc1cc(/C=C(\CC(=O)O)c2nc3ccccc3s2)ccc1O[C@H](C)C(=O)N(C)C ZINC000014022781 JJ Agent Anodyne CCOc1cc(/C=C2\C(=O)N(c3cccc(C)c3)C(=O)c3ccccc32)ccc1OCC(=O)N(C)C ZINC000014022951 JJ Agent Anodyne COc1ccc(Oc2ccc(/C=C/c3nc4sc(C(=O)O)c(C)c4c(=O)[nH]3)cc2[N+](=O)[O-])cc1 ZINC000014022953 JJ Agent Bother CCCn1c(C)cc(/C=C(\C#N)C(=O)OCC(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)c1C ZINC000014077133 JJ Agent Reactive CC(=O)N(c1ccccc1)c1nc(/C=C/C(=O)N(C)Cc2cnn(Cc3ccccc3)c2)cs1 ZINC000014077792 JJ Agent Anodyne CS(=O)(=O)N1CCC(Nc2nc(/C=C/c3ccccc3)nc3sc4c(c23)CCCC4)CC1 ZINC000014119777 JJ Agent Anodyne O=C1/C(=C\c2ccc(Br)s2)c2ccccc2C(=O)N1Cc1ccc2c(c1)OCO2 ZINC000014123757 JJ Agent Anodyne C[C@]1(C2CC2)NC(=O)N(CC(=O)N2N=C3/C(=C/c4ccccc4)CCC[C@@H]3[C@@H]2c2ccccc2)C1=O ZINC000014128660 JJ Agent Anodyne CN(Cc1nc2ccccc2s1)C(=O)/C=C/c1ccc(S(=O)(=O)N2CCCCCC2)cc1 ZINC000014138992 JJ Agent Anodyne COc1cc(/C=C2/CCn3c2nc2sc(C(=O)O)c(C)c2c3=O)ccc1OCCC(C)C ZINC000014140341 JJ Agent Anodyne CC(C)Oc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)/C=C/c1cccc2cccnc12 ZINC000014168901 JJ Agent Anodyne COc1cccc(Cn2nc(C)c(/C=C/C(=O)N3CCC(C(=O)N4CCCCCC4)CC3)c2Cl)c1 ZINC000014183362 JJ Agent Anodyne COc1ccccc1NC(=O)Cc1noc(COC(=O)/C(=C/c2ccc(F)cc2)c2cccs2)n1 ZINC000014202071 JJ Agent Anodyne COc1cc(/C=C2\C(=O)N(c3ccc(C)cc3)C(=O)c3ccccc32)ccc1OCC(=O)N1CCCC1 ZINC000014202409 JJ Agent Anodyne Cc1nn(Cc2ccccc2Cl)c(C)c1NS(=O)(=O)c1ccc(Br)cc1 ZINC000014223349 JJ Agent Anodyne CC(=O)N[C@@H](CC(=O)N(C/C=C/c1ccccc1)c1ccc2c(c1)OCCO2)c1ccccc1 ZINC000014228294 JJ Agent Anodyne CC(=O)N[C@H](CC(=O)N(C/C=C/c1ccccc1)c1ccc2c(c1)OCCO2)c1ccccc1 ZINC000014228298 JJ Agent Anodyne CC(C)c1ccc(S(=O)(=O)Nc2nn(Cc3ccccc3F)cc2Br)cc1 ZINC000014234158 JJ Agent Anodyne CCCCc1oc2ccccc2c1/C=C/C(=O)N(C)Cc1c(C)nn([C@@H]2CCS(=O)(=O)C2)c1C ZINC000014237667 JJ Agent Anodyne CCCCc1oc2ccccc2c1/C=C/C(=O)N(C)Cc1c(C)nn([C@H]2CCS(=O)(=O)C2)c1C ZINC000014237671 JJ Agent Anodyne COc1ccc(N(C(C)=O)c2nc(/C=C3\N=C(c4ccc(OC(C)C)cc4)OC3=O)cs2)cc1 ZINC000014240823 JJ Agent Anodyne CCOC(=O)/C(=C\c1ccc(Cl)c([N+](=O)[O-])c1)C1=Nn2c(nnc2-c2cccs2)SC1 ZINC000014241341 JJ Agent Bother Cc1cc(/C=C/C(=O)N2CCC(C(=O)N3CCCCCC3)CC2)c(C)n1-c1ccnn1C(C)C ZINC000014246471 JJ Agent Anodyne C/C=C/C=C/C(=O)OCC(=O)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 ZINC000014356717 JJ Agent Anodyne C/C=C/C=C/C(=O)OCC(=O)N(C[C@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 ZINC000014356719 JJ Agent Anodyne CN(C)S(=O)(=O)c1ccc(C(=O)/C=C/c2cn(-c3ccccc3)nc2-c2cccs2)cc1 ZINC000014356986 JJ Agent Mild CCCc1ccc(C(=O)/C(C#N)=C/c2ccc(-c3ccc(S(=O)(=O)N4CCOCC4)cc3)o2)cc1 ZINC000014359109 JJ Agent Reactive O=C(CC12CC3CC(CC(C3)C1)C2)N/N=C/c1ccc(Sc2ncccn2)c([N+](=O)[O-])c1 ZINC000014359504 JJ Agent Reactive C/C(=N/NC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@H]2C)cc1)c1ccc2ccccc2c1O ZINC000014361289 JJ Agent Reactive C/C(=N/NC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1)c1ccc2ccccc2c1O ZINC000014361290 JJ Agent Reactive COc1ccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)OCC(=O)N2CCCC2)cc1OC ZINC000014361334 JJ Agent Anodyne CC1CCN(c2ccc(C(=O)OCC(=O)/C=C3/N(C)c4ccccc4C3(C)C)cc2[N+](=O)[O-])CC1 ZINC000014361483 JJ Agent Mild Cc1nc(COc2ccccc2/C=C/C(=O)N(C)[C@H](C)c2ccc(-n3cncn3)cc2)cs1 ZINC000014526371 JJ Agent Anodyne Cc1nc(COc2ccccc2/C=C/C(=O)N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)cs1 ZINC000014526372 JJ Agent Anodyne O=C(/C=C/c1sc2ccccc2c1Cl)Nc1cccc(S(=O)(=O)/N=C2/CCCN2)c1 ZINC000014808516 JJ Agent Mild O=C(CSc1n[nH]c(/C=C/c2ccc(F)cc2)n1)N1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000014897987 JJ Agent Anodyne CC(=O)Nc1nc2c(Oc3cc(N4CCN([C@@H](C)c5ccc(F)cc5)CC4)ncn3)cccc2s1 ZINC000014974188 JJ Agent Anodyne O=C(O[C@@H]1C[C@@H](OCc2ccccc2)[C@@H](COCc2ccccc2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000014982911 JJ Agent Anodyne O=C1C(=NNc2ccc(Br)cc2)C(=O)N(c2ccccc2)C(=S)N1c1ccccc1 ZINC000001619504 JJ Agent Mild O=[N+]([O-])C(=C(\SCc1ccccc1)N1CCOCC1)/C(Cl)=C(/Cl)Br ZINC000001883420 JJ Agent Anodyne CCOP(=O)(OCC)C(NC(=O)OCC(Cl)(Cl)Cl)P(=O)(OCC)OCC ZINC000015020518 JJ Agent Anodyne C[C@@]1(O)CC(=O)[C@@H](C(=O)Nc2ccccc2)[C@@H](c2ccc(Cl)cc2)[C@@H]1C(=O)Nc1ccccc1 ZINC000015079757 JJ Agent Anodyne C[C@]1(O)CC(=O)[C@@H](C(=O)Nc2ccccc2)[C@@H](c2ccc(Cl)cc2)[C@@H]1C(=O)Nc1ccccc1 ZINC000015079761 JJ Agent Anodyne C[C@@]1(O)CC(=O)[C@H](C(=O)Nc2ccccc2)[C@@H](c2ccc(Cl)cc2)[C@@H]1C(=O)Nc1ccccc1 ZINC000015079764 JJ Agent Anodyne CCCn1c(C)cc(/C=C(\C#N)C(=O)Nc2cc(OCC)c(N3CCOCC3)cc2OCC)c1C ZINC000015081510 JJ Agent Reactive O=C(O)c1cc(-c2ccc(/C=N/Nc3nc4nonc4nc3Nc3ccc(F)cc3)o2)ccc1Cl ZINC000015162345 JJ Agent Mild COc1ccc(N2C(=O)/C(=C\Nc3cc(Cl)ccc3C#N)c3ccccc3C2=O)cc1OC ZINC000015212924 JJ Agent Mild COc1ccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)OCC(=O)NC2CCCC2)cc1OC ZINC000015221560 JJ Agent Anodyne O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2)NC(=O)NCc1ccco1 ZINC000015225698 JJ Agent Anodyne O=C(/C=C/c1ccc(S(=O)(=O)NCc2ccco2)cc1)OCc1cccc(C(F)(F)F)c1 ZINC000015229862 JJ Agent Anodyne O=C1C[C@H](Sc2nc(-c3ccc(Cl)c(Cl)c3)cc(C(F)(F)F)n2)[C@H]2CO[C@@H]1O2 ZINC000015240611 JJ Agent Anodyne COC(=O)C(C(=O)OC)[C@H](c1ccc(Br)cc1)[C@@H](C)C(=O)c1ccc(C)cc1C ZINC000015318963 JJ Agent Anodyne COC(=O)C(C(=O)OC)[C@@H](c1ccc(Br)cc1)[C@@H](C)C(=O)c1ccc(C)cc1C ZINC000015318966 JJ Agent Anodyne COC(=O)C(C(=O)OC)[C@H](c1ccc(Br)cc1)[C@H](C)C(=O)c1ccc(C)cc1C ZINC000015318969 JJ Agent Anodyne COC(=O)C(C(=O)OC)[C@@H](c1ccc(Br)cc1)[C@H](C)C(=O)c1ccc(C)cc1C ZINC000015318972 JJ Agent Anodyne CCOC(=O)c1c(-c2cccs2)csc1NC(=O)c1ccc(S(=O)(=O)N2CCCC2)cc1 ZINC000015323012 JJ Agent Anodyne O=C(CSc1nccc(=O)[nH]1)N1N=C2/C(=C/c3ccccc3)CCC[C@@H]2[C@@H]1c1ccccc1 ZINC000015379242 JJ Agent Anodyne O=C(CSc1nccc(=O)[nH]1)N1N=C2/C(=C/c3ccccc3)CCC[C@@H]2[C@H]1c1ccccc1 ZINC000015379246 JJ Agent Anodyne CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)CCC(=O)c1ccc(Cl)cc1 ZINC000015540420 JJ Agent Anodyne Cc1ccc(-c2csc(/C=C3\SCC(=O)N3CC(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1 ZINC000015587251 JJ Agent Bother CCCCOc1ccc(/C=C/C(=O)c2ccc(OC)c(CSc3nnnn3C)c2)cc1OC ZINC000015590102 JJ Agent Mild CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)CCC(=O)c1ccc2c(c1)CCCC2 ZINC000015598481 JJ Agent Anodyne CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)CCC(=O)c1ccc(C)c(C)c1 ZINC000015604093 JJ Agent Anodyne CN(C)c1ccc(CN2Cc3nc[nH]c3C[C@H]2c2nc(-c3ccc(F)c(Cl)c3)no2)cc1 ZINC000015707267 JJ Agent Clean C[C@H](C(=O)NC1CC1)[C@@H]1CC[C@@]2(C)Cc3sc(Nc4ccc(F)cc4)nc3[C@@H](C)[C@@H]2[C@H]1O ZINC000015708987 JJ Agent Anodyne C[C@@H]1c2nc(Nc3ccc(F)cc3)sc2C[C@]2(C)CC[C@H]([C@H](C)C(=O)NC3CC3)[C@H](O)[C@@H]12 ZINC000015708990 JJ Agent Anodyne O=S(=O)(/N=C(/N=C(\S)Nc1nc(-c2ccccc2)cs1)c1ccccc1)c1ccccc1 ZINC000015906413 JJ Agent Mild COc1cc(/C=C(\C#N)c2nnc3n2CCCCC3)ccc1OC(=O)c1ccc2ccccc2n1 ZINC000015906414 JJ Agent Reactive O=[N+]([O-])c1ccc(/C=C2\CCC(/C=N/N=C/c3c(Cl)nc4sccn34)=C2N2CCOCC2)cc1 ZINC000015906517 JJ Agent Anodyne O=C1/C(=C/Nc2cc(N3CCOCC3)ccc2Cl)c2ccccc2C(=O)N1c1ccc(Cl)cn1 ZINC000015911230 JJ Agent Anodyne CCOc1ccccc1N/C(S)=C(/C(=O)c1ccc2c(c1)OCCO2)n1c[n+](C)c2ccccc21 ZINC000015912086 JJ Agent Mild CCCOc1c(I)cc(C=NNc2cccc(C(=O)O)c2)cc1OCC ZINC000015930873 JJ Agent Anodyne COc1cc(C=NNc2cccc(C(=O)O)c2)cc(Br)c1OCC(=O)Nc1ccccc1 ZINC000015931138 JJ Agent Anodyne COc1ccc(/C=C2\CCC[C@@H]3C2=NN(C(=O)CSc2ncn[nH]2)[C@@H]3c2ccc(OC)cc2)cc1 ZINC000015973821 JJ Agent Anodyne COc1ccc(/C=C2\CCC[C@@H]3C2=NN(C(=O)CSc2ncn[nH]2)[C@H]3c2ccc(OC)cc2)cc1 ZINC000015973823 JJ Agent Anodyne O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)NN=C1CCCc2ccccc21 ZINC000015980709 JJ Agent Anodyne COc1ccc(N2C(=O)/C(=C\c3cccs3)N=C2SCC(=O)NCC(F)(F)F)cc1Cl ZINC000015981322 JJ Agent Anodyne C=C(C)C/N=c1\scc(-c2ccc(OC(F)F)cc2)n1/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000016035642 JJ Agent Mild Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C/C(=O)OCC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000016043912 JJ Agent Bother Cc1ccc(Cn2nc(C)c(/C=C/C(=O)OCC(=O)NCC34CC5CC(CC(C5)C3)C4)c2C)cc1 ZINC000016044309 JJ Agent Anodyne Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C/C(=O)OCC(=O)NCC12CC3CC(CC(C3)C1)C2 ZINC000016044468 JJ Agent Anodyne O=C(CN1C(C(=O)c2ccccc2)=C(N2CCCCC2)c2ccccc2S1(=O)=O)c1ccccc1 ZINC000002476750 JJ Agent Mild C#CCOc1ccc(Br)cc1/C=N/NC(=O)COc1ccc(-c2ccccc2)cc1 ZINC000020156979 JJ Agent Reactive COc1ccc(/C(C)=N/Nc2nc(SCC(=O)NC(c3ccccc3)c3ccccc3)n[nH]2)cc1 ZINC000020159850 JJ Agent Mild C=CCc1ccccc1OCC(=O)N/N=C/c1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000020161210 JJ Agent Reactive C=CCn1c(Cn2nnc3ccccc32)nnc1SCCC(=O)Nc1cc(Cl)ccc1Cl ZINC000020161288 JJ Agent Mild CCOCSc1nnc(NC(=O)CSc2nnc(-c3ccccc3)n2-c2ccccc2)s1 ZINC000020169227 JJ Agent Anodyne CCOC(=O)/C(C#N)=C/c1cc(Br)c(OCc2ccc([N+](=O)[O-])cc2)c(OCC)c1 ZINC000020175693 JJ Agent Reactive CCOc1cc(/C=C(\C#N)C(=O)NCc2ccc(F)cc2)ccc1OC(=O)C1CCCCC1 ZINC000020175836 JJ Agent Reactive CCOc1cc(/C=C(/C#N)C(=O)Nc2ccc3c(c2)OCCO3)ccc1OC(=O)c1cccs1 ZINC000020175882 JJ Agent Reactive CCOc1cc(/C=N/OC(=O)COc2ccc([N+](=O)[O-])cc2)ccc1OCc1ccccc1C ZINC000020176030 JJ Agent Mild CCOc1ccc(N2C(=O)/C(=C/c3ccc(OC)c(OC)c3)C(=O)N(c3ccccc3)C2=S)cc1 ZINC000020176485 JJ Agent Clean CCOc1ccc(Br)cc1/C=N/NC(=O)[C@@H](C)Oc1ccccc1Br ZINC000020177050 JJ Agent Reactive CCOc1ccc(Br)cc1/C=N/NC(=O)[C@H](C)Oc1ccccc1Br ZINC000020177053 JJ Agent Reactive Cc1cccc(Cl)c1COc1ccc(/C=N/NC(=O)CSc2nc3ccccc3n2C)o1 ZINC000020291631 JJ Agent Reactive C=CCOc1ccc(Br)cc1/C=N/NC(=O)[C@@H](C)Oc1ccc(Br)cc1 ZINC000020311292 JJ Agent Reactive C=CCOc1ccc(Br)cc1/C=N/NC(=O)[C@H](C)Oc1ccc(Br)cc1 ZINC000020311296 JJ Agent Reactive C=CCOc1ccc(Br)cc1/C=N/NC(=O)[C@@H](C)Oc1ccccc1Br ZINC000020311320 JJ Agent Reactive C=CCOc1ccc(Br)cc1/C=N/NC(=O)[C@H](C)Oc1ccccc1Br ZINC000020311325 JJ Agent Reactive C[C@@H](Oc1ccc(Br)cc1)C(=O)N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000020311468 JJ Agent Reactive C[C@H](Oc1ccc(Br)cc1)C(=O)N/N=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000020311474 JJ Agent Reactive C[C@@H](Oc1cccc(Br)c1)C(=O)O/N=C(\N)c1ccc(OCc2ccccc2F)cc1 ZINC000020312437 JJ Agent Mild C[C@H](Oc1cccc(Br)c1)C(=O)O/N=C(\N)c1ccc(OCc2ccccc2F)cc1 ZINC000020312443 JJ Agent Mild COC(=O)c1sc2nc(-c3ccccc3)nc(N3CCN(c4ccc(F)cc4)CC3)c2c1C ZINC000020343700 JJ Agent Anodyne COc1ccc(/C=N/N(C)S(=O)(=O)c2ccc(C)cc2)cc1CN1CCCc2ccccc21 ZINC000020368017 JJ Agent Mild Cc1ccc(-c2ccc(/C=C3\SC(=S)N(NC(=O)c4ccccc4)C3=O)o2)cc1[N+](=O)[O-] ZINC000020407209 JJ Agent Clean Cc1cccc(NC(=O)CSc2nnc3c4cc(Br)ccc4n(C)c3n2)c1C ZINC000020417827 JJ Agent Anodyne CC(=O)C1=C(C)NC(SCCCN2C(=O)c3ccccc3C2=O)=C(C#N)[C@@H]1c1sccc1C ZINC000020426875 JJ Agent Reactive CC(=O)C1=C(C)NC(SCCCN2C(=O)c3ccccc3C2=O)=C(C#N)[C@H]1c1sccc1C ZINC000020426879 JJ Agent Reactive N/C(=N\OC(=O)COc1cccc(Cl)c1Cl)c1ccc(OCc2ccc(F)cc2)cc1 ZINC000020429023 JJ Agent Mild O=C(CSc1n[nH]c(N/N=C/c2cccc(Br)c2)n1)c1ccc(Br)cc1 ZINC000020436770 JJ Agent Mild Fc1cccc(Cl)c1/C=N/n1cnn2c(SCc3cccc(C(F)(F)F)c3)nnc12 ZINC000020437068 JJ Agent Mild O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N/N=C/c1ccc(Br)cc1 ZINC000020457346 JJ Agent Reactive O=C(Nc1cc2c(c(C(=O)c3ccc(Br)cc3)c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000020457490 JJ Agent Bother O=C(COc1ccc(Br)cc1)NNC(=O)OCCCc1ccc(Cl)cc1Cl ZINC000020478687 JJ Agent Reactive O=C(N/N=C/c1cc2c(cc1Br)OCO2)c1ccc(COc2ccc3c(c2)CCC3)o1 ZINC000020494160 JJ Agent Reactive O=C(/C=C/c1ccccc1)NC(=S)Nc1ccc(C(=O)OC[C@@H]2CCCN3CCCC[C@H]23)cc1 ZINC000020508571 JJ Agent Anodyne O=C(Cn1cc(/C=C2/N=C(S)N(c3ccccc3)C2=O)c2ccccc21)NCc1ccccc1 ZINC000020522651 JJ Agent Anodyne N#C/C(=C\c1cn(Cc2ccc(Cl)cc2)nc1-c1ccccc1)C(=O)NCc1cccnc1 ZINC000020530196 JJ Agent Reactive COc1ccc(OC)c(/C=N/NC(=O)[C@@H]2[C@@H](C=C(Cl)Cl)C2(C)C)c1Br ZINC000020551645 JJ Agent Reactive COc1ccc(OC)c(/C=N/NC(=O)[C@H]2[C@@H](C=C(Cl)Cl)C2(C)C)c1Br ZINC000020551647 JJ Agent Reactive COc1ccc(OC)c(/C=N/NC(=O)[C@@H]2[C@H](C=C(Cl)Cl)C2(C)C)c1Br ZINC000020551648 JJ Agent Reactive COc1ccc(OC)c(/C=N/NC(=O)[C@H]2[C@H](C=C(Cl)Cl)C2(C)C)c1Br ZINC000020551650 JJ Agent Reactive CC[C@@H](Oc1ccc2ccccc2c1Br)C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1O ZINC000020572869 JJ Agent Reactive CC[C@H](Oc1ccc2ccccc2c1Br)C(=O)N/N=C/c1cc([N+](=O)[O-])ccc1O ZINC000020572872 JJ Agent Reactive CCC[C@@H]1C(C#N)=C(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Br)NC(C)=C1C(C)=O ZINC000020581919 JJ Agent Reactive CCC[C@H]1C(C#N)=C(SCC(=O)Nc2ccc([N+](=O)[O-])cc2Br)NC(C)=C1C(C)=O ZINC000020581922 JJ Agent Reactive CCCOP(=O)(OCCC)C(NS(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F ZINC000020595435 JJ Agent Anodyne CCCOc1ccc(/C=N/NC(=O)[C@@H](C)Oc2ccc(Br)cc2)c(OCCC)c1 ZINC000020595451 JJ Agent Reactive CCCOc1ccc(/C=N/NC(=O)[C@H](C)Oc2ccc(Br)cc2)c(OCCC)c1 ZINC000020595453 JJ Agent Reactive CCCc1cc(=O)[nH]c(SCc2ccc(-c3nc(-c4cc(OC)c(OC)c(OC)c4)no3)cc2)n1 ZINC000020595828 JJ Agent Anodyne Cc1c(-n2c(-c3ccccc3)cs/c2=N\N=Cc2ccc(O)cc2)c(=O)n(-c2ccccc2)n1C ZINC000245264273 JJ Agent Mild CCN(CC)c1ccc(/C=C2/CCC(C=NNC(=O)NC3CCCCC3)=C2N2CCOCC2)cc1 ZINC000245264370 JJ Agent Reactive O=C1N/C(=N\N=Cc2cccc(Br)c2)S[C@H]1Cc1ccc(SC(F)F)cc1 ZINC000245267513 JJ Agent Mild O=C1N/C(=N\N=Cc2cccc(Br)c2)S[C@@H]1Cc1ccc(SC(F)F)cc1 ZINC000245267515 JJ Agent Mild O=C1N/C(=N\N=Cc2ccc(Br)cc2)S[C@H]1Cc1ccc(SC(F)F)cc1 ZINC000245284380 JJ Agent Mild O=C1N/C(=N\N=Cc2ccc(Br)cc2)S[C@@H]1Cc1ccc(SC(F)F)cc1 ZINC000245284381 JJ Agent Mild Cc1nc2c(C(=O)N[C@@H]3C[C@@H](C)CC(C)(C)C3)nc(-c3ccccc3)cc2n1[C@H]1CCS(=O)(=O)C1 ZINC000247958770 JJ Agent Anodyne CO[C@@H]1O[C@@H]2CO[C@H](c3ccccc3)O[C@H]2[C@@H](OCc2ccccc2)[C@@H]1OCc1ccccc1 ZINC000002540623 JJ Agent Anodyne O=C1C(Br)=CC([N+](=O)[O-])=C/C1=C\N(O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000002557750 JJ Agent Mild CCOC(=O)[C@@](NC(=O)c1ccccc1Cl)(C(F)(F)F)P(=O)(OC(C)C)OC(C)C ZINC000002569223 JJ Agent Anodyne CCOC(=O)CNC(=NOC(=O)Nc1cc(Cl)nc(Cl)c1)c1c(Cl)cccc1Cl ZINC000002581902 JJ Agent Mild CC(=O)c1ccccc1NC(=O)CN1C(=O)CS/C1=C/c1nc(-c2ccc(C)cc2)cs1 ZINC000002618830 JJ Agent Anodyne CC(=O)c1ccccc1NC(=O)CN1C(=O)CS/C1=C\c1nc(-c2ccc(C)cc2)cs1 ZINC000002618831 JJ Agent Anodyne CCc1ccc(NC(=O)CSCc2nnc3n(CCC(C)C)c(=O)c4ccccc4n23)cc1 ZINC000002626352 JJ Agent Anodyne Cc1nn(C)c2nc(-c3cc(F)c(Cl)cc3Cl)cc(C(=O)N/N=C3\CCCCCN3)c12 ZINC000002626457 JJ Agent Reactive COc1cc2c(cc1NC(=O)[C@H](C)OC(=O)/C=C/c1ccc3c(c1)OCO3)oc1ccccc12 ZINC000002635128 JJ Agent Anodyne COc1cc2c(cc1NC(=O)[C@@H](C)OC(=O)/C=C/c1ccc3c(c1)OCO3)oc1ccccc12 ZINC000002635130 JJ Agent Anodyne Cc1cc(C(=O)COC(=O)/C=C/c2ccc(Br)o2)c(C)n1-c1ccc2c(c1)OCCO2 ZINC000002635877 JJ Agent Clean CSc1ccccc1NC(=O)CSc1nnc2n(-c3ccccc3C)c(=O)c3ccccc3n12 ZINC000002640880 JJ Agent Anodyne CC[C@@H](C)c1ccc(-n2c(=O)c3ccccc3n3c(SCC(=O)OC(C)(C)C)nnc23)cc1 ZINC000002643390 JJ Agent Anodyne CC[C@H](C)c1ccc(-n2c(=O)c3ccccc3n3c(SCC(=O)OC(C)(C)C)nnc23)cc1 ZINC000002643391 JJ Agent Anodyne C=CCn1c(=O)c2ccccc2n2c(SCC(=O)c3cc(C)n(-c4ccccc4)c3C)nnc12 ZINC000002645249 JJ Agent Mild Cc1cc(C)c(-c2csc(NC(=O)COC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)n2)c(C)c1 ZINC000002645887 JJ Agent Bother O=C(OCCOc1ccc(Br)cc1)c1ccccc1N/C=C/C(=O)C(F)(F)F ZINC000002647192 JJ Agent Mild Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)OCC(=O)NC(c1ccccc1)c1ccccc1 ZINC000002650442 JJ Agent Anodyne Cc1nn(Cc2ccccc2)c(Cl)c1/C=C/C(=O)OCC(=O)Nc1c(F)c(F)c(F)c(F)c1F ZINC000002650961 JJ Agent Anodyne COc1cccc(-n2c(=O)c3ccccc3n3c(SCc4cc(C(C)=O)ccc4OC)nnc23)c1 ZINC000002651175 JJ Agent Anodyne CCN(CC)S(=O)(=O)c1ccc(/C=C/C(=O)Nc2nnc(SCc3ccccc3)s2)cc1 ZINC000002657461 JJ Agent Anodyne CN(Cc1ccccc1)C(=O)CN1C(=O)CS/C1=C/c1nc(-c2ccc(Cl)cc2)cs1 ZINC000002659129 JJ Agent Anodyne Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)OCC(=O)c1cc(C)n(Cc2ccco2)c1C ZINC000002663670 JJ Agent Anodyne Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)O[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000002664100 JJ Agent Bother Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)O[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000002664102 JJ Agent Bother Cc1cc(C(=O)COC(=O)/C=C/c2cnc3ccccc3n2)c(C)n1CCc1ccc(F)cc1 ZINC000002664149 JJ Agent Anodyne O=C(CN1C(=O)CS/C1=C/c1nc(-c2ccc(F)cc2)cs1)NCCc1ccc(Cl)cc1 ZINC000002726106 JJ Agent Anodyne CCOc1cc(/C=C2\N=C(c3cccs3)OC2=O)cc(I)c1OC(C)C ZINC000002752585 JJ Agent Anodyne CCOc1cc(/C=C2\N=C(S)N(c3ccccc3OCC)C2=O)c(Br)cc1O ZINC000002779577 JJ Agent Anodyne NC(=O)COc1ccc(/C=C2/Sc3nnc(C(F)F)n3N=C2c2ccc(Cl)cc2Cl)cc1 ZINC000002782038 JJ Agent Anodyne Cc1nn(C)cc1/C=C1\N=C(SCC(=O)Nc2cccc3ccccc23)N(c2ccccc2)C1=O ZINC000002785757 JJ Agent Anodyne Cn1cc(/C=C2\N=C(SCC(=O)Nc3cccc4ccccc34)N(c3ccccc3)C2=O)cn1 ZINC000002785777 JJ Agent Anodyne Cn1cc(/C=C2\N=C(SCC(=O)Nc3ccc(Cl)cc3Cl)N(c3ccccc3)C2=O)cn1 ZINC000002786029 JJ Agent Anodyne Cc1nn(C)cc1/C=C1\N=C(SCC(=O)Nc2ccc(Cl)cc2Cl)N(CC(C)C)C1=O ZINC000002786074 JJ Agent Anodyne CC(C)(C)c1cc(C(F)(F)F)nc(SCCCNC(=O)/C=C/c2ccc([N+](=O)[O-])o2)n1 ZINC000002795086 JJ Agent Bother CCOc1cc2c(O)nc3c(C(=O)NCCc4ccccc4)sc(=S)n3c2cc1OCC ZINC000002957509 JJ Agent Anodyne CC(C)NC(=O)c1sc(=S)n2c1nc(O)c1ccc(C(=O)N[C@@H](C)c3ccccc3)cc12 ZINC000002957533 JJ Agent Anodyne CC(C)NC(=O)c1sc(=S)n2c1nc(O)c1ccc(C(=O)N[C@H](C)c3ccccc3)cc12 ZINC000002957534 JJ Agent Anodyne CC(C)NC(=O)c1sc(=S)n2c1nc(O)c1ccc(C(=O)N[C@@H]3CCC[C@H](C)[C@@H]3C)cc12 ZINC000002957536 JJ Agent Anodyne O=C(NCCC1=CCCCC1)C1CCN(Cc2cnn(-c3ccccc3)c2-n2cccc2)CC1 ZINC000002960473 JJ Agent Anodyne C[C@]1(C2CC2)NC(=O)N(CC(=O)N2N=C3/C(=C/c4ccccc4)CCC[C@@H]3[C@H]2c2ccccc2)C1=O ZINC000252445377 JJ Agent Anodyne CN1/C(=C/C=NNC(=O)c2ccccc2NS(=O)(=O)c2cccs2)C(C)(C)c2ccccc21 ZINC000252511678 JJ Agent Reactive CCN(CC)c1ccc(/C=C2/CCC(C=NNc3nc(C)cc(C)n3)=C2N2CCOCC2)cc1 