COc1cc([C@@H]2SCC(=O)N2c2ccc(Cl)cc2)cc(OC)c1OC ZINC000001091178 GI Annotated Anodyne COc1cc([C@H]2SCC(=O)N2c2ccc(Cl)cc2)cc(OC)c1OC ZINC000001091179 GI Annotated Anodyne Clc1ccc(Sc2oc(/C=N\n3cnnc3)cc2Br)cc1 ZINC000001105538 GI Annotated Mild Cc1cc(/C=N\n2cnnc2)c(C)n1-c1ccc(OCc2ccccc2F)cc1 ZINC000001154762 GI Annotated Mild COc1cc(C(=S)N2CCCC2)ccc1OC(=O)c1ccccc1Cl ZINC000001163825 GI Annotated Anodyne Cc1cc(/C=N\n2cnnc2)c(C)n1-c1ccc(OCc2ccc(F)cc2)cc1 ZINC000001167254 GI Annotated Mild Cc1c(/C=N\n2cnnc2)c2ccccc2n1CCOc1ccc(Cl)cc1 ZINC000001168590 GI Annotated Mild Cc1c(/C=N/n2cnnc2)c2ccccc2n1CCOc1ccc(Cl)cc1 ZINC000001168591 GI Annotated Mild COc1ccc2c(c1)nc(SCC(=O)c1ccc(Br)s1)n2C ZINC000001194302 GI Annotated Anodyne O=C(Nc1ccccc1SC(F)F)NS(=O)(=O)c1ccccc1Cl ZINC000001227055 GI Annotated Anodyne O=C(OCC(F)(F)C(F)F)c1ccccc1C(=O)Oc1ccc(F)cc1F ZINC000001230867 GI Annotated Anodyne Cc1ccc(C(=O)N/N=C/c2ccc(-c3cccc(Br)c3)o2)cn1 ZINC000001247061 GI Annotated Reactive CCC(=O)Nc1cc(OC)c(NC(=S)Nc2ccccc2CC)cc1OC ZINC000001324297 GI Annotated Anodyne Cc1nonc1NC(=O)CSc1nc(CCC2CCCC2)nc2ccccc12 ZINC000001356010 GI Annotated Anodyne Cc1ccc2cc(CN(Cc3ccco3)C(=O)c3cccc(F)c3)c(=O)[nH]c2c1 ZINC000001358571 GI Annotated Anodyne CCOc1ccc(N(CC(=O)NC2CCCC2)C(=O)c2ccc(C)s2)cc1 ZINC000001368491 GI Annotated Anodyne C#CC(=O)N(c1ccccc1F)[C@H](C(=O)NC1CCCCC1)c1ccccc1F ZINC000001376671 GI Annotated Mild C#CC(=O)N(c1ccccc1F)[C@@H](C(=O)NC1CCCCC1)c1ccccc1F ZINC000001376672 GI Annotated Mild CCOc1ccccc1NC(=O)N1CCC(n2nnc3cc(C)ccc32)CC1 ZINC000001380672 GI Annotated Anodyne NC(=O)C1(c2cccc(Sc3ccc(Cn4cccc4)cc3)c2)CCOCC1 ZINC000001485547 GI Annotated Anodyne Cc1cc(-c2c(F)c(F)c3c(=O)c(C(=O)O)cn(C4CC4)c3c2F)cc(C)n1 ZINC000001485867 GI Annotated Anodyne O=C(c1cccc2ccccc12)N1CCN(Cc2c[nH]cn2)Cc2ccccc21 ZINC000001487111 GI Annotated Anodyne O=C(c1cccc2ccccc12)N1CCN(Cc2c[nH]cn2)c2ccccc2C1 ZINC000001487113 GI Annotated Anodyne CN1C(=O)Cc2cc3c(CCC4CCN(Cc5ccccc5)CC4)noc3cc21 ZINC000001488164 GI Annotated Anodyne CN(C)CCc1c2c(c3nccc4c5ccccc5[nH]c1c34)NC(=O)CS2 ZINC000001489961 GI Annotated Bother O=C1OC2(CCC(C(=O)Nc3ncc(-c4ccccc4)cn3)CC2)c2ccccc21 ZINC000001493864 GI Annotated Anodyne O=c1c2ccccc2nc(/C=C(\O)c2ccncc2)n1-c1ccccc1Cl ZINC000100014165 GI Annotated Anodyne O=C(Nc1c(F)cccc1F)C1=C(O)CCn2c1nc1c(Cl)cccc12 ZINC000100018455 GI Annotated Anodyne O=C(Nc1c(F)cccc1F)C1=C(O)CCn2c1nc1cc(Cl)ccc12 ZINC000100018519 GI Annotated Anodyne COC(=O)CCCN1C=CC(c2ccc(OC)cc2)(c2ccc(OC)cc2)C=C1 ZINC000100028340 GI Annotated Anodyne O[C@]1(c2ccc(-c3ccc(Br)cc3)cc2)CN2CCCC[C@H]2CO1 ZINC000100059773 GI Annotated Anodyne in-vitro O[C@]1(c2ccc(-c3ccc(Br)s3)cc2)CN2CCCC[C@H]2CO1 ZINC000100059795 GI Annotated Anodyne in-vitro CCOC(=O)C1=C(O)C[C@H](c2ccccc2)N(C(=O)CCl)[C@@H]1c1ccccc1 ZINC000100078269 GI Annotated Reactive CCOC(=O)C1=C(O)C[C@@H](c2ccccc2)N(C(=O)CCl)[C@@H]1c1ccccc1 ZINC000100078271 GI Annotated Reactive CCOC(=O)C1=C(O)C[C@H](c2ccccc2)N(C(=O)CCl)[C@H]1c1ccccc1 ZINC000100078273 GI Annotated Reactive CCOC(=O)C1=C(O)C[C@@H](c2ccccc2)N(C(=O)CCl)[C@H]1c1ccccc1 ZINC000100078276 GI Annotated Reactive CC(C)[C@H]1C/C=C/C[C@@H](C)Oc2ccccc2C(=O)N(C)[C@H](C(C)C)C(=O)N1 ZINC000100084436 GI Annotated Anodyne CC(C)[C@H]1C/C=C/C[C@H](C)Oc2ccccc2C(=O)N(C)[C@H](C(C)C)C(=O)N1 ZINC000100084734 GI Annotated Anodyne CC(C)[C@@H]1C/C=C/C[C@H](C)Oc2ccccc2C(=O)N(C)[C@@H](C(C)C)C(=O)N1 ZINC000100087493 GI Annotated Anodyne CC(C)[C@@H]1C/C=C/C[C@H](C)Oc2ccccc2C(=O)N(C)[C@H](C(C)C)C(=O)N1 ZINC000100088212 GI Annotated Anodyne ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@@H]4C[C@@H]([C@@H]5O[C@H]54)[C@@H]3[C@@]1(Cl)C2(Cl)Cl ZINC000100091855 GI Annotated Anodyne in-man endogenous ClC1=C(Cl)[C@]2(Cl)[C@@H]3[C@@H]4C[C@@H]([C@@H]5O[C@H]54)[C@@H]3[C@@]1(Cl)C2(Cl)Cl ZINC000100091857 GI Annotated Anodyne in-man endogenous ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@H]([C@@H]4C[C@H]3[C@@H]3O[C@@H]43)[C@@]1(Cl)C2(Cl)Cl ZINC000100091860 GI Annotated Anodyne in-man endogenous ClC1=C(Cl)[C@]2(Cl)[C@H]3[C@@H]4C[C@@H]([C@@H]5O[C@@H]45)[C@@H]3[C@@]1(Cl)C2(Cl)Cl ZINC000100091866 GI Annotated Anodyne in-man endogenous O=C(Nc1ccccc1F)N1[C@@H]2CNC[C@H]1[C@@H]2c1ccc(-c2ccccc2)cc1 ZINC000100093595 GI Annotated Anodyne COc1cccc(NC(=O)N2[C@@H]3CNC[C@H]2[C@H]3c2ccc(-c3ccccc3)cc2)c1 ZINC000100094480 GI Annotated Anodyne N#Cc1c(N[C@@H]2CC[C@@H](N)CC2)cc(Nc2ccccc2Cl)n2nccc12 ZINC000100095259 GI Annotated Mild COc1cccc(NC(=O)N2[C@@H]3CNC[C@H]2[C@@H]3c2ccc(-c3ccccc3)cc2)c1 ZINC000100096112 GI Annotated Anodyne COc1ccccc1CN1[C@@H]2CNC[C@H]1[C@@H]2c1ccc(-c2ccc(C#N)cc2)cc1 ZINC000100101280 GI Annotated Mild COc1ccccc1CN1C[C@H]2N[C@@H](C1)[C@@H]2c1ccc(-c2ccc(C#N)cc2)cc1 ZINC000100101358 GI Annotated Mild COc1ccccc1CN1C[C@H]2N[C@@H](C1)[C@H]2c1ccc(-c2ccc(C#N)cc2)cc1 ZINC000100101362 GI Annotated Mild N#Cc1cccc(-c2ccc([C@H]3[C@H]4CNC[C@@H]3N4Cc3cccc(F)c3)cc2)c1 ZINC000100101467 GI Annotated Mild N#Cc1cccc(-c2ccc([C@@H]3[C@H]4CNC[C@@H]3N4Cc3cccc(F)c3)cc2)c1 ZINC000100101470 GI Annotated Mild COc1cccc(CN2C[C@H]3N[C@@H](C2)[C@@H]3c2ccc(-c3ccc(C#N)cc3)cc2)c1 ZINC000100101493 GI Annotated Mild COc1cccc(CN2C[C@H]3N[C@@H](C2)[C@H]3c2ccc(-c3ccc(C#N)cc3)cc2)c1 ZINC000100101519 GI Annotated Mild O=C(Nc1ccccc1F)N1[C@@H]2CNC[C@H]1[C@H]2c1ccc(-c2ccccc2)cc1 ZINC000100101537 GI Annotated Anodyne COc1cccc(CN2[C@@H]3CNC[C@H]2[C@H]3c2ccc(-c3cccc(C#N)c3)cc2)c1 ZINC000100101594 GI Annotated Mild COc1cccc(CN2[C@@H]3CNC[C@H]2[C@@H]3c2ccc(-c3cccc(C#N)c3)cc2)c1 ZINC000100101595 GI Annotated Mild Cc1ccccc1-c1ccc([C@H]2[C@H]3CN(C(=O)Cc4ccccc4)C[C@@H]2N3)cc1 ZINC000100101758 GI Annotated Anodyne Cc1ccccc1-c1ccc([C@@H]2[C@H]3CN(C(=O)Cc4ccccc4)C[C@@H]2N3)cc1 ZINC000100101760 GI Annotated Anodyne N#Cc1cccc(-c2ccc([C@H]3[C@H]4CNC[C@@H]3N4Cc3ccc(F)cc3)cc2)c1 ZINC000100105961 GI Annotated Mild N#Cc1cccc(-c2ccc([C@@H]3[C@H]4CNC[C@@H]3N4Cc3ccc(F)cc3)cc2)c1 ZINC000100105965 GI Annotated Mild O=C(C1CCCCC1)N1C[C@H]2N[C@@H](C1)[C@@H]2c1ccc(-c2ccccc2F)cc1 ZINC000100106248 GI Annotated Anodyne O=C(C1CCCCC1)N1C[C@H]2N[C@@H](C1)[C@H]2c1ccc(-c2ccccc2F)cc1 ZINC000100106251 GI Annotated Anodyne O=C(Nc1ccccc1)N1C[C@H]2N[C@@H](C1)[C@@H]2c1ccc(-c2ccccc2F)cc1 ZINC000100106286 GI Annotated Anodyne O=C(Nc1ccccc1)N1C[C@H]2N[C@@H](C1)[C@H]2c1ccc(-c2ccccc2F)cc1 ZINC000100106372 GI Annotated Anodyne N#Cc1ccc(-c2ccc([C@H]3[C@H]4CN(Cc5ccccc5F)C[C@@H]3N4)cc2)cc1 ZINC000100106871 GI Annotated Mild N#Cc1ccc(-c2ccc([C@@H]3[C@H]4CN(Cc5ccccc5F)C[C@@H]3N4)cc2)cc1 ZINC000100106872 GI Annotated Mild COc1cccc(-c2ccc([C@H]3[C@H]4CNC[C@@H]3N4Cc3ccc(F)cc3)cc2)c1 ZINC000100106988 GI Annotated Anodyne COc1cccc(-c2ccc([C@@H]3[C@H]4CNC[C@@H]3N4Cc3ccc(F)cc3)cc2)c1 ZINC000100106990 GI Annotated Anodyne COc1cccc(-c2ccc([C@@H]3[C@H]4CN(Cc5cccc(F)c5)C[C@@H]3N4)cc2)c1 ZINC000100107022 GI Annotated Anodyne COc1cccc(-c2ccc([C@H]3[C@H]4CN(Cc5cccc(F)c5)C[C@@H]3N4)cc2)c1 ZINC000100107025 GI Annotated Anodyne