ZINC000252512006 JJ Agent Mild CN1/C(=C/C=NNC(=O)c2ccc(NS(=O)(=O)c3cccs3)cc2)C(C)(C)c2ccccc21 ZINC000252513350 JJ Agent Reactive COc1ccc(/C=C/C(=O)N=C2N=C3C=CC(Br)=CN3Cc3ccccc32)cc1OC ZINC000252581835 JJ Agent Mild O=C(OCC(=O)N1N=C2/C(=C\c3ccco3)CCC[C@@H]2[C@H]1c1ccco1)c1cc(=O)c2ccccc2o1 ZINC000253392117 JJ Agent Anodyne COc1ccc(/C=C2/CCC[C@@H]3C2=NN(C(=O)CSc2nnc[nH]2)[C@H]3c2ccc(OC)cc2)cc1 ZINC000253392131 JJ Agent Anodyne O=C(CSc1nnnn1-c1ccccc1)N1N=C2/C(=C\c3ccco3)CCC[C@@H]2[C@H]1c1ccco1 ZINC000253392262 JJ Agent Anodyne CC(=O)Nc1ccc(C(=O)OCC(=O)N2N=C3/C(=C\c4ccco4)CCC[C@@H]3[C@H]2c2ccco2)cc1 ZINC000253392315 JJ Agent Anodyne Cn1cnnc1SCC(=O)N1N=C2/C(=C\c3cccs3)CCC[C@@H]2[C@H]1c1cccs1 ZINC000253392412 JJ Agent Anodyne C[C@]1(C2CC2)NC(=O)N(CC(=O)N2N=C3/C(=C\c4ccccc4)CCC[C@@H]3[C@H]2c2ccccc2)C1=O ZINC000253395146 JJ Agent Anodyne Cc1ccc(-c2nnn(CC(=O)N3N=C4/C(=C\c5ccco5)CCC[C@@H]4[C@H]3c3ccco3)n2)cc1 ZINC000253395189 JJ Agent Anodyne C=CCn1c(C)nnc1SCC(=O)N1N=C2/C(=C\c3ccco3)CCC[C@@H]2[C@H]1c1ccco1 ZINC000253397675 JJ Agent Mild Cc1ccc(OCC(=O)N2N=C3/C(=C\c4ccco4)CCC[C@@H]3[C@H]2c2ccco2)c([N+](=O)[O-])n1 ZINC000253398546 JJ Agent Bother CN(c1ccc(OC(=O)c2cccc(F)c2)cc1)S(=O)(=O)c1ccc(Br)cc1 ZINC000253426444 JJ Agent Anodyne Cn1c(SCC(=O)N2N=C3/C(=C\c4ccco4)CCC[C@@H]3[C@H]2c2ccco2)nnc1C(F)(F)F ZINC000253630058 JJ Agent Anodyne CC(C)(C)c1cc(Br)c(O)c(N=Nc2ccc(S(=O)(=O)N3CCOCC3)cc2)c1 ZINC000254010585 JJ Agent Clean Cc1ccc(S(=O)(=O)N(C)C)cc1N=c1scc(-c2ccccc2)n1N=Cc1cccc(O)c1 ZINC000254287605 JJ Agent Mild CC(C)Oc1ccccc1C=NOCC(=O)Nc1ccc(Br)cc1Br ZINC000254288095 JJ Agent Anodyne CN(C)C=Nc1nc2ccccc2nc1N1CCN(C(c2ccccc2)c2ccccc2)CC1 ZINC000254288377 JJ Agent Mild Cc1c(C=Nc2cccc(S(=O)(=O)N(C)C)c2)c2ccccn2c1C(=O)c1ccc(F)cc1 ZINC000254289028 JJ Agent Mild Cc1ccc(NC(=S)NN=Cc2sc(N3CCOCC3)nc2-c2ccccc2)cc1C ZINC000254289893 JJ Agent Mild O=C(NN=Cc1ccc(Cl)cc1Cl)c1nc[nH]c1C(=O)NN=Cc1ccc(Cl)cc1Cl ZINC000254289968 JJ Agent Anodyne Cc1ccc(OCC(=O)NN=Cc2ccc(-c3ccc(I)cc3)o2)cc1C ZINC000254290321 JJ Agent Anodyne Cc1ccc(N=c2scc(-c3ccc4c(c3)NC(=O)CO4)n2C[C@@H]2CCCO2)cc1Cl ZINC000254290535 JJ Agent Anodyne Cc1ccc(N=c2scc(-c3ccc4c(c3)NC(=O)CO4)n2C[C@H]2CCCO2)cc1Cl ZINC000254290541 JJ Agent Anodyne CC(=NNC(=O)c1cc2c(s1)CCCCC2)c1cccc(NS(=O)(=O)c2ccccc2)c1 ZINC000254290732 JJ Agent Reactive C/C(C=NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1)=C/c1ccccc1 ZINC000254290802 JJ Agent Reactive C/C(C=NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1)=C\c1ccccc1 ZINC000254290807 JJ Agent Reactive CN=c1scc(-c2ccc(Cl)cc2Cl)n1N=Cc1cc(OC)c(OC)cc1OC ZINC000254290834 JJ Agent Anodyne CCCN1C(=O)[C@H](CC(=O)Nc2cc(OC)ccc2OC)SC1=Nc1cc(C)cc(C)c1 ZINC000254291410 JJ Agent Anodyne CCCN1C(=O)[C@@H](CC(=O)Nc2cc(OC)ccc2OC)SC1=Nc1cc(C)cc(C)c1 ZINC000254291415 JJ Agent Anodyne O=C(C[C@H]1S/C(=N/N=Cc2ccc(OCc3ccc(Cl)cc3)cc2)NC1=O)Nc1ccccc1 ZINC000254293148 JJ Agent Anodyne O=C(C[C@@H]1S/C(=N/N=Cc2ccc(OCc3ccc(Cl)cc3)cc2)NC1=O)Nc1ccccc1 ZINC000254293155 JJ Agent Anodyne COCCCN1C(=O)[C@@H](CC(=O)Nc2ccc3ccccc3c2)SC1=Nc1cccc(OC)c1 ZINC000254294241 JJ Agent Anodyne COCCCN1C(=O)[C@H](CC(=O)Nc2ccc3ccccc3c2)SC1=Nc1cccc(OC)c1 ZINC000254294248 JJ Agent Anodyne C[C@@]1(c2ccc(OC(F)F)cc2)NC(=O)N(N=Cc2sc(Nc3ccccc3)nc2Cl)C1=O ZINC000254294621 JJ Agent Anodyne C[C@]1(c2ccc(OC(F)F)cc2)NC(=O)N(N=Cc2sc(Nc3ccccc3)nc2Cl)C1=O ZINC000254294626 JJ Agent Anodyne CCCNC(=O)c1c(N=Cc2ccc(COc3ccc(Br)cc3Cl)o2)cnn1C ZINC000254296112 JJ Agent Anodyne O=C(NN=C1C(=O)N(CN(Cc2ccccc2)Cc2ccccc2)c2ccccc21)c1cccs1 ZINC000254301225 JJ Agent Reactive COc1cc(C=Nn2c(C)nnc2-n2nc(C)cc2C)cc(Br)c1OCc1ccccc1 ZINC000254302356 JJ Agent Anodyne CCOc1cccc(NC(=O)[C@@H]2CC(=O)N(C)C(=Nc3ccc(OC(F)(F)Cl)cc3)S2)c1 ZINC000254303172 JJ Agent Anodyne CCOc1cccc(NC(=O)[C@H]2CC(=O)N(C)C(=Nc3ccc(OC(F)(F)Cl)cc3)S2)c1 ZINC000254303173 JJ Agent Anodyne C=CCOc1c(Br)cc(Br)cc1C=c1sc2nc3ccccc3n2c1=O ZINC000254303753 JJ Agent Anodyne COc1cc(C=NNC(=O)c2cc3c(s2)CCCC3)ccc1OCC(=O)Nc1ccc(C)cc1 ZINC000254306720 JJ Agent Reactive Cc1ccccc1N=C1SCCCN1C(=O)c1nn(-c2ccccc2)c(=O)c2ccccc12 ZINC000254307122 JJ Agent Mild NC(=O)c1cc(-c2csc(=Nc3ccc(Cl)cc3Cl)n2C[C@@H]2CCCO2)ccc1O ZINC000254309001 JJ Agent Anodyne NC(=O)c1cc(-c2csc(=Nc3ccc(Cl)cc3Cl)n2C[C@H]2CCCO2)ccc1O ZINC000254309008 JJ Agent Anodyne Cc1cc(C(=O)NN=Cc2cn(-c3ccccc3)nc2-c2cc3ccccc3oc2=O)c(C)o1 ZINC000254309758 JJ Agent Reactive Cc1cc(Br)c(NCC(=O)NN=C/C=C\c2ccccc2)c(Br)c1 ZINC000254313344 JJ Agent Anodyne Cc1cc(Br)c(NCC(=O)NN=C/C=C/c2ccccc2)c(Br)c1 ZINC000254313346 JJ Agent Anodyne COCCN1C(=O)[C@H](CC(=O)Nc2cccc(Cl)c2Cl)SC1=Nc1ccccc1 ZINC000254314029 JJ Agent Anodyne COCCN1C(=O)[C@@H](CC(=O)Nc2cccc(Cl)c2Cl)SC1=Nc1ccccc1 ZINC000254314031 JJ Agent Anodyne Cc1cc(C)c(O)c(N=Cc2cc(I)cc(I)c2O)c1 ZINC000254317277 JJ Agent Anodyne CC(Cn1nc(C)c(Cl)c1C)=NNC(=O)c1cc(-c2ccc(Cl)cc2)nc2c1c(C)nn2C ZINC000254319695 JJ Agent Anodyne O=C(C=NOCC(=O)NN(c1ccccc1)c1ccccc1)Nc1cccc(C(F)(F)F)c1 ZINC000254340573 JJ Agent Reactive CC1(C)[C@H]2CC[C@]1(C)C(=NNS(=O)(=O)c1cc(Br)ccc1Br)C2 ZINC000254340631 JJ Agent Anodyne Cn1cc(N=Cc2cn(-c3ccccc3)nc2-c2ccccc2)c(C(=O)NCc2ccco2)n1 ZINC000254340776 JJ Agent Mild Cc1cccc(N=C2S[C@H](CC(=O)Nc3ccccc3F)C(=O)N2CC(C)(C)CN(C)C)c1C ZINC000254341157 JJ Agent Anodyne Cc1cccc(N=C2S[C@@H](CC(=O)Nc3ccccc3F)C(=O)N2CC(C)(C)CN(C)C)c1C ZINC000254341165 JJ Agent Anodyne CC(=NNC(=O)COc1ccc(Cl)c(C)c1)c1ccc(NC(=O)c2ccccc2F)cc1 ZINC000254342070 JJ Agent Anodyne COc1ccc(N=C2S[C@@H](CC(=O)Nc3ccccc3F)C(=O)N2Cc2ccco2)cc1 ZINC000254342432 JJ Agent Mild COc1ccc(N=C2S[C@H](CC(=O)Nc3ccccc3F)C(=O)N2Cc2ccco2)cc1 ZINC000254342437 JJ Agent Mild Cc1cc(C)cc(N=C2S[C@H](CC(=O)Nc3ccc(F)cc3F)C(=O)N2C[C@@H]2CCCO2)c1 ZINC000254346215 JJ Agent Anodyne Cc1cc(C)cc(N=C2S[C@@H](CC(=O)Nc3ccc(F)cc3F)C(=O)N2C[C@H]2CCCO2)c1 ZINC000254346220 JJ Agent Anodyne Cc1cc(C)cc(N=C2S[C@@H](CC(=O)Nc3ccc(F)cc3F)C(=O)N2C[C@@H]2CCCO2)c1 ZINC000254346223 JJ Agent Anodyne Cc1cc(C)cc(N=C2S[C@H](CC(=O)Nc3ccc(F)cc3F)C(=O)N2C[C@H]2CCCO2)c1 ZINC000254346226 JJ Agent Anodyne O=C(NN=CC1=C(N2CCOCC2)/C(=C/c2ccccc2)CC1)c1ccc(Br)cc1 ZINC000254347805 JJ Agent Anodyne O=C(NN=CC1=C(N2CCOCC2)/C(=C\c2ccccc2)CC1)c1ccc(Br)cc1 ZINC000254347808 JJ Agent Anodyne Cc1nn(Cc2c(Cl)cccc2Cl)c(SCC(=O)O)c1C=NNC(=O)c1cccs1 ZINC000254348671 JJ Agent Anodyne COCCN=c1scc(-c2ccc(Cl)cc2Cl)n1N=Cc1ccc2c(c1)OCCO2 ZINC000254348996 JJ Agent Anodyne CCN1C(=O)C[C@H](C(=O)Nc2ccc(OC(F)(F)Cl)cc2)SC1=Nc1ccc(OC)cc1 ZINC000254349263 JJ Agent Anodyne O=C(C[C@@H]1SC(=Nc2ccc(F)cc2)N(C2CC2)C1=O)Nc1ccc(Br)cc1 ZINC000254352227 JJ Agent Anodyne O=C(C[C@H]1SC(=Nc2ccc(F)cc2)N(C2CC2)C1=O)Nc1ccc(Br)cc1 ZINC000254352233 JJ Agent Anodyne CCC(=NNC(=O)c1ccc(NS(=O)(=O)c2cccs2)cc1)c1ccc(OC(F)F)cc1 ZINC000254352698 JJ Agent Reactive CCOCCCN1C(=O)[C@@H](CC(=O)Nc2ccc(C(C)=O)cc2)SC1=Nc1ccc(CC)cc1 ZINC000254372257 JJ Agent Anodyne CCOCCCN1C(=O)[C@H](CC(=O)Nc2ccc(C(C)=O)cc2)SC1=Nc1ccc(CC)cc1 ZINC000254372258 JJ Agent Anodyne C[C@H]1CCCCC1=NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1 ZINC000254372600 JJ Agent Anodyne C[C@@H]1CCCCC1=NNC(=O)c1ccc(NS(=O)(=O)c2ccc(Br)cc2)cc1 ZINC000254372601 JJ Agent Anodyne CCN1C(=O)C[C@@H](C(=O)Nc2cccc(C)c2)SC1=Nc1ccc(I)cc1 ZINC000254375625 JJ Agent Anodyne CCN1C(=O)C[C@H](C(=O)Nc2cccc(C)c2)SC1=Nc1ccc(I)cc1 ZINC000254375626 JJ Agent Anodyne O=C(C[C@@H]1SC(=Nc2ccccc2)N(Cc2ccccn2)C1=O)Nc1cccc(Cl)c1 ZINC000254378138 JJ Agent Mild aggregator O=C(C[C@H]1SC(=Nc2ccccc2)N(Cc2ccccn2)C1=O)Nc1cccc(Cl)c1 ZINC000254378139 JJ Agent Mild aggregator COc1ccc(C=NNc2nc(-c3ccc4c(c3)OCCO4)cs2)cc1Cn1cc(Cl)cn1 ZINC000254381414 JJ Agent Anodyne Cc1nn(-c2ccccn2)c2nc(-c3ccncc3)cc(C(=O)NN=Cc3cccc(Cl)c3)c12 ZINC000254382656 JJ Agent Anodyne COc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)c2c[nH]c3ccccc23)cc1OC ZINC000254382677 JJ Agent Reactive CCn1nc(C(=O)NN=C(C)c2ccc3c(c2)Nc2ccccc2S3)c2ccccc2c1=O ZINC000254384008 JJ Agent Reactive CSc1cccc(NC(=O)CON=C(C)c2cnn(-c3ccc(C(F)(F)F)cn3)c2C)c1 ZINC000254384375 JJ Agent Mild CC(=NNS(=O)(=O)c1ccc(Br)cc1)c1ccc2ccccc2c1OC(F)F ZINC000254384941 JJ Agent Anodyne COc1cc(C=NOCC(=O)NC2CCCCCC2)ccc1OCC(=O)Nc1c(C)cc(C)cc1C ZINC000254385105 JJ Agent Mild CC(C)c1ccc(-n2c(=C(C#N)C(=O)C(C)(C)C)sc(=Cc3ccc(OC(F)F)cc3)c2=O)cc1 ZINC000254385954 JJ Agent Anodyne O=C(N=C1N=C2C=CC(I)=CN2Cc2ccccc21)c1c(F)cccc1F ZINC000254386153 JJ Agent Mild COCCN=c1scc(-c2ccc(OC(F)F)cc2)n1N=C(C)c1ccc(OC)cc1OC ZINC000254387343 JJ Agent Mild CCCCc1nc2c(sc3nc(C)cc(COC)c32)c(=O)n1N=Cc1ccc(NC(C)=O)cc1 ZINC000254387410 JJ Agent Mild C=C(C)CN=c1scc(-c2ccccc2F)n1N=C(C)c1ccc(N2CCOCC2)cc1 ZINC000254387476 JJ Agent Mild Cc1c(Br)cc(NCC(=O)NN=C/C=C\c2ccccc2)cc1Br ZINC000254390951 JJ Agent Anodyne Cc1c(Br)cc(NCC(=O)NN=C/C=C/c2ccccc2)cc1Br ZINC000254390952 JJ Agent Anodyne CC[C@H](Nc1ccc(I)cc1)C(=O)NN=Cc1ccc2ccccc2c1 ZINC000254391709 JJ Agent Anodyne CC[C@@H](Nc1ccc(I)cc1)C(=O)NN=Cc1ccc2ccccc2c1 ZINC000254391710 JJ Agent Anodyne COc1ccc([C@@]2(C)NC(=O)N(N=Cc3c(-c4ccccc4)n(C)c4ccccc34)C2=O)cc1 ZINC000254392330 JJ Agent Mild COc1ccc([C@]2(C)NC(=O)N(N=Cc3c(-c4ccccc4)n(C)c4ccccc34)C2=O)cc1 ZINC000254392332 JJ Agent Mild CCOC(=O)c1c(N=Cc2cc(Br)cc(Cl)c2O)sc2c1CCN(C)C2 ZINC000254393083 JJ Agent Anodyne Cc1cccn2c(=O)c(C=NNc3ccccc3C(=O)O)c(Sc3nc4ccccc4s3)nc12 ZINC000254395169 JJ Agent Mild O=C(NN=Cc1ccc(OC(=O)c2ccccc2)cc1)/C(=C\c1cccs1)NC(=O)c1ccccc1 ZINC000254398387 JJ Agent Reactive O=C(NN=Cc1ccc(OC(=O)c2ccccc2)cc1)/C(=C/c1cccs1)NC(=O)c1ccccc1 ZINC000254398391 JJ Agent Reactive COc1cc(Cl)cc(C=NNc2nc(Nc3ccc(C)cc3)nc(-n3nc(C)cc3C)n2)c1O ZINC000254401521 JJ Agent Anodyne Cc1nn(Cc2ccccc2)c(Cl)c1C=NNC(=O)CSc1nc2ccccc2s1 ZINC000254402923 JJ Agent Anodyne Cc1ccc(N2Cc3ccccc3C2=NC(=O)c2ccncc2)cc1S(=O)(=O)N1CCCCCC1 ZINC000254403651 JJ Agent Mild COc1cccc(C=Nn2c(-c3ccc(Br)cc3)csc2=NC[C@H]2CCCO2)c1O ZINC000254403803 JJ Agent Anodyne COc1cccc(C=Nn2c(-c3ccc(Br)cc3)csc2=NC[C@@H]2CCCO2)c1O ZINC000254403806 JJ Agent Anodyne COc1cc(C=Nc2cccc(S(=O)(=O)N3CCCC3)c2)ccc1OCc1ccc(F)cc1 ZINC000254404162 JJ Agent Mild CCn1c(C)nc2cc(C(=O)NN=C(C)c3ccc(OC)c(CSc4ncccn4)c3)ccc21 ZINC000254404459 JJ Agent Reactive C/C=C/C=C\C(=O)OCC(=O)N(C[C@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 ZINC000254405104 JJ Agent Anodyne CCOc1ccc(-n2c(C)cc(C=NNC(=O)c3ccc(CSc4nncn4C)cc3)c2C)cc1 ZINC000254405435 JJ Agent Reactive CCCCCCCCCCS(=O)(=O)NN=Cc1cccc(I)c1 ZINC000254405492 JJ Agent Anodyne COc1ccc(Cl)cc1C=NNc1nc(Nc2ccc(C)cc2)nc(-n2nc(C)cc2C)n1 ZINC000254406868 JJ Agent Anodyne COc1ccccc1NCC(=O)NN=Cc1c(C)nn(-c2ccccc2)c1Oc1ccc(F)cc1 ZINC000254412286 JJ Agent Reactive Cc1ccc(Nc2nc(NN=Cc3ccccc3C(F)(F)F)nc(N3CCOCC3)n2)cc1Cl ZINC000254416540 JJ Agent Anodyne Cc1ccc(OCC(=O)NN=Cc2cccc(OC(=O)c3ccccc3Br)c2)cc1 ZINC000254417032 JJ Agent Anodyne Oc1c(Br)cc(C=NNC(=S)Nc2ccc(F)cc2F)cc1Br ZINC000254419366 JJ Agent Anodyne CCOC(=O)c1ccc(NC(=O)COc2ccc(Br)cc2C=Nc2c(C)n[nH]c2C)cc1 ZINC000254432133 JJ Agent Anodyne COc1ccc(NS(=O)(=O)c2cc(N=Cc3ccc(SC)cc3)ccc2N2CCOCC2)cc1 ZINC000254438579 JJ Agent Mild COC(=O)c1ccc(NC(=O)[C@@H]2CC(=O)N(Cc3ccccc3)C(=Nc3ccc(F)cc3)S2)cc1 ZINC000254438592 JJ Agent Anodyne CC(=NNS(=O)(=O)c1ccc(CC(C)C)cc1)c1ccc(NC(=O)c2ccoc2C)cc1 ZINC000254439991 JJ Agent Mild C=CCc1cccc(C=NNC(=O)CNc2c(Br)cc(C)cc2Br)c1O ZINC000254441718 JJ Agent Anodyne O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)NN=Cc1ccccc1OC(F)F ZINC000254441845 JJ Agent Reactive Cc1ccc(-n2nc(C)c(C=NN3C(=O)N[C@](C)(c4ccc(OC(F)F)cc4)C3=O)c2Cl)cc1 ZINC000254441977 JJ Agent Anodyne Cc1ccc(-n2nc(C)c(C=NN3C(=O)N[C@@](C)(c4ccc(OC(F)F)cc4)C3=O)c2Cl)cc1 ZINC000254441982 JJ Agent Anodyne CSc1ccc(C=c2sc(=CC(=O)c3ccccc3C)n(Cc3cccc(F)c3)c2=O)cc1 ZINC000254442345 JJ Agent Anodyne COCCN=c1scc(-c2ccc(Cl)c(Cl)c2)n1N=Cc1ccc2c(c1)OCO2 ZINC000254442437 JJ Agent Anodyne Cc1cc(OCc2ccc(C=Nc3cnn(C)c3C(=O)NCc3ccco3)o2)ccc1Cl ZINC000254442766 JJ Agent Anodyne CC(CC(=O)Nc1ccc(C(C)C)cc1)=NNC(=O)COc1ccc(C)cc1Br ZINC000254443464 JJ Agent Anodyne CN(C)S(=O)(=O)c1cccc(C(=O)N2C(=Nc3ccccc3)SCc3ccccc32)c1 ZINC000254448127 JJ Agent Mild CCCn1nc(C)c2c(C(=O)NN=C(C)c3cccc(OC(F)F)c3)cc(-c3cnn(C)c3C)nc21 ZINC000254450308 JJ Agent Reactive O=c1c(C=Nc2cccc(C(F)(F)F)c2)c(Sc2nnnn2-c2ccccc2)nc2ccccn12 ZINC000254450544 JJ Agent Mild O=C(NN=Cc1ccc(N2CCOCC2)cc1)c1ccc(CN2C(=O)c3cccc4cccc2c34)cc1 ZINC000254450964 JJ Agent Reactive CCN1C(=O)C[C@@H](C(=O)Nc2ccccc2)SC1=Nc1ccc(OC(F)(F)Cl)cc1 ZINC000254456601 JJ Agent Anodyne CCN1C(=O)C[C@H](C(=O)Nc2ccccc2)SC1=Nc1ccc(OC(F)(F)Cl)cc1 ZINC000254456604 JJ Agent Anodyne O=C(C[C@H]1S/C(=N/N=Cc2ccc(OCc3ccccc3Cl)cc2)NC1=O)Nc1ccccc1 ZINC000254477817 JJ Agent Anodyne O=C(C[C@@H]1S/C(=N/N=Cc2ccc(OCc3ccccc3Cl)cc2)NC1=O)Nc1ccccc1 ZINC000254477818 JJ Agent Anodyne O=C(CN1CCCc2ccccc21)NN=Cc1sc(N2CCCCC2)nc1-c1ccccc1 ZINC000254481506 JJ Agent Reactive COc1ccc(C=Nn2c(S)nnc2C(F)F)cc1COc1cccc(C(F)(F)F)c1 ZINC000254481617 JJ Agent Mild COc1cccc(C=Nn2c(-c3ccc4c(c3)NC(=O)CO4)csc2=NC2CCCCC2)c1 ZINC000254482154 JJ Agent Mild Cc1cccc(OCC(=O)NN=Cc2ccc(OC(=O)c3cccc(Br)c3)cc2)c1 ZINC000254482520 JJ Agent Anodyne O=S(=O)(NN=Cc1cn(Cc2c(F)cccc2Cl)nc1-c1ccccc1)c1ccccc1 ZINC000254483810 JJ Agent Anodyne COCCN=c1scc(-c2cc(OC)ccc2OC)n1N=Cc1c(O)ccc2ccccc12 ZINC000254483996 JJ Agent Mild CCOCCCN1C(=O)[C@@H](CC(=O)Nc2ccc(C(C)=O)cc2)SC1=Nc1ccc(C)cc1C ZINC000254485700 JJ Agent Anodyne CCOCCCN1C(=O)[C@H](CC(=O)Nc2ccc(C(C)=O)cc2)SC1=Nc1ccc(C)cc1C ZINC000254485701 JJ Agent Anodyne COc1cc(C=Nn2c(S)nnc2-c2ccc(C(C)(C)C)cc2)cc(Br)c1O ZINC000254486356 JJ Agent Anodyne COc1ccc(/C=C(\C#N)C(=O)N=C2N=C3C=CC(Br)=CN3Cc3ccccc32)cc1 ZINC000254488126 JJ Agent Reactive COc1ccc(/C=C(/C#N)C(=O)N=C2N=C3C=CC(Br)=CN3Cc3ccccc32)cc1 ZINC000254488127 JJ Agent Reactive CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccc(C(C)C)cc2)n2c(sc(=Cc3ccco3)c2=O)=N1 ZINC000254488991 JJ Agent Anodyne CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccc(C(C)C)cc2)n2c(sc(=Cc3ccco3)c2=O)=N1 ZINC000254488993 JJ Agent Anodyne O=C(C[C@@H]1S/C(=N/N=Cc2ccc(-c3ccc(Br)cc3)o2)NC1=O)Nc1ccccc1 ZINC000254489860 JJ Agent Anodyne O=C(C[C@H]1S/C(=N/N=Cc2ccc(-c3ccc(Br)cc3)o2)NC1=O)Nc1ccccc1 ZINC000254489861 JJ Agent Anodyne C=CCN1C(=O)[C@H](CC(=O)Nc2cc(OC)ccc2OC)SC1=Nc1ccc(Cl)cc1 ZINC000254490596 JJ Agent Anodyne C=CCN1C(=O)[C@@H](CC(=O)Nc2cc(OC)ccc2OC)SC1=Nc1ccc(Cl)cc1 ZINC000254490598 JJ Agent Anodyne O=C(NN=Cc1ccc(Sc2nc3ccccc3c(=O)n2-c2ccccc2)o1)c1ccccc1O ZINC000254492068 JJ Agent Reactive CCOc1ccc(COc2ccc(C=Nn3c(S)nnc3C(F)(F)F)cc2)cc1OCC ZINC000254492361 JJ Agent Mild NC1=C(c2nc(-c3ccc(Cl)cc3)cs2)C(=O)CN1N=Cc1ccc(Br)cc1 ZINC000254496255 JJ Agent Anodyne O=S(=O)(NN=Cc1ccc(OCc2ccc(Br)cc2)cc1)c1ccc(Cl)cc1 ZINC000254497634 JJ Agent Anodyne Cc1ccc(Cn2ccsc2=NC(=O)CSc2nnc(-c3ccc(Cl)cc3)o2)cc1 ZINC000254498312 JJ Agent Anodyne Cn1ncc(N=Cc2ccc(COc3ccc(F)c(Cl)c3)o2)c1C(=O)NCc1ccco1 ZINC000254501746 JJ Agent Anodyne O=C(C[C@H]1S/C(=N/N=Cc2c[nH]c3ccc(OCc4ccccc4)cc23)NC1=O)Nc1ccccc1 ZINC000254504446 JJ Agent Anodyne O=c1nc2sc(=Cc3ccc(-c4cccc(Cl)c4)o3)c(=O)n2c2sc3c(c12)CCCC3 ZINC000254505067 JJ Agent Anodyne CC(=NOC(=O)CSc1nc(-c2ccc(F)cc2)cc(C(F)(F)F)n1)c1ccncc1 ZINC000254505680 JJ Agent Mild CN(c1ccccc1)S(=O)(=O)c1cc(C(=O)n2ccccc2=Nc2ccccc2)ccc1Cl ZINC000254505793 JJ Agent Anodyne CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccccc2)n2c(sc(=Cc3ccccc3Cl)c2=O)=N1 ZINC000254507681 JJ Agent Anodyne CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccccc2)n2c(sc(=Cc3ccccc3Cl)c2=O)=N1 ZINC000254507682 JJ Agent Anodyne Cc1ccc(-c2csc(=Nc3cc(S(=O)(=O)N(C)C)ccc3C)n2N=Cc2ccncc2)cc1 ZINC000254509968 JJ Agent Mild COc1ccc(-c2nn(-c3ccccc3)cc2C=NNc2nncc3ccccc23)cc1OC ZINC000254511148 JJ Agent Mild CCOc1ccc(S(=O)(=O)NN=Cc2ccc(COc3ccc(Cl)c(Cl)c3)o2)cc1 ZINC000254512188 JJ Agent Anodyne O=C(NN=Cc1ccc(Sc2nnc(-c3ccccc3)n2-c2ccccc2)o1)c1ccncc1 ZINC000254513524 JJ Agent Reactive Cc1ccccc1OCC(=O)NN=Cc1ccc(OC(=O)c2cccc(Br)c2)cc1 ZINC000254513952 JJ Agent Anodyne Cc1ccc(C(C)C)c(OCC(=O)NN=Cc2c(C)nn(-c3ccccc3)c2N2CCCC2)c1 ZINC000254514357 JJ Agent Reactive O=C(NC1CCN([C@@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)CC1)c1ccccc1 ZINC000254519774 JJ Agent Anodyne O=C(NC1CCN([C@H]2CC(=O)N(c3ccc(N=Nc4ccccc4)cc3)C2=O)CC1)c1ccccc1 ZINC000254519786 JJ Agent Anodyne COc1ccc(CCN2C(=O)C[C@H](C(=O)Nc3ccccc3)SC2=Nc2ccccc2)cc1 ZINC000254520087 JJ Agent Anodyne COc1ccc(CCN2C(=O)C[C@@H](C(=O)Nc3ccccc3)SC2=Nc2ccccc2)cc1 ZINC000254520089 JJ Agent Anodyne CN1C(=O)C[C@@H](C(=O)Nc2ccc(OC(F)(F)Cl)cc2)SC1=Nc1ccc(F)cc1 ZINC000254520263 JJ Agent Anodyne CN1C(=O)C[C@H](C(=O)Nc2ccc(OC(F)(F)Cl)cc2)SC1=Nc1ccc(F)cc1 ZINC000254520265 JJ Agent Anodyne CSc1nnc(-c2ccco2)n1N=Cc1ccc(COc2c(F)c(F)cc(F)c2F)o1 ZINC000254520292 JJ Agent Mild CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccc(Cl)cc2)n2c(sc(=Cc3ccccc3)c2=O)=N1 ZINC000254525331 JJ Agent Anodyne COc1ccc(C=NOCC(=O)N(Cc2ccco2)C23CC4CC(CC(C4)C2)C3)cc1OC ZINC000254525474 JJ Agent Mild O=C1CCC(=O)N1SC(Cl)=NC(=C(C(F)(F)F)C(F)(F)F)C(F)(F)C(F)(F)F ZINC000254526796 JJ Agent Mild CCCCCCCCCCS(=O)(=O)NN=Cc1ccccc1I ZINC000254555563 JJ Agent Anodyne Cc1cc(Br)c(NCC(=O)NN=Cc2c(O)ccc3ccccc23)c(Br)c1 ZINC000254556169 JJ Agent Anodyne CC[C@H](Nc1ccc(I)cc1C)C(=O)NN=Cc1cccc(Cl)c1 ZINC000254556743 JJ Agent Anodyne CC[C@@H](Nc1ccc(I)cc1C)C(=O)NN=Cc1cccc(Cl)c1 ZINC000254556744 JJ Agent Anodyne O=C(/C=C\c1nc2ccccc2o1)NC[C@H](NC(=O)/C=C\c1nc2ccccc2o1)c1ccccc1 ZINC000254557003 JJ Agent Anodyne O=C(/C=C\c1nc2ccccc2o1)NC[C@H](NC(=O)/C=C/c1nc2ccccc2o1)c1ccccc1 ZINC000254557004 JJ Agent Anodyne O=C(/C=C\c1nc2ccccc2o1)N[C@@H](CNC(=O)/C=C/c1nc2ccccc2o1)c1ccccc1 ZINC000254557005 JJ Agent Anodyne CCN(CC)S(=O)(=O)c1ccc(NN=Cc2c(-c3ccccc3)n(C)c3ccccc23)nc1 ZINC000254557743 JJ Agent Mild COCc1cc(C)nc2sc(C(=O)NN=Cc3cc(-c4cccs4)n[nH]3)c(-n3cccc3)c12 ZINC000254559472 JJ Agent Reactive Cc1nn(-c2ccccc2)c2nc(-c3cccnc3)cc(C(=O)NN=Cc3c(F)cccc3F)c12 ZINC000254560242 JJ Agent Reactive COc1cc(C=Nn2c(-c3ccc(O)cc3O)csc2=Nc2ccc(F)cc2)ccc1O ZINC000254568453 JJ Agent Mild O=C(O)c1cccc(NN=Cc2cn(-c3ccccc3)nc2-c2cc3ccccc3oc2=O)c1 ZINC000254577315 JJ Agent Mild CN1CCc2c(sc(N=Cc3cc(Br)ccc3O)c2C(=O)OC(C)(C)C)C1 ZINC000254588556 JJ Agent Anodyne O=C(CSc1nnc(CNc2cccc3ccccc23)n1-c1ccccc1)NN=Cc1ccccn1 ZINC000254592677 JJ Agent Reactive Cc1nnc(SCC(=O)Nc2ccc(Br)cc2)n1N=Cc1ccc(Cl)cc1 ZINC000254593439 JJ Agent Anodyne O=C(NN=Cc1ccc(Cl)cc1Cl)c1ccccc1NS(=O)(=O)c1cccs1 ZINC000254593455 JJ Agent Anodyne Cc1cc(C)cc(OCc2ccc(C(=O)NN=Cc3cc4c(cc3Br)OCO4)o2)c1 ZINC000254595034 JJ Agent Anodyne COc1ccccc1N=C1S[C@@H](c2ccccc2)C(=O)N1S(=O)(=O)c1ccc(F)c(C)c1 ZINC000254601339 JJ Agent Anodyne COc1ccccc1N=C1S[C@H](c2ccccc2)C(=O)N1S(=O)(=O)c1ccc(F)c(C)c1 ZINC000254601340 JJ Agent Anodyne Cc1ccc(C(C)C)c(OCc2nc3ccccc3c(=O)n2N=Cc2ccc(OCC(=O)O)cc2)c1 ZINC000254615112 JJ Agent Mild O=c1nc2sc(=Cc3ccc(-c4ccc(F)c(Cl)c4)o3)c(=O)n2c2sc3c(c12)CCCC3 ZINC000254615808 JJ Agent Anodyne CCOc1cc(C=NNc2ccc(Br)cc2)cc(I)c1O ZINC000254617129 JJ Agent Anodyne CC(=NNC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@H]2C)cc1)c1ccc(Br)s1 ZINC000254617529 JJ Agent Anodyne CC(=NNC(=O)c1ccc(OCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1)c1ccc(Br)s1 ZINC000254617530 JJ Agent Anodyne CC(=NNC(=O)c1ccc(OCC(=O)N2[C@H](C)CCC[C@H]2C)cc1)c1ccc(Br)s1 ZINC000254617531 JJ Agent Anodyne CCCCc1nc2c(sc3nc(C)cc(COC)c32)c(=O)n1N=Cc1ccc(N(C)C)cc1 ZINC000254620265 JJ Agent Mild COc1cc(Cl)c(C)cc1NC(=O)C[C@@H]1S/C(=N\N=Cc2ccccc2C(F)(F)F)NC1=O ZINC000254620808 JJ Agent Mild COc1cc(Cl)c(C)cc1NC(=O)C[C@H]1S/C(=N\N=Cc2ccccc2C(F)(F)F)NC1=O ZINC000254620809 JJ Agent Mild O=C(Oc1ccc(C=Nn2cnc3scc(-c4ccccc4)c3c2=O)cc1)c1cccnc1 ZINC000254622735 JJ Agent Mild CCOC(=O)c1oc2ccc(CCC(C)=NNC(=O)c3ccc(OC)c(OC)c3)cc2c1C ZINC000254624987 JJ Agent Reactive Cc1ccccc1COc1ccc(C=N/N=C2\NC(=O)[C@@H](CC(=O)Nc3ccccc3)S2)cc1 ZINC000254625306 JJ Agent Anodyne Cc1ccccc1COc1ccc(C=N/N=C2\NC(=O)[C@H](CC(=O)Nc3ccccc3)S2)cc1 ZINC000254625308 JJ Agent Anodyne Cc1ccc(C=NNC(=O)c2ccc(Oc3ccc(C(=O)NN=Cc4ccc(C)o4)cc3)cc2)o1 ZINC000254625494 JJ Agent Reactive O=S(=O)(Nc1ncccn1)c1ccc(-c2ccc(C=NNc3ncc(Cl)cc3Cl)o2)cc1 ZINC000254626846 JJ Agent Anodyne COCCN=c1scc(-c2cc(Cl)ccc2Cl)n1N=Cc1cc(OC)c(O)c(OC)c1 ZINC000254629790 JJ Agent Anodyne Cc1cccc(OCC(=O)NN=Cc2cccc(OC(=O)c3cccc(Br)c3)c2)c1 ZINC000254630527 JJ Agent Anodyne CCOC(=O)c1ccc(-c2ccc(C=NNC(=O)CSc3nc4ccccc4s3)o2)cc1 ZINC000254631773 JJ Agent Reactive C(=Nn1c(-c2cc3ccccc3o2)csc1=NC[C@@H]1CCCO1)c1ccc2c(c1)OCCO2 ZINC000254632405 JJ Agent Mild C(=Nn1c(-c2cc3ccccc3o2)csc1=NC[C@H]1CCCO1)c1ccc2c(c1)OCCO2 ZINC000254632408 JJ Agent Mild Cc1ccccc1NCC(=O)NN=Cc1cccc(OC(=O)c2ccccc2Br)c1 ZINC000254633044 JJ Agent Anodyne CC(C)(C(=O)N=C1N=C2C=CC(I)=CN2Cc2ccccc21)c1ccccc1 ZINC000254633313 JJ Agent Mild CC(=NOCc1nc2ccccc2c(=O)n1N=Cc1ccc(Br)cc1)c1ccccc1 ZINC000254635132 JJ Agent Anodyne CC(C)c1ccc(-n2c(=C(C#N)C(=O)C(C)(C)C)sc(=Cc3ccccc3OC(F)F)c2=O)cc1 ZINC000254647387 JJ Agent Anodyne Cc1cc(C)cc(N=Cc2cc(I)cc(I)c2O)c1 ZINC000254658278 JJ Agent Anodyne COCCN=c1scc(-c2ccc(Cl)cc2Cl)n1N=Cc1ccc2c(c1)OCO2 ZINC000254670542 JJ Agent Anodyne COc1ccc(N=C2c3ccccc3C3=NC(=O)N[C@](c4ccc(OC)cc4)(C(F)(F)F)N32)cc1 ZINC000254677433 JJ Agent Mild COc1ccc(N=C2c3ccccc3C3=NC(=O)N[C@@](c4ccc(OC)cc4)(C(F)(F)F)N32)cc1 ZINC000254677436 JJ Agent Mild Cc1ccc(-n2nc(C)c(C=NNC(=O)c3nc(Cl)c(Cl)c(N)c3Cl)c2Cl)cc1 ZINC000254682607 JJ Agent Anodyne CC(C)N=c1scc(-c2cccc(Br)c2)n1N=Cc1ccc2c(c1)OCCO2 ZINC000254692676 JJ Agent Anodyne C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NN=C/C=C2\N(C)c3ccccc3C2(C)C)cc1 ZINC000254696550 JJ Agent Reactive C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NN=C/C=C2\N(C)c3ccccc3C2(C)C)cc1 ZINC000254696551 JJ Agent Reactive C[C@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NN=C/C=C2/N(C)c3ccccc3C2(C)C)cc1 ZINC000254696552 JJ Agent Reactive C[C@@H]1CCC[C@@H](C)N1C(=O)COc1ccc(C(=O)NN=C/C=C2/N(C)c3ccccc3C2(C)C)cc1 ZINC000254696554 JJ Agent Reactive O=C(O)c1ccccc1N(Cc1ccc(Br)cc1)C(=O)CON=Cc1ccccc1 ZINC000254697023 JJ Agent Anodyne CCOC(=O)c1cc(C(=O)c2ccc(Cl)cc2)n2c(=O)c(=Cc3ccc(Cl)cc3)sc12 ZINC000254699204 JJ Agent Anodyne Cc1ccc(C=Nn2c(-c3ccc(Cl)cc3)csc2=NCCN2CCOCC2)c(C)c1 ZINC000254700990 JJ Agent Anodyne Cc1cc(C=NNC(=O)c2c[nH]c3ccccc23)c(C)n1-c1ccc(I)cc1 ZINC000254702591 JJ Agent Anodyne C[C@@H]1CN(C(=O)CCN2C(=O)NC3(CCCCC3)C2=O)C(=Nc2ccc(Cl)c(Cl)c2)S1 ZINC000254703486 JJ Agent Anodyne C[C@H]1CN(C(=O)CCN2C(=O)NC3(CCCCC3)C2=O)C(=Nc2ccc(Cl)c(Cl)c2)S1 ZINC000254703490 JJ Agent Anodyne Cc1nn(Cc2c(Cl)cccc2Cl)c(Cl)c1C=NNC(=O)c1c(C)nc2ccccn12 ZINC000254704638 JJ Agent Anodyne O=C(C[C@H]1S/C(=N/N=Cc2cccc(OCc3ccc(Cl)cc3)c2)NC1=O)Nc1ccccc1 ZINC000254706237 JJ Agent Anodyne O=C(C[C@@H]1S/C(=N/N=Cc2cccc(OCc3ccc(Cl)cc3)c2)NC1=O)Nc1ccccc1 ZINC000254706238 JJ Agent Anodyne COCCN=c1scc(-c2ccc(Cl)c(Cl)c2)n1N=Cc1ccc2c(c1)OCCO2 ZINC000254706993 JJ Agent Anodyne Cn1c(N)c(-c2nc(N)nc(Nc3ccccc3)n2)sc1=NC(=Nc1ccccc1)c1ccccc1 ZINC000254708491 JJ Agent Mild COc1ccc(Cl)cc1-c1ccc(C=c2sc3nc(=O)c4c5c(sc4n3c2=O)CCCC5)o1 ZINC000254710352 JJ Agent Anodyne O=C(CSc1nc2ccc(N=Cc3ccc(Br)cc3)cc2s1)N1CCOCC1 ZINC000254710372 JJ Agent Anodyne Cc1cccc(Nc2nc(NN=Cc3ccc4c(c3)OCO4)nc(N3CCC(C)CC3)n2)c1C ZINC000254714523 JJ Agent Mild Cc1cc(C=NNc2ccc(Cl)nn2)c(C)n1-c1ccc(I)cc1 ZINC000254716717 JJ Agent Anodyne COCCN=c1scc(-c2cccs2)n1N=Cc1c(C)nn(-c2ccccc2)c1Cl ZINC000254721275 JJ Agent Anodyne CCOc1cc(C=NNc2ccc(Br)cc2)c(Br)cc1OCC#N ZINC000254722129 JJ Agent Anodyne Cc1cccc(-n2c(=C(C#N)C(=O)c3ccccc3)sc(=Cc3ccc(Cl)c(Cl)c3)c2=O)c1 ZINC000254730092 JJ Agent Anodyne CN(C)S(=O)(=O)c1ccc(Cl)c(N=Cc2ccc(N3CCC(c4ccccc4)=N3)cc2)c1 ZINC000254733912 JJ Agent Anodyne CC(CC(=O)Nc1cc(Cl)ccc1C)=NNC(=O)COc1ccc(C)cc1Br ZINC000254734313 JJ Agent Anodyne Cc1ccc(C)c(Nc2nc(NN=Cc3ccccc3C(F)(F)F)nc(N3CCOCC3)n2)c1 ZINC000254734975 JJ Agent Mild Clc1ccccc1NN=C(Cn1cnc(Br)c1)c1ccnc(Br)c1 ZINC000254736299 JJ Agent Anodyne C[C@H](Sc1nnc(CNc2ccc(Cl)cc2)n1-c1ccccc1)C(=O)NN=Cc1cccnc1 ZINC000254736552 JJ Agent Anodyne C[C@@H](Sc1nnc(CNc2ccc(Cl)cc2)n1-c1ccccc1)C(=O)NN=Cc1cccnc1 ZINC000254736554 JJ Agent Anodyne O=C(CSc1nnc(CNc2cccc3ccccc23)n1-c1ccccc1)NN=Cc1cccnc1 ZINC000254737206 JJ Agent Reactive CCCC(C)=NNC(=O)CNc1c(Br)cc(Br)cc1Br ZINC000254737357 JJ Agent Anodyne Cc1ccc(S(=O)(=O)N(C)Cc2ccc(C(=O)NN=CC3=CC[C@H]4C[C@H]3C4(C)C)cc2)cc1 ZINC000254737397 JJ Agent Reactive CC(=NNC(=O)c1cc(C2CC2)nc2c1c(C1CC1)nn2C)c1cc(Br)cs1 ZINC000254737737 JJ Agent Anodyne CN=c1scc(-c2cccc(Br)c2)n1N=Cc1ccccc1I ZINC000254738638 JJ Agent Anodyne O=C(C1CCN(S(=O)(=O)c2c(Cl)cccc2Cl)CC1)n1ccccc1=NC1CCCCC1 ZINC000254738850 JJ Agent Anodyne COCCN=c1scc(-c2ccc(C3CCCCC3)cc2)n1N=Cc1ccc(O)c(O)c1O ZINC000254741273 JJ Agent Mild CCN=c1scc(-c2ccc(OC(F)F)cc2OC(F)F)n1N=Cc1ccccc1O ZINC000254741349 JJ Agent Mild C[C@H]1CCc2sc(C(=O)NN=Cc3sc(N4CCOCC4)nc3-c3ccccc3)cc2C1 ZINC000254742114 JJ Agent Reactive C[C@@H]1CCc2sc(C(=O)NN=Cc3sc(N4CCOCC4)nc3-c3ccccc3)cc2C1 ZINC000254742115 JJ Agent Reactive O=C1COc2ccc(-c3csc(=Nc4ccc(OC(F)F)cc4)n3C[C@@H]3CCCO3)cc2N1 ZINC000254742522 JJ Agent Anodyne O=C1COc2ccc(-c3csc(=Nc4ccc(OC(F)F)cc4)n3C[C@H]3CCCO3)cc2N1 ZINC000254742523 JJ Agent Anodyne COCCCN1C(=O)[C@@H](CC(=O)Nc2ccccc2OC)SC1=Nc1ccc(C(C)C)cc1 ZINC000254742655 JJ Agent Anodyne COCCCN1C(=O)[C@H](CC(=O)Nc2ccccc2OC)SC1=Nc1ccc(C(C)C)cc1 ZINC000254742656 JJ Agent Anodyne O=C(C[C@@H]1SC(=Nc2ccc(Cl)cc2)N(C[C@H]2CCCO2)C1=O)Nc1ccc(F)cc1 ZINC000254743347 JJ Agent Anodyne O=C(C[C@@H]1SC(=Nc2ccc(Cl)cc2)N(C[C@@H]2CCCO2)C1=O)Nc1ccc(F)cc1 ZINC000254743348 JJ Agent Anodyne O=C(C[C@H]1SC(=Nc2ccc(Cl)cc2)N(C[C@@H]2CCCO2)C1=O)Nc1ccc(F)cc1 ZINC000254743349 JJ Agent Anodyne O=C(C[C@H]1SC(=Nc2ccc(Cl)cc2)N(C[C@H]2CCCO2)C1=O)Nc1ccc(F)cc1 ZINC000254743350 JJ Agent Anodyne Cn1ncc2c(SCC(=O)N(N=Cc3ccccc3)c3cccc(C(F)(F)F)c3)ncnc21 ZINC000254745285 JJ Agent Reactive COc1cc(C=Nn2cnc3sc4c(c3c2=O)CCCC4)ccc1OC(=O)c1cccs1 ZINC000254745767 JJ Agent Mild Cc1nn(-c2ccc(F)cc2)c(Cl)c1C=NNC(=O)c1nc(Cl)c(Cl)c(N)c1Cl ZINC000254747054 JJ Agent Anodyne Brc1ccc(-c2csc(=NC3CC3)n2N=Cc2ccc3c(c2)OCCO3)s1 ZINC000254750005 JJ Agent Anodyne COc1cc(C=Nn2cnnc2SCc2ccc(Cl)cc2)ccc1OC(=O)c1cccnc1 ZINC000254750123 JJ Agent Anodyne CCOc1ccc(C(C)=NNC(=O)c2ccc(CN(c3ccc(C)c(C)c3)S(C)(=O)=O)cc2)cc1 ZINC000254750783 JJ Agent Reactive COc1cc(CCC(=O)N=c2sccn2Cc2ccc(Cl)cc2Cl)cc(OC)c1OC ZINC000254751201 JJ Agent Anodyne CN(C)C=c1sc2c(-c3nc4ccccc4s3)cc(C(=O)c3ccc(Cl)cc3)n2c1=O ZINC000254751210 JJ Agent Anodyne COc1ccc(/C=C\C(=O)OCc2csc(N(N=Cc3ccc(C)cc3)C(C)=O)n2)cc1OC ZINC000254752985 JJ Agent Reactive COc1ccc(/C=C/C(=O)OCc2csc(N(N=Cc3ccc(C)cc3)C(C)=O)n2)cc1OC ZINC000254752987 JJ Agent Reactive Cc1sc2ncnc(NN=Cc3sc(N4CCOCC4)nc3-c3ccccc3)c2c1C ZINC000254753156 JJ Agent Mild CC(=NOCC(=O)Nc1sc2c(c1C#N)CC[C@@H](C)C2)c1nc2ccccc2n1C(F)F ZINC000254753178 JJ Agent Mild CC(=NOCC(=O)Nc1sc2c(c1C#N)CC[C@H](C)C2)c1nc2ccccc2n1C(F)F ZINC000254753179 JJ Agent Mild CC(=NNC(=O)CSc1cc(C)c(Br)cc1C)c1ccc(-n2ccnc2)cc1 ZINC000254753189 JJ Agent Anodyne Cc1cccc(Cl)c1OCc1ccc(C=Nc2cnn(C)c2C(=O)NCc2ccco2)o1 ZINC000254756723 JJ Agent Anodyne COC[C@@H](C)n1c(-c2ccc3c(c2)NC(=O)CO3)csc1=Nc1ccc(OC(F)F)cc1 ZINC000254757885 JJ Agent Anodyne COC[C@H](C)n1c(-c2ccc3c(c2)NC(=O)CO3)csc1=Nc1ccc(OC(F)F)cc1 ZINC000254757886 JJ Agent Anodyne COc1ccc(N=C2S[C@@H](CC(=O)Nc3ccc(F)cc3)C(=O)N2Cc2ccco2)cc1 ZINC000254758127 JJ Agent Mild COc1ccc(N=C2S[C@H](CC(=O)Nc3ccc(F)cc3)C(=O)N2Cc2ccco2)cc1 ZINC000254758129 JJ Agent Mild CC(=NNc1nc(Cl)c(Cl)cc1Cl)c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000254758452 JJ Agent Anodyne CCN=c1scc(-c2ccc(F)cc2)n1N=Cc1ccccc1I ZINC000254758736 JJ Agent Anodyne COCc1cc(C)nc2sc3c(=O)n(N=Cc4ccc(OC)cc4)c(CC(C)C)nc3c12 ZINC000254759715 JJ Agent Mild CC1(C)Cc2c(sc3ncn4nc(CON=Cc5ccccc5Cl)nc4c23)C(C)(C)N1 ZINC000254760790 JJ Agent Anodyne CCCCc1nc2c(sc3nc(C)cc(COC)c32)c(=O)n1N=Cc1ccc(OC)cc1 ZINC000254761003 JJ Agent Mild CC(=NNC(=O)c1ccc(CN(C)S(=O)(=O)c2ccc(C)cc2)cc1)c1cc2ccccc2o1 ZINC000254761215 JJ Agent Reactive CCCn1nc(C)c2c(C(=O)NN=C(C)c3ccc(OC(F)F)cc3)cc(-c3cnn(C)c3C)nc21 ZINC000254761401 JJ Agent Reactive COC(=O)c1ccc(COc2ccc3ccccc3c2C=Nn2c(SC)nnc2C(F)F)o1 ZINC000254762799 JJ Agent Mild COCCn1c(C)cc(C=NNC(=O)c2ccc(CSc3nc4ccccc4[nH]3)cc2)c1C ZINC000254764086 JJ Agent Reactive Cc1nn(-c2ccccc2)c2sc(C(=O)NN=C3C(=O)N(CCC(C)C)c4ccccc43)cc12 ZINC000254770374 JJ Agent Reactive O=C(CSc1nnc(-c2ccccc2)n1-c1ccccc1)NN=Cc1c[nH]c2ccccc12 ZINC000254770400 JJ Agent Reactive O=C(C[C@@H]1S/C(=N/N=Cc2cn(Cc3ccccc3)c3ccccc23)NC1=O)Nc1ccccc1 ZINC000254771080 JJ Agent Anodyne O=C(C[C@H]1S/C(=N/N=Cc2cn(Cc3ccccc3)c3ccccc23)NC1=O)Nc1ccccc1 ZINC000254771086 JJ Agent Anodyne COc1ccc(C=Nn2c(S)nnc2C(F)F)cc1COc1cccc(Br)c1 ZINC000254772185 JJ Agent Anodyne CC(=NNC(=O)c1csc2c1CCCC2)c1cccc(NS(=O)(=O)c2ccccc2)c1 ZINC000254788340 JJ Agent Reactive CC(=NNC(=O)c1cc2c(s1)C[C@@H](C)CC2)c1cccc(NS(=O)(=O)c2ccccc2)c1 ZINC000254790303 JJ Agent Reactive CC(=NNC(=O)c1cc2c(s1)C[C@H](C)CC2)c1cccc(NS(=O)(=O)c2ccccc2)c1 ZINC000254790306 JJ Agent Reactive COc1cc(C=NOCC(=O)Nc2ccccc2C(=O)N[C@@H](C)c2ccccc2)ccc1OC(F)F ZINC000254792126 JJ Agent Mild COc1cc(C=NOCC(=O)Nc2ccccc2C(=O)N[C@H](C)c2ccccc2)ccc1OC(F)F ZINC000254792131 JJ Agent Mild C(=Nc1nc2ccccc2nc1N1CCOCC1)N1CCN(C(c2ccccc2)c2ccccc2)CC1 ZINC000254797705 JJ Agent Mild Fc1ccc(Nc2nc(NN=Cc3ccc(-c4cccc(Cl)c4)o3)nc(N3CCOCC3)n2)cc1 ZINC000254797889 JJ Agent Anodyne CCC(=NNC(=O)CNc1c(Br)cc(Br)cc1Br)C(C)C ZINC000254799678 JJ Agent Anodyne CN=c1scc(-c2ccc(Cl)cc2)n1N=Cc1ccccc1I ZINC000254807684 JJ Agent Anodyne CC(CC12C[C@H]3C[C@@H](CC(Br)(C3)C1)C2)=NNC(=O)c1cc(C)nc2c1c(C)nn2C ZINC000254814817 JJ Agent Reactive Cc1ccccc1OCC(=O)NN=Cc1ccc(OC(=O)c2ccccc2Br)cc1 ZINC000254816823 JJ Agent Anodyne CCCCC(=NNC(=N)S[C@H]1CC(=O)N(c2ccc(OCC)cc2)C1=O)c1ccccc1 ZINC000254816843 JJ Agent Anodyne CCCCC(=NNC(=N)S[C@@H]1CC(=O)N(c2ccc(OCC)cc2)C1=O)c1ccccc1 ZINC000254816844 JJ Agent Anodyne FC(F)(F)c1cccc(NC(=S)NN=Cc2sc(N3CCOCC3)nc2-c2ccccc2)c1 ZINC000254817154 JJ Agent Mild CCCCCN1C(=O)[C@@H](CC(=O)Nc2cc(OC)ccc2OC)SC1=Nc1ccccc1OC ZINC000254821327 JJ Agent Anodyne CCCCCN1C(=O)[C@H](CC(=O)Nc2cc(OC)ccc2OC)SC1=Nc1ccccc1OC ZINC000254821328 JJ Agent Anodyne COc1ccc(-c2nn(-c3ccccc3)cc2C=NNC(=O)c2ccc3ccccc3n2)cc1OC ZINC000254822159 JJ Agent Reactive CCOC(=O)c1sc2ncn(N=C3C=C(c4ccccc4)[C@](O)(c4ccccc4)C3)c(=O)c2c1C ZINC000254822490 JJ Agent Mild CCOC(=O)c1sc2ncn(N=C3C=C(c4ccccc4)[C@@](O)(c4ccccc4)C3)c(=O)c2c1C ZINC000254822491 JJ Agent Mild C=CCN=c1scc(-c2ccc(OC(F)F)cc2)n1N=Cc1cc(OC)c(OC)c(OC)c1 ZINC000254822701 JJ Agent Mild C=CCN=c1scc(-c2ccc(Br)cc2)n1N=Cc1ccc(N2CCOCC2)cc1 ZINC000254822857 JJ Agent Anodyne COc1ccc(C=Nn2c(S)nnc2C(F)F)cc1COc1ccc(Br)cc1 ZINC000254823780 JJ Agent Anodyne COc1ccc([C@]2(C(F)(F)F)NC(=O)N=C3c4ccccc4C(=Nc4ccccc4OC)N32)cc1 ZINC000254826851 JJ Agent Mild COc1ccc([C@@]2(C(F)(F)F)NC(=O)N=C3c4ccccc4C(=Nc4ccccc4OC)N32)cc1 ZINC000254826852 JJ Agent Mild CC(C)(C)C(=O)C=c1sc(=Cc2c(F)cccc2Cl)c(=O)n1Cc1ccc(F)cc1Cl ZINC000254833198 JJ Agent Anodyne Cc1cccc(C)c1OCC(=O)NN=Cc1cccc(OC(=O)c2ccccc2Br)c1 ZINC000254835485 JJ Agent Anodyne O=C(NN=CCCc1ccccc1)c1ccc(CN2c3cccc4cccc(c34)S2(=O)=O)cc1 ZINC000254836591 JJ Agent Reactive aggregator COc1ccc(-c2nnc(SCC(=O)NN=Cc3ccccc3F)n2-c2ccc(Cl)cc2)cc1 ZINC000254837018 JJ Agent Anodyne O=C(c1nn(Cc2ccccc2)c(=O)c2ccccc12)N1CCCSC1=Nc1ccccc1 ZINC000254837873 JJ Agent Mild COc1ccccc1N=C1S[C@H](CC(=O)Nc2ccccc2C(F)(F)F)C(=O)N1C1CC1 ZINC000254838188 JJ Agent Anodyne CC[C@@H]1CSC(=Nc2ccc(Cl)c(Cl)c2)N1C(=O)c1nn(C)c(=O)c2ccccc12 ZINC000254838189 JJ Agent Anodyne COc1ccccc1N=C1S[C@@H](CC(=O)Nc2ccccc2C(F)(F)F)C(=O)N1C1CC1 ZINC000254838190 JJ Agent Anodyne CC[C@H]1CSC(=Nc2ccc(Cl)c(Cl)c2)N1C(=O)c1nn(C)c(=O)c2ccccc12 ZINC000254838191 JJ Agent Anodyne CCN(CC)c1ccc(C=Nc2cc(S(=O)(=O)N3CCCCC3)ccc2Cl)c(O)c1 ZINC000254838839 JJ Agent Anodyne CCC(CC)N1C(=O)[C@H](CC(=O)Nc2cc(OC)ccc2OC)SC1=Nc1ccc(F)cc1 ZINC000254840229 JJ Agent Anodyne CCC(CC)N1C(=O)[C@@H](CC(=O)Nc2cc(OC)ccc2OC)SC1=Nc1ccc(F)cc1 ZINC000254840230 JJ Agent Anodyne Cc1ccc(OCC(=O)NN=Cc2cccc(OC(=O)c3cccc(Br)c3)c2)cc1C ZINC000254840352 JJ Agent Anodyne COc1ccc(CCC(=O)NN=C(C)c2cccc(NC(=O)c3ccc(Br)o3)c2)cc1 ZINC000254841575 JJ Agent Anodyne C/N=C1\S[C@H](CC(=O)Nc2ccc(Cl)cc2)C(=O)N1N=C(C)c1ccc(OC(F)F)cc1 ZINC000254842335 JJ Agent Anodyne C/N=C1/S[C@@H](CC(=O)Nc2ccc(Cl)cc2)C(=O)N1N=C(C)c1ccc(OC(F)F)cc1 ZINC000254842336 JJ Agent Anodyne C/N=C1/S[C@H](CC(=O)Nc2ccc(Cl)cc2)C(=O)N1N=C(C)c1ccc(OC(F)F)cc1 ZINC000254842337 JJ Agent Anodyne C/N=C1\S[C@@H](CC(=O)Nc2ccc(Cl)cc2)C(=O)N1N=C(C)c1ccc(OC(F)F)cc1 ZINC000254842338 JJ Agent Anodyne COc1ccc(-c2nn(-c3ccccc3)cc2C=Nn2cnc3sc(C)c(C)c3c2=O)cc1OC ZINC000254844484 JJ Agent Mild CC(C)(C)c1ccc(C(=O)N=c2c(C#N)cc3c(=O)n4ccccc4nc3n2Cc2ccccc2)cc1 ZINC000254846360 JJ Agent Bother COc1cc(C=NNS(=O)(=O)c2ccc3ccccc3c2)cc(Br)c1OC(C)C ZINC000254847238 JJ Agent Anodyne CCOCCCN1C(=O)[C@H](CC(=O)Nc2ccccc2F)SC1=Nc1ccccc1OCC ZINC000254848889 JJ Agent Anodyne CCOCCCN1C(=O)[C@@H](CC(=O)Nc2ccccc2F)SC1=Nc1ccccc1OCC ZINC000254848890 JJ Agent Anodyne Cc1ccc(N=C2S[C@H](CC(=O)NCc3ccccc3)C(=O)N2Cc2ccccn2)c(C)c1 ZINC000254853928 JJ Agent Anodyne Cc1ccc(N=C2S[C@@H](CC(=O)NCc3ccccc3)C(=O)N2Cc2ccccn2)c(C)c1 ZINC000254853934 JJ Agent Anodyne COc1cc(C=NOCC(=O)N2CCc3ccccc32)ccc1OCc1ccc(Cl)cc1 ZINC000254855693 JJ Agent Anodyne Cc1ccccc1OCC(=O)NN=Cc1cccc(OC(=O)c2cccc(Br)c2)c1 ZINC000254855795 JJ Agent Anodyne Cc1ccc(Cn2nc(C)c(C=Nn3c(S)nnc3-c3ccc(OC(F)F)cc3)c2C)cc1 ZINC000254860896 JJ Agent Mild CCN=c1scc(-c2ccc(OC(F)F)cc2)n1N=Cc1c(OC)cc(OC)cc1OC ZINC000254861061 JJ Agent Mild C/C(C=NNC(=O)C(=O)Nc1ccccc1I)=C\c1ccc(C(C)C)cc1 ZINC000254866142 JJ Agent Anodyne O=C(C[C@H]1S/C(=N/N=Cc2ccccc2OCc2ccccc2Cl)NC1=O)Nc1ccccc1 ZINC000254866369 JJ Agent Anodyne O=C(C[C@@H]1S/C(=N/N=Cc2ccccc2OCc2ccccc2Cl)NC1=O)Nc1ccccc1 ZINC000254866371 JJ Agent Anodyne COC[C@H](C)n1c(-c2ccc(N3CCCC3=O)cc2)csc1=Nc1cccc(NC(C)=O)c1 ZINC000254866806 JJ Agent Anodyne COC[C@@H](C)n1c(-c2ccc(N3CCCC3=O)cc2)csc1=Nc1cccc(NC(C)=O)c1 ZINC000254866809 JJ Agent Anodyne COc1ccc(C=Nn2c(S)nnc2C(F)(F)Cl)cc1COc1ccc(Cl)cc1 ZINC000254867267 JJ Agent Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1C=NNC(=O)c1cc(-c2ccccc2)n[nH]1 ZINC000254868132 JJ Agent Anodyne CC(CC(=O)Nc1cccc(Cl)c1C)=NNC(=O)COc1ccc(C)cc1Br ZINC000254869756 JJ Agent Anodyne C=CCN=c1scc(-c2ccc(OC(F)F)cc2)n1N=Cc1cc(OC)c(OC)cc1OC ZINC000254869884 JJ Agent Mild Cn1ncc(N=Cc2cn(-c3ccccc3)nc2-c2ccccc2)c1C(=O)NCc1ccco1 ZINC000254871101 JJ Agent Mild COc1cc(CC(=O)N=c2sccn2Cc2ccc(Cl)cc2Cl)cc(OC)c1OC ZINC000254872264 JJ Agent Anodyne CCOc1cc(C(=O)NN=Cc2cn(-c3ccccc3)nc2-c2cccnc2)cc(OCC)c1OCC ZINC000254872710 JJ Agent Reactive COc1ccc(N=C2S[C@H](CC(=O)Nc3ccccc3OC)C(=O)N2Cc2ccccc2)cc1 ZINC000254874218 JJ Agent Anodyne COc1ccc(N=C2S[C@@H](CC(=O)Nc3ccccc3OC)C(=O)N2Cc2ccccc2)cc1 ZINC000254874219 JJ Agent Anodyne C(=NNc1nc(Nc2cccc3ccccc23)nc(N2CCOCC2)n1)c1c[nH]c2ccccc12 ZINC000254874410 JJ Agent Mild CCN(Cc1ccccc1)c1ccc(C=c2sc(=C(C#N)C#N)n(-c3c(C)cccc3C)c2=O)cc1 ZINC000254874903 JJ Agent Clean COc1cc(C=NNc2ccc(Cl)c(C(=O)O)c2)ccc1OCC(=O)N1[C@H](C)CCC[C@H]1C ZINC000254876100 JJ Agent Anodyne CN=c1scc(-c2ccc(Br)cc2)n1N=Cc1ccccc1I ZINC000254876736 JJ Agent Anodyne COc1cc(Cl)cc(C=NNc2nc(Nc3ccc(Cl)cc3)nc(-n3nc(C)cc3C)n2)c1O ZINC000254877651 JJ Agent Anodyne O=C(Nc1ccccc1)[C@@H]1CC(=O)N(Cc2ccc3c(c2)OCO3)C(=Nc2ccc(F)cc2)S1 ZINC000254877945 JJ Agent Anodyne CCN(CC)c1ccc(/C=C2\CCC(C=NNc3nc(C)cc(C)n3)=C2N2CCOCC2)cc1 ZINC000254879355 JJ Agent Mild C(=Nc1nc2ccccc2nc1N1CCN(C(c2ccccc2)c2ccccc2)CC1)N1CCOCC1 ZINC000254881189 JJ Agent Mild FC(F)Oc1ccc(-c2csc(=NC3CC3)n2N=Cc2ccc(N3CCOCC3)cc2)cc1 ZINC000254898002 JJ Agent Mild Cc1ccc(S(=O)(=O)Oc2ccc3ccccc3c2C=c2sc3nc4ccccc4n3c2=O)cc1 ZINC000254899517 JJ Agent Anodyne O=C(N=C1N=C2C=CC(I)=CN2Cc2ccccc21)c1cccc(Cl)c1 ZINC000254908207 JJ Agent