COc1cccc(CN2C[C@H]3N[C@@H](C2)[C@H]3c2ccc(-c3ccccc3F)cc2)c1 ZINC000100107184 GI Annotated Anodyne COc1cccc(CN2C[C@H]3N[C@@H](C2)[C@@H]3c2ccc(-c3ccccc3F)cc2)c1 ZINC000100107189 GI Annotated Anodyne N#Cc1ccc(-c2ccc([C@@H]3[C@H]4CN(C(=O)C5CCCCC5)C[C@@H]3N4)cc2)cc1 ZINC000100107474 GI Annotated Mild N#Cc1ccc(-c2ccc([C@H]3[C@H]4CN(C(=O)C5CCCCC5)C[C@@H]3N4)cc2)cc1 ZINC000100107476 GI Annotated Mild COc1ccccc1-c1ccc([C@@H]2[C@H]3CNC[C@@H]2N3Cc2ccc(F)cc2)cc1 ZINC000100107941 GI Annotated Anodyne Cc1ccccc1-c1ccc([C@@H]2[C@H]3CN(Cc4ccc5c(c4)OCO5)C[C@@H]2N3)cc1 ZINC000100108413 GI Annotated Anodyne Cc1ccccc1-c1ccc([C@H]2[C@H]3CN(Cc4ccc5c(c4)OCO5)C[C@@H]2N3)cc1 ZINC000100108417 GI Annotated Anodyne Cc1ccccc1-c1ccc([C@H]2[C@H]3CNC[C@@H]2N3Cc2ccc3c(c2)OCO3)cc1 ZINC000100108599 GI Annotated Anodyne Cc1ccccc1-c1ccc([C@@H]2[C@H]3CNC[C@@H]2N3Cc2ccc3c(c2)OCO3)cc1 ZINC000100108700 GI Annotated Anodyne COc1cccc(CN2[C@@H]3CNC[C@H]2[C@@H]3c2ccc(-c3ccc(C#N)cc3)cc2)c1 ZINC000100108918 GI Annotated Mild COc1ccccc1CN1[C@@H]2CNC[C@H]1[C@@H]2c1ccc(-c2cccc(C#N)c2)cc1 ZINC000100109141 GI Annotated Mild COc1ccccc1CN1[C@@H]2CNC[C@H]1[C@H]2c1ccc(-c2cccc(C#N)c2)cc1 ZINC000100109144 GI Annotated Mild Cc1ccccc1-c1ccc([C@H]2[C@H]3CN(C(=O)NC4CCCCC4)C[C@@H]2N3)cc1 ZINC000100109155 GI Annotated Anodyne Cc1ccccc1-c1ccc([C@@H]2[C@H]3CN(C(=O)NC4CCCCC4)C[C@@H]2N3)cc1 ZINC000100109160 GI Annotated Anodyne O=C(NC1CCCCC1)N1[C@@H]2CNC[C@H]1[C@H]2c1ccc(-c2ccccc2F)cc1 ZINC000100113987 GI Annotated Anodyne N#CC1=C(N)S[C@@H](c2cccs2)[C@@H]([N+](=O)[O-])[C@H]1c1ccccc1Cl ZINC000100175429 GI Annotated Reactive N#CC1=C(N)S[C@@H](c2cccs2)[C@@H]([N+](=O)[O-])[C@@H]1c1ccccc1Cl ZINC000100175434 GI Annotated Reactive N#CC1=C(N)S[C@@H](c2cccs2)[C@H]([N+](=O)[O-])[C@H]1c1ccccc1Cl ZINC000100175440 GI Annotated Reactive N#CC1=C(N)S[C@@H](c2cccs2)[C@H]([N+](=O)[O-])[C@@H]1c1ccccc1Cl ZINC000100175445 GI Annotated Reactive CC1(C)C[C@@H]2[C@@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@]32C1 ZINC000100234794 GI Annotated Reactive in-vitro CC1(C)C[C@H]2[C@@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@@]23C1 ZINC000100234797 GI Annotated Reactive in-vitro CC1(C)C[C@@H]2[C@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@]32C1 ZINC000100234801 GI Annotated Reactive in-vitro CC1(C)C[C@H]2[C@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@]32C1 ZINC000100234808 GI Annotated Reactive in-vitro COc1ccccc1CN/C=C1\Nc2ccc(Br)c(Cl)c2C1=O ZINC000100292274 GI Annotated Mild ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@@H]4C[C@H]([C@@H]3[C@@]1(Cl)C2(Cl)Cl)[C@H]1O[C@@H]41 ZINC000100307748 GI Annotated Anodyne in-vitro O=C(/C=C/c1ccccc1)[C@@H]1C(=O)C(=O)N(c2ccccc2)[C@H]1c1ccccc1 ZINC000100313303 GI Annotated Mild COc1ccc(/C=C/C(=O)C2=C(O)N(C)[C@]3(C)C[C@H]2c2ccccc2O3)cc1 ZINC000100453989 GI Annotated Mild COc1ccc(/C=C/C(=O)C2=C(O)N(C)[C@@]3(C)C[C@H]2c2ccccc2O3)cc1 ZINC000100453994 GI Annotated Mild COc1ccc(/C=C/C(=O)C2=C(O)N(C)[C@]3(C)C[C@@H]2c2ccccc2O3)cc1 ZINC000100453999 GI Annotated Mild COc1ccc(/C=C/C(=O)C2=C(O)N(C)[C@@]3(C)C[C@@H]2c2ccccc2O3)cc1 ZINC000100454003 GI Annotated Mild COc1ccc(-c2c(C(F)(F)F)[nH]n3c(=O)cc(-c4ccccc4)nc23)cc1 ZINC000100493113 GI Annotated Anodyne Cc1ccc(N/C=C2\C=C3C(=CC2=O)OC(N)=C(C#N)[C@H]3c2ccccc2)cc1 ZINC000100538072 GI Annotated Reactive Cc1ccc(N/C=C2\C=C3C(=CC2=O)OC(N)=C(C#N)[C@@H]3c2ccccc2)cc1 ZINC000100538077 GI Annotated Reactive CCCc1ccc(O)c(N/C=C2\C=C(Br)C=C(OCC)C2=O)c1 ZINC000100538355 GI Annotated Mild CN(C)c1ccc(/C=C/C(=O)C2=C(O)N(C)[C@]3(C)C[C@H]2c2ccccc2O3)cc1 ZINC000100553555 GI Annotated Mild CN(C)c1ccc(/C=C/C(=O)C2=C(O)N(C)[C@@]3(C)C[C@H]2c2ccccc2O3)cc1 ZINC000100553557 GI Annotated Mild CN(C)c1ccc(/C=C/C(=O)C2=C(O)N(C)[C@]3(C)C[C@@H]2c2ccccc2O3)cc1 ZINC000100553559 GI Annotated Mild CN(C)c1ccc(/C=C/C(=O)C2=C(O)N(C)[C@@]3(C)C[C@@H]2c2ccccc2O3)cc1 ZINC000100553561 GI Annotated Mild Cc1ccccc1N/C=C1\C=C2C(=CC1=O)OC(N)=C(C#N)[C@H]2c1ccccc1 ZINC000100557517 GI Annotated Reactive Cc1ccccc1N/C=C1\C=C2C(=CC1=O)OC(N)=C(C#N)[C@@H]2c1ccccc1 ZINC000100557519 GI Annotated Reactive COc1ccc(CN/C=C2\Nc3ccc(Br)c(Cl)c3C2=O)cc1 ZINC000100573482 GI Annotated Mild C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](n1cc(CSc3nc4ccccc4s3)nn1)C2 ZINC000100597423 GI Annotated Bother C[N+]1(C)[C@H]2CC[C@@H]1C[C@@H](n1cc(COc3ccccc3C3CCCC3)nn1)C2 ZINC000100597435 GI Annotated Bother N=C(N)c1ccc(/C=C2\CCCCC/C(=C\c3ccc(C(=N)N)cc3)C2=O)cc1 ZINC000100607376 GI Annotated Mild CCOC(=O)C(=C1Nc2ccccc2N1)n1c(-c2cccnc2)nc2ccccc21 ZINC000100612388 GI Annotated Anodyne O=C(N1CC[C@]2(c3c[nH]c4ncccc34)C[C@@H]12)C1(c2ccc(Cl)cc2)CC1 ZINC000100617152 GI Annotated Anodyne O=C(N1CC[C@@]2(c3c[nH]c4ncccc34)C[C@H]12)C1(c2ccc(Cl)cc2)CC1 ZINC000100617155 GI Annotated Anodyne COC(=O)c1ccc2c(c1)CC[C@H]1[C@@H]2CCCN1C(=O)c1ccc2c(c1)N=CC2 ZINC000100620833 GI Annotated Anodyne COC(=O)c1ccc2c(c1)CC[C@H]1[C@H]2CCCN1C(=O)c1ccc2c(c1)N=CC2 ZINC000100620835 GI Annotated Anodyne Cn1cc(-c2ccc3c(c2)[C@H]2CCCN(C(=O)c4ccc5c(c4)N=CC5)[C@H]2C3)cn1 ZINC000100621283 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4cccc(Cl)c4)ccc31)[C@@H]1CC[C@@H](C2)N1 ZINC000100632320 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4cccc(Cl)c4)ccc31)[C@H]1CC[C@H](C2)N1 ZINC000100632331 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc(Cl)cc4)ccc31)[C@@H]1CC[C@@H](C2)N1 ZINC000100632436 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc(Cl)cc4)ccc31)[C@H]1CC[C@H](C2)N1 ZINC000100632445 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4)cc(Cl)c31)[C@@H]1CC[C@@H](C2)N1 ZINC000100632745 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4)cc(Cl)c31)[C@H]1CC[C@H](C2)N1 ZINC000100632750 GI Annotated Anodyne CC(C)n1c2c(c3cc(S(=O)(=O)c4ccccc4)ccc31)[C@@H]1CC[C@@H](C2)N1 ZINC000100632771 GI Annotated Anodyne CC(C)n1c2c(c3cc(S(=O)(=O)c4ccccc4)ccc31)[C@H]1CC[C@H](C2)N1 ZINC000100632773 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4Cl)ccc31)[C@@H]1CC[C@@H](C2)N1 ZINC000100632942 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4Cl)ccc31)[C@H]1CC[C@H](C2)N1 ZINC000100632945 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc5occc5c4)ccc31)[C@@H]1CC[C@@H](C2)N1 ZINC000100632946 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc5occc5c4)ccc31)[C@H]1CC[C@H](C2)N1 ZINC000100632947 GI Annotated Anodyne COc1cc([C@H]2Sc3ccccc3N=C3COC(O)=C32)cc(OC)c1OC ZINC000100634321 GI Annotated Anodyne COc1cc([C@@H]2Sc3ccccc3N=C3COC(O)=C32)cc(OC)c1OC ZINC000100634323 GI Annotated Anodyne CCCC(=O)C[C@@H]1CC[C@@H](CCN2CCN(c3nccc4c3CCO4)CC2)CC1 ZINC000100636940 GI Annotated Anodyne CC(=O)C[C@@H]1CC[C@@H](CCN2CCN(c3ncc(C)c4occc34)CC2)CC1 ZINC000100636968 GI Annotated Anodyne COC(=O)C[C@@H]1CC[C@@H](CCN2CCC(c3cccc4c3OCO4)CC2)CC1 ZINC000100638831 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@]1(C)[C@H](/N=C(\N)Nc1ccccc1I)C2 ZINC000100653265 GI Annotated Mild CC1(C)[C@H]2CC[C@@]1(C)[C@H](/N=C(\N)Nc1ccccc1I)C2 ZINC000100653273 GI Annotated