Anodyne O=C(O)/C(Cl)=C(\Cl)C=NNC(=O)c1ccc(COc2ccc(Br)cc2Cl)o1 ZINC000254924493 JJ Agent Anodyne O=C(O)/C(Cl)=C(/Cl)C=NNC(=O)c1ccc(COc2ccc(Br)cc2Cl)o1 ZINC000254924494 JJ Agent Anodyne C/C(=N/NC(=O)c1ccc(OCC(=O)N2[C@H](C)CCC[C@H]2C)cc1)c1ccc2ccccc2c1O ZINC000255961448 JJ Agent Reactive O=C(CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)c1cccc(F)c1)[C@@H]23)NCc1ccccc1 ZINC000257175483 JJ Agent Anodyne CCOc1ccccc1NC(=O)N1CCC2(CC1)C[C@H](Cc1nc(-c3ccncc3)no1)CCO2 ZINC000257176223 JJ Agent Anodyne CCOc1ccccc1NC(=O)N1CCC2(CC1)C[C@@H](Cc1nc(-c3ccncc3)no1)CCO2 ZINC000257176225 JJ Agent Anodyne O=C(CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1Cc1cccnc1)[C@@H]23)N1CCc2ccccc2C1 ZINC000257178918 JJ Agent Anodyne CCN(Cc1ccncc1)C(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1Cc1ccccc1)[C@@H]23 ZINC000257179974 JJ Agent Anodyne O=C(CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)c1ccccc1F)[C@@H]23)Nc1ccccc1 ZINC000257181235 JJ Agent Anodyne Cn1c(CNC(=O)CCC[C@@H]2[C@H]3CCCN4CCC[C@@H](CN2Cc2ccccc2)[C@@H]34)nc2ccccc21 ZINC000257182278 JJ Agent Anodyne COc1ccccc1C(=O)N1C[C@@H]2CCCN3CCC[C@@H]([C@H]23)[C@H]1CCCC(=O)Nc1ccccc1 ZINC000257182321 JJ Agent Anodyne CCN(Cc1ccccc1)C(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1Cc1cccnc1)[C@@H]23 ZINC000257182410 JJ Agent Anodyne O=C(CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)c1ccccc1)[C@@H]23)NCc1cc(F)cc(F)c1 ZINC000257182473 JJ Agent Anodyne O=C(CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)c1cccc(F)c1)[C@@H]23)Nc1ccccc1 ZINC000257182895 JJ Agent Anodyne O=C(CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)c1cc(F)ccc1F)[C@@H]23)NCc1ccccc1 ZINC000257184387 JJ Agent Anodyne CCn1cc(CN(C)C(=O)CCC[C@@H]2[C@H]3CCCN4CCC[C@@H](CN2Cc2ccccc2)[C@@H]34)c(C)n1 ZINC000257185220 JJ Agent Anodyne Cc1ccccc1CNC(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1Cc1cccnc1)[C@@H]23 ZINC000257186982 JJ Agent Anodyne O=C(CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)c1cc(F)cc(F)c1)[C@@H]23)NCc1ccccc1 ZINC000257187063 JJ Agent Anodyne CN(Cc1cccnc1)C(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1Cc1ccccc1)[C@@H]23 ZINC000257189106 JJ Agent Anodyne Cc1ccc(C(=O)N2CCCCCCNC(=O)[C@@H]3C[C@@H](c4nc(Cc5ccccc5)no4)C[C@@H]32)s1 ZINC000257189537 JJ Agent Anodyne CCN(Cc1ccccc1)C(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)c1cccnc1)[C@@H]23 ZINC000257190726 JJ Agent Anodyne CN(Cc1ccc(N2CCCCC2)cc1)C(=O)CCC[C@H]1NC[C@@H]2C[C@H]1CN(Cc1ccccc1)C2 ZINC000257191559 JJ Agent Clean CN(CCc1ccccn1)C(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1Cc1ccccc1)[C@@H]23 ZINC000257192421 JJ Agent Anodyne O=C(CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)c1cccs1)[C@@H]23)NCc1ccccc1 ZINC000257193218 JJ Agent Anodyne CCn1nc(C)c(CNC(=O)CCC[C@@H]2[C@H]3CCCN4CCC[C@@H](CN2Cc2ccccc2)[C@@H]34)c1C ZINC000257193340 JJ Agent Anodyne O=C(CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)c1ccc(F)cc1)[C@@H]23)Nc1ccccc1 ZINC000257194348 JJ Agent Anodyne O=C(CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)c1cccs1)[C@@H]23)Nc1ccccc1 ZINC000257195216 JJ Agent Anodyne CCN(Cc1ccncc1)C(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)c1ccccc1)[C@@H]23 ZINC000257195695 JJ Agent Anodyne Cc1ccccc1CNC(=O)CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)c1ccccc1)[C@@H]23 ZINC000257195965 JJ Agent Anodyne COCCN1CCCCC[C@@H](O)c2cc(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)ccc21 ZINC000257196944 JJ Agent Clean COCCN1CCCCC[C@H](O)c2cc(C(=O)NCc3ccc(N4CCC(C)CC4)cc3)ccc21 ZINC000257196945 JJ Agent Clean O=C1NCCCCCCN(C(=O)Nc2ccccc2)[C@H]2C[C@H](c3nc(Cc4ccccc4)no3)C[C@@H]12 ZINC000257196975 JJ Agent Anodyne O=C(CCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1C(=O)c1ccsc1)[C@@H]23)NCc1ccccc1 ZINC000257196996 JJ Agent Anodyne Cc1ccc(C(=O)N=C2N=C3C=CC(I)=CN3Cc3ccccc32)cc1 ZINC000263622082 JJ Agent Mild CN=c1scc(-c2ccc(F)cc2)n1N=Cc1cc(Br)c(O)c(Br)c1 ZINC000263622260 JJ Agent Anodyne CCCc1ccc(C(=O)C(C#N)=c2sc(=Cc3cccs3)c(=O)n2-c2cc(C)ccc2C)cc1 ZINC000263622456 JJ Agent Anodyne FC(F)c1nnc(S)n1N=Cc1ccc(COc2ccc(Br)cc2Cl)o1 ZINC000263625868 JJ Agent Anodyne C=CCN(c1ccccc1)S(=O)(=O)c1cccc(C(=O)N=c2ccccn2Cc2ccccc2)c1 ZINC000263626196 JJ Agent Mild O=C(C[C@@H]1S/C(=N/N=Cc2c[nH]c3ccc(OCc4ccccc4)cc23)NC1=O)Nc1ccccc1 ZINC000263627287 JJ Agent Anodyne Cn1ncc(N=Cc2ccc(COc3ccc(F)cc3Cl)o2)c1C(=O)NCc1ccco1 ZINC000263629663 JJ Agent Anodyne Cc1cc(C)n(-c2nc(NN=Cc3ccc(F)cc3)nc(Nc3ccc(Br)cc3)n2)n1 ZINC000263629883 JJ Agent Anodyne CC(=NNS(=O)(=O)c1ccc(F)cc1)c1ccc(NC(=O)c2csc3c2CCCC3)cc1 ZINC000263630519 JJ Agent Mild Cn1cc(C(=O)NN=Cc2ccc(COc3ccccc3Br)o2)c2ccccc21 ZINC000263630699 JJ Agent Anodyne CCCCCn1c(=NC(=O)/C=C/c2ccc(Cl)cc2)c(C#N)cc2c(=O)n3ccccc3nc21 ZINC000263631695 JJ Agent Anodyne CCCCCn1c(=NC(=O)/C=C\c2ccc(Cl)cc2)c(C#N)cc2c(=O)n3ccccc3nc21 ZINC000263631696 JJ Agent Anodyne Cc1cc(Br)c(NCC(=O)NN=Cc2ccccc2Cl)c(Br)c1 ZINC000263632139 JJ Agent Anodyne Cc1cc(Br)ccc1NC(=O)CCC(=O)OCC(=O)c1ccc(Br)cc1 ZINC000003024312 JJ Agent Anodyne O=C(COc1ccccc1)N/N=C/c1ccc(Sc2nc3ccccc3s2)c([N+](=O)[O-])c1 ZINC000003073325 JJ Agent Reactive O=C(COC(=O)c1ccc(N2Cc3ccccc3C2)cc1O)c1ccc(Br)cc1 ZINC000003097295 JJ Agent Anodyne CCOC(=O)[C@](NC(=O)c1ccccc1Cl)(C(F)(F)F)P(=O)(OC(C)C)OC(C)C ZINC000003103437 JJ Agent Anodyne CCS(=O)(=O)c1ccc2oc(CN3C(=O)S/C(=C\c4ccccc4Cl)C3=O)nc2c1 ZINC000003169608 JJ Agent Anodyne CC[n+]1cn(-c2nc3ccccc3nc2NS(=O)(=O)c2cc(Cl)ccc2Cl)c2ccccc21 ZINC000003171933 JJ Agent Anodyne CN(C(=O)CCCN1C(=O)/C(=C/c2ccccc2OC(F)F)SC1=S)c1ccccc1 ZINC000003178137 JJ Agent Clean O=S(=O)(Nc1nc2ccccc2nc1-[n+]1ccc2ccccc2c1)c1ccc(Br)cc1 ZINC000003190912 JJ Agent Anodyne O=C1Nc2ccc(Br)cc2/C1=C1/SC(=S)N(c2ccccc2Cl)C1=O ZINC000003191585 JJ Agent Clean O=S(=O)(CCC1=C(N2CCOCC2)/C(=C/c2ccc(Cl)cc2)CC1)Oc1ccccc1 ZINC000003194202 JJ Agent Anodyne Cc1nn(-c2ccccc2)c2c1[P@@](=O)(N1CCOCC1)/C(=C1\N(C)c3ccccc3C1(C)C)C=N2 ZINC000003201577 JJ Agent Anodyne Cc1nn(-c2ccccc2)c2c1[P@](=O)(N1CCOCC1)/C(=C1\N(C)c3ccccc3C1(C)C)C=N2 ZINC000003201582 JJ Agent Anodyne COc1ccc(/C=C/C(=O)OC2=C(Sc3ccccc3[N+](=O)[O-])C(=O)CCC2)cc1OC ZINC000003205462 JJ Agent Mild COc1cc(/C=C2\CCC(C(=S)Nc3ccccc3)=C2N2CCOCC2)cc(OC)c1OC ZINC000003206801 JJ Agent Anodyne CCOc1cc(C(=O)N/N=C/C=C2\N(C)c3ccccc3C2(C)C)cc(OCC)c1OCC ZINC000003208180 JJ Agent Reactive CN1/C(=C/C(=O)C(=O)C2=C(N3CCOCC3)/C(=C/c3ccccc3)CC2)C(C)(C)c2ccccc21 ZINC000003214495 JJ Agent Mild COc1cc(NC(=O)C2=C(N3CCOCC3)/C(=C/c3ccc(Cl)cc3)CC2)cc(OC)c1OC ZINC000003218889 JJ Agent Anodyne CCN(CC)S(=O)(=O)c1ccc(/C=C/C(=O)OCc2csc(-c3ccccc3)n2)cc1 ZINC000003220353 JJ Agent Anodyne O=C1/C(=C/Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2C(=O)N1Cc1ccc2c(c1)OCO2 ZINC000003220696 JJ Agent Bother Cc1ccc(N/C(SCC(=O)N2CCOCC2)=C(/C#N)c2nc3ccccc3s2)cc1 ZINC000003220859 JJ Agent Reactive COc1ccccc1/C=C(/C(=O)OCC(=O)Nc1ncc(Br)s1)c1ccccc1 ZINC000003221836 JJ Agent Anodyne CCOc1ccc(S(=O)(=O)/N=C(\c2ccccc2)N2c3ccc(C)cc3[C@@H]3CN(C)CC[C@@H]32)cc1 ZINC000003237264 JJ Agent Mild O=C(CSc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12)Nc1ccccc1C(F)(F)F ZINC000003239618 JJ Agent Anodyne COc1ccc(/C=C(\C#N)C(=O)OCC(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1 ZINC000003240770 JJ Agent Reactive CCOc1ccccc1NC(=O)[C@H](OC(=O)/C(C#N)=C/c1ccc(OC)cc1)c1ccccc1 ZINC000003245698 JJ Agent Reactive CCOc1ccccc1NC(=O)[C@@H](OC(=O)/C(C#N)=C/c1ccc(OC)cc1)c1ccccc1 ZINC000003245700 JJ Agent Reactive Cc1ccccc1-n1c(=O)c2ccccc2n2c(SCC(=O)Nc3c(C)cccc3C)nnc12 ZINC000003257548 JJ Agent Anodyne COc1ccc(N2C(=O)/C(=C/c3ccco3)N=C2SCC(=O)Nc2ccccc2C#N)cc1Cl ZINC000003258976 JJ Agent Mild O=C(/C=C/c1cn(-c2ccccc2)nc1-c1cccnc1)OCC(=O)c1ccc(OC(F)F)cc1 ZINC000003260416 JJ Agent Anodyne O=S(=O)(Nc1nc2ccccc2nc1-[n+]1cccc(Cc2ccccc2)c1)c1ccc(Cl)cc1 ZINC000003261031 JJ Agent Anodyne CC(C)N(C(=O)CSc1nnc2n(Cc3ccccc3)c(=O)c3ccccc3n12)c1ccccc1 ZINC000003266605 JJ Agent Anodyne COC(=O)c1ccc(COc2ccccc2/C=C(\C#N)C(=O)NCc2ccc(Cl)cc2)cc1 ZINC000003271463 JJ Agent Reactive COc1ccc(C)cc1NC(=O)[C@H](OC(=O)/C(C#N)=C/c1ccc2c(c1)OCO2)c1ccccc1 ZINC000003278125 JJ Agent Reactive COc1ccc(C)cc1NC(=O)[C@@H](OC(=O)/C(C#N)=C/c1ccc2c(c1)OCO2)c1ccccc1 ZINC000003278129 JJ Agent Reactive Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)OCC(=O)Nc1ccc(SC(F)F)cc1 ZINC000003281936 JJ Agent Anodyne CC(C)(C)N(Cc1ccccc1)C(=O)CSc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12 ZINC000003290965 JJ Agent Anodyne O=C(CSc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12)Nc1cccc2ccccc12 ZINC000003292318 JJ Agent Anodyne CCN(CC)c1ccc(NC(=O)CSc2nnc3n(-c4ccccc4)c(=O)c4ccccc4n23)cc1 ZINC000003292332 JJ Agent Anodyne C=CCn1c(=O)c2ccccc2n2c(S[C@@H](C(=O)Nc3cccc(OC)c3)c3ccccc3)nnc12 ZINC000003292710 JJ Agent Mild C=CCn1c(=O)c2ccccc2n2c(S[C@H](C(=O)Nc3cccc(OC)c3)c3ccccc3)nnc12 ZINC000003292712 JJ Agent Mild Cc1ccc(Cl)cc1NC(=O)CSc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12 ZINC000003293603 JJ Agent Anodyne C=CCn1c(=O)c2ccccc2n2c(SCC(=O)Nc3ccc(Cl)cc3C(F)(F)F)nnc12 ZINC000003293690 JJ Agent Mild Cc1ccc(Cn2c(=O)c3ccccc3n3c(SCC(=O)N(CC(C)C)CC(C)C)nnc23)cc1 ZINC000003293697 JJ Agent Anodyne CCc1cccc(C)c1NC(=O)CSc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12 ZINC000003294202 JJ Agent Anodyne C=CCn1c(=O)c2ccccc2n2c(SCC(=O)Nc3ccc(OCc4ccccc4)cc3)nnc12 ZINC000003294204 JJ Agent Mild C=CCn1c(=O)c2ccccc2n2c(SCC(=O)Nc3c(Cl)ccc(C)c3Cl)nnc12 ZINC000003294459 JJ Agent Mild CC(C)N(Cc1ccccc1)C(=O)CSc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12 ZINC000003294552 JJ Agent Anodyne CC(C)c1ccccc1NC(=O)CSc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12 ZINC000003294581 JJ Agent Anodyne C=CCn1c(=O)c2ccccc2n2c(SCC(=O)Nc3cc(C(F)(F)F)ccc3Cl)nnc12 ZINC000003294812 JJ Agent Mild C=CCn1c(=O)c2ccccc2n2c(SCC(=O)N(CC)c3cccc4ccccc34)nnc12 ZINC000003294959 JJ Agent Mild CCCn1c[n+](-c2nc3ccccc3nc2NS(=O)(=O)c2ccc(Cl)cc2)c2ccccc21 ZINC000003295135 JJ Agent Anodyne O=C1CN(C(=O)COC(=O)/C(=C/c2ccc(Cl)cc2)c2ccc(F)cc2)c2ccccc2N1 ZINC000003295547 JJ Agent Anodyne O=C(CSc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12)Nc1ccc(F)cc1Cl ZINC000003295614 JJ Agent Anodyne O=C(CSc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12)c1ccc(Cl)s1 ZINC000003295743 JJ Agent Anodyne O=C(CSc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12)c1ccc(Br)s1 ZINC000003295777 JJ Agent Anodyne Cc1cc(NC(=O)/C(C#N)=C/c2sc(N3CCOCC3)nc2-c2ccccc2)n(-c2ccccc2)n1 ZINC000003296453 JJ Agent Reactive Cc1nn(Cc2ccccc2Cl)c(Cl)c1/C=C/C(=O)OCC(=O)N1CCCC[C@H]1C ZINC000003297440 JJ Agent Anodyne Cc1nn(Cc2ccccc2Cl)c(Cl)c1/C=C/C(=O)OCC(=O)N1CCCC[C@@H]1C ZINC000003297444 JJ Agent Anodyne CC(=O)N/C(=C\c1ccccc1)C(=O)OCC(=O)c1cc(C)n(-c2ccc(OC(F)F)cc2)c1C ZINC000003297792 JJ Agent Clean Cc1cc(C(=O)N/N=C/c2ccc(Sc3ncccn3)c([N+](=O)[O-])c2)c(C)n1-c1ccccc1 ZINC000003298940 JJ Agent Reactive C=CCn1c(=O)c2ccccc2n2c(SCC(=O)Nc3c(Cl)cccc3C(F)(F)F)nnc12 ZINC000003300059 JJ Agent Mild C=CCn1c(=O)c2ccccc2n2c(SCC(=O)Nc3c(Cl)cc(Cl)cc3Cl)nnc12 ZINC000003300065 JJ Agent Mild C=CCn1c(=O)c2ccccc2n2c(SCC(=O)Nc3ccc(Oc4ccccc4)cc3)nnc12 ZINC000003301676 JJ Agent Mild C=CCn1c(=O)c2ccccc2n2c(S[C@@H](C)C(=O)Nc3ccc(Cl)cc3Cl)nnc12 ZINC000003301683 JJ Agent Mild C=CCn1c(=O)c2ccccc2n2c(S[C@H](C)C(=O)Nc3ccc(Cl)cc3Cl)nnc12 ZINC000003301685 JJ Agent Mild Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)O[C@@H](C)C(=O)Nc1ncc(Cl)cc1Cl ZINC000003302304 JJ Agent Anodyne Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)O[C@H](C)C(=O)Nc1ncc(Cl)cc1Cl ZINC000003302308 JJ Agent Anodyne Cc1cc(/C=C(\C#N)C(=O)OCC(=O)Nc2ccccc2OC(F)F)c(C)n1CCC(C)C ZINC000003303206 JJ Agent Reactive N#C/C(=C\c1sc(N2CCOCC2)nc1-c1ccccc1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000003307668 JJ Agent Reactive N#C/C(=C/c1sc(N2CCOCC2)nc1-c1ccccc1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000003307670 JJ Agent Reactive COc1ccc(/C=C(\C#N)S(=O)(=O)c2cc(Br)ccc2Br)c(OC)c1 ZINC000003308727 JJ Agent Reactive COc1ccc(/C=C2\N=C(SCC(=O)NCC(C)C)N(c3cc(C)cc(C)c3)C2=O)cc1 ZINC000003315013 JJ Agent Anodyne COc1ccc(N2C(=O)/C(=C\c3cccs3)N=C2SCC(=O)Nc2cc(C)on2)cc1Cl ZINC000003315093 JJ Agent Anodyne Cc1ccc(Cn2c(=O)c3ccccc3n3c(SCC(=O)Nc4cccc(Cl)c4)nnc23)cc1 ZINC000003316718 JJ Agent Anodyne Cc1ccc(NC(=O)COC(=O)c2ccccc2N/C=C/C(=O)C(F)(F)F)c(Br)c1 ZINC000003317521 JJ Agent Mild O=C(CN(Cc1ccccc1Cl)S(=O)(=O)/C=C/c1ccccc1)Nc1ccc2c(c1)OCO2 ZINC000003323366 JJ Agent Anodyne O=C(CCCSc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12)c1ccc(F)cc1 ZINC000003325209 JJ Agent Anodyne Cn1cnnc1Sc1ccc(/C=C2/N=C(c3ccc(Cl)cc3Cl)OC2=O)cc1[N+](=O)[O-] ZINC000003326208 JJ Agent Bother O=C(/C=C/c1c(Cl)nc2sccn12)Nc1cc(C(F)(F)F)ccc1N1CCOCC1 ZINC000003328961 JJ Agent Anodyne C=CCn1c(=O)c2ccccc2n2c(SCC(=O)Nc3ccccc3Oc3ccccc3)nnc12 ZINC000003338315 JJ Agent Mild C=CCn1c(C)cc(C(=O)CSc2nnc3n(-c4ccccc4)c(=O)c4ccccc4n23)c1C ZINC000003338402 JJ Agent Mild C=CCN(CC(=O)/C=C1/N(C)c2ccccc2C1(C)C)S(=O)(=O)c1c(C)c(C)cc(C)c1C ZINC000003339102 JJ Agent Mild COc1ccc(/C=C2/N=C(SCC(=O)Nc3ccccc3C#N)N(c3cccc(OC)c3)C2=O)cc1 ZINC000003340096 JJ Agent Mild COc1ccc(/C=C2\N=C(SCC(=O)Nc3ccccc3C#N)N(c3cccc(OC)c3)C2=O)cc1 ZINC000003340097 JJ Agent Mild COc1ccc(N2C(=O)/C(=C/c3cccs3)N=C2SCC(=O)NCC(F)(F)F)cc1Cl ZINC000003344159 JJ Agent Anodyne Cc1ccc(C(=O)OCC(=O)/C=C2/N(C)c3ccccc3C2(C)C)cc1NC(=O)c1ccco1 ZINC000003346099 JJ Agent Mild COc1cc2c(cc1OC)CN(C(=O)/C=C/c1c(C)nn(-c3ccc(F)cc3)c1Cl)CC2 ZINC000003349452 JJ Agent Anodyne N#C/C(=C(\OC(=O)Cc1c(Cl)cccc1Cl)C(F)(F)F)c1nnc2n1CCCCC2 ZINC000003353214 JJ Agent Reactive COc1cccc(-n2c(=O)c3ccccc3n3c(SCc4cc(=O)oc5cc(C)ccc45)nnc23)c1 ZINC000003358898 JJ Agent Anodyne CC(=O)c1ccc(Sc2nnc3n(Cc4ccc(C)cc4)c(=O)c4ccccc4n23)c([N+](=O)[O-])c1 ZINC000003363833 JJ Agent Bother O=C1c2cccc3cc([N+](=O)[O-])cc(c23)C(=O)N1/N=C/c1ccc(OC(F)F)cc1OC(F)F ZINC000003366503 JJ Agent Mild COc1ccc(N2C(=O)/C(=C/c3cccs3)N=C2SCC(=O)N2CCCCC2)cc1Cl ZINC000003367728 JJ Agent Anodyne COc1cc(/C=C/C(=O)OCC(=O)Nc2c(Cl)cccc2C(F)(F)F)cc(OC)c1OC ZINC000003373023 JJ Agent Anodyne CCCn1c(=O)c2ccccc2n2c(SCc3c(C(=O)OCC)oc4ccccc34)nnc12 ZINC000003375429 JJ Agent Anodyne CCCn1c(=O)c2ccccc2n2c(SCc3nnc(-c4ccccc4Br)o3)nnc12 ZINC000003375472 JJ Agent Anodyne Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C/C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000003377818 JJ Agent Anodyne Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C/C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000003377824 JJ Agent Anodyne COc1ccc(Br)cc1/C=C/C(=O)OCC(=O)Nc1nc(C)c(Cl)cc1Cl ZINC000003379804 JJ Agent Anodyne Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C/C(=O)OCC(=O)Nc1ccc(F)c(F)c1F ZINC000003379945 JJ Agent Anodyne Cc1cc(/C=C(\C#N)C(=O)OCC(=O)Nc2ccccc2OC(F)F)c(C)n1-c1ccccc1F ZINC000003381254 JJ Agent Reactive O=C(COC(=O)/C=C/c1cnc2ccccc2n1)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000003390486 JJ Agent Anodyne Cc1ccc(Cn2c(=O)c3ccccc3n3c(SCC(=O)Nc4ccc5c(c4)CCC5)nnc23)cc1 ZINC000003393823 JJ Agent Anodyne O=C(CSC1=N/C(=C/c2ccco2)C(=O)N1c1ccc(OC(F)F)cc1)NCc1cccs1 ZINC000003409065 JJ Agent Anodyne O=C(CSC1=N/C(=C\c2ccco2)C(=O)N1c1ccc(OC(F)F)cc1)NCc1cccs1 ZINC000003409067 JJ Agent Anodyne O=C1/C(=C\c2ccccc2)N=C(SCc2cc(=O)n3ccsc3n2)N1c1ccc(F)cc1 ZINC000003410791 JJ Agent Anodyne Cc1ccc(N2C(=O)/C(=C\Nc3ccccc3C(=O)NC3CC3)c3ccccc3C2=O)cc1C ZINC000003410794 JJ Agent Anodyne O=C1/C(=C/c2ccccc2)N=C(SCc2cc(=O)n3ccsc3n2)N1c1ccc(F)cc1 ZINC000003410795 JJ Agent Anodyne Cc1nn(Cc2ccccc2Cl)c(Cl)c1/C=C/C(=O)OCC(=O)N1CCc2ccccc21 ZINC000003413412 JJ Agent Anodyne CCOC(=O)c1sc(NC(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccnc2)nc1C ZINC000003414052 JJ Agent Anodyne Cc1ccc(N2C(=O)/C(=C\NCC(=O)Nc3c(C)cccc3C)c3ccccc3C2=O)cc1C ZINC000003418985 JJ Agent Anodyne CN(C)[C@@H](CN/C=C1/C(=O)N(c2cccc(Cl)c2)C(=O)c2ccccc21)c1cccs1 ZINC000003419136 JJ Agent Anodyne CN(C)[C@H](CN/C=C1/C(=O)N(c2cccc(Cl)c2)C(=O)c2ccccc21)c1cccs1 ZINC000003419144 JJ Agent Anodyne COc1cccc(/C=C(/C(=O)OCc2cc(=O)n3cc(Br)ccc3n2)c2ccccc2)c1 ZINC000003425028 JJ Agent Anodyne C=CCn1c(=O)c2ccccc2n2c(SCC(=O)c3cc(C)n(-c4ccc(OC)cc4)c3C)nnc12 ZINC000003427208 JJ Agent Mild O=C(/C=C/c1ccc(S(=O)(=O)N2CCc3ccccc32)cc1)OCC(=O)c1ccc(Cl)s1 ZINC000003428416 JJ Agent Anodyne CCCOc1ccc(/C=C/C(=O)OCc2cc(=O)n3c(n2)sc2ccccc23)cc1OCC ZINC000003429565 JJ Agent Anodyne Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C/C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000003431283 JJ Agent Bother COc1ccccc1-n1c(C)cc(/C=C(\C#N)C(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)c1C ZINC000003431799 JJ Agent Reactive Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C/C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000003431835 JJ Agent Bother Cc1nn(-c2ccccc2)c(C)c1/C=C/C(=O)OCC(=O)c1cc(C)n(CC(F)(F)F)c1C ZINC000003432226 JJ Agent Anodyne CCN(CC)S(=O)(=O)c1ccc(/C=C/C(=O)N(c2ccccc2)c2nc(C)cs2)cc1 ZINC000003432746 JJ Agent Anodyne COc1cc(/C=C/C(=O)Nc2ccccc2C(=O)NCc2ccc3c(c2)OCO3)ccc1OC(F)F ZINC000003432792 JJ Agent Anodyne COc1cc(/C=C/C(=O)O)cc(S(=O)(=O)Nc2cc(Cl)c(Cl)cc2Cl)c1OC ZINC000003442241 JJ Agent Anodyne Cc1nn(Cc2ccccc2)c(Cl)c1/C=C/C(=O)OCC(=O)N[C@@H](C)CCc1ccccc1 ZINC000003442945 JJ Agent Anodyne Cc1nn(Cc2ccccc2)c(Cl)c1/C=C/C(=O)OCC(=O)N[C@H](C)CCc1ccccc1 ZINC000003442951 JJ Agent Anodyne CC(=O)c1cccc(NC(=O)COC(=O)/C=C/c2c(C)nn(Cc3ccc(C)cc3)c2Cl)c1 ZINC000003448277 JJ Agent Anodyne O=C1/C(=C/c2cn(-c3ccccc3)nc2-c2cccs2)CS(=O)(=O)c2ccc(F)cc21 ZINC000003449050 JJ Agent Mild O=C1/C(=C\c2cn(-c3ccccc3)nc2-c2cccs2)CS(=O)(=O)c2ccc(F)cc21 ZINC000003449054 JJ Agent Mild O=C(CSC1=N/C(=C\c2ccc(Cl)c(Cl)c2)C(=O)N1c1ccccc1F)NC1CC1 ZINC000003449922 JJ Agent Anodyne COc1ccc(-n2c(C)cc(/C=C(\C#N)C(=O)OCc3cc([N+](=O)[O-])cc4c3OCOC4)c2C)cc1 ZINC000003450965 JJ Agent Reactive Cc1noc(C)c1COc1ccc(CC(=O)OCC(=O)/C=C2/N(C)c3ccccc3C2(C)C)cc1 ZINC000003450994 JJ Agent Mild Cc1nc(NC(=O)COC(=O)/C=C/c2c(C)nn(-c3ccc(F)cc3)c2C)c(Cl)cc1Cl ZINC000003451854 JJ Agent Anodyne O=C(CSC1=N/C(=C/c2ccccc2)C(=O)N1c1ccc(F)cc1)N1CCc2ccccc2C1 ZINC000003460348 JJ Agent Anodyne O=C(CSC1=N/C(=C\c2ccccc2)C(=O)N1c1ccc(F)cc1)N1CCc2ccccc2C1 ZINC000003460354 JJ Agent Anodyne COc1ccc(N2C(=O)/C(=C/c3ccco3)N=C2SCc2cc(=O)n3ccsc3n2)cc1Cl ZINC000003490580 JJ Agent Anodyne Cc1ccc(Cn2c(=O)c3ccccc3n3c(S[C@@H](C)C(=O)Nc4ccccc4)nnc23)cc1 ZINC000003492164 JJ Agent Anodyne Cc1ccc(Cn2c(=O)c3ccccc3n3c(S[C@H](C)C(=O)Nc4ccccc4)nnc23)cc1 ZINC000003492166 JJ Agent Anodyne COc1ccccc1Cn1c(=O)c2ccccc2n2c(SCC(=O)c3ccc(Cl)cc3)nnc12 ZINC000003509708 JJ Agent Anodyne C=CCn1c(=O)c2ccccc2n2c(SCc3cc(=O)oc4ccc5ccccc5c34)nnc12 ZINC000003516438 JJ Agent Mild CCN(C(=O)[C@@H](C)Sc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12)c1ccccc1 ZINC000003556812 JJ Agent Anodyne CCN(C(=O)[C@H](C)Sc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12)c1ccccc1 ZINC000003556814 JJ Agent Anodyne CCN(C(=O)[C@@H](C)Sc1nnc2n(Cc3ccc(C)cc3)c(=O)c3ccccc3n12)c1ccccc1 ZINC000003556949 JJ Agent Anodyne CCN(C(=O)[C@H](C)Sc1nnc2n(Cc3ccc(C)cc3)c(=O)c3ccccc3n12)c1ccccc1 ZINC000003556951 JJ Agent Anodyne CCOc1c(Br)cc(/C=C(\C#N)S(=O)(=O)c2ccc(Cl)cc2)cc1OC ZINC000003560257 JJ Agent Reactive CC[C@@H](C)c1ccc(-n2c(=O)c3ccccc3n3c(SCC(=O)N4CCCCC4)nnc23)cc1 ZINC000003565280 JJ Agent Anodyne CC[C@H](C)c1ccc(-n2c(=O)c3ccccc3n3c(SCC(=O)N4CCCCC4)nnc23)cc1 ZINC000003565281 JJ Agent Anodyne COc1cc(/C=N/OCc2cc([N+](=O)[O-])cc3c2OCOC3)ccc1OCc1ccccc1 ZINC000003579052 JJ Agent Mild CCOc1cc(/C=C(\C#N)S(=O)(=O)c2ccc(F)cc2)cc(Br)c1OCC ZINC000003588684 JJ Agent Reactive CCCOc1c(Br)cc(/C=C(\C#N)S(=O)(=O)c2ccc(F)cc2)cc1OC ZINC000003588689 JJ Agent Reactive COc1cccc(/C=C(\C#N)S(=O)(=O)c2cc(Br)ccc2Br)c1 ZINC000003588776 JJ Agent Reactive CC(C)N(C(=O)CSc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12)c1ccccc1 ZINC000003590464 JJ Agent Anodyne COc1ccc(C(C)=O)cc1CSc1nnc2n(-c3ccccc3)c(=O)c3ccccc3n12 ZINC000003590499 JJ Agent Anodyne CCOC(=O)c1c(CN2CCCC2)oc2cc(Br)c(OC)c(Br)c12 ZINC000003627560 JJ Agent Anodyne CCOC(=O)CSc1nc2c(sc(=S)n2Cc2ccccc2)c(=O)n1-c1ccccc1OC ZINC000003629910 JJ Agent Anodyne CCCCCS(=O)(=O)NC(=O)c1ccc2nc(C)n(Cc3ccc(Cl)cc3Cl)c2c1 ZINC000003820333 JJ Agent Anodyne in-man O=C1C=C[C@H]2C(=C1Br)Oc1c(ccc(O)c1Br)[C@H]2c1ccccc1C(=O)O ZINC000003861528 JJ Agent Anodyne Cc1ccc(/C=C/C2=Cc3c(sc(NC(=O)CSc4n[nH]c(N)n4)c3C#N)C(C)(C)C2)o1 ZINC000004195189 JJ Agent Mild N/C(=N\OC(=O)c1ccc(C(F)(F)F)cc1)c1cccc(Cn2cnc(Cl)c2Cl)c1 ZINC000004285941 JJ Agent Mild Cc1cc(NC(=O)/C(C#N)=C\c2sc(N3CCOCC3)nc2-c2ccccc2)n(-c2ccccc2)n1 ZINC000004489255 JJ Agent Reactive COc1cc2c(cc1OC)[C@@H](C(=O)Nc1ccc(C)c(F)c1)[C@@H](c1ccccc1F)N(C)C2=O ZINC000004760397 JJ Agent Anodyne COc1cc2c(cc1OC)[C@H](C(=O)Nc1ccc(C)c(F)c1)[C@@H](c1ccccc1F)N(C)C2=O ZINC000004760398 JJ Agent Anodyne COc1cc2c(cc1OC)[C@@H](C(=O)Nc1ccc(C)c(F)c1)[C@H](c1ccccc1F)N(C)C2=O ZINC000004760399 JJ Agent Anodyne COc1cc2c(cc1OC)[C@H](C(=O)Nc1ccc(C)c(F)c1)[C@H](c1ccccc1F)N(C)C2=O ZINC000004760402 JJ Agent Anodyne O=C(Nc1ccccc1)[C@H]1CC(=O)N(Cc2ccc3c(c2)OCO3)C(=Nc2ccc(F)cc2)S1 ZINC000000710484 JJ Agent Anodyne COc1ccc(C(C)=NOCc2nc3c4c5c(sc4ncn3n2)CCCCC5)cc1OC ZINC000000894769 JJ Agent Anodyne CCOc1ccc(S(=O)(=O)/N=C2\C=CC(=O)C(Sc3nc4ccccc4s3)=C2)cc1 ZINC000000944524 JJ Agent Mild CCOc1cc(/C=C(\C#N)S(=O)(=O)c2ccccc2)ccc1OC(=O)c1ccc(OC)cc1 ZINC000058976374 JJ Agent Reactive N#C/C(=C\c1cccc(OC(=O)c2ccc(Cl)cc2)c1)C(=O)NCc1ccc2c(c1)OCO2 ZINC000058978698 JJ Agent Reactive CC(C)(C(=O)OCCSc1ccc(Cl)cc1)S(=O)(=O)c1ccc(C(F)(F)F)cn1 ZINC000006059000 JJ Agent Anodyne COc1cc(/C=C/C(=O)O)cc(S(=O)(=O)Nc2cc(C(F)(F)F)cc(C(F)(F)F)c2)c1OC ZINC000006144446 JJ Agent Anodyne CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccc(Cl)cc2)n2c(sc(=Cc3ccccc3)c2=O)=N1 ZINC000006172279 JJ Agent Anodyne CCOc1ccccc1NC(=O)[C@@H](OC(=O)/C(C#N)=C\c1ccc(OC)cc1)c1ccccc1 ZINC000006271127 JJ Agent Reactive CCS(=O)(=O)c1ccc2oc(CN3C(=O)S/C(=C/c4ccccc4Cl)C3=O)nc2c1 ZINC000006271221 JJ Agent Anodyne Cc1ccc(/C=C\C2=Cc3c(sc(NC(=O)CSc4n[nH]c(N)n4)c3C#N)C(C)(C)C2)o1 ZINC000008014797 JJ Agent Mild CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1 ZINC000008382330 JJ Agent Anodyne CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1 ZINC000008382331 JJ Agent Anodyne CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@H]4C[C@H](O)[C@@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1 ZINC000008382332 JJ Agent Anodyne CC(C)(O)[C@@H]1CC[C@](C)([C@H]2[C@@H](O)C[C@@]3(C)[C@H]4C[C@H](O)[C@H]5C(C)(C)[C@@H](O)CC[C@]5(C)C4=CC[C@]23C)O1 ZINC000008382333 JJ Agent Anodyne CN(C)c1ccc(/C=C2\CCC[C@@H]3C2=NN(C(=O)CCC(=O)O)[C@@H]3c2ccc(N(C)C)cc2)cc1 ZINC000008431619 JJ Agent Clean CN(C)c1ccc(/C=C2\CCC[C@@H]3C2=NN(C(=O)CCC(=O)O)[C@H]3c2ccc(N(C)C)cc2)cc1 ZINC000008431621 JJ Agent Clean N#CC1(NC(=O)COC(=O)c2c3c(nc4ccccc24)/C(=C/c2ccc(O)cc2)CC3)CCCCC1 ZINC000008629241 JJ Agent Mild CCOc1cc(/C=C/c2nc3cc(C)c(C)cc3s2)ccc1OCC(=O)N1CCOCC1 ZINC000008684988 JJ Agent Anodyne Cc1cc(/C=C(\C#N)c2nnc(N3CCOCC3)n2-c2ccccc2)c(C)n1-c1ccccc1 ZINC000008687942 JJ Agent Reactive N#C/C(=C\C1=C(N2CCOCC2)/C(=C/c2cccc([N+](=O)[O-])c2)CC1)C(=O)Nc1ccccc1F ZINC000008691202 JJ Agent Reactive O=C1/C(=C/Nc2nnc(Cc3ccccc3)s2)c2ccccc2C(=O)N1c1ccc(Cl)cn1 ZINC000008691216 JJ Agent Anodyne aggregator CCOC(=O)Cc1csc(N/C=C2/C(=O)N(c3ccc(C)cc3C)C(=O)c3ccccc32)n1 ZINC000008692126 JJ Agent Anodyne CC[C@@H](C)N(CC(=O)Nc1cccc(C)c1C)C(=O)COC(=O)/C=C/c1cccc2cccnc12 ZINC000008705460 JJ Agent Anodyne CC[C@H](C)N(CC(=O)Nc1cccc(C)c1C)C(=O)COC(=O)/C=C/c1cccc2cccnc12 ZINC000008705461 JJ Agent Anodyne Cc1cc(C2=NN/C(=N/c3c(C)n(C)n(-c4ccccc4)c3=O)SC2)c(C)n1-c1ccccc1 ZINC000008719489 JJ Agent Mild Cc1ccccc1-n1c(=O)c2ccccc2n2c(=S)n(CN3CCc4[nH]c5ccccc5c4C3)nc12 ZINC000008721286 JJ Agent Anodyne Cc1cc(C2=NN/C(=N/c3c(C)n(C)n(-c4ccccc4)c3=O)SC2)c(C)n1-c1ccc(F)cc1 ZINC000008747244 JJ Agent Mild CCc1ccccc1NC(=O)CSc1nnc2n(Cc3ccc(C)cc3)c(=O)c3ccccc3n12 ZINC000008749698 JJ Agent Anodyne O=C(/C=C/c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc(S(=O)(=O)N2CCCC2)cc1 ZINC000008752449 JJ Agent Mild Cc1ccc(/C=C/C(=O)N(C)CC(=O)Nc2ccccc2C(F)(F)F)c(Br)c1 ZINC000008772426 JJ Agent Anodyne O=C(CSC1=N/C(=C/c2ccc(Cl)c(Cl)c2)C(=O)N1c1ccccc1F)NC1CC1 ZINC000008773157 JJ Agent Anodyne aggregator Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C/C(=O)N1CCC(C(=O)N2CCCCCC2)CC1 ZINC000008778368 JJ Agent Anodyne Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C/C(=O)N(C)Cc1ccccc1N1CCOCC1 ZINC000008779779 JJ Agent Anodyne Cc1c(Br)cc(NCC(=O)NN=Cc2ccc(Cl)cc2)cc1Br ZINC000008809630 JJ Agent Anodyne CNc1nc(NN=Cc2ccc(OC)c(Br)c2)nc(Nc2cccc(C(F)(F)F)c2)n1 ZINC000008809827 JJ Agent Anodyne O=C(N/N=C/c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc(CSc2nc3ccccc3s2)cc1 ZINC000008824811 JJ Agent Reactive C=CCOc1ccc(CN(C[C@@H]2CCCO2)C(=O)/C=C/c2ccc(-n3ccnc3)cc2)cc1OC ZINC000008825436 JJ Agent Mild C=CCOc1ccc(CN(C[C@H]2CCCO2)C(=O)/C=C/c2ccc(-n3ccnc3)cc2)cc1OC ZINC000008825437 JJ Agent Mild CC(=O)c1ccc(/N=C2/SCCCN2C(=O)c2nn(-c3ccccc3Cl)c(C)cc2=O)cc1 ZINC000008825980 JJ Agent Mild CCOc1cc(C(=O)N2N=C3c4ccccc4C(=O)[C@@H]4C=CC=C2[C@@H]34)cc(OCC)c1OCC ZINC000008834322 JJ Agent Anodyne CCOc1cc(C(=O)N2N=C3c4ccccc4C(=O)[C@H]4C=CC=C2[C@@H]34)cc(OCC)c1OCC ZINC000008834323 JJ Agent Anodyne CCOc1cc(C(=O)N2N=C3c4ccccc4C(=O)[C@@H]4C=CC=C2[C@H]34)cc(OCC)c1OCC ZINC000008834324 JJ Agent Anodyne CCOc1cc(C(=O)N2N=C3c4ccccc4C(=O)[C@H]4C=CC=C2[C@H]34)cc(OCC)c1OCC ZINC000008834325 JJ Agent Anodyne Cc1nn(Cc2ccccc2)c(Cl)c1/C=C/C(=O)N(C)Cc1cnn(Cc2ccccc2)c1 ZINC000008862162 JJ Agent Anodyne COc1ccc(N=C2S[C@@H](C(=O)Nc3ccc(C(=O)O)cc3)CC(=O)N2Cc2cccs2)cc1 ZINC000008868944 JJ Agent Anodyne COc1ccc(N=C2S[C@H](C(=O)Nc3ccc(C(=O)O)cc3)CC(=O)N2Cc2cccs2)cc1 ZINC000008868947 JJ Agent Anodyne CCOc1cc(/C=C/c2nc3ccc([N+](=O)[O-])cc3s2)cc(Cl)c1OCC(=O)N(C)C ZINC000008880293 JJ Agent Bother Cc1ccc(Cn2nc(C)c(/C=C/C(=O)OCC(=O)c3cc(C)n(-c4cc(C)on4)c3C)c2C)cc1 ZINC000008883029 JJ Agent Anodyne Cn1cnnc1SCC(=O)N1N=C2/C(=C/c3cccs3)CCC[C@@H]2[C@H]1c1cccs1 ZINC000008897437 JJ Agent Anodyne Cn1cnnc1SCC(=O)N1N=C2/C(=C/c3cccs3)CCC[C@@H]2[C@@H]1c1cccs1 ZINC000008897443 JJ Agent Anodyne O=C(C1CCN(c2ncnc3c2sc2cccc(F)c23)CC1)N1CCN(c2ccccc2)CC1 ZINC000008912771 JJ Agent Anodyne COc1cccc(OCCCn2cc(/C=C3/C(=N)N4N=C(C)SC4=NC3=O)c3ccccc32)c1 ZINC000008916775 JJ Agent Clean C=CCOc1ccc(/C=C2/C(=N)N3N=C(SCc4ccccc4)SC3=NC2=O)cc1OC ZINC000008958809 JJ Agent Mild COCCN/C(C)=C1/C(=O)N(c2nc3ccccc3s2)N=C1CSc1ccc(Cl)cc1 ZINC000008984325 JJ Agent Clean COc1ccc(OCCn2c(C)c(/C=c3\sc4nc5ccccc5n4c3=O)c3ccccc32)cc1 ZINC000008985659 JJ Agent Anodyne CC(=O)N(c1nc(/C=C/C(=O)N2CCC(C(=O)N3CCCCCC3)CC2)cs1)c1ccccc1F ZINC000009048591 JJ Agent Anodyne O=C(/C(=C/c1ccc(-c2ccccc2Br)o1)c1nc2ccccc2[nH]1)N1CCOCC1 ZINC000009056820 JJ Agent Anodyne Cc1ccccc1OCC1=NN2C(=N)/C(=C/c3cc(Cl)c(O)c(Cl)c3)C(=O)N=C2S1 ZINC000009057158 JJ Agent Clean CCN(C(=O)[C@@H](C)N1C(=O)c2ccccc2C1=O)[C@H](C(=O)Nc1c(C)cccc1C)c1ccccc1 ZINC000009057251 JJ Agent Anodyne CCN(C(=O)[C@@H](C)N1C(=O)c2ccccc2C1=O)[C@@H](C(=O)Nc1c(C)cccc1C)c1ccccc1 ZINC000009057252 JJ Agent Anodyne CCN(C(=O)[C@H](C)N1C(=O)c2ccccc2C1=O)[C@H](C(=O)Nc1c(C)cccc1C)c1ccccc1 ZINC000009057253 JJ Agent Anodyne CCN(C(=O)[C@H](C)N1C(=O)c2ccccc2C1=O)[C@@H](C(=O)Nc1c(C)cccc1C)c1ccccc1 ZINC000009057254 JJ Agent Anodyne CCOc1cc(/C=C(/C(=O)N2CCOCC2)c2nc3ccccc3[nH]2)ccc1OCc1ccccc1 ZINC000009058181 JJ Agent Anodyne COc1cc(/C=C(\C#N)c2nnc3n2CCCCC3)ccc1OC(=O)c1ccc(Br)o1 ZINC000009086885 JJ Agent Reactive N#C/C(=C\c1c(-c2ccccc2)nc2sccn12)c1nnc(N2CCOCC2)n1-c1ccccc1 ZINC000009090393 JJ Agent Reactive Nc1cc(S(=O)(=O)N(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)c2cccc(Cl)c2)ccc1Cl ZINC000009090453 JJ Agent Bother CCNc1ccc(C(=O)N/N=C/c2cn(-c3cccs3)nc2-c2ccccc2)cc1[N+](=O)[O-] ZINC000009097003 JJ Agent Reactive COc1ccccc1NS(=O)(=O)c1ccc(N/N=C/c2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000009097229 JJ Agent Mild CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)/C=C/c1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000009114422 JJ Agent Anodyne CC(=O)Nc1ccc2c(COC(=O)/C=C/c3c(C)nn(Cc4ccc(C)cc4)c3C)cc(=O)oc2c1 ZINC000009119746 JJ Agent Anodyne COc1cc(/C=C2\SC(N3CCOCC3)=NC2=O)ccc1OCc1ccc(Cl)cc1Cl ZINC000009120536 JJ Agent Clean COc1cc(/C=C(\C#N)c2nnc3n2CCCCC3)ccc1OC(=O)c1cc(F)c(F)c(F)c1F ZINC000009120614 JJ Agent Reactive Cc1ccc(-n2c(=O)c3ccccc3n3c(SCC(=O)c4c[nH]c5ccccc45)nnc23)cc1 ZINC000009124986 JJ Agent Anodyne O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccco1)CC2)Nc1ccc2c(c1)OCO2 ZINC000009125483 JJ Agent Anodyne COC(=O)c1ccc(COc2ccc(/C=C/c3nc(-c4ccc(O)cc4)no3)cc2OC)cc1 ZINC000009126010 JJ Agent Anodyne O=C(CSc1nnc2n(Cc3ccccc3)c(=O)c3ccccc3n12)c1c[nH]c2ccccc12 ZINC000009127097 JJ Agent Anodyne CCOC(=O)/C(=C\c1ccc(OC)c(O)c1)C1=Nn2c(nnc2-c2ccc(C(C)(C)C)cc2)SC1 ZINC000009127486 JJ Agent Anodyne CCN1C[C@H](CN(C)C(=O)/C=C/c2ccc(OCc3c(C)noc3C)c(OC)c2)Oc2ccccc21 ZINC000009156482 JJ Agent Anodyne CCN1C[C@@H](CN(C)C(=O)/C=C/c2ccc(OCc3c(C)noc3C)c(OC)c2)Oc2ccccc21 ZINC000009156483 JJ Agent Anodyne Cc1[nH]c2ccccc2c1C(=O)CSc1nnc2n(CCC(C)C)c(=O)c3ccccc3n12 ZINC000009157372 JJ Agent Anodyne COc1cc(/C=C/c2ccc3c([N+](=O)[O-])cccc3n2)cc(Br)c1OCC(=O)N(C)C ZINC000009168310 JJ Agent Bother O=C(Nc1nc(-c2cccs2)cs1)C1CCN(S(=O)(=O)/C=C/c2ccccc2)CC1 ZINC000009171636 JJ Agent Anodyne CC(=O)Nc1ccc(/C=C(/C(=O)N2CCCC2)c2nc3sc(-c4ccccc4)cc3c(=O)[nH]2)cc1 ZINC000009218982 JJ Agent Anodyne COc1ccc(/C=C(/C(=O)N2CCCC2)c2nc3sc(-c4ccccc4)cc3c(=O)[nH]2)cc1O ZINC000009219000 JJ Agent Anodyne Cc1ccsc1/C=C/C1=Cc2c(sc(NC(=O)CN3CCC(C(N)=O)CC3)c2C#N)C(C)(C)C1 ZINC000009219018 JJ Agent Mild N#Cc1ccc(/C=C/C(=O)N(CC(=O)Nc2ccccc2Br)Cc2ccco2)cc1 ZINC000009222816 JJ Agent Mild CN(CC(=O)Nc1cccc(/C=C/c2ccccn2)c1)S(=O)(=O)c1ccc2ccccc2c1 ZINC000009223110 JJ Agent Anodyne Cc1cc(/C=C/C(=O)N(Cc2nc3ccccc3c(=O)[nH]2)C(C)C)c(C)n1-c1ccc2c(c1)OCO2 ZINC000009223395 JJ Agent Clean COc1cc2c(cc1/C=C/C(=O)N(Cc1nnc(-c3ccccc3Cl)o1)C1CC1)O[C@H](C)C2 ZINC000009223811 JJ Agent Anodyne COc1cc2c(cc1/C=C/C(=O)N(Cc1nnc(-c3ccccc3Cl)o1)C1CC1)O[C@@H](C)C2 ZINC000009223812 JJ Agent Anodyne CCN(Cc1ccc2c(c1)OCCO2)C(=O)/C=C/c1ccc(OCc2c(C)noc2C)c(OC)c1 ZINC000009223910 JJ Agent Anodyne COCCN(Cc1nnc(-c2cccs2)o1)C(=O)/C=C/c1ccc(-c2ccccc2F)o1 ZINC000009253337 JJ Agent Anodyne Cc1ccc(-c2csc3ncnc(SCc4nnc5n(C)c(=O)c6ccccc6n45)c23)cc1 ZINC000009255640 JJ Agent Anodyne CCc1ccc(-n2c(=O)c3ccccc3n3c(SCC(=O)Nc4ccccc4C(C)=O)nnc23)cc1 ZINC000009283296 JJ Agent Anodyne Cc1ccc(Cn2c(=O)c3ccccc3n3c(SCC(=O)Nc4cccc(C)c4C)nnc23)cc1 ZINC000009283523 JJ Agent Anodyne Cc1ccc(Cn2c(=O)c3ccccc3n3c(SCC(=O)Nc4c(C)cccc4C)nnc23)cc1 ZINC000009283525 JJ Agent Anodyne Cc1cc(-n2c(C)cc(C(=O)COC(=O)/C=C/c3c(C)nn(-c4ccccc4)c3C)c2C)no1 ZINC000009283578 JJ Agent Anodyne Cc1ccc(Cn2c(=O)c3ccccc3n3c(SCC(=O)Nc4ccc(C)cc4C)nnc23)cc1 ZINC000009283945 JJ Agent Anodyne COc1cc(-c2nnc(COC(=O)/C=C/c3cccc(Cl)c3Cl)o2)cc(OC)c1OC ZINC000009284224 JJ Agent Anodyne Cc1nn(-c2ccccc2)c(C)c1/C=C(\C#N)C(=O)OCC(=O)Nc1ccc2ccccc2c1 ZINC000009284720 JJ Agent Reactive Cc1ccc(Cn2nc(C)c(/C=C/C(=O)OCC(=O)Nc3c(C)nn(-c4ccccc4)c3C)c2C)cc1 ZINC000009284864 JJ Agent Anodyne CCc1ccc(-n2c(=O)c3ccccc3n3c(SCC(=O)Nc4cc(C)cc(C)c4)nnc23)cc1 ZINC000009285630 JJ Agent Anodyne N#CCn1c(COC(=O)/C(=C/c2ccc(Cl)cc2)c2ccc(F)cc2)nc2ccccc2c1=O ZINC000009318099 JJ Agent Mild COc1ccc(C(=O)OCC(=O)N2N=C3/C(=C/c4ccco4)CCC[C@@H]3[C@H]2c2ccco2)cc1OC ZINC000009335216 JJ Agent Anodyne COc1ccc(C(=O)OCC(=O)N2N=C3/C(=C/c4ccco4)CCC[C@@H]3[C@@H]2c2ccco2)cc1OC ZINC000009335217 JJ Agent Anodyne Cc1cnc(C(=O)OCC(=O)N2N=C3/C(=C/c4ccccc4)CCC[C@@H]3[C@H]2c2ccccc2)cn1 ZINC000009335232 JJ Agent Anodyne Cc1cnc(C(=O)OCC(=O)N2N=C3/C(=C/c4ccccc4)CCC[C@@H]3[C@@H]2c2ccccc2)cn1 ZINC000009335233 JJ Agent Anodyne CCOc1ccc([C@@H]2CCCN2C(=O)/C=C/c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1 ZINC000009335661 JJ Agent Anodyne CCOc1ccc([C@H]2CCCN2C(=O)/C=C/c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1 ZINC000009335662 JJ Agent Anodyne COc1cccc(N2C(=O)/C(=C\c3ccc(C(C)C)cc3)N=C2S[C@@H]2CCCCNC2=O)c1 ZINC000009337794 JJ Agent Anodyne COc1cccc(N2C(=O)/C(=C\c3ccc(C(C)C)cc3)N=C2S[C@H]2CCCCNC2=O)c1 ZINC000009337795 JJ Agent Anodyne CCSc1nnc(NC(=O)CSc2nnc(NC(=O)c3cccc4ccccc34)s2)s1 ZINC000009369153 JJ Agent Anodyne COc1ccc(N2C(=O)/C(=C\c3ccco3)N=C2SCC(=O)Nc2ccccc2C#N)cc1Cl ZINC000009373194 JJ Agent Mild CCS(=O)(=O)c1ccc2oc(SCC(=O)/C=C3/N(C)c4ccccc4C3(C)C)nc2c1 ZINC000009373257 JJ Agent Mild C=CCOc1ccccc1CN(C(=O)/C=C/c1c(C)nn(C)c1C)c1ccc2c(c1)OCCO2 ZINC000009376156 JJ Agent Mild Cc1cc(/C=C(\C#N)C(=O)O[C@H](C(N)=O)c2ccc(F)cc2)c(C)n1-c1ccc(Br)cc1 ZINC000009376298 JJ Agent Reactive Cc1cc(/C=C(\C#N)C(=O)O[C@@H](C(N)=O)c2ccc(F)cc2)c(C)n1-c1ccc(Br)cc1 ZINC000009376299 JJ Agent Reactive COc1cccc(/C=C(/C(=O)N2CCCC2)c2nc3sc(-c4ccccc4)cc3c(=O)[nH]2)c1 ZINC000009377096 JJ Agent Anodyne O=C(COC(=O)/C=C/c1cn(Cc2ccccc2)nc1-c1cccs1)Nc1ccc2c(c1)OCO2 ZINC000009387714 JJ Agent Anodyne CCOC(=O)c1sc2nc(/C=C/c3cn(Cc4ccccc4)nc3-c3cccnc3)[nH]c(=O)c2c1C ZINC000009390513 JJ Agent Anodyne O=C(COC(=O)/C=C/c1cn(Cc2ccccc2)nc1-c1cccs1)Nc1cccnc1Cl ZINC000009390548 JJ Agent Anodyne CC(C)(C)NC(=O)NC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C/c1cccs1)CC2 ZINC000009396701 JJ Agent Anodyne CCOc1cc(/C=C/C(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc(Br)c1OC ZINC000009397509 JJ Agent Mild COc1ccc(/C=C(\C#N)S(=O)(=O)c2cc(Br)ccc2Br)cc1OC ZINC000009399181 JJ Agent Reactive COc1ccc(/C=C(\C#N)S(=O)(=O)c2cc(Br)ccc2Br)cc1 ZINC000009399182 JJ Agent Reactive COc1ccccc1NS(=O)(=O)c1ccc(N/N=C/c2c(F)cccc2Cl)c([N+](=O)[O-])c1 ZINC000009403173 JJ Agent Mild COc1ccc(C(=O)/C=C/c2cn(CCC(=O)O)nc2-c2ccc(Br)cc2)cc1 ZINC000009403380 JJ Agent Mild CC[C@@H](C)N1C(=O)[C@H](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])S/C1=N\c1ccc(F)cc1F ZINC000009403432 JJ Agent Mild CC[C@H](C)N1C(=O)[C@H](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])S/C1=N\c1ccc(F)cc1F ZINC000009403433 JJ Agent Mild CC[C@@H](C)N1C(=O)[C@@H](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])S/C1=N\c1ccc(F)cc1F ZINC000009403434 JJ Agent Mild CC[C@H](C)N1C(=O)[C@@H](CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])S/C1=N\c1ccc(F)cc1F ZINC000009403435 JJ Agent Mild COc1ccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)OCC(=O)Nc2ccon2)cc1OC ZINC000009415059 JJ Agent Anodyne Cc1nn(-c2ccccc2)c(Cl)c1/C=C(\C#N)c1nc2ccc(Br)cc2c(=O)[nH]1 ZINC000009425347 JJ Agent Reactive O=C(CN(Cc1ccco1)C(=O)/C=C/c1ccc(F)cc1)Nc1ccccc1Br ZINC000009439054 JJ Agent Anodyne Cc1nn(-c2ccccc2)c(N2CCCC2)c1/C=C(\C#N)c1nc2sc(C)c(C)c2c(=O)[nH]1 ZINC000009439501 JJ Agent Reactive COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N/N=C/[C@H](C)c1ccccc1 ZINC000009439932 JJ Agent Mild COc1ccccc1NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N/N=C/[C@@H](C)c1ccccc1 ZINC000009439938 JJ Agent Mild O=C(COC(=O)C1CCN(/C=C/C(=O)C(F)(F)F)CC1)Nc1ccccc1Sc1ccccc1 ZINC000009439950 JJ Agent Mild COc1ccc(CCNC(=O)/C(C#N)=C/c2c(C)nn(-c3ccc(Cl)cc3)c2Cl)cc1OC ZINC000009440017 JJ Agent Reactive O=C(COc1ccccc1)OCC(=O)N1N=C2/C(=C/c3ccco3)CCC[C@@H]2[C@H]1c1ccco1 ZINC000009441046 JJ Agent Anodyne O=C(OCC(=O)N1N=C2/C(=C/c3ccco3)CCC[C@@H]2[C@H]1c1ccco1)c1cc2ccccc2oc1=O ZINC000009441076 JJ Agent Anodyne Cc1ccc(Cn2nc(C)c(/C=C/C(=O)OCc3nnc(-c4ccc([N+](=O)[O-])cc4)o3)c2C)cc1 ZINC000009441127 JJ Agent Bother COc1ccc(CC(=O)OCC(=O)N2N=C3/C(=C/c4ccco4)CCC[C@@H]3[C@H]2c2ccco2)cc1 ZINC000009441177 JJ Agent Anodyne COc1ccc(CC(=O)OCC(=O)N2N=C3/C(=C/c4ccco4)CCC[C@@H]3[C@@H]2c2ccco2)cc1 ZINC000009441179 JJ Agent Anodyne COc1cc(/C=C(\C(=O)O)c2ccc(S(=O)(=O)N3CCCC3)s2)ccc1OCCC(C)C ZINC000009442346 JJ Agent Anodyne O=C(OCC(=O)N1N=C2/C(=C/c3ccc(F)cc3)CCC[C@@H]2[C@H]1c1ccc(F)cc1)c1cnccn1 ZINC000009443363 JJ Agent