Mild Cc1cnc(NC(=O)[C@H]2C(=O)N3c4ccc(F)cc4Cc4cc(F)cc2c43)s1 ZINC000100658452 GI Annotated Anodyne Cc1cnc(NC(=O)[C@@H]2C(=O)N3c4ccc(F)cc4Cc4cc(F)cc2c43)s1 ZINC000100658454 GI Annotated Anodyne Cc1cc(NC(=O)[C@H]2C(=O)N3c4ccccc4Sc4cccc2c43)sn1 ZINC000100658458 GI Annotated Anodyne Cc1cnc(NC(=O)[C@H]2C(=O)N3c4ccccc4Sc4cccc2c43)s1 ZINC000100658527 GI Annotated Anodyne Cc1cnc(NC(=O)[C@@H]2C(=O)N3c4ccccc4Sc4cccc2c43)s1 ZINC000100658528 GI Annotated Anodyne O=C(Nc1cc(F)ccc1F)[C@@H]1C(=O)N2c3ccc(F)cc3Cc3cccc1c32 ZINC000100658556 GI Annotated Anodyne O=C(Nc1c(F)cccc1F)[C@@H]1C(=O)N2c3ccccc3Cc3cccc1c32 ZINC000100658606 GI Annotated Anodyne Cc1cc(NC(=O)[C@H]2C(=O)N3c4ccc(F)cc4Cc4cc(F)cc2c43)ns1 ZINC000100658658 GI Annotated Anodyne CSc1ccc(CNc2nc3nc(C)c(Cc4ccccc4)c(O)n3n2)cc1 ZINC000100695400 GI Annotated Anodyne CCc1ccccc1-n1c(SCc2ccccc2F)nc2nncc-2c1O ZINC000100702990 GI Annotated Anodyne C=CCO/C(O)=C1/C(C)=Nc2nc(O)nc(O)c2[C@@H]1c1ccc(C(C)C)cc1 ZINC000100703098 GI Annotated Mild C=CCO/C(O)=C1/C(C)=Nc2nc(O)nc(O)c2[C@H]1c1ccc(C(C)C)cc1 ZINC000100703101 GI Annotated Mild CCSc1nc(O)c2c(n1)N=C(C)/C(=C(/O)OC)[C@@H]2c1ccc(F)cc1 ZINC000100704587 GI Annotated Anodyne CSc1nc(O)c2c(n1)N=C1CC(C)(C)CC(O)=C1[C@@H]2c1cccc(O)c1 ZINC000100704734 GI Annotated Anodyne CSc1nc(O)c2c(n1)N=C1CC(C)(C)CC(O)=C1[C@H]2c1cccc(O)c1 ZINC000100704736 GI Annotated Anodyne Cc1cccc(NC(=O)CSc2nc3c4ccccc4nc-3c(O)n2C)c1C ZINC000100705149 GI Annotated Anodyne Cc1ccc(C)c(NC(=O)CSc2nc3c4ccccc4nc-3c(O)n2C)c1 ZINC000100705170 GI Annotated Anodyne Cc1ccc(NC(=O)CSc2nc3c4ccccc4nc-3c(O)n2C)c(C)c1 ZINC000100705192 GI Annotated Anodyne CCOC(=O)CSc1nc2c3ccccc3nc-2c(O)n1-c1ccc(C)cc1 ZINC000100705403 GI Annotated Anodyne CCOC(=O)CSc1nc2c3ccccc3nc-2c(O)n1-c1ccc(F)cc1 ZINC000100705719 GI Annotated Anodyne Cn1c(SCC(=O)c2ccc(Cl)cc2)nc2c3ccccc3nc-2c1O ZINC000100705859 GI Annotated Anodyne COC(=O)[C@H](C)Sc1nc2c3ccccc3nc-2c(O)n1-c1ccc(F)cc1 ZINC000100705921 GI Annotated Anodyne COC(=O)[C@@H](C)Sc1nc2c3ccccc3nc-2c(O)n1-c1ccc(F)cc1 ZINC000100705924 GI Annotated Anodyne O=C(O)c1ccc2c(c1)[C@H]1c3cccc[n+]3[C@H]2CC1(c1ccoc1)c1ccoc1 ZINC000100721988 GI Annotated Anodyne O=C(O)c1ccc2c(c1)[C@@H]1c3cccc[n+]3[C@@H]2CC1(c1ccoc1)c1ccoc1 ZINC000100721994 GI Annotated Anodyne COc1ccc(-c2nnc(-c3ccc([125I])cc3)o2)cc1 ZINC000100752076 GI Annotated Anodyne CC(C)=CC[C@H]1C(=O)C(C(=O)CCC(C)C)=C(O)[C@@](O)(CC=C(C)C)C1=O ZINC000100772831 GI Annotated Mild in-man endogenous CC(C)=CC[C@H]1C(=O)C(C(=O)CCC(C)C)=C(O)[C@](O)(CC=C(C)C)C1=O ZINC000100772832 GI Annotated Mild in-man endogenous CC(C)=CC[C@@H]1C(=O)C(C(=O)CCC(C)C)=C(O)[C@@](O)(CC=C(C)C)C1=O ZINC000100772835 GI Annotated Mild in-man endogenous CC(C)=CC[C@@H]1C(=O)C(C(=O)CCC(C)C)=C(O)[C@](O)(CC=C(C)C)C1=O ZINC000100772837 GI Annotated Mild in-man endogenous COC(=O)[C@]1(OC(C)=O)C[C@]23CC[C@H]4[C@](C)(C=O)CCC[C@]4(C)[C@H]2CC[C@H]1C3 ZINC000100777067 GI Annotated Mild in-man endogenous COC(=O)[C@@]1(OC(C)=O)C[C@]23CC[C@H]4[C@](C)(C=O)CCC[C@]4(C)[C@H]2CC[C@H]1C3 ZINC000100777068 GI Annotated Mild in-man endogenous COC(=O)[C@]1(OC(C)=O)C[C@@]23CC[C@H]4[C@](C)(C=O)CCC[C@]4(C)[C@H]2CC[C@H]1C3 ZINC000100777071 GI Annotated Mild in-man endogenous COC(=O)[C@@]1(OC(C)=O)C[C@@]23CC[C@H]4[C@](C)(C=O)CCC[C@]4(C)[C@H]2CC[C@H]1C3 ZINC000100777073 GI Annotated Mild in-man endogenous Cc1cc(O)cc(O)c1C(=O)O[C@@H]1C[C@]2(C)[C@@H]3CC(C)(C)C[C@H]3C=C(C=O)[C@H]12 ZINC000100782776 GI Annotated Reactive in-man endogenous Cc1cc(O)cc(O)c1C(=O)O[C@H]1C[C@@]2(C)[C@@H]1C(C=O)=C[C@@H]1CC(C)(C)C[C@H]12 ZINC000100782778 GI Annotated Reactive in-man endogenous Cc1cc(O)cc(O)c1C(=O)O[C@@H]1C[C@@]2(C)[C@@H]3CC(C)(C)C[C@H]3C=C(C=O)[C@H]12 ZINC000100782781 GI Annotated Reactive in-man endogenous Cc1cc(O)cc(O)c1C(=O)O[C@H]1C[C@]2(C)[C@@H]1C(C=O)=C[C@@H]1CC(C)(C)C[C@H]12 ZINC000100782782 GI Annotated Reactive in-man endogenous C=CCN1C[C@H](C)N(/C(=N\c2ccccc2)c2ccc(C(=O)OC)cc2)C[C@H]1C ZINC000100800586 GI Annotated Mild C[C@@H](c1ccccc1)[C@H](O)/C=C/[C@@H]1[C@@H]2CC[C@H](O2)[C@@H]1C/C=C\C/C=C/C(=O)O ZINC000100801990 GI Annotated Anodyne C[C@@H](c1ccccc1)[C@H](O)/C=C/[C@@H]1[C@H]2CC[C@@H](O2)[C@@H]1C/C=C\C/C=C/C(=O)O ZINC000100801995 GI Annotated Anodyne CS/C(Nc1cccc([C@@H]2CN3CCSC3=N2)c1)=[N+](/C)c1ccccc1 ZINC000100802540 GI Annotated Mild CN(C)CCC[C@@H](O)[C@@]12CCC[C@H]3C[C@@](OCc4ccccc4)(CC[C@]31C)O2 ZINC000100806309 GI Annotated Anodyne CN(C)CCC[C@@H](O)[C@@]12CCC[C@H]3C[C@@](OCc4ccccc4)(CC[C@@]31C)O2 ZINC000100806310 GI Annotated Anodyne CN(C)CCC[C@@H](O)[C@@]12CCC[C@@H]3C[C@@](OCc4ccccc4)(CC[C@]31C)O2 ZINC000100806313 GI Annotated Anodyne CC(=O)c1[nH]c(-c2ccc3c(n2)C(=O)C(=N)C=C3O)c2nc3ccccc3c-2c1C ZINC000100807407 GI Annotated Clean CSc1ccc2c(c1)c(=O)c(C(=S)N(C)c1ccccc1)c(S)n2C ZINC000100828938 GI Annotated Anodyne CN1C(=O)/C(=C(/S)N(C)c2ccc(F)c(F)c2)C(=O)c2cc(Cl)ccc21 ZINC000100830391 GI Annotated Mild CO[C@H]1O[C@@]2(C)CC[C@H]3CCC[C@@H](CCOCc4ccc(F)cc4)[C@]13OO2 ZINC000100863480 GI Annotated Reactive CO[C@H]1O[C@]2(C)CC[C@H]3CCC[C@@H](CCOCc4ccc(F)cc4)[C@@]13OO2 ZINC000100863483 GI Annotated Reactive C[C@@H]1CC[C@H]2CC(=O)N(Cc3ccc(Cl)cc3)[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000100868042 GI Annotated Reactive COc1cc([C@H]2C3=C(O)OCC3=Nc3cc4c(cc32)CCC4)cc(OC)c1OC ZINC000100872791 GI Annotated Anodyne COc1cc([C@@H]2C3=C(O)OCC3=Nc3cc4c(cc32)CCC4)cc(OC)c1OC ZINC000100872794 GI Annotated Anodyne Cc1nccc2c1[nH]c1cc(OC(=O)[C@@]34CC[C@](C)(C(=O)O3)C4(C)C)ccc12 ZINC000100875240 GI Annotated Anodyne Cc1nccc2c1[nH]c1cc(OC(=O)[C@]34CC[C@@](C)(C(=O)O3)C4(C)C)ccc12 ZINC000100875246 GI Annotated Anodyne OC1=C[C@@]2(O)CC/C=C\CCCCN3CC[C@@H]1[C@]1(C[C@@H]4C=CCCCCN4[C@@H]21)C3 ZINC000100891407 GI Annotated Anodyne ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@@H]4C[C@@H]([C@@H]3[C@@]1(Cl)C2(Cl)Cl)[C@H]1O[C@H]41 ZINC000100898137 GI Annotated Anodyne in-vitro ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@@H]4C[C@H]([C@@H]5O[C@@H]54)[C@@H]3[C@@]1(Cl)C2(Cl)Cl ZINC000100898138 GI Annotated Anodyne in-vitro ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@@H]4C[C@@H]([C@@H]3[C@@]1(Cl)C2(Cl)Cl)[C@H]1O[C@@H]41 ZINC000100898140 GI Annotated Anodyne in-vitro ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@@H]4C[C@H]([C@@H]5O[C@H]54)[C@@H]3[C@@]1(Cl)C2(Cl)Cl ZINC000100898141 GI Annotated Anodyne in-vitro ClC1=C(Cl)[C@@]2(Cl)[C@H]3[C@@H]([C@H](Cl)[C@H]4O[C@@H]43)[C@@]1(Cl)C2(Cl)Cl ZINC000100899327 GI Annotated Reactive in-vitro ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@@H]([C@H](Cl)[C@H]4O[C@@H]43)[C@@]1(Cl)C2(Cl)Cl ZINC000100899329 GI Annotated Reactive in-vitro ClC1=C(Cl)[C@@]2(Cl)[C@H]3[C@H](Cl)[C@H]4O[C@@H]4[C@H]3[C@@]1(Cl)C2(Cl)Cl ZINC000100899331 GI Annotated Reactive in-vitro ClC1=C(Cl)[C@@]2(Cl)[C@H]3[C@H]4O[C@@H]4[C@@H](Cl)[C@@H]3[C@@]1(Cl)C2(Cl)Cl ZINC000100899333 GI Annotated Reactive in-vitro CC1(C)CC(=O)C(CC(=O)Nc2cc(C(F)(F)F)ccc2Cl)C(=O)C1 ZINC000100919368 GI Annotated