Anodyne O=C(OCC(=O)N1N=C2/C(=C/c3ccc(F)cc3)CCC[C@@H]2[C@@H]1c1ccc(F)cc1)c1cnccn1 ZINC000009443365 JJ Agent Anodyne COc1ccc(NS(=O)(=O)c2ccc(Cl)c(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])c2)cc1 ZINC000009444289 JJ Agent Bother Cc1ccc(NS(=O)(=O)c2ccc(C)c(NC(=O)/C=C/c3ccc([N+](=O)[O-])cc3)c2)c(C)c1 ZINC000009444312 JJ Agent Bother CCOc1ccccc1N/C(S)=C(/C(=O)c1ccc2c(c1)OCCO2)[n+]1ccc(CC)cc1 ZINC000009444450 JJ Agent Mild Cc1cc(N2CCN(C(=O)/C=C/c3cn(-c4ccccc4)nc3-c3cccnc3)CC2)nc(C(C)C)n1 ZINC000009448423 JJ Agent Anodyne COc1ccccc1NS(=O)(=O)c1ccc(/C=C/C(=O)N2CCC[C@@H]2c2cccs2)cc1 ZINC000009465035 JJ Agent Anodyne COc1ccccc1NS(=O)(=O)c1ccc(/C=C/C(=O)N2CCC[C@H]2c2cccs2)cc1 ZINC000009465037 JJ Agent Anodyne O=C(/C(=C/c1csc(-c2ccc(Cl)cc2)n1)c1nc2ccccc2[nH]1)N1CCOCC1 ZINC000009466528 JJ Agent Anodyne O=C(/C(=C/c1csc(-c2cccc(Br)c2)n1)c1nc2ccccc2[nH]1)N1CCOCC1 ZINC000009466890 JJ Agent Anodyne COc1cccc(CN(C)C(=O)/C=C/c2ccc(OCc3cn4ccccc4n3)cc2)c1OC ZINC000009466892 JJ Agent Anodyne COc1cc(OC)cc([C@H](NC(=O)/C=C/c2cc(Cl)c(OC(C)C)c(OC)c2)c2nccn2C)c1 ZINC000009467751 JJ Agent Anodyne COc1cc(OC)cc([C@@H](NC(=O)/C=C/c2cc(Cl)c(OC(C)C)c(OC)c2)c2nccn2C)c1 ZINC000009467752 JJ Agent Anodyne CCOc1cc(/C=C/c2ncc([N+](=O)[O-])n2C)ccc1OCC(=O)Nc1cccc(C(F)(F)F)c1 ZINC000009467800 JJ Agent Bother CCOc1cc(/C=C2\C(=O)N(Cc3ccccn3)C(=O)c3ccccc32)cc(Br)c1O ZINC000009469405 JJ Agent Anodyne COC(=O)c1ccc(COc2ccc(/C=C(\C#N)c3nc(N)nc(Nc4ccccc4)n3)cc2)cc1 ZINC000009469656 JJ Agent Reactive CCCCC[C@@H](C)n1c(SCc2nnc3n(C)c(=O)c4ccccc4n23)nc2ccccc2c1=O ZINC000009469817 JJ Agent Anodyne CCCCC[C@H](C)n1c(SCc2nnc3n(C)c(=O)c4ccccc4n23)nc2ccccc2c1=O ZINC000009469818 JJ Agent Anodyne Cc1cc(/C=C2\C(=O)N(Cc3ccccn3)C(=O)c3ccccc32)c(C)n1-c1ccnn1C(C)C ZINC000009469884 JJ Agent Anodyne CN(Cc1ccc(-c2ccc(Cl)cc2)o1)C(=O)CCNS(=O)(=O)/C=C/c1ccccc1 ZINC000009479846 JJ Agent Anodyne O=C(/C(=C/c1ccc2c(c1)OCCO2)c1nc2sc(-c3ccccc3)cc2c(=O)[nH]1)N1CCCC1 ZINC000009481545 JJ Agent Anodyne COc1ccc(N2C(=O)/C(=C\Nc3cc(Cl)ccc3O)c3ccccc3C2=O)cc1OC ZINC000009493101 JJ Agent Anodyne CCOc1cc(/C=C/C(=O)Oc2cc3ccccc3cc2C(=O)N2CCOCC2)cc(Cl)c1OC ZINC000009493239 JJ Agent Anodyne C=CCNC(=O)c1ccccc1N/C=C1/C(=O)N(c2ccc(C)cc2C)C(=O)c2ccccc21 ZINC000009493351 JJ Agent Mild COC(=O)c1ccc(/C=C/c2cc(S[C@@H](C)C(=O)O)n3c(nc4ccccc43)c2C#N)cc1 ZINC000009493477 JJ Agent Mild COC(=O)c1ccc(/C=C/c2cc(S[C@H](C)C(=O)O)n3c(nc4ccccc43)c2C#N)cc1 ZINC000009493478 JJ Agent Mild COc1cc(/C=C/C(=O)N(Cc2nnc(-c3ccccc3Cl)o2)C2CC2)cc(OC)c1OC ZINC000009493492 JJ Agent Anodyne CCOc1cc(/C=C/C(=O)c2cc3ccccc3o2)cc(Br)c1OCC(=O)N(C)C ZINC000009493541 JJ Agent Mild Cc1nc(-c2ccc(CNC(=O)C3CCN(C(=O)/C=C/c4ccccc4)CC3)s2)cs1 ZINC000009494833 JJ Agent Anodyne COc1cccc(-n2c(=O)c3ccccc3n3c(SCC(=O)c4cc(C)c(C)cc4C)nnc23)c1 ZINC000009494892 JJ Agent Anodyne COc1cccc(-n2c(=O)c3ccccc3n3c(S[C@@H](C)C(=O)c4ccc(F)c(F)c4)nnc23)c1 ZINC000009495309 JJ Agent Anodyne COc1cccc(-n2c(=O)c3ccccc3n3c(S[C@H](C)C(=O)c4ccc(F)c(F)c4)nnc23)c1 ZINC000009495314 JJ Agent Anodyne Cc1ccc(Cn2nc(C)c(/C=C/C(=O)N3CCC(C(=O)N4CCCCCC4)CC3)c2Cl)cc1 ZINC000009495580 JJ Agent Anodyne COc1ccc(-n2c(=O)c3ccccc3n3c(S[C@H](C)C(=O)c4ccc(C)cc4)nnc23)cc1 ZINC000009496168 JJ Agent Anodyne COc1ccc(-n2c(=O)c3ccccc3n3c(S[C@@H](C)C(=O)c4ccc(C)cc4)nnc23)cc1 ZINC000009496170 JJ Agent Anodyne COc1ccc(-n2c(=O)c3ccccc3n3c(S[C@@H](C)C(=O)c4ccc(F)c(F)c4)nnc23)cc1 ZINC000009496229 JJ Agent Anodyne COc1ccc(-n2c(=O)c3ccccc3n3c(S[C@H](C)C(=O)c4ccc(F)c(F)c4)nnc23)cc1 ZINC000009496232 JJ Agent Anodyne O=C1[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C(=O)N1CN(C(=O)c1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 ZINC000009500036 JJ Agent Anodyne O=C1[C@H]2[C@@H]3C=C[C@@H](C3)[C@@H]2C(=O)N1CN(C(=O)c1ccc(Cl)cc1)c1cccc(C(F)(F)F)c1 ZINC000009500044 JJ Agent Anodyne O=C(/C=C/c1ccc(S(=O)(=O)NCc2ccco2)cc1)N1CCC[C@H]1c1nc2ccccc2s1 ZINC000009502998 JJ Agent Anodyne O=C(/C=C/c1ccc(S(=O)(=O)NCc2ccco2)cc1)N1CCC[C@@H]1c1nc2ccccc2s1 ZINC000009503003 JJ Agent Anodyne CCOc1ccc(/C=C/C(=O)O[C@@H](C)C(=O)Nc2nc(-c3cccc([N+](=O)[O-])c3)cs2)cc1OC ZINC000009506744 JJ Agent Bother COc1cccc(N2C(=O)/C(=C\c3ccc(C(C)C)cc3)N=C2S[C@@H](C)C(=O)NC2CC2)c1 ZINC000009507054 JJ Agent Anodyne COc1cccc(N2C(=O)/C(=C\c3ccc(C(C)C)cc3)N=C2S[C@H](C)C(=O)NC2CC2)c1 ZINC000009507056 JJ Agent Anodyne O=C(OCc1cc(=O)n2cc(Br)ccc2n1)/C(=C/c1cccs1)c1cccs1 ZINC000009509311 JJ Agent Anodyne CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)/C=C/c1cc(Cl)c(OC)c(OC)c1 ZINC000009509869 JJ Agent Anodyne CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)/C=C/c1ccc(OC(F)F)cc1 ZINC000009509973 JJ Agent Anodyne CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)/C=C/c1ccc(OC(F)F)c(OC)c1 ZINC000009510222 JJ Agent Anodyne C=CCOc1ccc(/C=C/C(=O)N(Cc2ccccc2)Cc2nc3ccsc3c(=O)[nH]2)cc1 ZINC000009513693 JJ Agent Mild CC(=O)c1ccc(N2CCN(C(=O)/C=C/c3cn(-c4ccccc4)nc3-c3cccnc3)CC2)c(F)c1 ZINC000009514338 JJ Agent Anodyne Cc1sc2nc(/C(=C\c3cc(Cl)c4c(c3)OCCCO4)C(=O)N3CCCC3)[nH]c(=O)c2c1C ZINC000009531690 JJ Agent Anodyne O=C(C[C@H]1S/C(=N\c2ccccc2[N+](=O)[O-])N(CCc2ccccc2)C1=O)Nc1ccccc1F ZINC000009539404 JJ Agent Mild O=C(/C(=C(\S)Nc1ccccc1F)[n+]1ccc(CCCO)cc1)c1ccc(Br)s1 ZINC000009539715 JJ Agent Mild COc1cc(/C=C(\C#N)c2nc3sc4c(c3c(=O)[nH]2)CC[C@@H](C)C4)cc(Br)c1O ZINC000009540482 JJ Agent Reactive COc1cc(/C=C(\C#N)c2nc3sc4c(c3c(=O)[nH]2)CC[C@H](C)C4)cc(Br)c1O ZINC000009540483 JJ Agent Reactive COc1ccc(N2C(=O)/C(=C\c3cccs3)N=C2SCC(=O)N2CCCCC2)cc1Cl ZINC000009540505 JJ Agent Anodyne Cc1ccc(Cn2c(=O)c3ccccc3n3c(Sc4ccc(C(F)(F)F)cn4)nnc23)cc1 ZINC000009540630 JJ Agent Anodyne O=[N+]([O-])c1cc(/C=N/n2c(S)nnc2-c2ccc(Cl)cc2Cl)ccc1N1CCCC1 ZINC000009540644 JJ Agent Mild O=C(/C(=C/c1ccc2c(c1)OCCO2)c1nc2scc(-c3ccccc3)c2c(=O)[nH]1)N1CCCC1 ZINC000009544835 JJ Agent Anodyne Cc1ccc(Cn2nc(C)c(/C=C/C(=O)OCC(=O)Nc3ncc(Cl)cc3Cl)c2C)cc1 ZINC000009545100 JJ Agent Anodyne C[C@H](Sc1nnc2n(Cc3ccccc3)c(=O)c3ccccc3n12)C(=O)NCCC1=CCCCC1 ZINC000009548963 JJ Agent Anodyne C[C@@H](Sc1nnc2n(Cc3ccccc3)c(=O)c3ccccc3n12)C(=O)NCCC1=CCCCC1 ZINC000009548964 JJ Agent Anodyne CNC(=O)c1ccc(CN(C)C(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2ccccc2OC)cc1 ZINC000009549153 JJ Agent Anodyne Cc1ccc(C)c(-n2c(=O)c3ccccc3n3c(SCC(=O)N(CC(C)C)CC(C)C)nnc23)c1 ZINC000009558656 JJ Agent Anodyne N#C/C(=C\c1cccc(OCc2ccccc2)c1)c1nnc(N2CCOCC2)n1-c1ccccc1 ZINC000009561681 JJ Agent Reactive COc1cc(Br)c(/C=C(/Sc2nnc(-c3ccccc3)o2)C(=O)O)cc1OC ZINC000009561851 JJ Agent Anodyne COc1ccc(-c2nnc(S/C(=C/c3cc(Br)ccc3F)C(=O)O)o2)cc1 ZINC000009561852 JJ Agent Anodyne O=C(O)/C(=C\c1ccc(N2CCCCC2)c([N+](=O)[O-])c1)Sc1nnc(-c2ccccc2)o1 ZINC000009561855 JJ Agent Clean CN(CCC#N)C(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C\c1ccc(Cl)cc1)CC2 ZINC000009562015 JJ Agent Mild C/C(N)=C(/C#N)C(=O)CSc1nnc(-c2ccc(Br)cc2)n1C1CCCCC1 ZINC000009562120 JJ Agent Reactive Cn1cnnc1Sc1ccc(/C=N/Nc2nc(Cl)c(Cl)cc2Cl)cc1[N+](=O)[O-] ZINC000009562682 JJ Agent Mild COc1cc(/C=C/C(=O)O[C@@H](C)C(=O)Nc2cc(C(F)(F)F)ccc2Cl)ccc1OCC#N ZINC000009562765 JJ Agent Mild C/C(N)=C(/C#N)C(=O)CSc1nnc(CSc2nc3ccccc3s2)n1Cc1ccccc1 ZINC000009562858 JJ Agent Reactive COc1ccc(/C=C(/C(=O)N2CCCC2)c2nc3sc(-c4ccccc4)cc3c(=O)[nH]2)cc1 ZINC000009578630 JJ Agent Anodyne COc1ccc(N/C=C2\C(=O)N(Cc3ccc4c(c3)OCO4)C(=O)c3ccccc32)cc1Cl ZINC000009580242 JJ Agent Anodyne N#Cc1c(SCC(=O)NC[C@@H]2CCCO2)nc2c(c1-c1ccco1)CC/C2=C/c1ccco1 ZINC000009580332 JJ Agent Mild CC(=O)N(c1ccccc1)c1nc(/C=C/C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cs1 ZINC000009582322 JJ Agent Anodyne CC(=O)N(c1ccccc1)c1nc(/C=C/C(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)cs1 ZINC000009582327 JJ Agent Anodyne O=C(/C=C/c1cn(Cc2ccccc2)nc1-c1cccnc1)c1ccc(N2CCOCC2)cc1 ZINC000009583544 JJ Agent Mild COc1ccc(/C=C/C(=O)N(Cc2ccccc2)[C@@H](C)Cc2cccs2)cc1S(=O)(=O)N(C)C ZINC000009584210 JJ Agent Anodyne COc1ccc(/C=C/C(=O)N(Cc2ccccc2)[C@H](C)Cc2cccs2)cc1S(=O)(=O)N(C)C ZINC000009584218 JJ Agent Anodyne CC(=O)N(c1nc(/C=C/C(=O)N(C)Cc2cnn(Cc3ccccc3)c2)cs1)c1ccccc1F ZINC000009585931 JJ Agent Anodyne CCOC(=O)NC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(OC)cc1)C[C@H](C)C2 ZINC000009587215 JJ Agent Anodyne N#C/C(=C\c1cn(Cc2ccccc2)nc1-c1cccnc1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000009589090 JJ Agent Reactive COc1ccc(/C=C/c2noc(C)c2NC(=O)CCn2c(=O)oc3cc(Cl)ccc32)cc1 ZINC000009592401 JJ Agent Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=C/C(=O)N1CCN(C(=O)c2cccs2)CC1 ZINC000009593775 JJ Agent Anodyne COc1ccc(-c2csc3nc(/C=C/c4cc(OC)c5c(c4)OCO5)[nH]c(=O)c23)cc1OC ZINC000009595633 JJ Agent Anodyne CNC(=O)c1ccc(CN(C)C(=O)/C=C/c2cn(Cc3ccccc3)nc2-c2cccs2)cc1 ZINC000009605069 JJ Agent Anodyne COc1cc(/C=C(\C#N)c2nc(N)nc(Nc3ccccc3)n2)ccc1OC(=O)c1ccc(F)cc1 ZINC000009606381 JJ Agent Reactive NC(=O)c1ccc(NC(=O)COC(=O)c2c3c(nc4ccccc24)/C(=C/c2cccs2)CC3)cc1 ZINC000009612740 JJ Agent Anodyne CCN(c1ccccc1)S(=O)(=O)c1ccc(Cl)c(NC(=O)COC(=O)/C=C/c2ccccc2)c1 ZINC000009613184 JJ Agent Anodyne COc1cc(C(=O)N2CCS/C2=N\CCc2ccccc2)ccc1OCc1c(C)noc1C ZINC000009613403 JJ Agent Mild O=C(OCC(=O)N1CCCCCC1)c1c2c(nc3ccccc13)/C(=C/c1ccc(O)cc1)CC2 ZINC000009613406 JJ Agent Anodyne CCOc1cccc(-c2n[nH]c(=S)n2/N=C/c2ccc(N3CCCCC3)c([N+](=O)[O-])c2)c1 ZINC000009630498 JJ Agent Mild CCC[C@@H](CNC(=O)COC(=O)/C(=C/c1ccccc1)NC(C)=O)c1ccc(Cl)cc1Cl ZINC000009630755 JJ Agent Anodyne CCC[C@H](CNC(=O)COC(=O)/C(=C/c1ccccc1)NC(C)=O)c1ccc(Cl)cc1Cl ZINC000009630756 JJ Agent Anodyne COCCOC(=O)c1sc2nc(/C(Cl)=C/c3ccc(SC)cc3)[nH]c(=O)c2c1C ZINC000009630910 JJ Agent Anodyne N#C/C(=C\c1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1)c1nnc2n1CCCCC2 ZINC000009630958 JJ Agent Reactive CCOc1cc(/C=N/Nc2cccc(C(=O)O)c2)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000009631074 JJ Agent Mild NC(=O)c1ccc(NC(=O)COC(=O)c2c3c(nc4ccccc24)/C(=C\c2ccco2)CCC3)cc1 ZINC000009631354 JJ Agent Anodyne C=CCNC(=O)COC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc(OC)c(OC)c1)CCC2 ZINC000009631464 JJ Agent Mild O=C(/C(=C/c1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)c1nc2ccccc2[nH]1)N1CCOCC1 ZINC000009631508 JJ Agent Bother O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)ccc1N/N=C/c1c(F)c(F)c(F)c(F)c1F ZINC000009631556 JJ Agent Mild N#Cc1ccc(NC(=O)CSC2=N/C(=C/c3ccccc3)C(=O)N2c2ccc(F)cc2)cc1 ZINC000009632241 JJ Agent Mild Cc1ccc(Cn2c(=O)c3ccccc3n3c(SCC(=O)Nc4cc(C)ccc4C)nnc23)cc1 ZINC000009632598 JJ Agent Anodyne COc1ccc(/C=C2\CCc3c2nc2ccccc2c3C(=O)OCC(=O)NCC(F)(F)F)cc1 ZINC000009632903 JJ Agent Anodyne Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C/C(=O)OCC(=O)Nc1c(C#N)oc2ccccc12 ZINC000009633467 JJ Agent Mild CCOc1ccccc1N1C(=O)/C(=C\c2cc(O)c(OC)cc2Br)SC1=S ZINC000009634111 JJ Agent Clean Cc1ccc(Cn2nc(C)c(/C=C/C(=O)OCC(=O)C(C#N)=C3Nc4ccccc4N3)c2Cl)cc1 ZINC000009634585 JJ Agent Reactive Cc1ccc(-n2nc(C)c(/C=N/N3C(=O)c4cccc5c([N+](=O)[O-])ccc(c45)C3=O)c2Cl)cc1 ZINC000009634738 JJ Agent Mild Cc1nn(-c2cccc(Cl)c2)c(Cl)c1/C=C(\C#N)C(=O)Nc1ccc(N2CCOCC2)cc1 ZINC000009635516 JJ Agent Reactive O=C(CN(Cc1ccco1)C(=O)/C=C/c1cccc([N+](=O)[O-])c1)Nc1ccccc1C(F)(F)F ZINC000009641497 JJ Agent Bother O[C@H](COc1c(Cl)cccc1Cl)CSC1=NN/C(=C2\C=Nc3ccccc32)N1C1CC1 ZINC000009646811 JJ Agent Anodyne O[C@@H](COc1c(Cl)cccc1Cl)CSC1=NN/C(=C2\C=Nc3ccccc32)N1C1CC1 ZINC000009646813 JJ Agent Anodyne Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C/C(=O)OCc1nc2c(oc3ccccc32)c(=O)[nH]1 ZINC000009646852 JJ Agent Anodyne O=C1[C@H]2CC=CC[C@H]2C(=O)N1CC(=O)N1N=C2/C(=C/c3cccs3)CCC[C@@H]2[C@H]1c1cccs1 ZINC000009662261 JJ Agent Anodyne O=C1[C@H]2CC=CC[C@H]2C(=O)N1CC(=O)N1N=C2/C(=C/c3cccs3)CCC[C@@H]2[C@@H]1c1cccs1 ZINC000009662263 JJ Agent Anodyne O=[N+]([O-])c1ccc(N/N=C2/C(O)=Nc3ccc(F)cc32)c(S(=O)(=O)Nc2ccccc2Cl)c1 ZINC000009662309 JJ Agent Mild CCc1ccc(-n2c(=O)c3ccccc3n3c(SCC(=O)N[C@@H](C)c4ccccc4)nnc23)cc1 ZINC000009663769 JJ Agent Anodyne CCc1ccc(-n2c(=O)c3ccccc3n3c(SCC(=O)N[C@H](C)c4ccccc4)nnc23)cc1 ZINC000009663773 JJ Agent Anodyne CCc1cccc(NC(=O)CSc2nnc3n(Cc4ccc(C)cc4)c(=O)c4ccccc4n23)c1 ZINC000009664197 JJ Agent Anodyne CC(=O)Nc1ccc(C(=O)OCC(=O)N2N=C3/C(=C/c4ccco4)CCC[C@@H]3[C@H]2c2ccco2)cc1 ZINC000009665573 JJ Agent Anodyne CC(=O)Nc1ccc(C(=O)OCC(=O)N2N=C3/C(=C/c4ccco4)CCC[C@@H]3[C@@H]2c2ccco2)cc1 ZINC000009665575 JJ Agent Anodyne O=C(OCC(=O)N1N=C2/C(=C/c3ccco3)CCC[C@@H]2[C@H]1c1ccco1)c1cc(=O)c2ccccc2o1 ZINC000009665837 JJ Agent Anodyne O=C(OCC(=O)N1N=C2/C(=C/c3ccco3)CCC[C@@H]2[C@@H]1c1ccco1)c1cc(=O)c2ccccc2o1 ZINC000009665840 JJ Agent Anodyne C=CCn1c(C)nnc1SCC(=O)N1N=C2/C(=C/c3ccco3)CCC[C@@H]2[C@H]1c1ccco1 ZINC000009666052 JJ Agent Mild C=CCn1c(C)nnc1SCC(=O)N1N=C2/C(=C/c3ccco3)CCC[C@@H]2[C@@H]1c1ccco1 ZINC000009666053 JJ Agent Mild CCc1ccc(-n2c(=O)c3ccccc3n3c(SCC(=O)Nc4c(C)cccc4C)nnc23)cc1 ZINC000009666262 JJ Agent Anodyne CN(c1ccccc1)c1ccc(/C=C2\CCn3c2nc2cc(C(=O)O)ccc2c3=O)cc1[N+](=O)[O-] ZINC000009670156 JJ Agent Bother Cc1ccc(C)n1-c1ccc(C(=O)Nc2ccc(S(=O)(=O)/N=C3\CCCCCN3)cc2)cc1 ZINC000009671110 JJ Agent Mild Cc1noc(C)c1COc1ccc(/C=C2\C(=O)N(Cc3ccccn3)C(=O)c3ccccc32)cc1 ZINC000009671313 JJ Agent Anodyne O=C(/C=C/c1ccccc1)N1CCC(C(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)CC1 ZINC000009672117 JJ Agent Anodyne O=C(/C=C/c1ccccc1)N1CCC(C(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)CC1 ZINC000009672118 JJ Agent Anodyne CCOc1c(Cl)cc(C(=O)OCc2nnc3n(CCC(C)C)c(=O)c4ccccc4n23)cc1OC ZINC000009672445 JJ Agent Anodyne COCCn1c(C)cc(/C=C(\C#N)C(=O)OCc2csc(Nc3ccc(C)cc3)n2)c1C ZINC000009672589 JJ Agent Reactive CCc1ccc(-n2c(=O)c3ccccc3n3c(SCC(=O)Nc4cc(F)ccc4F)nnc23)cc1 ZINC000009704165 JJ Agent Anodyne COc1cc(/C=C2/N=C3CCCCCN3C2=O)ccc1OCC(=O)Nc1c(C)cc(C)cc1C ZINC000009704300 JJ Agent Anodyne CCOc1cc(/C=C(\C#N)S(=O)(=O)c2ccc(Br)cc2)cc(Br)c1O ZINC000009704302 JJ Agent Reactive O=C(COc1ccc(-c2nnco2)cc1)N(C/C=C/c1ccccc1)c1ccc2c(c1)OCCO2 ZINC000009712524 JJ Agent Anodyne COc1ccc(-c2nn(CCC#N)cc2/C=C2\C(=O)N(Cc3ccccn3)C(=O)c3ccccc32)cc1 ZINC000009712597 JJ Agent Mild O=C(Nc1ccc(-c2cn3ccsc3n2)cc1)C1CCN(C(=O)/C=C/c2ccccc2)CC1 ZINC000009712779 JJ Agent Anodyne CN(CC(=O)N(c1ccccc1)c1nc2ccccc2s1)S(=O)(=O)/C=C/c1ccccc1 ZINC000009713019 JJ Agent Anodyne COc1ccccc1-c1nn(-c2ccccc2)cc1/C=C/C(=O)N1CCN(C(=O)c2cccs2)CC1 ZINC000009713346 JJ Agent Anodyne C=CCn1c(=O)c2ccccc2n2c(SCC(=O)c3cc(C)n(-c4ccc(F)cc4)c3C)nnc12 ZINC000009716015 JJ Agent Mild O=C1NC2(CCCC2)C(=O)N1CC(=O)N1N=C2/C(=C/c3cccs3)CCC[C@@H]2[C@H]1c1cccs1 ZINC000009721214 JJ Agent Anodyne O=C1NC2(CCCC2)C(=O)N1CC(=O)N1N=C2/C(=C/c3cccs3)CCC[C@@H]2[C@@H]1c1cccs1 ZINC000009721216 JJ Agent Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=N/NC(=O)c1cc(-c2ccccc2)n[nH]1 ZINC000009731627 JJ Agent Reactive O=C(/C=C/c1ccccc1)N1CCC(C(=O)N(C[C@@H]2CCCO2)c2nc3ccccc3s2)CC1 ZINC000009748650 JJ Agent Anodyne O=C(/C=C/c1ccccc1)N1CCC(C(=O)N(C[C@H]2CCCO2)c2nc3ccccc3s2)CC1 ZINC000009748656 JJ Agent Anodyne COc1cc(/C=C/C(=O)OCC(=O)N(C)Cc2ccc(C)cc2C)ccc1OCc1c(C)noc1C ZINC000009749080 JJ Agent Anodyne CCN(Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C(=O)/C=C/c1cc(C)n(Cc2ccco2)c1C ZINC000009749751 JJ Agent Anodyne Cc1sc2nc(/C(=C\c3ccc(N4CCCCC4)cc3)C(=O)N3CCCC3)[nH]c(=O)c2c1C ZINC000009791867 JJ Agent Clean COc1cccc(-c2nc(/C=C(/C(=O)N3CCCC3)c3nc4sc(C)c(C)c4c(=O)[nH]3)cs2)c1 ZINC000009793473 JJ Agent Anodyne N#Cc1ccc(/C=C(/C(=O)N2CCCC2)c2nc3sc(-c4ccccc4)cc3c(=O)[nH]2)cc1 ZINC000009795491 JJ Agent Mild COc1ccccc1/C=C(/C(=O)OCC(=O)Nc1ccccc1N1CCCC1=O)c1ccccc1 ZINC000009801816 JJ Agent Anodyne COc1ccc(/C=C/C(=O)N(c2ccccc2)c2nc(C)cs2)cc1S(=O)(=O)NC(C)C ZINC000009819419 JJ Agent Anodyne CC(=O)N(c1nc(/C=C/C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cs1)c1ccccc1F ZINC000009822784 JJ Agent Anodyne O=C(CCc1nnc2n(Cc3ccccc3Cl)c(=O)c3ccccc3n12)NC1CCCCCC1 ZINC000009831529 JJ Agent Anodyne O=C(CCc1nnc2n(CCc3ccccc3)c(=O)c3ccccc3n12)Nc1cccc(Cl)c1 ZINC000009831547 JJ Agent Anodyne COc1ccc(CCNc2c(Sc3nnc(-c4ccco4)o3)c(=O)[nH]c3ccccc23)cc1 ZINC000009833959 JJ Agent Anodyne C[C@H](NC(=O)/C(C#N)=C/c1cn(CCC#N)nc1-c1ccc(Cl)cc1)c1nc2ccccc2[nH]1 ZINC000009869721 JJ Agent Reactive CC(=O)N(c1ccccc1)c1nc(/C=C/C(=O)N(C)Cc2cnn(-c3ccccc3)c2)cs1 ZINC000009869984 JJ Agent Anodyne Cc1cc(/C=C/C(=O)N(Cc2nc3ccccc3c(=O)[nH]2)C[C@@H]2CCCO2)c(C)n1-c1ccccc1 ZINC000009872094 JJ Agent Clean Cc1cc(/C=C/C(=O)N(Cc2nc3ccccc3c(=O)[nH]2)C[C@H]2CCCO2)c(C)n1-c1ccccc1 ZINC000009872102 JJ Agent Clean C/C=C/c1ccc(OCC(=O)OCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)c(OC)c1 ZINC000009882278 JJ Agent Anodyne CCOC(=O)/C(=C\c1cc(Cl)c(OC)c(OCC)c1)c1nc2sc(C)c(C)c2c(=O)[nH]1 ZINC000009882753 JJ Agent Anodyne COc1ccccc1/C=C(/C(=O)OCC(=O)C(C#N)=C1Nc2ccccc2N1)c1ccccc1 ZINC000009883467 JJ Agent Reactive Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=C(\C#N)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000009883554 JJ Agent Reactive CCOC(=O)c1c(C)[nH]c(C(=O)/C(C#N)=C/c2cn(Cc3ccccc3)nc2-c2cccnc2)c1C ZINC000009884270 JJ Agent Reactive Cc1ccc(Cn2nc(C)c(/C=C/C(=O)Nc3cc(C(N)=O)ccc3N3CCCC3)c2Cl)cc1 ZINC000009905580 JJ Agent Anodyne Cc1cc(NC(=O)COC(=O)/C=C/c2c(C)nn(Cc3c(Cl)cccc3Cl)c2Cl)on1 ZINC000009909022 JJ Agent Anodyne Cc1nc(-c2ccc(CNC(=O)C3CCN(S(=O)(=O)/C=C/c4ccccc4)CC3)s2)cs1 ZINC000009913843 JJ Agent Anodyne Cc1c(O)ccc2c(CSc3nnc4n(Cc5ccccc5)c(=O)c5ccccc5n34)cc(=O)oc12 ZINC000009946975 JJ Agent Anodyne CC(C)N(Cc1ccccc1)C(=O)CSc1nnc2n(Cc3ccccc3)c(=O)c3ccccc3n12 ZINC000009947113 JJ Agent Anodyne CCOCCCn1c(=O)c2ccccc2n2c(S[C@@H](C)C(=O)c3c(C)[nH]c4ccccc34)nnc12 ZINC000009947650 JJ Agent Anodyne CCOCCCn1c(=O)c2ccccc2n2c(S[C@H](C)C(=O)c3c(C)[nH]c4ccccc34)nnc12 ZINC000009947651 JJ Agent Anodyne COc1ccc(/C=C(/C(=O)N2CCOCC2)c2nc3ccccc3[nH]2)cc1OCc1ccccc1 ZINC000009951278 JJ Agent Anodyne O=C(OCC(=O)N1CCCCC1)c1c2c(nc3ccccc13)/C(=C/c1ccc3c(c1)OCO3)CC2 ZINC000009955658 JJ Agent Anodyne Cc1cccn2c(=O)cc(COC(=O)c3c4c(nc5ccccc35)/C(=C/c3ccco3)CC4)nc12 ZINC000009955794 JJ Agent Anodyne C=CCn1c(=O)c2ccccc2n2c(SCc3csc(-c4cccc(OC)c4)n3)nnc12 ZINC000009956296 JJ Agent Mild Cn1c(=O)c2ccccc2n2c(CSc3nnc(-c4sc5ccccc5c4Cl)o3)nnc12 ZINC000009956300 JJ Agent Anodyne O=C(OCC(=O)N1N=C2/C(=C/c3ccco3)CCC[C@@H]2[C@H]1c1ccco1)c1ccc2c(c1)OCO2 ZINC000009956940 JJ Agent Anodyne O=C(OCC(=O)N1N=C2/C(=C/c3ccco3)CCC[C@@H]2[C@@H]1c1ccco1)c1ccc2c(c1)OCO2 ZINC000009956954 JJ Agent Anodyne C[C@H](OC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc3c(c1)OCO3)CC2)C(=O)NCc1ccco1 ZINC000009959963 JJ Agent Anodyne C[C@@H](OC(=O)c1c2c(nc3ccccc13)/C(=C/c1ccc3c(c1)OCO3)CC2)C(=O)NCc1ccco1 ZINC000009959964 JJ Agent Anodyne COc1ccc(NS(=O)(=O)c2cc(NC(=O)/C=C/c3cccs3)ccc2N2CCCC2)cc1 ZINC000009963656 JJ Agent Anodyne CC(C)CCn1c(=O)c2ccccc2n2c(SCc3cc(Cl)cc4c3OCOC4)nnc12 ZINC000009963761 JJ Agent Anodyne CCCN(Cc1nnc(-c2ccco2)o1)C(=O)/C=C/c1csc(N(C(C)=O)c2ccccc2)n1 ZINC000009983228 JJ Agent Anodyne CCN(Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C(=O)/C=C/c1cc(Br)ccc1F ZINC000009983627 JJ Agent Anodyne CC(=O)N/C(=C\c1ccccc1)C(=O)OCC(=O)c1c(-c2ccccc2)n(C)c2ccccc12 ZINC000009985715 JJ Agent Anodyne CCCN(Cc1nnc(-c2ccco2)o1)C(=O)/C=C/c1ccc(OCc2c(C)noc2C)c(OC)c1 ZINC000009986590 JJ Agent Anodyne O=C(CSc1nnnn1-c1ccccc1)N1N=C2/C(=C/c3ccco3)CCC[C@@H]2[C@H]1c1ccco1 ZINC000009987841 JJ Agent Anodyne O=C(CSc1nnnn1-c1ccccc1)N1N=C2/C(=C/c3ccco3)CCC[C@@H]2[C@@H]1c1ccco1 ZINC000009987847 JJ Agent Anodyne CCCN(Cc1nnc(-c2ccco2)o1)C(=O)/C=C/c1cc(C)n(-c2ccnn2C(C)C)c1C ZINC000009996106 JJ Agent Anodyne N#C/C(=C/c1cn(Cc2ccc(Br)cc2)nc1-c1ccccc1)C(=O)NCc1ccccn1 ZINC000096438292 JJ Agent Reactive COc1ccc(/C=C(/C#N)C(=O)Nc2sccc2C(=O)OC(C)C)cc1Cn1nc(C)cc1C ZINC000096438299 JJ Agent Reactive CCOc1cc(/C=C(/C#N)C(=O)Nc2sccc2C(=O)OC)cc(Br)c1OCC ZINC000096438562 JJ Agent Reactive CCOc1cc(/C=C(/C#N)C(=O)Nc2sccc2C(=O)OC(C)C)cc(Br)c1O ZINC000096438565 JJ Agent Reactive COC(=O)c1ccsc1NC(=O)/C(C#N)=C\c1cccc(OC)c1OCc1ccccc1C ZINC000096438581 JJ Agent Reactive COC(=O)c1ccsc1NC(=O)/C(C#N)=C\c1ccc(OC(=O)c2ccc(Cl)cc2)c(OC)c1 ZINC000096438601 JJ Agent Reactive CCCc1cc(C(=O)OC)c(NC(=O)/C(C#N)=C\c2cc(OC)c(OC)cc2Br)s1 ZINC000096438605 JJ Agent Reactive COc1cc(/C=C(/C#N)C(=O)NCc2ccc3c(c2)OCO3)ccc1OC(=O)c1ccc(Cl)cc1 ZINC000096438768 JJ Agent Reactive CCOc1cc(/C=C(/C#N)C(=O)NCc2ccc3c(c2)OCO3)ccc1OCc1ccc(C)cc1 ZINC000096438798 JJ Agent Reactive COc1ccc(-c2nn(Cc3ccc(F)cc3)cc2/C=C(/C#N)C(=O)NCc2ccco2)cc1OC ZINC000096438804 JJ Agent Reactive N#C/C(=C/c1cccc(OC(=O)c2ccccc2Cl)c1)C(=O)NCc1ccc2c(c1)OCO2 ZINC000096438805 JJ Agent Reactive COc1cccc(/C=C(/C#N)C(=O)NCc2ccc3c(c2)OCO3)c1OCc1cccc(Cl)c1 ZINC000096438809 JJ Agent Reactive N#C/C(=C/c1ccc(COc2ccc(Br)cc2)o1)C(=O)NCc1ccc2c(c1)OCO2 ZINC000096438822 JJ Agent Reactive CCCCCOc1ccc(Cl)cc1/C=C(/C#N)C(=O)Nc1sc(C(N)=O)c(C)c1C(=O)OC ZINC000096438957 JJ Agent Reactive CCOc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)O[C@@H](C)C(=O)N(C)c3ccccc3)c2C)cc1 ZINC000096445785 JJ Agent Reactive CCOc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)O[C@H](C)C(=O)N(C)c3ccccc3)c2C)cc1 ZINC000096445787 JJ Agent Reactive CN1/C(=C/C(=O)CSc2nnc(-c3ccc(C(C)(C)C)cc3)n2N)C(C)(C)c2ccccc21 ZINC000096445813 JJ Agent Mild Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C\C(=O)O[C@@H](C)C(=O)N1CCc2ccccc21 ZINC000096446665 JJ Agent Anodyne Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C\C(=O)O[C@H](C)C(=O)N1CCc2ccccc21 ZINC000096446668 JJ Agent Anodyne Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C\C(=O)OCC(=O)Nc1c(C#N)oc2ccccc12 ZINC000096446692 JJ Agent Anodyne COc1cc(/C=C\C(=O)OCC(=O)c2ccc(NC(=O)CC(C)C)cc2)cc(Cl)c1OC ZINC000096447491 JJ Agent Anodyne COCCn1c(C)cc(/C=C(/C#N)C(=O)OCc2csc(Nc3ccc(OC)cc3)n2)c1C ZINC000096447591 JJ Agent Reactive COCCn1c(C)cc(/C=C(/C#N)C(=O)OCc2csc(Nc3ccc(C)cc3)n2)c1C ZINC000096447615 JJ Agent Reactive Cc1ccc(Cn2nc(C)c(/C=C\C(=O)OCC(=O)c3cc(C)n(-c4cc(C)on4)c3C)c2C)cc1 ZINC000096449610 JJ Agent Anodyne Cc1ccc(Cn2nc(C)c(/C=C\C(=O)OCc3cc(=O)n4c(n3)sc3ccccc34)c2C)cc1 ZINC000096449615 JJ Agent Anodyne CC(=O)Nc1ccc2c(COC(=O)/C=C\c3c(C)nn(Cc4ccc(C)cc4)c3C)cc(=O)oc2c1 ZINC000096449631 JJ Agent Anodyne O=C(OCC(=O)N1N=C2/C(=C\c3ccco3)CCC[C@@H]2[C@H]1c1ccco1)c1ccc2c(c1)OCO2 ZINC000096455215 JJ Agent Anodyne Cc1ccc(/C=C\C2=Cc3c(sc(NC(=O)CSc4nnnn4C)c3C#N)C(C)(C)C2)o1 ZINC000096462645 JJ Agent Mild CS(=O)(=O)c1ccc(Cl)c(NC(=O)COC(=O)/C(=C\c2ccc(F)cc2)c2cccs2)c1 ZINC000096481460 JJ Agent Anodyne CC1(C)C(=O)Nc2ccccc2N1C(=O)COC(=O)/C(=C\c1ccc(F)cc1)c1cccs1 ZINC000096481481 JJ Agent Anodyne COc1ccccc1NC(=O)Cc1noc(COC(=O)/C(=C\c2ccc(F)cc2)c2cccs2)n1 ZINC000096481582 JJ Agent Anodyne O=C(COC(=O)/C(=C\c1ccc(F)cc1)c1cccs1)Nc1ccccc1C(=O)NC1CC1 ZINC000096481652 JJ Agent Anodyne O=C(/C=C\c1cn(-c2ccccc2)nc1-c1cccs1)OCC(=O)N1CCC(c2ccccc2)=N1 ZINC000096481705 JJ Agent Anodyne CC(=O)/C(=C(/C)O)[C@H]1c2cc(Br)ccc2O[C@H](C(Cl)(Cl)Cl)[C@H]1[N+](=O)[O-] ZINC000096482277 JJ Agent Anodyne O=C(/C=C\c1ccc(S(=O)(=O)NCc2ccco2)cc1)OCc1cccc(C(F)(F)F)c1 ZINC000096484720 JJ Agent Anodyne CCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)Nc2ccc3c(c2)OC2(CCCC2)O3)c1C ZINC000096491574 JJ Agent Reactive Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C\C(=O)O[C@@H](C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000096491753 JJ Agent Anodyne Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C\C(=O)O[C@H](C)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000096491755 JJ Agent Anodyne O=C1[C@H]2CC=CC[C@H]2C(=O)N1CC(=O)N1N=C2/C(=C\c3cccs3)CCC[C@@H]2[C@H]1c1cccs1 ZINC000096498641 JJ Agent Anodyne COc1ccc(-c2nn(Cc3ccccc3F)cc2/C=C(/C#N)C(=O)NCc2ccco2)cc1OC ZINC000096504288 JJ Agent Reactive CCOc1cc(/C=C(/C#N)C(=O)NCCc2ccccc2)c(Br)cc1OC(C)C ZINC000096504369 JJ Agent Reactive O=C(/C=C\c1cc(Br)ccc1OC(F)F)OCC(=O)c1c[nH]c2ccccc12 ZINC000096505275 JJ Agent Anodyne O=C(COC(=O)/C=C\c1nc2ccccc2s1)Nc1ccccc1C(=O)Nc1ccccc1 ZINC000096506511 JJ Agent Anodyne C/C=C\c1ccc(OCC(=O)OCC(=O)Nc2ccc(Cl)cc2C(F)(F)F)c(OC)c1 ZINC000096506641 JJ Agent Anodyne CCOC(=O)Nc1ccc2c(COC(=O)/C=C\c3c(C)nn(-c4ccccc4)c3C)cc(=O)oc2c1 ZINC000096506729 JJ Agent Anodyne Cc1nn(-c2ccccc2)c(C)c1/C=C\C(=O)OCC(=O)Nc1ccc(SC(F)F)cc1 ZINC000096506732 JJ Agent Anodyne Cc1nn(Cc2ccccc2Cl)c(Cl)c1/C=C\C(=O)OCC(=O)N1CCCC[C@@H]1C ZINC000096506743 JJ Agent Anodyne Cc1nn(Cc2ccccc2Cl)c(Cl)c1/C=C\C(=O)OCC(=O)N1CCCC[C@H]1C ZINC000096506744 JJ Agent Anodyne Cc1nn(Cc2ccccc2Cl)c(Cl)c1/C=C\C(=O)OCC(=O)N1CCc2ccccc21 ZINC000096506749 JJ Agent Anodyne COc1ccc(/C=C(/C#N)S(=O)(=O)c2ccccc2)cc1Cn1nc(C)c(Br)c1C ZINC000096507699 JJ Agent Reactive COc1ccc(-c2nn(Cc3ccccc3)cc2/C=C(/C#N)S(=O)(=O)c2ccccc2)cc1 ZINC000096507988 JJ Agent Reactive COc1ccccc1N(CC(=O)Nc1ccc(OC(F)F)cc1)S(=O)(=O)/C=C\c1ccccc1 ZINC000096513925 JJ Agent Anodyne COc1ccc(NS(=O)(=O)c2cc(NC(=O)/C=C\c3cccs3)ccc2N2CCCC2)cc1 ZINC000096525182 JJ Agent Anodyne CCN(CC)S(=O)(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2c2nc3ccccc3s2)cc1 ZINC000096533446 JJ Agent Anodyne CCN(CC)S(=O)(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2c2nc3ccccc3s2)cc1 ZINC000096533447 JJ Agent Anodyne CN(Cc1cccc(Cl)c1Cl)C(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1 ZINC000096533493 JJ Agent Anodyne N#Cc1ccc(/C=C\C(=O)N(CC(=O)Nc2ccccc2Br)Cc2ccco2)cc1 ZINC000096536941 JJ Agent Anodyne Cc1ccc(/C=C\C(=O)N(C)CC(=O)Nc2ccccc2C(F)(F)F)c(Br)c1 ZINC000096544610 JJ Agent Anodyne COCCN(CC(=O)Nc1cccc(C)c1C)C(=O)/C=C\c1c(C)nn(-c2ccc(F)cc2)c1Cl ZINC000096545182 JJ Agent Anodyne CCN(Cc1ccc2c(c1)OCCO2)C(=O)/C=C\c1ccc(OCc2c(C)noc2C)c(OC)c1 ZINC000096565472 JJ Agent Anodyne O=C(Nc1nc(-c2cccs2)cs1)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1 ZINC000096576396 JJ Agent Anodyne O=C(/C=C\c1ccccc1)N1CCC(C(=O)N(C[C@@H]2CCCO2)c2nc3ccccc3s2)CC1 ZINC000096576420 JJ Agent Anodyne O=C(/C=C\c1ccccc1)N1CCC(C(=O)N(C[C@H]2CCCO2)c2nc3ccccc3s2)CC1 ZINC000096576421 JJ Agent Anodyne CCN(Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C(=O)/C=C\c1cc(C)n(Cc2ccco2)c1C ZINC000096578004 JJ Agent Anodyne CCN(Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C(=O)/C=C\c1cc(Br)ccc1F ZINC000096578017 JJ Agent Anodyne CCCN(Cc1nc2cc(Cl)ccc2c(=O)[nH]1)C(=O)/C=C\c1cccc(Br)c1 ZINC000096578040 JJ Agent Anodyne CCCN(Cc1nnc(-c2ccco2)o1)C(=O)/C=C\c1ccc(OCc2c(C)noc2C)c(OC)c1 ZINC000096578117 JJ Agent Anodyne CCCN(Cc1nnc(-c2ccco2)o1)C(=O)/C=C\c1csc(N(C(C)=O)c2ccccc2)n1 ZINC000096578135 JJ Agent Anodyne O=C(/C=C\c1ccccc1)N1CCC(C(=O)N2CCC[C@H](c3nc4ccccc4s3)C2)CC1 ZINC000096578752 JJ Agent Anodyne O=C(/C=C\c1ccccc1)N1CCC(C(=O)N2CCC[C@@H](c3nc4ccccc4s3)C2)CC1 ZINC000096578756 JJ Agent Anodyne O=C(C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)N1CCC[C@H](c2nc3ccccc3s2)C1 ZINC000096578782 JJ Agent Anodyne O=C(C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)N1CCC[C@@H](c2nc3ccccc3s2)C1 ZINC000096578785 JJ Agent Anodyne N#CCCn1cc(/C=C\C(=O)N2CCN(Cc3nc4ccccc4s3)CC2)c2ccccc21 ZINC000096578847 JJ Agent Mild O=C(Nc1ccc(-c2cn3ccsc3n2)cc1)C1CCN(C(=O)/C=C\c2ccccc2)CC1 ZINC000096579155 JJ Agent Anodyne Cc1csc(N(C(=O)C2CCN(S(=O)(=O)/C=C\c3ccccc3)CC2)c2ccccc2)n1 ZINC000096585291 JJ Agent Anodyne COc1ccc(/C=C\C(=O)N(c2ccccc2)c2nc(C)cs2)cc1S(=O)(=O)NC(C)C ZINC000096585292 JJ Agent Anodyne CC[C@H](NC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)c1ccc(Br)cc1 ZINC000096585350 JJ Agent Anodyne CC[C@@H](NC(=O)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1)c1ccc(Br)cc1 ZINC000096585351 JJ Agent Anodyne CC(=O)N(c1ccccc1)c1nc(/C=C\C(=O)N2CCC[C@@H]2c2ccc3c(c2)OCCO3)cs1 ZINC000096585559 JJ Agent Anodyne CC(=O)N(c1ccccc1)c1nc(/C=C\C(=O)N2CCC[C@H]2c2ccc3c(c2)OCCO3)cs1 ZINC000096585560 JJ Agent Anodyne COc1ccc(/C=C\C(=O)N(Cc2ccccc2)[C@@H](C)Cc2cccs2)cc1S(=O)(=O)N(C)C ZINC000096586131 JJ Agent Anodyne COc1ccc(/C=C\C(=O)N(Cc2ccccc2)[C@H](C)Cc2cccs2)cc1S(=O)(=O)N(C)C ZINC000096586132 JJ Agent Anodyne O=C(Nc1nc(-c2c[nH]c3ccccc23)cs1)C1CCN(S(=O)(=O)/C=C\c2ccccc2)CC1 ZINC000096600622 JJ Agent Anodyne COc1cc(C)c(NC(=O)/C=C\c2cn(Cc3ccccc3)nc2-c2cccnc2)cc1OC ZINC000096600628 JJ Agent Anodyne O=C(Nc1nc(SCc2ccccc2)ns1)C1CCN(C(=O)/C=C\c2ccccc2)CC1 ZINC000096601761 JJ Agent Anodyne N#CCCn1cc(/C=C\C(=O)N2CCN(c3ncc(C(F)(F)F)cc3Cl)CC2)c2ccccc21 ZINC000096619957 JJ Agent Mild O=C(/C=C\c1cn(Cc2ccccc2)nc1-c1cccs1)N1CCN(c2ccccc2O)CC1 ZINC000096623612 JJ Agent Anodyne CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)/C=C\c1ccc(OC(F)F)c(OC)c1 ZINC000096623731 JJ Agent Anodyne CCCn1c(C)cc(/C=C(/C#N)C(=O)Nc2cc(OCC)c(N3CCOCC3)cc2OCC)c1C ZINC000096623734 JJ Agent Reactive CC(=O)N(c1nc(/C=C2/N=C(c3ccc4c(c3)OCO4)OC2=O)cs1)c1c(C)cccc1C ZINC000096635103 JJ Agent Anodyne COc1ccc(N(C(C)=O)c2nc(/C=C3/N=C(c4ccc(OC(C)C)cc4)OC3=O)cs2)cc1 ZINC000096635153 JJ Agent Anodyne CC(=O)N(c1ccccc1)c1nc(/C=C2/N=C(c3ccccc3Br)OC2=O)cs1 ZINC000096635168 JJ Agent Anodyne COc1ccc(N(C(C)=O)c2nc(/C=C3/N=C(c4ccccc4Br)OC3=O)cs2)cc1 ZINC000096635171 JJ Agent Anodyne COc1ccccc1NS(=O)(=O)c1ccc(/C=C\C(=O)N2CCC[C@@H]2c2cccs2)cc1 ZINC000096647409 JJ Agent Anodyne COc1ccccc1NS(=O)(=O)c1ccc(/C=C\C(=O)N2CCC[C@H]2c2cccs2)cc1 ZINC000096647412 JJ Agent Anodyne COc1ccc(CCNC(=O)/C(C#N)=C\c2c(C)nn(-c3ccc(Cl)cc3)c2Cl)cc1OC ZINC000096663257 JJ Agent Reactive CCOc1cc(/C=C(/C#N)C(=O)N2CCCC2)ccc1OCC(=O)Nc1cccc(C(F)(F)F)c1 ZINC000096663277 JJ Agent Reactive CC(=O)N(c1nc(/C=C2/SC(=S)N(CCCC(=O)O)C2=O)cs1)c1cccc(C)c1C ZINC000096663503 JJ Agent Clean CC(=O)N(c1nc(/C=C2/SC(=S)N(CCCC(=O)O)C2=O)cs1)c1c(C)cccc1C ZINC000096663504 JJ Agent Clean COc1cc(/C=C(/C#N)S(=O)(=O)c2cc(Cl)ccc2Cl)cc(Br)c1O ZINC000096663541 JJ Agent Reactive COc1cc(/C=C(/C#N)S(=O)(=O)c2cc(Cl)ccc2Cl)cc(OC)c1OC(F)F ZINC000096669413 JJ Agent Reactive CCOC(=O)c1c(C)[nH]c(C(=O)/C(C#N)=C\c2cn(Cc3ccccc3)nc2-c2cccnc2)c1C ZINC000096669483 JJ Agent Reactive Cc1cccc(-n2c(C)cc(/C=C(/C#N)c3nnc(N4CCOCC4)n3-c3ccccc3)c2C)c1 ZINC000096669548 JJ Agent Reactive CCOc1cc(/C=C(/C#N)c2nnc(N3CCOCC3)n2-c2ccccc2)ccc1OCC(C)C ZINC000096669551 JJ Agent Reactive CCOc1cc(/C=C2/SC(NC3CCCC3)=NC2=O)ccc1OCC(=O)N(C(C)C)C(C)C ZINC000096669669 JJ Agent Clean CCCn1c(C)cc(C(=O)/C(C#N)=C\c2ccc(O[C@@H](C)C(=O)N(C)C)c(OCC)c2)c1C ZINC000096669726 JJ Agent Reactive CCCn1c(C)cc(C(=O)/C(C#N)=C\c2ccc(O[C@H](C)C(=O)N(C)C)c(OCC)c2)c1C ZINC000096669727 JJ Agent Reactive CCOC(=O)/C(=C/c1cc(Cl)c(OC)c(OCC)c1)c1nc2sc(C)c(C)c2c(=O)[nH]1 ZINC000096759048 JJ Agent Anodyne COc1ccc(-c2csc3nc(/C=C\c4cc(OC)c5c(c4)OCO5)[nH]c(=O)c23)cc1OC ZINC000096765465 JJ Agent Anodyne COc1cccc(-c2nc(/C=C(\C(=O)N3CCCC3)c3nc4sc(C)c(C)c4c(=O)[nH]3)cs2)c1 ZINC000096765500 JJ Agent Anodyne C[C@H](Oc1ccc(C(=O)/C=C\c2cn(Cc3ccccc3)nc2-c2cccnc2)cc1)C(=O)O ZINC000096765682 JJ Agent Mild C[C@@H](Oc1ccc(C(=O)/C=C\c2cn(Cc3ccccc3)nc2-c2cccnc2)cc1)C(=O)O ZINC000096765683 JJ Agent Mild COc1ccc(/C=C(\C(=O)N2CCCC2)c2nc3sc(-c4ccccc4)cc3c(=O)[nH]2)cc1 ZINC000096765796 JJ Agent Anodyne COc1cccc(/C=C(\C(=O)N2CCCC2)c2nc3sc(-c4ccccc4)cc3c(=O)[nH]2)c1 ZINC000096765797 JJ Agent Anodyne O=C(/C=C\c1cn(Cc2ccccc2)nc1-c1cccnc1)c1ccc(N2CCOCC2)cc1 ZINC000096767064 JJ Agent Mild CCOc1cc(/C=C\c2nc3cc(C)c(C)cc3s2)ccc1OCC(=O)N1CCOCC1 ZINC000096767227 JJ Agent Anodyne CCOc1cc(/C=C(/CC(=O)O)c2nc3ccccc3s2)ccc1O[C@@H](C)C(=O)N(C)C ZINC000096767481 JJ Agent Anodyne CCOc1cc(/C=C(/CC(=O)O)c2nc3ccccc3s2)ccc1O[C@H](C)C(=O)N(C)C ZINC000096767482 JJ Agent Anodyne Cc1ccsc1/C=C\C1=Cc2c(sc(NC(=O)CN3CCC(C(N)=O)CC3)c2C#N)C(C)(C)C1 ZINC000096775250 JJ Agent Mild CCOC(=O)c1c(-c2ccc(C)o2)csc1NC(=O)CN1CCN(C/C=C\c2ccccc2)CC1 ZINC000096781161 JJ Agent Anodyne O=C(CN1CCN(C/C=C\c2ccccc2)CC1)N1N=C(c2cccs2)C[C@H]1c1cccs1 ZINC000096781175 JJ Agent Anodyne O=C(CN1CCN(C/C=C\c2ccccc2)CC1)N1N=C(c2cccs2)C[C@@H]1c1cccs1 ZINC000096781176 JJ Agent Anodyne O=S(=O)(c1ccc(-c2ccc(/C=C\c3nc4cc(Cl)ccc4o3)o2)cc1)N1CCOCC1 ZINC000096792092 JJ Agent Anodyne CCOc1cc(/C=C\C(=O)c2ccc(S(=O)(=O)N3CCCC3)cc2)cc(Br)c1OC ZINC000096792379 JJ Agent Mild Cc1ccc(Cn2nc(C)c(/C=C\C(=O)c3ccc(S(=O)(=O)N4CCCC4)cc3)c2Cl)cc1 ZINC000096792384 JJ Agent Mild N#C/C(=C/c1cn(Cc2ccccc2)nc1-c1cccnc1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000096792425 JJ Agent Reactive CCOc1cc(/C=C(/C#N)S(=O)(=O)c2ccc(F)cc2)cc(Br)c1OCC ZINC000096792444 JJ Agent Reactive CCCOc1c(Br)cc(/C=C(/C#N)S(=O)(=O)c2ccc(F)cc2)cc1OC ZINC000096792445 JJ Agent Reactive CC(=O)Nc1ccc(/C=C(/C#N)S(=O)(=O)c2cc(Br)ccc2Br)cc1 ZINC000096792467 JJ Agent Reactive COc1cccc(/C=C(/C#N)S(=O)(=O)c2cc(Br)ccc2Br)c1OC ZINC000096792476 JJ Agent Reactive COc1ccc(/C=C(/C#N)S(=O)(=O)c2cc(Br)ccc2Br)cc1 ZINC000096792477 JJ Agent Reactive Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=C(/C#N)C(=O)Nc1ccc2c(c1)OCCO2 ZINC000096792486 JJ Agent Reactive COc1cc(/C=C(/C#N)S(=O)(=O)c2cc(Br)ccc2Br)cc(OC)c1 ZINC000096792513 JJ Agent Reactive Cc1nn(-c2cccc(Cl)c2)c(Cl)c1/C=C(/C#N)C(=O)Nc1ccc(N2CCOCC2)cc1 ZINC000096792515 JJ Agent Reactive CCOC(=O)/C(=C/c1ccc(Br)cc1)C1=Nn2c(nnc2-c2ccc(OC)cc2)SC1 ZINC000096792776 JJ Agent Anodyne CCOC(=O)/C(=C/c1cccc(Br)c1)C1=Nn2c(nnc2-c2ccc(OC)cc2)SC1 ZINC000096792777 JJ Agent Anodyne O=C(O[C@H]1C[C@@H](OCc2ccccc2)[C@@H](COCc2ccccc2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000096793170 JJ Agent Anodyne Cc1cc(/C=C(/C#N)C(=O)OCc2nc3sc4c(c3c(=O)[nH]2)CCCC4)c(C)n1CC(C)C ZINC000096801513 JJ Agent Reactive COCCn1c(SCC(=O)/C(C#N)=C2/Sc3ccccc3N2C)nnc1-c1cccc(C)c1 ZINC000096809714 JJ Agent Reactive CC(C)Nc1nnc(SCC(=O)N(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)s1 ZINC000096809754 JJ Agent Anodyne O=C(COc1ccc(-c2nnco2)cc1)N(C/C=C\c1ccccc1)c1ccc2c(c1)OCCO2 ZINC000096809864 JJ Agent Anodyne CCOc1ccc(C(=O)/C=C\c2cc(OC)c(OC)cc2Br)cc1CN1CCOCC1 ZINC000096814742 JJ Agent Mild CC(=O)N[C@@H](CC(=O)N(C/C=C\c1ccccc1)c1ccc2c(c1)OCCO2)c1ccccc1 ZINC000096822835 JJ Agent Anodyne CC(=O)N[C@H](CC(=O)N(C/C=C\c1ccccc1)c1ccc2c(c1)OCCO2)c1ccccc1 ZINC000096822836 JJ Agent Anodyne C=CCOc1ccccc1CN(C(=O)/C=C\c1c(C)nn(C)c1C)c1ccc2c(c1)OCCO2 ZINC000096822895 JJ Agent Mild CCCN(Cc1nnc(-c2ccccc2Cl)o1)C(=O)/C=C\c1cc(OC)c(OC)c(OC)c1 ZINC000096826476 JJ Agent Anodyne COc1cc2c(cc1/C=C\C(=O)N(Cc1nnc(-c3ccccc3Cl)o1)C1CC1)O[C@H](C)C2 ZINC000096826504 JJ Agent Anodyne COc1cc2c(cc1/C=C\C(=O)N(Cc1nnc(-c3ccccc3Cl)o1)C1CC1)O[C@@H](C)C2 ZINC000096826509 JJ Agent Anodyne C/C=C\c1ccc(OCC(=O)Nc2ccnn2Cc2cc(Br)cs2)c(OC)c1 ZINC000096826520 JJ Agent Anodyne C=CCN(Cc1ccc(Cl)s1)C(=O)/C=C\c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000096826592 JJ Agent Mild CCS(=O)(=O)c1ccc2oc(SCC(=O)/C=C3\N(C)c4ccccc4C3(C)C)nc2c1 ZINC000096837925 JJ Agent Mild COc1cc(Br)c(/C=C(\Sc2nnc(-c3ccccc3)o2)C(=O)O)cc1OC ZINC000096839011 JJ Agent Anodyne CN(Cc1ccc(-c2ccc(Cl)cc2)o1)C(=O)CCNS(=O)(=O)/C=C\c1ccccc1 ZINC000096842053 JJ Agent Anodyne O=C(/C=C\c1cn(-c2ccccc2)nc1-c1cccs1)N1CCN(C(=O)c2cccs2)CC1 ZINC000096842686 JJ Agent Anodyne COc1ccccc1NC(=O)CN(Cc1ccco1)C(=O)/C=C\c1cc(C)n(-c2cc(C)on2)c1C ZINC000096845237 JJ Agent Anodyne Cc1cc(/C=C\C(=O)N(Cc2nc3ccccc3c(=O)[nH]2)C(C)C)c(C)n1-c1ccc2c(c1)OCO2 ZINC000096851321 JJ Agent Clean C=CCOc1ccc(CN(C[C@@H]2CCCO2)C(=O)/C=C\c2ccc(-n3ccnc3)cc2)cc1OC ZINC000096851349 JJ Agent Mild C=CCOc1ccc(CN(C[C@H]2CCCO2)C(=O)/C=C\c2ccc(-n3ccnc3)cc2)cc1OC ZINC000096851350 JJ Agent Mild CN(CC(=O)Nc1cccc(/C=C\c2ccccn2)c1)S(=O)(=O)c1ccc2ccccc2c1 ZINC000096851368 JJ Agent Anodyne CCCN(Cc1nnc(-c2ccco2)o1)C(=O)/C=C\c1cc(C)n(-c2ccnn2C(C)C)c1C ZINC000096851374 JJ Agent Anodyne COCCN(Cc1nnc(-c2cccs2)o1)C(=O)/C=C\c1ccc(-c2ccccc2F)o1 ZINC000096851432 JJ Agent Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=C\C(=O)N1CCN(C(=O)c2cccs2)CC1 ZINC000096858843 JJ Agent Anodyne COc1ccccc1-c1nn(-c2ccccc2)cc1/C=C\C(=O)N1CCN(C(=O)c2cccs2)CC1 ZINC000096858847 JJ Agent Anodyne COc1cc(/C=C\C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)cc(Cl)c1OC(C)C ZINC000096858920 JJ Agent Anodyne Cc1cc(/C=C\C(=O)N(Cc2nc3ccccc3c(=O)[nH]2)C[C@@H]2CCCO2)c(C)n1-c1ccccc1 ZINC000096861249 JJ Agent Clean Cc1cc(/C=C\C(=O)N(Cc2nc3ccccc3c(=O)[nH]2)C[C@H]2CCCO2)c(C)n1-c1ccccc1 