Anodyne CC(C)(C)c1cc(I)c2c(c1)CN[C@@]1(O2)C2C[C@H]3C1[C@@H]3C2 ZINC000100949306 GI Annotated Anodyne CC(C)(C)c1cc(I)c2c(c1)CN[C@]1(O2)C2C[C@H]3C1[C@@H]3C2 ZINC000100949309 GI Annotated Anodyne COC(=O)[C@@H]1[C@@H]2CC[C@@H]3CC[C@@H]1N(C/C2=C\c1ccc(-n2cccc2)cc1)C3 ZINC000100950889 GI Annotated Anodyne COC(=O)[C@H]1[C@@H]2CC[C@@H]3CC[C@@H]1N(C/C2=C\c1ccc(-n2cccc2)cc1)C3 ZINC000100950894 GI Annotated Anodyne COC(=O)[C@H]1[C@@H]2CC[C@H]3CC[C@H]1/C(=C/c1ccc(-n4cccc4)cc1)CN2C3 ZINC000100950900 GI Annotated Anodyne COC(=O)[C@@H]1[C@@H]2CC[C@H]3CC[C@H]1/C(=C/c1ccc(-n4cccc4)cc1)CN2C3 ZINC000100950906 GI Annotated Anodyne CCCCCCCCCCCCCCCOC1=C(O)O[C@H]([C@H](O)CO)C1=O ZINC000100973039 GI Annotated Mild CCCCCCCCCCCCCCCOC1=C(O)O[C@@H]([C@H](O)CO)C1=O ZINC000100973041 GI Annotated Mild CCCCCCCCCCCCCCCOC1=C(O)O[C@H]([C@@H](O)CO)C1=O ZINC000100973045 GI Annotated Mild CCCCCCCCCCCCCCCOC1=C(O)O[C@@H]([C@@H](O)CO)C1=O ZINC000100973047 GI Annotated Mild CCOc1ccc2c(c1)sc1[n+]2C(=O)[C@@H](CC)C(=O)N1CC1CCCCC1 ZINC000100980417 GI Annotated Clean CCOc1ccc2c(c1)sc1[n+]2C(=O)[C@H](CC)C(=O)N1CC1CCCCC1 ZINC000100980420 GI Annotated Clean Cc1ccc2c(c1)/C(=C(\O)Nc1ccc(Cl)cc1Cl)C(=O)N(C)C2=O ZINC000100992477 GI Annotated Anodyne O=C1[C@H]2[C@H]3C=C[C@@H](C3)[C@H]2C(=O)N1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000101003507 GI Annotated Anodyne O=C1[C@H]2[C@@H]3C=C[C@H](C3)[C@H]2C(=O)N1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000101003514 GI Annotated Anodyne O=S(=O)(N[C@H]1[C@H]2CC[C@H]1Cc1c(F)cccc1C2)c1ccc(Cl)s1 ZINC000101009405 GI Annotated Anodyne O=S(=O)(N[C@H]1[C@@H]2CC[C@@H]1Cc1c(F)cccc1C2)c1ccc(Cl)s1 ZINC000101009411 GI Annotated Anodyne N#C/N=c1/c2ccccc2nc2n1CC/C2=C\c1ccccc1Br ZINC000101010279 GI Annotated Anodyne CCNC(=O)c1ccc(C(C#N)=C2C[C@@H]3CC[C@@H](C2)N3Cc2ccoc2)cc1 ZINC000101017456 GI Annotated Reactive CCNC(=O)c1ccc(C(C#N)=C2C[C@H]3CC[C@H](C2)N3Cc2ccoc2)cc1 ZINC000101017459 GI Annotated Reactive CCC(C)(C)/N=c1/c(-c2ccc(C(=O)CCc3ccccc3)cc2)c(O)c1=O ZINC000101026005 GI Annotated Anodyne CCOc1cc2c3cc(OC)c(OC)cc3c[n+](C)c2c2cc(OC)c(O)cc12 ZINC000101027661 GI Annotated Bother O=S(=O)(N[C@H]1[C@H]2CC[C@H]1Cc1cc(F)ccc1C2)c1ccc(Cl)s1 ZINC000101027755 GI Annotated Anodyne O=S(=O)(N[C@H]1[C@@H]2CC[C@@H]1Cc1cc(F)ccc1C2)c1ccc(Cl)s1 ZINC000101027759 GI Annotated Anodyne N=c1c(Cc2ccc(Cl)c(Cl)c2)c[nH]c(=O)n1-c1ccc(Cl)cc1 ZINC000101045210 GI Annotated Anodyne Nc1ccc(/C=C/c2cc(=O)c3cc([125I])ccc3o2)cc1 ZINC000101080006 GI Annotated Anodyne COC1=C(C)C(=O)/C(=C(O)/C=C/c2ccc(Br)cc2)C(=O)C1(C)C ZINC000101083221 GI Annotated Mild C[C@]12C[C@@H](NC(=O)N1c1ccccc1F)c1cc(Br)ccc1O2 ZINC000101092402 GI Annotated Anodyne CN(C)c1ccc(/C=C/C(=O)c2ccc([125I])s2)cc1 ZINC000101094821 GI Annotated Mild CCOC(=O)[C@H]1CC[C@@H](N(C(=O)c2cc(Cl)c(N)c(Cl)c2)C2CC2)CC1 ZINC000101099784 GI Annotated Anodyne O=C(Nc1ccc(-c2ccccc2)cc1)C1=C(O)[C@@H](CCc2ccccc2)NC1=O ZINC000101142368 GI Annotated Anodyne O=C(Nc1ccc(C2CCCCC2)cc1)C1=C(O)[C@@H](c2ccccc2)NC1=O ZINC000101162320 GI Annotated Anodyne O=C(Nc1ccc(C2CCCCC2)cc1)C1=C(O)[C@H](c2ccccc2)NC1=O ZINC000101162323 GI Annotated Anodyne CCOc1ccc(C[C@@H]2CN3C(=NC[C@@H]3C)N2CC[C@@H]2C[C@@H]3CC[C@@H]2C3)cc1 ZINC000101217111 GI Annotated Anodyne CCOc1ccc(C[C@@H]2CN3C(=NC[C@@H]3C)N2CC[C@H]2C[C@@H]3CC[C@@H]2C3)cc1 ZINC000101217116 GI Annotated Anodyne C[C@@]12CC[C@]3(OCc4cccc(Br)c4)C[C@@H]1CCC[C@@]2(CO)O3 ZINC000101221538 GI Annotated Anodyne C[C@@]12CC[C@]3(OCc4cccc(Br)c4)C[C@H]1CCC[C@@]2(CO)O3 ZINC000101221543 GI Annotated Anodyne C=CCN(C(=S)c1c(O)c2cc(Cl)ccc2n(C)c1=O)c1ccccc1 ZINC000101252506 GI Annotated Mild CN1C(=O)/C(=C(/S)N(C)c2ccc(Cl)cc2)C(=O)c2cc(Cl)ccc21 ZINC000101256961 GI Annotated Mild CC(C)=CCO[C@]1(C)CC[C@@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 ZINC000101265181 GI Annotated Reactive CC(C)=CCO[C@@]1(C)CC[C@@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 ZINC000101265185 GI Annotated Reactive COc1cccc2c1O[C@@]1(C)C[C@H]2NC(=O)N1c1ccc(Br)cc1 ZINC000101268739 GI Annotated Anodyne COc1cccc(N2C(=O)N[C@H]3C[C@@]2(C)Oc2ccc(Br)cc23)c1 ZINC000101268792 GI Annotated Anodyne C[C@@H]1CC[C@H]2CC(=O)N(CCCc3ccccc3)[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000101276652 GI Annotated Reactive CC1(C)OC[C@]2(C[C@]34C[C@@H]2CC[C@H]3[C@]2(C)CCCC(C)(C)[C@H]2C(=O)[C@H]4O)O1 ZINC000101279237 GI Annotated Anodyne O=C1O[C@@H](CN2C=CN3CCCCC[C@@H]32)CC1(c1ccccc1)c1ccccc1 ZINC000101326455 GI Annotated Anodyne O=C1O[C@H](CN2C=CN3CCCCC[C@@H]32)CC1(c1ccccc1)c1ccccc1 ZINC000101326459 GI Annotated Anodyne C[C@H]1C(=O)N(Cc2cccc(Cl)c2)c2scc(-c3ccccc3)[n+]2C1=O ZINC000101329892 GI Annotated Clean C[C@@H]1C(=O)N(Cc2cccc(Cl)c2)c2scc(-c3ccccc3)[n+]2C1=O ZINC000101329894 GI Annotated Clean COc1cccc2c1O[C@]1(C)C[C@@H]2NC(=O)N1c1ccccc1C(F)(F)F ZINC000101335733 GI Annotated Anodyne Cc1nnn(C23C[C@@H]4C[C@H](CC(CC(=O)Nc5ccc(C)c(Cl)c5)(C4)C2)C3)n1 ZINC000101356867 GI Annotated Anodyne Clc1ccc(C2=C[C@H](c3ccc(Br)o3)n3ncnc3N2)cc1 ZINC000101385409 GI Annotated Anodyne Clc1ccc(C2=C[C@@H](c3ccc(Br)o3)n3ncnc3N2)cc1 ZINC000101385411 GI Annotated Anodyne CCCC[C@]12C[C@]1(C(=O)NCc1ccccc1)C(=O)Nc1ccc(Cl)cc12 ZINC000101396555 GI Annotated Anodyne CCCC[C@@]12C[C@@]1(C(=O)NCc1ccccc1)C(=O)Nc1ccc(Cl)cc12 ZINC000101396559 GI Annotated Anodyne CN(Cc1ccc(C#N)cc1)[C@@H]1CC[C@@H]([C@H](N)Cc2cc(F)ccc2F)CC1 ZINC000101403035 GI Annotated Mild CN(Cc1cccc(C#N)c1)[C@@H]1CC[C@@H]([C@H](N)Cc2cc(F)ccc2F)CC1 ZINC000101403038 GI Annotated Mild O=c1cc(C(F)(F)F)[nH]c2c(-c3ccc(Cl)cc3)c(C(F)(F)F)nn12 ZINC000101404877 GI Annotated Anodyne N=c1c(Cc2ccccc2Cl)c[nH]c(=O)n1-c1ccc(Cl)cc1Cl ZINC000101413920 GI Annotated Anodyne Cc1ccc(NC(=O)Nc2ccc(N3C(=O)[C@H]4CC=CC[C@H]4C3=O)cc2)cc1C ZINC000101415719 GI Annotated Anodyne Cc1ccc(NC(=O)Nc2ccc(N3C(=O)[C@H]4CC=CC[C@@H]4C3=O)cc2)cc1C ZINC000101415721 GI Annotated Anodyne CC1=CN[C@H]2C(NCCN3CCCCC3)=Nc3cc(-c4ccccc4)sc3N12 ZINC000101442102 GI Annotated Anodyne CC1=CN[C@@H]2C(NCCN3CCCCC3)=Nc3cc(-c4ccccc4)sc3N12 ZINC000101442106 GI Annotated Anodyne CCOC(=O)/C(=C/Nc1ccc(Br)cc1)c1ccc(OC)cc1 ZINC000101442313 GI Annotated Anodyne O=C(Nc1ccc(C2CCCCC2)cc1)C1=C(O)[C@@H](Cc2ccccc2)NC1=O ZINC000101446017 GI Annotated Anodyne O=C(Nc1ccc(C2CCCCC2)cc1)C1=C(O)[C@H](Cc2ccccc2)NC1=O ZINC000101446022 GI Annotated Anodyne COc1ccc(NC(=O)Cc2cs/c(=N/c3ccc(SC)cc3)n2C)cc1 ZINC000101452847 GI Annotated Anodyne CC/C(O)=C(\C#N)C(=O)Nc1ccc(-c2ccc(F)cc2F)c(C(=O)OC)c1 ZINC000101459822 GI Annotated Reactive CC/C(O)=C(\C#N)C(=O)Nc1ccc(-c2ccc(F)cc2C)c(C(=O)OC)c1 ZINC000101459830 GI Annotated Reactive Cc1ccc(C)c(SCC(=O)OC/C(O)=C(\C#N)c2nc3ccccc3[nH]2)c1 ZINC000101489013 GI Annotated Reactive O=C(CC12C[C@@H]3C[C@H](CC(Br)(C3)C1)C2)OCCN1CCCCC1 ZINC000101489989 GI Annotated Anodyne CC(C)=CCC1=C(O)C(C(=O)[C@H](C)C(C)C)=C(O)[C@](O)(CC=C(C)C)C1=O ZINC000101504141 GI Annotated Mild CC(C)=CCC1=C(O)C(C(=O)[C@@H](C)C(C)C)=C(O)[C@](O)(CC=C(C)C)C1=O ZINC000101504143 GI Annotated Mild O=[N+]([O-])c1ccc(-n2s/c(=N/Cc3cccnc3)nc2-c2ccccc2)cc1 ZINC000101506414 GI Annotated Bother CNc1ccc(-c2nc(-c3ccc([125I])cc3)no2)cc1 ZINC000101506959 GI Annotated Anodyne COc1ccc([C@H]2C3=C(CCCC3=O)N=C3C(c4ccccc4)=C(C)NN32)cc1 ZINC000101510442 GI Annotated Mild COc1ccc([C@@H]2C3=C(CCCC3=O)N=C3C(c4ccccc4)=C(C)NN32)cc1 ZINC000101510446 GI Annotated Mild CCOC(=O)Cc1c(C)nc2c(-c3ccccc3)c(-c3ccccc3)nn2c1O ZINC000101517759 GI Annotated Anodyne CCCn1cc(C(=O)N[C@@H]2C(C)(C)[C@@H]3CC[C@]2(C)C3)c(=O)c2ccc(F)cc21 ZINC000101541032 GI Annotated Anodyne Cc1c(N[C@@H]2CC[C@@H](N)CC2)nc2ccnn2c1Nc1ccc(F)c(Cl)c1 ZINC000101556668 GI Annotated Anodyne CCCSc1c(C(=O)NC2CCCCC2)cnn1[C@@H]1CC[C@@H](C(=O)O)CC1 ZINC000101580066 GI Annotated Anodyne CCCSc1c(C(=O)NC2CCCCC2)cnn1[C@@H]1CC[C@H](C(=O)O)CC1 ZINC000101580071 GI Annotated Anodyne CN1c2ccsc2C(O)=C(/C=N/c2cccc(C(F)(F)F)c2)S1(=O)=O ZINC000101584934 GI Annotated Mild C[C@@H]1CC[C@@H]([C@](C)(NC(=O)c2ccsc2)c2cn(C(C)(C)C#N)nn2)CC1 ZINC000101594280 GI Annotated Mild O=c1[nH]c([C@@H]2CC[C@H](c3ccccc3)CC2)c(Cc2ncccc2Cl)c(=O)[nH]1 ZINC000101598405 GI Annotated Anodyne COc1ccccc1Cc1c([C@@H]2CC[C@H](c3ccccc3)CC2)[nH]c(=O)[nH]c1=O ZINC000101598451 GI Annotated Anodyne CC(C)n1c(O)c(/N=N/C(=O)CNC(=O)CCc2ccccc2)c2ccccc21 ZINC000101607487 GI Annotated Clean CCCCCCCN/C=C1/C=C(C=O)c2c(ccc3c(C)cc(=O)oc23)C1=O ZINC000101608888 GI Annotated Reactive N#Cc1c(Cl)cc(Cl)cc1COc1cccc(C(=O)/C=C(\O)C(=O)O)c1 ZINC000101618466 GI Annotated Mild CC(C)=C[C@@H](O)C(=O)/C(C)=C/CC/C(C)=C/C[C@@]1(O)Oc2cccc(C)c2C1=O ZINC000101618897 GI Annotated Mild CC(C)=C[C@H](O)C(=O)/C(C)=C/CC/C(C)=C/C[C@]1(O)Oc2cccc(C)c2C1=O ZINC000101618901 GI Annotated Mild Cc1cccc2c1CC[C@H](Cn1cncn1)/C2=N/OCc1cccc(Cl)c1 ZINC000101628849 GI Annotated Mild Cc1cccc2c1CC[C@@H](Cn1cncn1)/C2=N/OCc1cccc(Cl)c1 ZINC000101628855 GI Annotated Mild CCSc1nc(O)c2c(n1)N=C(C)/C(=C(/O)OC(C)C)[C@H]2c1ccncc1 ZINC000101630631 GI Annotated Anodyne CCSc1nc(O)c2c(n1)N=C(C)/C(=C(/O)OC(C)C)[C@@H]2c1ccncc1 ZINC000101630633 GI Annotated Anodyne CCCO[C@@H]1CC[C@@](C)(N2CCC(N3C(=O)Cc4ccc(C)cc43)CC2)CC1 ZINC000101638158 GI Annotated Anodyne CCO[C@@H]1CC[C@@](C)(N2CCC(n3c(=O)oc4cc(F)c(C)cc43)CC2)CC1 ZINC000101638179 GI Annotated Anodyne CCO[C@@H]1CC[C@@](C)(N2CCC(n3c(=O)oc4c(F)cc(C)cc43)CC2)CC1 ZINC000101638184 GI Annotated Anodyne CCOC(=O)[C@H]1C(=O)C=C(NCCCc2ccccc2)C[C@H]1c1ccccc1 ZINC000101643224 GI Annotated Mild CCOC(=O)[C@@H]1C(=O)C=C(NCCCc2ccccc2)C[C@H]1c1ccccc1 ZINC000101643228 GI Annotated Mild CCOC(=O)[C@H]1C(=O)C=C(NCCCc2ccccc2)C[C@@H]1c1ccccc1 ZINC000101643233 GI Annotated Mild CCOC(=O)[C@@H]1C(=O)C=C(NCCCc2ccccc2)C[C@@H]1c1ccccc1 ZINC000101643235 GI Annotated Mild CCOC(=O)[C@H]1C(=O)C=C(NCCCCc2ccccc2)C[C@H]1c1ccccc1 ZINC000101646443 GI Annotated Mild CCOC(=O)[C@@H]1C(=O)C=C(NCCCCc2ccccc2)C[C@H]1c1ccccc1 ZINC000101646445 GI Annotated Mild CCOC(=O)[C@H]1C(=O)C=C(NCCCCc2ccccc2)C[C@@H]1c1ccccc1 ZINC000101646447 GI Annotated Mild CCOC(=O)[C@@H]1C(=O)C=C(NCCCCc2ccccc2)C[C@@H]1c1ccccc1 ZINC000101646451 GI Annotated Mild CCN(CC)CC(=O)N1C[C@H](c2ccccc2)Oc2c(C)c(C)c(OC)c(C)c21 ZINC000101656901 GI Annotated Anodyne COC(=O)[C@]1(OC(C)=O)C[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C=O)[C@@H]2CC[C@H]1C3 ZINC000101659171 GI Annotated Mild CC(C)=CCC[C@@](C)(O)[C@@H]1CC2=C(O1)/C(=C(/O)C(C)C)C(=O)C(C)(C)C2=O ZINC000101665479 GI Annotated Mild O=c1cc(-c2cccc3[nH]ccc23)c2ccccc2n1C[C@@H]1CN2CCC1CC2 ZINC000101668886 GI Annotated Anodyne O=c1cc(-c2cccc3[nH]ccc23)c2ccccc2n1C[C@H]1CN2CCC1CC2 ZINC000101668889 GI Annotated Anodyne CC1(C)CCC[C@H]1N1C(=O)CC(=O)N(CCc2cccc(C(F)(F)F)c2)C1=O ZINC000101677922 GI Annotated Anodyne CC(C)(CN1C(=O)CC(=O)N(C2CCCC2)C1=O)c1cccc(C(F)(F)F)c1 ZINC000101678002 GI Annotated Anodyne O=C1CC(=O)N(C2CCCC2)C(=O)N1CCc1ccc(-c2ccccc2)cc1 ZINC000101678042 GI Annotated Anodyne CC(C)=CN1Cc2c(I)ccc3[nH]c(=S)n(c23)C[C@@H]1C ZINC000101702047 GI Annotated Anodyne Cc1cc(N2CC[C@H](N3CCC[C@@H]3C)C2)ccc1NC(=O)[C@@H]1C[C@@H]2CC[C@@H]1C2 ZINC000101706392 GI Annotated Anodyne Cc1cc(N2CC[C@H](N3CCC[C@@H]3C)C2)ccc1NC(=O)[C@H]1C[C@@H]2CC[C@@H]1C2 ZINC000101706394 GI Annotated Anodyne Cc1cc(NC(=O)[C@@H]2C[C@@H]3CC[C@@H]2C3)ccc1N1CC[C@H](N2CCC[C@@H]2C)C1 ZINC000101706556 GI Annotated Anodyne Cc1cc(NC(=O)[C@@H]2C[C@@H]3CC[C@@H]2C3)ccc1N1CC[C@@H](N2CCC[C@@H]2C)C1 ZINC000101706559 GI Annotated Anodyne COc1ccc(CCC(=O)N2CCCS/C2=N\c2ccc(C(C)=O)cc2)cc1 ZINC000101711083 GI Annotated Mild Cc1cc(C)n(CCC(=O)/N=N/c2c(O)[nH]c3ccc(Br)cc23)n1 ZINC000101712775 GI Annotated Clean CC(C)n1c(O)c(/N=N/C(=O)Cn2ccc(C(F)(F)F)n2)c2ccccc21 ZINC000101718830 GI Annotated Clean COc1cc2c(cc1OC)[S@](C)(=O)=NC(N1CCC(c3ccccc3)CC1)=N2 ZINC000101761965 GI Annotated Anodyne COc1cc2c(cc1OC)[S@@](C)(=O)=NC(N1CCC(c3ccccc3)CC1)=N2 ZINC000101761970 GI Annotated Anodyne CCn1c(SCC(=O)N(C)c2ccccc2)nc2c3ccccc3nc-2c1O ZINC000101803684 GI Annotated Anodyne O/N=C(/c1ccc(Oc2ccc(-n3ccnc3)cc2)nc1)N1CCCCCC1 ZINC000101806637 GI Annotated Mild N#C/C(=C(/O)COC(=O)CSc1ccc(Cl)cc1)c1nc2ccccc2[nH]1 ZINC000101812265 GI Annotated Reactive aggregator NC(=S)/N=N/c1c(O)n(Cc2ccc(Br)cc2)c2ccccc12 ZINC000101816945 GI Annotated Clean CC(C)c1ccc2c(c1)CC=C(c1ccccc1)C(N1CCN(CCO)CC1)=N2 ZINC000101817826 GI Annotated Anodyne CCCO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@H]1c1cc(OC)ccc1OC ZINC000101834811 GI Annotated Mild O=S(=O)(Cc1ccccc1)/N=N/c1c(O)[nH]c2ccc(Br)cc12 ZINC000101863751 GI Annotated Clean O=C1CCCc2nc(-c3ccco3)c3c(c21)C(=O)C=C(Nc1ccccc1)C3=O ZINC000101900071 GI Annotated Mild CCSc1nc(O)c2c(n1)N=C(C)/C(=C(/O)OC(C)C)[C@H]2c1cccnc1 ZINC000101903671 GI Annotated Anodyne Oc1ccc(-c2ccc3c(c2)OCO3)cc1CNC[C@@H]1C[C@@H]2C=C[C@@H]1C21CC1 ZINC000101912625 GI Annotated Clean Oc1ccc(-c2ccc3c(c2)OCO3)cc1CNC[C@H]1C[C@@H]2C=C[C@@H]1C21CC1 ZINC000101912627 GI Annotated Clean O/N=C1\c2ccccc2-c2c1c(-n1ccnc1)nc1ccc(Br)cc21 ZINC000101913545 GI Annotated Mild CCCO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@H]1c1cccc(OC)c1OC ZINC000101938745 GI Annotated Mild CCCO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@@H]1c1cccc(OC)c1OC ZINC000101938751 GI Annotated Mild CC(C)[C@@H]1C[C@@H]2C[C@@]13CC[C@]1(C)[C@@H](Br)CC[C@@](C)(O)[C@H]1[C@@H]3[C@H]2O ZINC000101945149 GI Annotated Reactive Cc1nn(-c2cccc3ccccc23)c(O)c1/C=N/c1ccc2[nH]c(O)nc2c1 ZINC000101959756 GI Annotated Mild CN(C)c1ccc(-c2nnc(-c3ccc([125I])cc3)o2)cc1 ZINC000101981843 GI Annotated Anodyne CC1=NN(C(=O)c2sc3ccccc3c2Cl)C(=O)/C1=N/Nc1ccccc1 ZINC000102060258 GI Annotated Mild Cc1ccc(C(=O)Oc2ccccc2N2C(=O)[C@H]3CC[C@@H](C)C[C@H]3C2=O)cc1 ZINC000102071008 GI Annotated Anodyne O=C1[C@H]2[C@@H](c3ccccc3)C=C[C@@H](c3ccccc3)[C@@H]2C(=O)N1c1cccnc1 ZINC000102130808 GI Annotated Anodyne CN(C)c1ccc([C@H]2N[C@@H](c3ccc(N(C)C)cc3)[C@H]3CCC[C@H]2C3=O)cc1 ZINC000102147405 GI Annotated Clean CN(C)c1ccc([C@@H]2N[C@@H](c3ccc(N(C)C)cc3)[C@H]3CCC[C@H]2C3=O)cc1 ZINC000102147410 GI Annotated Clean CO[C@H]1O[C@@]2(C)OO[C@]13[C@H](CCOCc1ccccc1)CCC[C@@H]3C[C@@H]2C