ZINC000096861250 JJ Agent Clean CN(CC(=O)N(c1ccccc1)c1nc2ccccc2s1)S(=O)(=O)/C=C\c1ccccc1 ZINC000096861351 JJ Agent Anodyne CC(C)c1ccc(-c2nnc(NC(=O)C3CCN(S(=O)(=O)/C=C\c4ccccc4)CC3)s2)cc1 ZINC000096861599 JJ Agent Anodyne C=CCN(C(=O)/C=C\c1nc2ccccc2o1)c1nc(-c2ccc(S(C)(=O)=O)cc2)cs1 ZINC000096861677 JJ Agent Mild O=C1O[C@@H](c2ccccc2)Cc2cc(C(=O)N3CCN(C/C=C\c4ccccc4)CC3)ccc21 ZINC000096865526 JJ Agent Anodyne O=C1O[C@H](c2ccccc2)Cc2cc(C(=O)N3CCN(C/C=C\c4ccccc4)CC3)ccc21 ZINC000096865527 JJ Agent Anodyne O=C(NCCN1C(=O)S/C(=C/c2cccc(Cl)c2Cl)C1=O)c1cc(F)ccc1F ZINC000096867738 JJ Agent Anodyne CC(C)CNC(=O)c1ccccc1NC(=O)COC(=O)/C(=C\c1ccccc1)c1cccs1 ZINC000096869790 JJ Agent Anodyne CCN(C(=O)/C=C\c1cc(OC)c(OC)c(S(=O)(=O)N2CCc3ccccc32)c1)C1CCCCC1 ZINC000096870923 JJ Agent Anodyne CCN(C(=O)COC(=O)/C=C\c1c(C)nn(Cc2ccccc2Cl)c1C)c1ccc(F)cc1 ZINC000096871306 JJ Agent Anodyne Cc1cc(C(=O)NCCN2C(=O)S/C(=C/c3cccs3)C2=O)c(C)n1Cc1cccs1 ZINC000096872907 JJ Agent Anodyne O=C(CCn1c(=O)oc2ccccc21)N(C/C=C\c1ccccc1)c1ccc2c(c1)OCCO2 ZINC000096873021 JJ Agent Anodyne Cc1c(Cl)cccc1NC(=O)CNC(=O)COC(=O)/C(=C\c1cccs1)c1cccs1 ZINC000096876552 JJ Agent Anodyne COc1cc(/C=C\C(=O)OCC(=O)N(C)Cc2ccc(C)cc2C)ccc1OCc1c(C)noc1C ZINC000096876623 JJ Agent Anodyne CCOc1cc(N2CCOCC2)c(OCC)cc1NC(=O)/C=C\c1cccc(OC)c1OC(F)F ZINC000096878972 JJ Agent Anodyne O=C(/C=C\c1sc2ccccc2c1Cl)Nc1cccc(S(=O)(=O)/N=C2/CCCN2)c1 ZINC000096879019 JJ Agent Mild CN(Cc1nc2ccccc2s1)C(=O)/C=C\c1ccc(S(=O)(=O)N2CCCCCC2)cc1 ZINC000096879308 JJ Agent Anodyne CCCCc1oc2ccccc2c1/C=C\C(=O)N(C)Cc1c(C)nn([C@@H]2CCS(=O)(=O)C2)c1C ZINC000096883562 JJ Agent Anodyne CCCCc1oc2ccccc2c1/C=C\C(=O)N(C)Cc1c(C)nn([C@H]2CCS(=O)(=O)C2)c1C ZINC000096883571 JJ Agent Anodyne CCOc1cc(/C=C\C(=O)Nn2c(S)nnc2-c2ccccc2Cl)cc(Cl)c1OC ZINC000096884156 JJ Agent Anodyne COc1cc(/C=C\C(=O)Nn2c(S)nnc2-c2ccccc2F)cc(Cl)c1OC(C)C ZINC000096884162 JJ Agent Anodyne Cc1ccc(Cn2nc(C)c(/C=C\C(=O)OCc3nc4c(oc5ccccc54)c(=O)[nH]3)c2Cl)cc1 ZINC000096887832 JJ Agent Anodyne Cc1nn(-c2ccc(F)cc2)c(Cl)c1/C=C\C(=O)OCc1nc2c(oc3ccccc32)c(=O)[nH]1 ZINC000096888123 JJ Agent Anodyne O=C(/C=C\c1sc2ccccc2c1Cl)OCC(=O)c1cc2c3c(c1)CC(=O)N3CCC2 ZINC000096888150 JJ Agent Anodyne COC(=O)c1ccc(COc2ccc(/C=C\c3nc(-c4ccc(O)cc4)no3)cc2OC)cc1 ZINC000096889712 JJ Agent Anodyne CCCn1c(/C(Cl)=C\c2cccc(C)c2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 ZINC000096891404 JJ Agent Anodyne CCn1c(/C(Cl)=C\c2ccc(C(=O)OC)cc2)nc2cc(S(=O)(=O)N3CCCCC3)ccc21 ZINC000096891431 JJ Agent Anodyne CCn1c(/C(Cl)=C\c2ccc(C(F)(F)F)cc2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 ZINC000096891434 JJ Agent Anodyne CCn1c(/C(Cl)=C\c2ccc(SC)cc2)nc2cc(S(=O)(=O)N3CCOCC3)ccc21 ZINC000096891443 JJ Agent Anodyne CCOc1cc(/C=C(/c2nc(C)cs2)c2nc3ccccc3n2C)ccc1OCC(=O)N(C)C ZINC000096891604 JJ Agent Anodyne COc1cccc(/C=C\C(=O)Nc2ccnn2Cc2ccc(Br)cc2)c1OC(F)F ZINC000096891857 JJ Agent Anodyne CC(=O)N(c1ccccc1)c1nc(/C=C\C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cs1 ZINC000096891999 JJ Agent Anodyne CC(=O)N(c1nc(/C=C\C(=O)N2CCC(C(=O)Nc3ccccc3)CC2)cs1)c1ccccc1F ZINC000096892001 JJ Agent Anodyne CCN(CC)c1ccc(-c2nnc(SCC(=O)N3CCN(C/C=C\c4ccccc4)CC3)o2)cc1 ZINC000096892623 JJ Agent Anodyne CCn1c(SCC(=O)N2CCN(C/C=C\c3ccccc3)CC2)nnc1-c1cccc(Cl)c1 ZINC000096892697 JJ Agent Anodyne COc1ccc(/C=C2/N=C(SCC(=O)Nc3ccnn3C(C)C)N(Cc3ccccc3)C2=O)cc1 ZINC000096893552 JJ Agent Anodyne CCN(Cc1nc2cc(OC)c(OC)cc2c(=O)[nH]1)C(=O)/C=C\c1cccc(Oc2ccccc2)c1 ZINC000096904501 JJ Agent Anodyne CC(=O)N(c1nc(/C=C\C(=O)N2CCC(C(=O)N3CCCCCC3)CC2)cs1)c1ccccc1F ZINC000096904939 JJ Agent Anodyne COc1cc(/C=C\C(=O)N(CC(=O)Nc2ccccc2C(F)(F)F)Cc2ccco2)cc(OC)c1 ZINC000096911875 JJ Agent Anodyne Cc1nc(-c2ccc(CNC(=O)C3CCN(S(=O)(=O)/C=C\c4ccccc4)CC3)s2)cs1 ZINC000096912104 JJ Agent Anodyne Cc1nc(-c2ccc(CNC(=O)C3CCN(C(=O)/C=C\c4ccccc4)CC3)s2)cs1 ZINC000096912105 JJ Agent Anodyne Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C\C(=O)N(C)Cc1ccccc1N1CCOCC1 ZINC000096912149 JJ Agent Anodyne CNC(=O)c1ccc(CN(C)C(=O)/C=C\c2cn(Cc3ccccc3)nc2-c2cccs2)cc1 ZINC000096912659 JJ Agent Anodyne CNC(=O)c1ccc(CN(C)C(=O)/C=C\c2cn(Cc3ccccc3)nc2-c2ccccc2)cc1 ZINC000096912661 JJ Agent Anodyne CNC(=O)c1ccc(CN(C)C(=O)/C=C\c2cn(Cc3ccccc3)nc2-c2ccccc2OC)cc1 ZINC000096912662 JJ Agent Anodyne COc1ccc(/C=C2/N=C(SCc3nnsc3Cl)N(Cc3ccccc3)C2=O)cc1 ZINC000096917278 JJ Agent Anodyne CCOC(=O)C1=C(Nc2ccccc2)O/C(=C/c2c(C)nn(Cc3ccccc3)c2Cl)C1=O ZINC000096919992 JJ Agent Mild CCNC(=O)COc1ccc(/C=C\c2nc(-c3ccccc3)c(C(=O)O)s2)cc1OCC ZINC000096920017 JJ Agent Anodyne CC(=O)N(c1ccccc1)c1nc(/C=C\C(=O)N(C)Cc2cnn(-c3ccccc3)c2)cs1 ZINC000096920336 JJ Agent Anodyne CC(=O)N(c1nc(/C=C\C(=O)N(C)Cc2cnn(-c3ccccc3)c2)cs1)c1ccccc1F ZINC000096920337 JJ Agent Anodyne CCN1C[C@H](CN(C)C(=O)/C=C\c2ccc(OCc3c(C)noc3C)c(OC)c2)Oc2ccccc21 ZINC000096920584 JJ Agent Anodyne Cc1nn(Cc2ccccc2Cl)c(C)c1/C=C\C(=O)N1CCC(C(=O)N2CCCCCC2)CC1 ZINC000096920588 JJ Agent Anodyne COc1cccc(Cn2nc(C)c(/C=C\C(=O)N3CCC(C(=O)N4CCCCCC4)CC3)c2Cl)c1 ZINC000096920589 JJ Agent Anodyne Cc1ccc(Cn2nc(C)c(/C=C\C(=O)N3CCC(C(=O)N4CCCCCC4)CC3)c2Cl)cc1 ZINC000096920590 JJ Agent Anodyne CCN(CC)c1ccc(-c2nn(CN3CCN(C/C=C\c4ccccc4)CC3)c(=S)n2C)cc1 ZINC000096920762 JJ Agent Anodyne CCOc1ccccc1N1C(=O)/C(=C/c2cc(O)c(OC)cc2Br)SC1=S ZINC000096921022 JJ Agent Clean CCOc1ccc(CN(C)C(=O)/C=C\c2ccc(OCc3cn4ccccc4n3)cc2)cc1OC ZINC000096924605 JJ Agent Anodyne COc1cccc(CN(C)C(=O)/C=C\c2ccc(OCc3cn4ccccc4n3)cc2)c1OC ZINC000096924623 JJ Agent Anodyne Cc1cc(N2CCN(C(=O)/C=C\c3cn(-c4ccccc4)nc3-c3cccnc3)CC2)nc(C(C)C)n1 ZINC000096924669 JJ Agent Anodyne CC(=O)c1ccc(N2CCN(C(=O)/C=C\c3cn(-c4ccccc4)nc3-c3cccnc3)CC2)c(F)c1 ZINC000096924701 JJ Agent Anodyne CC(=O)N(c1ccccc1)c1nc(/C=C\C(=O)N(C)Cc2cnn(Cc3ccccc3)c2)cs1 ZINC000096924789 JJ Agent Anodyne CC(=O)N(c1nc(/C=C\C(=O)N(C)Cc2cnn(Cc3ccccc3)c2)cs1)c1ccccc1F ZINC000096924794 JJ Agent Anodyne Cc1nn(Cc2ccccc2)c(Cl)c1/C=C\C(=O)N(C)Cc1cnn(Cc2ccccc2)c1 ZINC000096924806 JJ Agent Anodyne O=C(/C=C\c1ccc(S(=O)(=O)NCc2ccco2)cc1)N1CCC[C@H]1c1nc2ccccc2s1 ZINC000096925107 JJ Agent Anodyne O=C(/C=C\c1ccc(S(=O)(=O)NCc2ccco2)cc1)N1CCC[C@@H]1c1nc2ccccc2s1 ZINC000096925108 JJ Agent Anodyne Cc1cc(/C=C\C(=O)N2CCC(C(=O)N3CCCCCC3)CC2)c(C)n1-c1ccnn1C(C)C ZINC000096925272 JJ Agent Anodyne CCOc1ccc([C@@H]2CCCN2C(=O)/C=C\c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1 ZINC000096925329 JJ Agent Anodyne CCOc1ccc([C@H]2CCCN2C(=O)/C=C\c2ccc(S(=O)(=O)NCc3ccco3)cc2)cc1 ZINC000096925330 JJ Agent Anodyne O=C(/C=C\c1cc(F)cc2c1OCOC2)N(Cc1nnc(-c2ccccc2Cl)o1)C1CC1 ZINC000096925671 JJ Agent Anodyne Cc1ccc(Cn2nc(C)c(/C=C\C(=O)Nc3cc(C(N)=O)ccc3N3CCCC3)c2Cl)cc1 ZINC000096925744 JJ Agent Anodyne CC(=O)N1CCc2cc(C(=O)[C@H](C)OC(=O)/C=C\c3c(C)nn(-c4ccccc4)c3Cl)ccc21 ZINC000096925804 JJ Agent Anodyne CC(=O)N1CCc2cc(C(=O)[C@@H](C)OC(=O)/C=C\c3c(C)nn(-c4ccccc4)c3Cl)ccc21 ZINC000096925805 JJ Agent Anodyne CN1CCN(C(=O)/C=C\c2cn(Cc3ccccc3)nc2-c2cccnc2)[C@H](c2ccccc2)C1 ZINC000096925966 JJ Agent Anodyne C#CCOc1ccc(/C=C(/Cl)c2nnc(C(=O)NCc3ccccc3)s2)cc1OCC ZINC000096926336 JJ Agent Mild COc1cc(OC)cc([C@H](NC(=O)/C=C\c2cc(Cl)c(OC(C)C)c(OC)c2)c2nccn2C)c1 ZINC000096926452 JJ Agent Anodyne COc1cc(OC)cc([C@@H](NC(=O)/C=C\c2cc(Cl)c(OC(C)C)c(OC)c2)c2nccn2C)c1 ZINC000096926453 JJ Agent Anodyne Cc1cc(NC(=O)/C=C\c2cc(C)n(-c3ccnn3C(C)C)c2C)ccc1N1CCN(C)CC1 ZINC000096926459 JJ Agent Anodyne O=C(CCc1ccc2c(c1)OCO2)NCCN1C(=O)S/C(=C/c2cccc(Cl)c2Cl)C1=O ZINC000096926602 JJ Agent Anodyne O=C(CCc1ccc2c(c1)OCO2)NCCN1C(=O)S/C(=C/c2ccc(Cl)cc2Cl)C1=O ZINC000096926605 JJ Agent Anodyne CCOC(=O)/C=C\c1ccc(NC(=O)C2(S(=O)(=O)c3cc(C)ccc3C)CCCC2)cc1 ZINC000096930951 JJ Agent Anodyne CCOC(=O)/C=C\c1ccc(NC(=O)C2(S(=O)(=O)c3ccc(C)c(C)c3)CCCC2)cc1 ZINC000096930952 JJ Agent Anodyne COc1ccccc1/C=C(\C(=O)OCC(=O)Nc1ccccc1N1CCCC1=O)c1ccccc1 ZINC000096930998 JJ Agent Anodyne CCOC(=O)/C=C\c1ccc(NC(=O)CSc2nnc3c(Cl)cc(C(F)(F)F)cn23)cc1 ZINC000096931006 JJ Agent Anodyne Cc1cc(NC(=O)COC(=O)/C=C\c2c(C)nn(Cc3c(Cl)cccc3Cl)c2Cl)on1 ZINC000096931089 JJ Agent Anodyne COC(=O)c1ccc(COc2ccc(/C=C(/C#N)c3nc(N)nc(Nc4ccccc4)n3)cc2)cc1 ZINC000096931104 JJ Agent Reactive COc1cc(/C=C(/C#N)c2nc(N)nc(Nc3ccccc3)n2)ccc1OC(=O)c1ccc(F)cc1 ZINC000096931115 JJ Agent Reactive COc1ccc(/C=C\c2noc(C)c2NC(=O)CCn2c(=O)oc3cc(Cl)ccc32)cc1 ZINC000096931201 JJ Agent Anodyne Cc1cc(/C=C(/C#N)C(=O)O[C@H](C(N)=O)c2ccc(F)cc2)c(C)n1-c1ccc(Br)cc1 ZINC000096931208 JJ Agent Reactive Cc1cc(/C=C(/C#N)C(=O)O[C@@H](C(N)=O)c2ccc(F)cc2)c(C)n1-c1ccc(Br)cc1 ZINC000096931209 JJ Agent Reactive CC(C)n1ncc2c(C(=O)N3CCN(C/C=C\c4ccccc4)CC3)cc(-c3ccco3)nc21 ZINC000096931214 JJ Agent Anodyne CNS(=O)(=O)c1ccc(-c2ccc(/C=C(/Cl)c3nc(O)c4c5c(sc4n3)CCC5)o2)cc1 ZINC000096931676 JJ Agent Anodyne COc1cccc(N2C(=O)/C(=C/c3ccc(C(C)C)cc3)N=C2S[C@@H]2CCCCNC2=O)c1 ZINC000096935778 JJ Agent Anodyne COc1cccc(N2C(=O)/C(=C/c3ccc(C(C)C)cc3)N=C2S[C@H]2CCCCNC2=O)c1 ZINC000096935779 JJ Agent Anodyne C=CCOc1ccc(/C=C\C(=O)N(Cc2ccccc2)Cc2nc3ccsc3c(=O)[nH]2)cc1 ZINC000096935816 JJ Agent Mild CC(=O)N(c1nc(/C=C2\SC(=S)N(CCCN(C)C)C2=O)cs1)c1cccc(C)c1C ZINC000096935925 JJ Agent Clean CCOC(=O)c1c(NC(=O)COC(=O)/C=C\c2csc(C)n2)sc(C)c1-c1ccccc1 ZINC000096936045 JJ Agent Anodyne Cc1nc(/C=C\C(=O)OCC(=O)N(C)Cc2ccc(-c3ccc(Br)cc3)o2)cs1 ZINC000096936048 JJ Agent Anodyne O=S(=O)(/C=C\c1ccc(Cl)cc1)N1CCC[C@H](c2nnc3ccc(C(F)(F)F)cn23)C1 ZINC000096936121 JJ Agent Anodyne CS(=O)(=O)N1CCC(Nc2nc(/C=C\c3ccccc3)nc3sc4c(c23)CCCC4)CC1 ZINC000096936407 JJ Agent Anodyne Cc1nc(COc2ccccc2/C=C\C(=O)N(Cc2nc3ccccc3c(=O)[nH]2)C(C)C)cs1 ZINC000096936737 JJ Agent Anodyne Cc1nc(COc2ccccc2/C=C\C(=O)Nc2ccc(C(=O)c3nccn3C)cc2)cs1 ZINC000096936783 JJ Agent Anodyne C/C=C\c1ccc(OCC(=O)OCC(=O)Nc2c(C#N)c(C)c(C)n2C2CCCC2)c(OC)c1 ZINC000096936786 JJ Agent Mild Cc1nc(COc2ccccc2/C=C\C(=O)N(C)[C@@H](C)c2ccc(-n3cncn3)cc2)cs1 ZINC000096936794 JJ Agent Anodyne Cc1nc(COc2ccccc2/C=C\C(=O)N(C)[C@H](C)c2ccc(-n3cncn3)cc2)cs1 ZINC000096936795 JJ Agent Anodyne O=C(/C=C\c1ccccc1OC(F)F)N(Cc1ccccc1)Cc1nc2ccccc2c(=O)[nH]1 ZINC000096936965 JJ Agent Anodyne Cc1ccccc1/C=C\c1nc(SCC(=O)Nc2ccc(I)cc2C)n[nH]1 ZINC000096937167 JJ Agent Anodyne CN(Cc1nc2ccsc2c(=O)[nH]1)C(=O)/C=C\c1cn(-c2ccccc2)nc1-c1ccc(F)cc1 ZINC000096937229 JJ Agent Anodyne C/C=C\c1ccc(OC[C@H](O)Cn2cnc3scc(-c4ccc(OC)cc4)c3c2=O)c(OC)c1 ZINC000096939944 JJ Agent Anodyne C/C=C\c1ccc(OC[C@@H](O)Cn2cnc3scc(-c4ccc(OC)cc4)c3c2=O)c(OC)c1 ZINC000096939946 JJ Agent Anodyne C/C=C\c1cc(C(=O)N2CCN(Cc3csc(-c4ccccc4)n3)CC2)cc(OC)c1OC ZINC000096940583 JJ Agent Anodyne CCOc1cc(/C=C\C(=O)NCc2ccc(Cn3cncn3)cc2)ccc1OCCOc1ccccc1 ZINC000096940748 JJ Agent Anodyne Cc1ccc(-c2noc(CN3CCN(C(=O)/C=C\c4csc(-c5ccc(F)cc5)n4)CC3)n2)cc1 ZINC000096941052 JJ Agent Anodyne CC[C@@H](C)N(CC(=O)Nc1cccc(C)c1C)C(=O)COC(=O)/C=C\c1cccc2cccnc12 ZINC000096941172 JJ Agent Anodyne CC[C@H](C)N(CC(=O)Nc1cccc(C)c1C)C(=O)COC(=O)/C=C\c1cccc2cccnc12 ZINC000096941173 JJ Agent Anodyne Cc1c(C#N)c(NC(=O)COC(=O)/C=C\c2cccc3cccnc23)n(Cc2ccc(F)cc2)c1C ZINC000096941201 JJ Agent Mild CC(C)Oc1ccc(S(=O)(=O)N2CCCCC2)cc1NC(=O)/C=C\c1cccc2cccnc12 ZINC000096941244 JJ Agent Anodyne Cc1noc(CSC2=N/C(=C/c3ccc(N(C)C)cc3)C(=O)N2c2ccc(OC(F)F)cc2)n1 ZINC000096941973 JJ Agent Clean COc1cc(/C=C\C(=O)Nc2nc(C)c(-c3nccn3C(F)F)s2)ccc1OC(F)F ZINC000096942158 JJ Agent Anodyne O=C(CSc1n[nH]c(/C=C\c2ccc(F)cc2)n1)N1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000096942229 JJ Agent Anodyne O=C1C[C@@H](C(=O)N(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)c2ccc(F)cc2N1 ZINC000096943469 JJ Agent Anodyne O=C1C[C@H](C(=O)N(C/C=C\c2ccccc2)c2ccc3c(c2)OCCO3)c2ccc(F)cc2N1 ZINC000096943472 JJ Agent Anodyne N#C/C(=C/c1ccc(-n2cccn2)cc1)S(=O)(=O)c1cc(Br)ccc1Br ZINC000096947649 JJ Agent Reactive Cc1c(C#N)c(NC(=O)COC(=O)/C=C\c2cccc3cccnc23)n(-c2ccccc2)c1C ZINC000096973090 JJ Agent Mild CCOc1cc(/C=C2/COc3ccc(Br)cc3C2=O)cc(Cl)c1OCC(=O)N(C)C ZINC000096973237 JJ Agent Mild CCOc1cc(/C=C\C(=O)c2cnn(-c3ccccc3)c2C)cc(Cl)c1OCC(=O)N(C)C ZINC000096973262 JJ Agent Mild COC(=O)c1cccc(C#Cc2cccc(NC(=O)/C=C\c3cc(F)cc4c3OCOC4)c2)c1 ZINC000096988906 JJ Agent Mild O=C(/C(=C\c1ccc(F)cc1)c1cccs1)N1CCN(Cc2nc(-c3ccsc3)no2)CC1 ZINC000096993350 JJ Agent Anodyne Cc1nn2c(C(F)(F)F)ccnc2c1/C=C\C(=O)N[C@@H](C)c1ccc(Br)cc1 ZINC000096993365 JJ Agent Anodyne Cc1nn2c(C(F)(F)F)ccnc2c1/C=C\C(=O)N[C@H](C)c1ccc(Br)cc1 ZINC000096993366 JJ Agent Anodyne COc1cc(/C=C\C(=O)Nc2cc(-c3nnc4n3CCCCC4)ccc2C)cc(OC)c1OC ZINC000096993579 JJ Agent Anodyne COc1ccc(-c2nn(CCC#N)cc2/C=C(/C#N)C(=O)N(C)CCOc2cc(C)cc(C)c2)cc1 ZINC000096993790 JJ Agent Reactive CCCOc1c(Cl)cc(/C=C\C(=O)N2CCC[C@@H]2c2nnc3n2CCCCC3)cc1OC ZINC000096993823 JJ Agent Anodyne CCCOc1c(Cl)cc(/C=C\C(=O)N2CCC[C@H]2c2nnc3n2CCCCC3)cc1OC ZINC000096993825 JJ Agent Anodyne Cc1nc(CN2CCN(C(=O)/C=C\c3cn(-c4ccccc4)nc3-c3cccs3)CC2)cs1 ZINC000096993842 JJ Agent Anodyne CCOC(=O)c1sc2cccc(F)c2c1COC(=O)/C=C\c1cc2ccccc2[nH]c1=O ZINC000096993862 JJ Agent Anodyne Cc1ccc(N=C2S[C@@H](CC(=O)Nc3ccc(C(=O)O)cc3)C(=O)N2C2CCCC2)cc1 ZINC000096994079 JJ Agent Anodyne Cc1ccc(N=C2S[C@H](CC(=O)Nc3ccc(C(=O)O)cc3)C(=O)N2C2CCCC2)cc1 ZINC000096994081 JJ Agent Anodyne CCOc1ccc(N=C2S[C@@H](CC(=O)Nc3ccc(C(=O)O)cc3)C(=O)N2C2CCCC2)cc1 ZINC000096994091 JJ Agent Anodyne CCOc1ccc(N=C2S[C@H](CC(=O)Nc3ccc(C(=O)O)cc3)C(=O)N2C2CCCC2)cc1 ZINC000096994092 JJ Agent Anodyne Cc1nc(CN2CCN(C(=O)/C=C\c3cn(Cc4ccccc4)nc3-c3ccccc3)CC2)cs1 ZINC000096998256 JJ Agent Anodyne Cc1nn(CC(C)C)c(Cl)c1/C=C\C(=O)N(Cc1ccc(C(=O)NCC(F)(F)F)cc1)C1CC1 ZINC000097004831 JJ Agent Anodyne Cn1nccc1/C=C\C(=O)N(C[C@@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 ZINC000097013868 JJ Agent Anodyne Cn1nccc1/C=C\C(=O)N(C[C@H]1CCCO1)c1nc(-c2ccc(Br)cc2)cs1 ZINC000097013872 JJ Agent Anodyne CCOC(=O)c1ccc(N2C(=O)/C(=C/c3nc(C)n4ccccc34)c3ccccc3C2=O)cc1 ZINC000097029957 JJ Agent Anodyne CCOCc1ccccc1CNC(=O)/C=C\c1c(C)nn(Cc2cccc(OC)c2)c1Cl ZINC000097035428 JJ Agent Anodyne O=C(/C=C\c1cc(Br)ccc1F)Nc1ccc(-n2nccn2)cc1C(F)(F)F ZINC000097073382 JJ Agent Anodyne CCCCCNC(=O)C1CCN(C(=O)/C=C\c2ccc(OCc3csc(C)n3)cc2)CC1 ZINC000097161593 JJ Agent Anodyne COc1ccccc1-n1c(C)cc(/C=C(/C#N)C(=O)OCc2nnc(-c3ccccc3)o2)c1C ZINC000097654691 JJ Agent Reactive CCOc1ccc(-n2c(C)cc(/C=C(/C#N)C(=O)OCC(=O)N(C)C3CCCCC3)c2C)cc1 ZINC000097654708 JJ Agent Reactive COCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)c2cc(C)n(Cc3ccccc3)c2C)c1C ZINC000097654774 JJ Agent Reactive O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C\c1c(F)cccc1Cl)CC2)NC[C@@H]1CCCO1 ZINC000097656609 JJ Agent Anodyne O=C(COC(=O)c1c2c(nc3ccccc13)/C(=C\c1c(F)cccc1Cl)CC2)NC[C@H]1CCCO1 ZINC000097656611 JJ Agent Anodyne CCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)Nc2nc(-c3ccc(OC)cc3)cs2)c1C ZINC000097657758 JJ Agent Reactive CCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)Nc2sc3c(c2C#N)CC[C@@H](C)C3)c1C ZINC000097657776 JJ Agent Reactive CCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)Nc2sc3c(c2C#N)CC[C@H](C)C3)c1C ZINC000097657780 JJ Agent Reactive CCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)c2cc(C)n(-c3ccc4c(c3)OCO4)c2C)c1C ZINC000097657807 JJ Agent Reactive N#CC1(NC(=O)CSC2=N/C(=C\c3ccccc3)C(=O)N2c2ccc(F)cc2)CCCCC1 ZINC000097664269 JJ Agent Mild C/C=C/[C@@H]1O[C@H]([C@H](O)/C=C/C=C(\C)C[C@@H](C)/C=C(C)\C=C\[C@H]2CC=CC(=O)O2)C[C@@H](O)[C@@H]1C ZINC000097943081 JJ Agent Anodyne C/C=C/[C@@H]1O[C@H]([C@H](O)/C=C/C=C/C[C@@H](C)/C=C(\C=C\[C@H]2CC=CC(=O)O2)CC)C[C@@H](O)[C@@H]1C ZINC000097950157 JJ Agent Anodyne C[C@@H](CI)[C@H]1CC[C@]2(C)C(OS(=O)(=O)C(F)(F)F)=CCC[C@H]12 ZINC000097978043 JJ Agent Unstable C[C@@H](CI)[C@H]1CC[C@]2(C)C(OS(=O)(=O)C(F)(F)F)=CCC[C@@H]12 ZINC000097978044 JJ Agent Unstable CCOc1cc(/C=C2/N=C(C34CC5CC(CC(C5)C3)C4)OC2=O)cc(Cl)c1OCC(=O)N(C)C ZINC000097982733 JJ Agent Anodyne COC(=O)c1ccc(COc2ccc(/C=C(/C#N)S(=O)(=O)c3ccc(C)cc3)cc2OC)cc1 ZINC000097990716 JJ Agent Reactive O=C(NCCN1C(=O)S/C(=C/c2ccccc2F)C1=O)Nc1ccc(Cl)c(Cl)c1 ZINC000097991072 JJ Agent Anodyne C/C(=N/Nc1ccc(S(=O)(=O)Nc2ccc(C)cc2C)cc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000097991308 JJ Agent Mild C/C(=N/Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccc(S(=O)(=O)NCc2ccco2)cc1 ZINC000097991477 JJ Agent Mild CCOc1c(Br)cc(/C=C(/Cl)c2nc(O)c3ccc(C(=O)O)cc3n2)cc1OC ZINC000097992417 JJ Agent Anodyne CCOc1cc(/C=C(/Cl)c2nc(O)c3c(C)c(C(=O)OCCOC)sc3n2)ccc1OC ZINC000097992422 JJ Agent Anodyne CC(C)CCOc1ccc(/C=C(/C(=O)O)c2ccc(S(=O)(=O)N3CCCCC3)s2)cc1 ZINC000097993165 JJ Agent Anodyne C/C(=N/N=C1\NC(=O)[C@@H](CC(=O)Nc2c(C)cccc2C)S1)c1ccc(N2CCCCC2)c(F)c1 ZINC000097995204 JJ Agent Mild C/C(=N/N=C1\NC(=O)[C@H](CC(=O)Nc2c(C)cccc2C)S1)c1ccc(N2CCCCC2)c(F)c1 ZINC000097995205 JJ Agent Mild C=CC/N=C1\S/C(=C2\Sc3ccccc3N2CC)C(=O)N1S(=O)(=O)c1ccc(C)cc1 ZINC000097995210 JJ Agent Mild CCCn1c(C)cc(/C=C(/C#N)C(=O)OCC(=O)Nc2c(C#N)c(C)c(C)n2Cc2ccco2)c1C ZINC000097996869 JJ Agent Reactive COc1cc(OC)cc(C2=N/C(=C/c3csc(N(C(C)=O)c4ccc(C)c(C)c4)n3)C(=O)O2)c1 ZINC000098002336 JJ Agent Anodyne CC(=O)N(c1ccc(C)c(C)c1)c1nc(/C=C2\SC(=S)N(CCCN(C)C)C2=O)cs1 ZINC000098002405 JJ Agent Clean COCCCN1C(=O)/C(=C/c2csc(N(C(C)=O)c3ccc(C)c(C)c3)n2)SC1=S ZINC000098002425 JJ Agent Clean COCCCN1C(=O)/C(=C/c2csc(N(C(C)=O)c3cccc(C)c3C)n2)SC1=S ZINC000098002427 JJ Agent Clean COCCCN1C(=O)/C(=C/c2csc(N(C(C)=O)c3cccc(Cl)c3)n2)SC1=S ZINC000098002428 JJ Agent Clean O=S(=O)(/C=C\c1ccccc1)N1CCN(Cn2c(=S)n(-c3ccccc3)c3ccccc32)CC1 ZINC000098053625 JJ Agent Anodyne C/C(=N\Nc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1[N+](=O)[O-])c1ccc(O)cc1 ZINC000098053693 JJ Agent Mild CCN(CC)c1oc(/C=N\NC(=O)c2cccc([N+](=O)[O-])c2)cc1Sc1ccccc1[N+](=O)[O-] ZINC000098053839 JJ Agent Reactive CCN(CC)c1oc(/C=N\NC(=O)c2ccc([N+](=O)[O-])cc2)cc1Sc1ccccc1[N+](=O)[O-] ZINC000098053840 JJ Agent Reactive CCCCOc1ccc(/C=C\C(=O)c2ccc(OC)c(CSc3nnnn3C)c2)cc1OC ZINC000098053967 JJ Agent Mild O=C1/C(=C/c2cnn(-c3ccccc3)c2)CN(CC(F)F)C/C1=C\c1cnn(-c2ccccc2)c1 ZINC000098055708 JJ Agent Mild