ZINC000102179690 GI Annotated Reactive CN1C(=O)/C(=C(/S)N(C)c2cccc(Cl)c2)C(=O)c2cc(Cl)ccc21 ZINC000102187470 GI Annotated Mild CCO[C@@]1(C(F)(F)F)O[C@H]2O[C@]3(C)CC[C@@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 ZINC000102188186 GI Annotated Reactive CCO[C@@]1(C(F)(F)F)O[C@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 ZINC000102188198 GI Annotated Reactive CC(C)=CC[C@]12OC(C)(C)[C@H]3C[C@@]4(OC(c5ccccc5)=CC(=O)C4=C[C@@H]31)C2=O ZINC000102215765 GI Annotated Mild CC(C)=CC[C@]12OC(C)(C)[C@@H]3C[C@@]4(OC(c5ccccc5)=CC(=O)C4=C[C@@H]31)C2=O ZINC000102215769 GI Annotated Mild COc1ccc(/C=C2/C(=O)/C(=C/c3ccc(OC)cc3)[C@@H]3CC[C@@H]2N3C)cc1 ZINC000102219101 GI Annotated Mild Cc1ccc([C@H]2N[C@@H](c3ccc(C)cc3)[C@H]3CCC[C@H]2C3=NNC(N)=S)cc1 ZINC000102243766 GI Annotated Mild Cc1ccc([C@@H]2N[C@@H](c3ccc(C)cc3)[C@H]3CCC[C@H]2C3=NNC(N)=S)cc1 ZINC000102243773 GI Annotated Mild CCO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@H]1c1coc2ccccc2c1=O ZINC000102280432 GI Annotated Mild CCO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@@H]1c1coc2ccccc2c1=O ZINC000102280436 GI Annotated Mild C[C@H]1C[C@H](C)CN(C(=O)c2ccc(CSc3nc4cc[nH]cc-4n3)cc2)C1 ZINC000102348773 GI Annotated Anodyne C[C@@H]1C[C@@H](C)CN(C(=O)c2ccc(CSc3nc4cc[nH]cc-4n3)cc2)C1 ZINC000102348778 GI Annotated Anodyne CN(C)c1ccc(/C=C/C(O)=C2\C(=O)N(C)[C@@]3(C)C[C@H]2c2ccccc2O3)cc1 ZINC000102360081 GI Annotated Clean CN(C)c1ccc(/C=C/C(O)=C2\C(=O)N(C)[C@]3(C)C[C@@H]2c2ccccc2O3)cc1 ZINC000102360085 GI Annotated Clean COc1ccc(CNC(=O)C23C[C@@H]4C[C@H](CC(Br)(C4)C2)C3)cc1 ZINC000102365399 GI Annotated Anodyne COC(=O)c1nc2n(n1)[C@@H](c1cccc(Cl)c1)C1=C(O)CC(C)(C)CC1=N2 ZINC000102383466 GI Annotated Anodyne aggregator COC(=O)c1nc2n(n1)[C@H](c1cccc(Cl)c1)C1=C(O)CC(C)(C)CC1=N2 ZINC000102383469 GI Annotated Anodyne aggregator CC1(C)O[C@H]2C3=C4[C@@H](CCCC[C@@]42O1)[C@H](C1(O)CCCCC1)C=CC=C3CO ZINC000102405523 GI Annotated Anodyne CC1(C)O[C@H]2C3=C([C@H]2O1)[C@@H](c1ccccc1)[C@H](C1(O)CCCC1)C=CC=C3CO ZINC000102406167 GI Annotated Anodyne CN(C)/C=N/c1c(C=O)c(-c2ccccc2)nn1-c1ccc(Br)cc1 ZINC000102409910 GI Annotated Mild Cc1cc(C)n(CCC(=O)/N=N\c2c(O)[nH]c3ccc(Br)cc23)n1 ZINC000102414204 GI Annotated Clean O=C1CCC/C(=N\NC(=O)c2ccc(COc3cccc4cccnc34)cc2)C1 ZINC000102454151 GI Annotated Reactive COc1ccc(CCN(C)C(=O)C23C[C@@H]4C[C@H](CC(Cl)(C4)C2)C3)cc1OC ZINC000102543555 GI Annotated Anodyne CC(C)n1c(O)c(/N=N\C(=O)CNC(=O)CCc2ccccc2)c2ccccc21 ZINC000102588223 GI Annotated Clean O=S(=O)(Cc1ccccc1)/N=N\c1c(O)[nH]c2ccc(Br)cc12 ZINC000102611739 GI Annotated Clean Cc1ccccc1NC(=O)c1cccc(N2C(=O)[C@H]3CC[C@@H](C)C[C@H]3C2=O)c1 ZINC000102618598 GI Annotated Anodyne Cc1ccccc1NC(=O)c1cccc(N2C(=O)[C@H]3CC[C@H](C)C[C@H]3C2=O)c1 ZINC000102618601 GI Annotated Anodyne Cc1c(/N=C\C=C2\N(C)c3ccccc3C2(C)C)c(=O)n(-c2ccccc2)n1C ZINC000102624563 GI Annotated Mild CCSc1nc(O)c2c(n1)N=C(C)/C(=C(\O)OC(C)C)[C@H]2c1cccnc1 ZINC000102624753 GI Annotated Anodyne CCSc1nc(O)c2c(n1)N=C(C)/C(=C(\O)OC(C)C)[C@@H]2c1cccnc1 ZINC000102624756 GI Annotated Anodyne COc1ccc(/C=C/C(O)=C2\C(=O)N(C)[C@@]3(C)C[C@H]2c2ccccc2O3)cc1 ZINC000102632199 GI Annotated Anodyne COc1ccc(/C=C/C(O)=C2\C(=O)N(C)[C@]3(C)C[C@@H]2c2ccccc2O3)cc1 ZINC000102632203 GI Annotated Anodyne Oc1[nH]c2ccc(Br)cc2c1/N=N/C(S)=N\C[C@@H]1CCCO1 ZINC000102692790 GI Annotated Mild Cc1ccc2nc(NCc3ccccc3)c(/C=N\Cc3ccccc3)c(=O)n2c1 ZINC000102697193 GI Annotated Mild Cc1ccc(S(=O)(=O)N/N=C2/CCCC[C@@H]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000102747383 GI Annotated Mild Cc1ccc(S(=O)(=O)N/N=C2/CCCC[C@H]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000102747386 GI Annotated Mild CCC1=C(O)c2c(oc(-c3ccc4c(c3)OCCO4)cc2=O)C(CC)(CC)C1=O ZINC000102814831 GI Annotated Mild CCC1=C(O)c2c(oc(-c3ccc4c(c3)OCO4)cc2=O)C(CC)(CC)C1=O ZINC000102814833 GI Annotated Mild O=c1cc(C(F)(F)F)[nH]c2c(-c3c[nH]c4ccccc34)c(C(F)(F)F)nn12 ZINC000102816996 GI Annotated Anodyne O=c1c2c[nH]c3ccc(Br)cc3c-2nn1-c1nc2ccccc2s1 ZINC000102827655 GI Annotated Anodyne CC/C=C1/C(=O)[C@@]2(C(=O)c3ccccc3)C[C@@H]3CC[C@@](CCC)(C2=O)[C@@]13OC ZINC000102833704 GI Annotated Mild CC/C=C1\C(=O)[C@@]2(C(=O)c3ccccc3)C[C@@H]3CC[C@@](CCC)(C2=O)[C@@]13OC ZINC000102833706 GI Annotated Mild Cc1n[nH]c2nc3nc(-c4ccccc4)cc(-c4ccc(Cl)cc4)c3c(=O)n12 ZINC000102843736 GI Annotated Anodyne CCSc1nc(O)c2c(n1)N=C(C)/C(=C(\O)OC(C)C)[C@H]2c1ccncc1 ZINC000102845601 GI Annotated Anodyne CCSc1nc(O)c2c(n1)N=C(C)/C(=C(\O)OC(C)C)[C@@H]2c1ccncc1 ZINC000102845603 GI Annotated Anodyne Cc1cccc(C)c1N/C=C1\C=C(C=O)c2c(ccc3c(C)cc(=O)oc23)C1=O ZINC000102897260 GI Annotated Reactive C1=C(c2ccccc2)NC2=NC=C3N(c4ccccc4)N=C(c4ccccc4)N3[C@H]12 ZINC000102899574 GI Annotated Anodyne C1=C(c2ccccc2)NC2=NC=C3N(c4ccccc4)N=C(c4ccccc4)N3[C@@H]12 ZINC000102899576 GI Annotated Anodyne O=C1c2ccccc2C(=O)C1C(c1ccc(F)cc1)C1C(=O)c2ccccc2C1=O ZINC000102941029 GI Annotated Clean CCCCCCN1C[C@H]2[C@@H](C1)[C@@]2(c1cccc(NS(C)(=O)=O)c1)C(C)C ZINC000102948637 GI Annotated Anodyne CCCCCCN1C[C@H]2[C@@H](C1)[C@]2(CCC)c1cccc(NS(C)(=O)=O)c1 ZINC000102948639 GI Annotated Anodyne CCCCCCN1C[C@H]2[C@@H](C1)[C@]2(C)c1cccc(NS(=O)(=O)C(C)C)c1 ZINC000102948642 GI Annotated Anodyne CC(=O)O[C@@H]1/C=C(\C)[C@H](OC(C)=O)C/C=C(/C)CC[C@H]2[C@@H](/C=C/C1=O)C2(C)C ZINC000102952128 GI Annotated Mild CCCCCCN1C[C@H]2[C@@H](C1)[C@]2(C)c1cccc(NS(=O)(=O)CCC)c1 ZINC000102955372 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@]1(C)/C(=C(\Br)I)C(=O)C2 ZINC000102955664 GI Annotated Mild CC1(C)[C@H]2CC[C@@]1(C)/C(=C(\Br)I)C(=O)C2 ZINC000102955666 GI Annotated Mild CC(C)=CCC[C@@H](C)C1=C(O)[C@H](O)C(C)=C2N=C(c3ccccc3)C(=O)O[C@@H]21 ZINC000102956439 GI Annotated Anodyne CC(C)=CCC[C@@H](C)C1=C(O)[C@H](O)C(C)=C2N=C(c3ccccc3)C(=O)O[C@H]21 ZINC000102956442 GI Annotated Anodyne CC(C)=CCC[C@@H](C)C1=C(O)[C@@H](O)C(C)=C2N=C(c3ccccc3)C(=O)O[C@@H]21 ZINC000102956445 GI Annotated Anodyne CC(C)=CCC[C@@H](C)C1=C(O)[C@@H](O)C(C)=C2N=C(c3ccccc3)C(=O)O[C@H]21 ZINC000102956449 GI Annotated Anodyne C=C1C(=O)O[C@H]2C[C@H]1[C@H](OC(C)=O)C/C(C)=C/CC/C(C)=C\CC[C@]2(C)O ZINC000102957158 GI Annotated Anodyne Cc1ccc(O)c(C2=CC3=NNC(=O)[C@@H]3[C@H](c3cccc(Br)c3)C2)c1 ZINC000102958495 GI Annotated Anodyne Cc1ccc(O)c(C2=CC3=NNC(=O)[C@H]3[C@H](c3cccc(Br)c3)C2)c1 ZINC000102958497 GI Annotated Anodyne Cc1ccc(O)c(C2=CC3=NNC(=O)[C@@H]3[C@@H](c3cccc(Br)c3)C2)c1 ZINC000102958500 GI Annotated Anodyne Cc1ccc(O)c(C2=CC3=NNC(=O)[C@H]3[C@@H](c3cccc(Br)c3)C2)c1 ZINC000102958502 GI Annotated Anodyne Cc1ccc2c(c1)CCCN2C(=O)c1cnn2c1NC(=C1CC1)C=C2C(F)F ZINC000102961580 GI Annotated Anodyne COc1ccc(/C=C2\CCC[C@@H]([C@H](NO)c3ccc(OC)cc3)\C2=N\O)cc1 ZINC000102969610 GI Annotated Mild COc1ccc(/C=C2\CCC[C@H]([C@@H](NO)c3ccc(OC)cc3)\C2=N\O)cc1 ZINC000102969611 GI Annotated Mild COc1ccc(/C=C2\CCC[C@@H]([C@@H](NO)c3ccc(OC)cc3)\C2=N\O)cc1 ZINC000102969615 GI Annotated Mild CC1=C2CN(C(=O)OCC(C)C)CC[C@@H]2C2=C(C(=O)c3ccccc3C2=O)[C@@H]1C ZINC000102978892 GI Annotated Mild CC1=C2CN(C(=O)OCC(C)C)CC[C@@H]2C2=C(C(=O)c3ccccc3C2=O)[C@H]1C ZINC000102978894 GI Annotated Mild COC(=O)C1=C[C@@H]2C(=O)c3ccccc3[C@]1(c1ccccc1)N2C1CCCCC1 ZINC000102979343 GI Annotated Anodyne COC(=O)C1=C[C@H]2C(=O)c3ccccc3[C@@]1(c1ccccc1)N2C1CCCCC1 ZINC000102979346 GI Annotated Anodyne O=C(O)Cc1cccc2c1O[C@@H](c1ccccc1)[C@H](C(=O)c1ccccc1)C2=O ZINC000102984949 GI Annotated Anodyne CSC1=Nc2c(c(C)c(-c3ccccc3)n2CCCCl)C2=NC(=O)CN12 ZINC000102988483 GI Annotated Reactive C[C@@H]1CC[C@@H](C(=O)N(c2cc(C#CC(C)(C)C)sc2C(=O)O)N(C)C)CC1 ZINC000103005825 GI Annotated Reactive C=CC/N=c1/scc(-c2ccccc2Br)n1/N=C/c1ccccn1 ZINC000103103417 GI Annotated Mild COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@H](CC[C@H]12)[C@@H](C1NCCCN1)C3 ZINC000103110046 GI Annotated Anodyne CC1(C)[C@]2(C)CC[C@]1(C(=O)NCc1ccccc1Cl)[C@@H](Br)C2=O ZINC000103113719 GI Annotated Reactive CC1(C)[C@@]2(C)CC[C@@]1(C(=O)NCc1ccccc1Cl)[C@@H](Br)C2=O ZINC000103113725 GI Annotated Reactive O=C(N[C@H]1CCCc2ccccc21)c1cnn2c1NC(=C1CC1)C=C2C(F)F ZINC000103115117 GI Annotated Anodyne O=C(N[C@@H]1CCCc2ccccc21)c1cnn2c1NC(=C1CC1)C=C2C(F)F ZINC000103115120 GI Annotated Anodyne Cc1ccc(O/C=C2/Nn3c(nnc3-c3cc(-c4ccccc4)[nH]n3)S2)cc1 ZINC000103117369 GI Annotated Anodyne CO[C@]12C(=O)c3ccccc3C(=O)[C@@H]1C(C1CC1)=C2c1ccc(O)c2ncccc12 ZINC000103151877 GI Annotated Clean CO[C@]12C(=O)c3ccccc3C(=O)[C@@H]1C(C1CC1)=C2c1cnc2ccccc2c1 ZINC000103152088 GI Annotated Clean CO[C@]12C(=O)c3ccccc3C(=O)[C@@H]1C(C1CC1)=C2c1cncc2ccccc12 ZINC000103152095 GI Annotated Clean Brc1cccc([C@H]2C3=C(CCCC3)Nc3ncn4ncnc4c32)c1 ZINC000103157173 GI Annotated Anodyne Brc1cccc([C@@H]2C3=C(CCCC3)Nc3ncn4ncnc4c32)c1 ZINC000103157175 GI Annotated Anodyne COc1ccc(-c2c3nc(N)n(C)c3cc3cc(OC)c(OC)c(OC)c23)cc1 ZINC000103158980 GI Annotated Anodyne O=C1[C@@H](Cl)[C@@H](c2cc3ccccc3nc2Cl)N1c1cccc([N+](=O)[O-])c1 ZINC000103167311 GI Annotated Reactive O=C1[C@@H](Cl)[C@H](c2cc3ccccc3nc2Cl)N1c1cccc([N+](=O)[O-])c1 ZINC000103167313 GI Annotated Reactive O=C1[C@H](Cl)[C@@H](c2cc3ccccc3nc2Cl)N1c1cccc([N+](=O)[O-])c1 ZINC000103167314 GI Annotated Reactive O=C1[C@H](Cl)[C@H](c2cc3ccccc3nc2Cl)N1c1cccc([N+](=O)[O-])c1 ZINC000103167317 GI Annotated Reactive CN(C)c1ccc(/C=C2\SC(=S)N(Cc3nc4ccccc4[nH]3)C2=O)cc1 ZINC000103167724 GI Annotated Clean O=C1[C@@H](Cl)[C@@H](c2cc3ccccc3nc2Cl)N1c1ccc([N+](=O)[O-])cc1 ZINC000103167895 GI Annotated Reactive O=C1[C@@H](Cl)[C@H](c2cc3ccccc3nc2Cl)N1c1ccc([N+](=O)[O-])cc1 ZINC000103167896 GI Annotated Reactive O=C1[C@H](Cl)[C@@H](c2cc3ccccc3nc2Cl)N1c1ccc([N+](=O)[O-])cc1 ZINC000103167898 GI Annotated Reactive O=C1[C@H](Cl)[C@H](c2cc3ccccc3nc2Cl)N1c1ccc([N+](=O)[O-])cc1 ZINC000103167900 GI Annotated Reactive O=C1O/C(=C\c2cccc3c2OCO3)C=C1Cc1ccc(Br)cc1 ZINC000103168838 GI Annotated Anodyne Nc1c(C=O)c(-c2ccc(Cl)cc2)nn1-c1ccc(Br)cc1 ZINC000103169193 GI Annotated Anodyne Cc1ccc(NC(=O)NS(=O)(=O)[C@@H]2CCCCCCCCCCC2=O)cc1 ZINC000103170093 GI Annotated Anodyne Cc1ccc(NC(=O)NS(=O)(=O)[C@H]2CCCCCCCCCCC2=O)cc1 ZINC000103170095 GI Annotated Anodyne Fc1cc(F)c(-c2c(F)nc3nccnc3c2NCC(F)(F)F)c(F)c1 ZINC000103170361 GI Annotated Mild CSc1ccc(/C=N/N(C(=O)c2ccccc2)C(=O)c2ccncc2)cc1 ZINC000103170659 GI Annotated Reactive CS(=O)(=O)c1ccc(-c2nc(N[C@H]3CC=CCC3)cc(C(F)(F)F)n2)cc1 ZINC000103170816 GI Annotated Anodyne CS(=O)(=O)c1ccc(-c2nc(N[C@@H]3CC=CCC3)cc(C(F)(F)F)n2)cc1 ZINC000103170818 GI Annotated Anodyne CC1(C)SC(Nc2ccccc2)=NN1C(=O)COc1ccccc1Cl ZINC000103172334 GI Annotated Anodyne Cc1cc(OCC(=O)O[C@@H](C)P2(=O)OCC(C)(C)CO2)ccc1Cl ZINC000103173529 GI Annotated Anodyne Cc1cc(OCC(=O)O[C@H](C)P2(=O)OCC(C)(C)CO2)ccc1Cl ZINC000103173531 GI Annotated Anodyne Cc1cc(Cl)ccc1OCC(=O)O[C@@H](C)P1(=O)OCC(C)(C)CO1 ZINC000103174178 GI Annotated Anodyne Cc1cc(Cl)ccc1OCC(=O)O[C@H](C)P1(=O)OCC(C)(C)CO1 ZINC000103174180 GI Annotated Anodyne O=C(N/C(=C/c1ccccc1)c1nc2ccc([N+](=O)[O-])cc2[nH]1)c1ccccc1 ZINC000103174972 GI Annotated Bother O=C1O/C(=C/c2cccc([N+](=O)[O-])c2)C=C1Cc1ccc(Br)cc1 ZINC000103175025 GI Annotated Bother CNC(=O)[C@@H](OC)c1ccccc1CO/N=C(\C)c1ccc(C(F)(F)F)cc1 ZINC000103176291 GI Annotated Mild CNC(=O)[C@H](OC)c1ccccc1CO/N=C(\C)c1ccc(C(F)(F)F)cc1 ZINC000103176293 GI Annotated Mild CNC(=O)[C@@H](OC)c1ccccc1CO/N=C(\C)c1cccc(C(F)(F)F)c1 ZINC000103176295 GI Annotated Mild CNC(=O)[C@H](OC)c1ccccc1CO/N=C(\C)c1cccc(C(F)(F)F)c1 ZINC000103176299 GI Annotated Mild CNC(=O)[C@@H](OC)c1ccccc1CO/N=C(\C)c1ccccc1C(F)(F)F ZINC000103176302 GI Annotated Mild CNC(=O)[C@H](OC)c1ccccc1CO/N=C(\C)c1ccccc1C(F)(F)F ZINC000103176305 GI Annotated Mild O=C1[C@@H](Cl)[C@@H](c2cc3ccccc3nc2Cl)N1c1ccccc1[N+](=O)[O-] ZINC000103176499 GI Annotated Reactive O=C1[C@@H](Cl)[C@H](c2cc3ccccc3nc2Cl)N1c1ccccc1[N+](=O)[O-] ZINC000103176501 GI Annotated Reactive O=C1[C@H](Cl)[C@@H](c2cc3ccccc3nc2Cl)N1c1ccccc1[N+](=O)[O-] ZINC000103176503 GI Annotated Reactive O=C1[C@H](Cl)[C@H](c2cc3ccccc3nc2Cl)N1c1ccccc1[N+](=O)[O-] ZINC000103176506 GI Annotated Reactive COc1ccc(-c2nn3c(COc4ccc(C)cc4)nc(=S)nc3o2)cc1 ZINC000103176882 GI Annotated Anodyne O=[N+]([O-])c1ccc(NS(=O)(=O)c2cc(Cl)c(Cl)cc2Cl)c(F)c1 ZINC000103177673 GI Annotated Bother O=c1nc(-c2c(F)cccc2F)on1-c1ccc(OC(F)(F)F)c(Cl)c1 ZINC000103177694 GI Annotated Anodyne Cc1cc(OC(F)(F)F)ccc1-n1sc(-c2c(F)cccc2F)nc1=O ZINC000103177788 GI Annotated Anodyne COc1cc2c3c(c4ccc(OCC#N)cc4c2cc1OC)CN1CCC[C@@H]1C3 ZINC000103179177 GI Annotated Mild COc1cc2c3c(c4ccc(OCC#N)cc4c2cc1OC)CN1CCC[C@H]1C3 ZINC000103179181 GI Annotated Mild COc1ccc(-c2nn3c(COc4cccc(C)c4)nc(=S)nc3o2)cc1 ZINC000103179586 GI Annotated Anodyne CC(=O)OC1=C(c2ccccc2)C(=O)N(C(C)(C)c2nc3ccccc3s2)C1 ZINC000103180981 GI Annotated Anodyne Cc1cc(C)c(C2=C(OC(=O)CC(C)(C)C)C(C)(C)N(OCC#N)C2=O)c(C)c1 ZINC000103181824 GI Annotated Mild COc1cc([C@@H]2CC(c3ccccc3)=Cc3n[nH]c(O)c32)cc(OC)c1OC ZINC000103182699 GI Annotated Anodyne COc1cc([C@H]2CC(c3ccccc3)=Cc3n[nH]c(O)c32)cc(OC)c1OC ZINC000103182700 GI Annotated Anodyne COc1ccc(C2=Cc3n[nH]c(O)c3[C@H](c3ccc(OC)c(OC)c3)C2)cc1 ZINC000103182724 GI Annotated Anodyne COc1ccc(C2=Cc3n[nH]c(O)c3[C@@H](c3ccc(OC)c(OC)c3)C2)cc1 ZINC000103182726 GI Annotated Anodyne COc1ccc([C@@H]2CC(c3ccc(OC)c(OC)c3)=Cc3n[nH]c(O)c32)cc1 ZINC000103182851 GI Annotated Anodyne COc1ccc([C@H]2CC(c3ccc(OC)c(OC)c3)=Cc3n[nH]c(O)c32)cc1 ZINC000103182852 GI Annotated Anodyne CO/N=C(/c1nnco1)c1ccccc1COc1ccc(Cl)cc1Cl ZINC000103183963 GI Annotated Mild CO/N=C(/c1nnco1)c1ccccc1COc1cc(Cl)ccc1Cl ZINC000103183965 GI Annotated Mild CCc1nn(C)c(C(=O)NCc2ccc(Oc3ccc(C#N)cc3)cc2)c1Cl ZINC000103184371 GI Annotated Mild CCOCC1=C(C(F)(F)F)O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@]42OO3 ZINC000103184983 GI Annotated Reactive CCCN(CCC)C(=O)c1nc(C)c(C)nc1C(=O)Nc1cc(C)ccc1C ZINC000103185364 GI Annotated Anodyne C=CCOCC1=C(C(F)(F)F)O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]1[C@]42OO3 ZINC000103186125 GI Annotated Reactive CCc1c(Sc2ccccc2)n(OCCc2ccccc2)c(=S)[nH]c1=O ZINC000103186232 GI Annotated Anodyne C[C@@H]1CC[C@H]2C(CN=[N+]=[N-])=C(C(F)(F)F)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000103187413 GI Annotated Reactive Cc1ccc(/C=N\NC(=O)[C@@H](C)Oc2cc(Cl)c(Cl)cc2Cl)o1 ZINC000103188061 GI Annotated Reactive Cc1ccc(/C=N\NC(=O)[C@H](C)Oc2cc(Cl)c(Cl)cc2Cl)o1 ZINC000103188063 GI Annotated Reactive COc1cc2c(=O)c(-c3ccc4c(c3)OCO4)coc2c2c1OC(C)(C)CC2 ZINC000103188279 GI Annotated Anodyne C[C@@H]1CC[C@H]2[C@@](C)(C(=O)Sc3ccccc3)O[C@@H]3O[C@]4(C)CC[C@H]1[C@@]23OO4 ZINC000103188967 GI Annotated Reactive C[C@@H]1CC[C@H]2[C@@](C)(C(=O)Sc3ccccc3)O[C@@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000103188969 GI Annotated Reactive Cc1cc(-n2sc(-c3c(F)cccc3F)nc2=O)ccc1OC(F)(F)F ZINC000103189037 GI Annotated Anodyne O=C1[C@@H](Cl)[C@@H](c2cc3ccccc3nc2S)N1c1ccccc1[N+](=O)[O-] ZINC000103189201 GI Annotated Reactive O=C1[C@@H](Cl)[C@H](c2cc3ccccc3nc2S)N1c1ccccc1[N+](=O)[O-] ZINC000103189202 GI Annotated Reactive O=C1[C@H](Cl)[C@@H](c2cc3ccccc3nc2S)N1c1ccccc1[N+](=O)[O-] ZINC000103189205 GI Annotated Reactive O=C1[C@H](Cl)[C@H](c2cc3ccccc3nc2S)N1c1ccccc1[N+](=O)[O-] ZINC000103189207 GI Annotated Reactive CN(C)CCCN1C(=O)/C(=C(/c2ccccc2)c2ccc[nH]2)c2cc(F)ccc21 ZINC000103190292 GI Annotated Anodyne COP(=O)(OC)[C@H](OC(=O)COc1ccc(F)cc1F)c1cccs1 ZINC000103190374 GI Annotated Anodyne COP(=O)(OC)[C@@H](OC(=O)COc1ccc(F)cc1F)c1cccs1 ZINC000103190378 GI Annotated Anodyne O=c1nc(-c2c(F)cccc2F)sn1-c1ccc(OC(F)(F)F)cc1F ZINC000103190963 GI Annotated Anodyne O=c1nc(-c2c(F)cccc2F)sn1-c1ccc(OC(F)(F)F)c(F)c1 ZINC000103190966 GI Annotated Anodyne CO/N=C(\c1ccccc1/C=N/O[C@H](C)c1ccccc1C)c1nccn1C ZINC000103191135 GI Annotated Mild CO/N=C(\c1ccccc1/C=N/O[C@@H](C)c1ccccc1C)c1nccn1C ZINC000103191137 GI Annotated Mild CO/N=C(\c1ccccc1/C=N/O[C@H](C)c1cccc(C)c1)c1nccn1C ZINC000103191140 GI Annotated Mild CO/N=C(\c1ccccc1/C=N/O[C@@H](C)c1cccc(C)c1)c1nccn1C ZINC000103191142 GI Annotated Mild COP(=O)(OC)[C@@H](OC(=O)COc1cccc(C)c1C)c1cccs1 ZINC000103192139 GI Annotated Anodyne COP(=O)(OC)[C@H](OC(=O)COc1cccc(C)c1C)c1cccs1 ZINC000103192142 GI Annotated Anodyne COP(=O)(OC)[C@H](OC(=O)COc1ccc(Cl)cc1F)c1ccco1 ZINC000103192507 GI Annotated Anodyne COP(=O)(OC)[C@@H](OC(=O)COc1ccc(Cl)cc1F)c1ccco1 ZINC000103192509 GI Annotated Anodyne COP(=O)(OC)[C@H](OC(=O)COc1ccc(F)cc1Cl)c1ccco1 ZINC000103192513 GI Annotated Anodyne COP(=O)(OC)[C@@H](OC(=O)COc1ccc(F)cc1Cl)c1ccco1 ZINC000103192514 GI Annotated Anodyne CNC(=O)/C(=N/OC)c1ccccc1Oc1ccc(Oc2ccccc2)cc1 ZINC000103192850 GI Annotated Mild CNC(=O)[C@@H](OC)c1ccccc1CO/N=C(/C)c1ccc(C(F)(F)F)cc1 ZINC000103192856 GI Annotated Mild CNC(=O)[C@H](OC)c1ccccc1CO/N=C(/C)c1ccc(C(F)(F)F)cc1 ZINC000103192860 GI Annotated Mild CNC(=O)[C@@H](OC)c1ccccc1CO/N=C(\C)c1ccc(Cl)cc1Cl ZINC000103192891 GI Annotated Mild CNC(=O)[C@H](OC)c1ccccc1CO/N=C(\C)c1ccc(Cl)cc1Cl ZINC000103192895 GI Annotated Mild CNC(=O)[C@@H](OC)c1ccccc1CO/N=C(\C)c1ccc(Cl)c(Cl)c1 ZINC000103192978 GI Annotated Mild CNC(=O)[C@H](OC)c1ccccc1CO/N=C(\C)c1ccc(Cl)c(Cl)c1 ZINC000103192981 GI Annotated Mild CCC/C(=N\OCc1ccccc1[C@H](OC)C(=O)NC)c1ccc(Cl)cc1 ZINC000103193007 GI Annotated Mild CCC/C(=N\OCc1ccccc1[C@@H](OC)C(=O)NC)c1ccc(Cl)cc1 ZINC000103193009 GI Annotated Mild CC(=O)N1N=C(c2ccc(-n3c(C)ccc3C)cc2)O[C@H]1c1ccc(O)cc1 ZINC000103193024 GI Annotated Clean CC(=O)N1N=C(c2ccc(-n3c(C)ccc3C)cc2)O[C@@H]1c1ccc(O)cc1 ZINC000103193027 GI Annotated Clean N#CCN(C(=O)c1ccccc1OCc1ccc(Cl)nc1)c1ccccc1 ZINC000103193335 GI Annotated Mild COc1ccc(NC2=NN(C(=O)COc3cccc(C)c3)C(C)(C)S2)cc1 ZINC000103193490 GI Annotated Anodyne CO/N=C(\c1ccccc1/C=N/OCc1ccc(Cl)cc1)c1nccn1C ZINC000103194357 GI Annotated Mild CO/N=C(\c1ccccc1/C=N/N=C(/C)c1ccc(Cl)cc1)c1nccn1C ZINC000103194432 GI Annotated Mild CNC(=O)[C@H](OC)c1ccccc1CO/N=C(/SC)c1ccc(Cl)cc1 ZINC000103194615 GI Annotated Mild CNC(=O)[C@@H](OC)c1ccccc1CO/N=C(/SC)c1ccc(Cl)cc1 ZINC000103194616 GI Annotated Mild Cc1nn(C)c(C(=O)NC(c2ccccc2)c2ccccc2)c1Br ZINC000103195125 GI Annotated Anodyne CCOC(=O)CSc1nnc(-c2nc(C(C)C)cs2)n1-c1ccccc1 ZINC000103195818 GI Annotated Anodyne O=C1[C@@H](Cl)[C@@H](c2cc3ccccc3nc2S)N1c1cccc([N+](=O)[O-])c1 ZINC000103196245 GI Annotated Reactive O=C1[C@@H](Cl)[C@H](c2cc3ccccc3nc2S)N1c1cccc([N+](=O)[O-])c1 ZINC000103196248 GI Annotated Reactive O=C1[C@H](Cl)[C@@H](c2cc3ccccc3nc2S)N1c1cccc([N+](=O)[O-])c1 ZINC000103196250 GI Annotated Reactive O=C1[C@H](Cl)[C@H](c2cc3ccccc3nc2S)N1c1cccc([N+](=O)[O-])c1 ZINC000103196253 GI Annotated Reactive O=C1[C@@H](Cl)[C@@H](c2cc3ccccc3nc2S)N1c1ccc([N+](=O)[O-])cc1 ZINC000103196257 GI Annotated Reactive O=C1[C@@H](Cl)[C@H](c2cc3ccccc3nc2S)N1c1ccc([N+](=O)[O-])cc1 ZINC000103196258 GI Annotated Reactive O=C1[C@H](Cl)[C@@H](c2cc3ccccc3nc2S)N1c1ccc([N+](=O)[O-])cc1 ZINC000103196261 GI Annotated Reactive O=C1[C@H](Cl)[C@H](c2cc3ccccc3nc2S)N1c1ccc([N+](=O)[O-])cc1 ZINC000103196263 GI Annotated Reactive O=C1CS[C@H](c2cc3ccccc3nc2S)N1c1ccccc1[N+](=O)[O-] ZINC000103196409 GI Annotated Bother O=C1CS[C@@H](c2cc3ccccc3nc2S)N1c1ccccc1[N+](=O)[O-] ZINC000103196411 GI Annotated Bother O=C1CS[C@H](c2cc3ccccc3nc2S)N1c1cccc([N+](=O)[O-])c1 ZINC000103196414 GI Annotated Bother O=C1CS[C@@H](c2cc3ccccc3nc2S)N1c1cccc([N+](=O)[O-])c1 ZINC000103196416 GI Annotated Bother O=C1CS[C@H](c2cc3ccccc3nc2S)N1c1ccc([N+](=O)[O-])cc1 ZINC000103196420 GI Annotated Bother O=C1CS[C@@H](c2cc3ccccc3nc2S)N1c1ccc([N+](=O)[O-])cc1 ZINC000103196424 GI Annotated Bother Cc1cc(Cl)n2s/c(=N\C(=O)[C@H](c3ccc(Cl)cc3)C(C)C)nc2n1 ZINC000103196752 GI Annotated Anodyne Cc1cc(C2=C[C@H](c3ccccc3Cl)N(C(=O)c3ccncc3)N2)ccc1O ZINC000103197722 GI Annotated Anodyne Cc1cc(C2=C[C@@H](c3ccccc3Cl)N(C(=O)c3ccncc3)N2)ccc1O ZINC000103197725 GI Annotated Anodyne Cc1cc(C2=C[C@H](c3ccc(Cl)cc3)N(C(=O)c3ccncc3)N2)ccc1O ZINC000103197742 GI Annotated Anodyne Cc1cc(C2=C[C@@H](c3ccc(Cl)cc3)N(C(=O)c3ccncc3)N2)ccc1O ZINC000103197744 GI Annotated Anodyne CO/N=C(\c1ccccc1/C=N/O[C@H](C)c1ccc(C)cc1)c1nccn1C ZINC000103197830 GI Annotated Mild CO/N=C(\c1ccccc1/C=N/O[C@@H](C)c1ccc(C)cc1)c1nccn1C ZINC000103197834 GI Annotated Mild Cc1c(C(F)(F)F)noc1OCC(=O)N(C)c1c(Cl)cccc1Cl ZINC000103198536 GI Annotated Anodyne C[C@H](C(=O)N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(-c2ccccc2)c(F)c1 ZINC000103198728 GI Annotated Reactive C[C@@H](C(=O)N/N=C/c1ccc([N+](=O)[O-])o1)c1ccc(-c2ccccc2)c(F)c1 ZINC000103198729 GI Annotated Reactive COc1cccc2cc(-c3ccc4c(=O)oc5c(C)cccc5c4n3)c(=O)oc12 ZINC000103198787 GI Annotated Bother CNC(=O)[C@@H](OC)c1ccccc1CO/N=C(\C)c1ccc(C(C)(C)C)cc1 ZINC000103199215 GI Annotated Mild CNC(=O)[C@H](OC)c1ccccc1CO/N=C(\C)c1ccc(C(C)(C)C)cc1 ZINC000103199217 GI Annotated Mild CCOC(=O)c1s/c(=N\Cc2ccccc2Cl)n(-c2ccccc2)c1N ZINC000103199689 GI Annotated Anodyne CCn1c(-c2ccc(Br)cc2)cc(-c2cccn2C)c(C#N)c1=O ZINC000103200655 GI Annotated Mild O=C(N/N=C(\C=C\c1ccccc1O)c1ccccc1O)Nc1ccc(F)cc1 ZINC000103200925 GI Annotated Reactive CN(C)c1ccc(/C=N/NC(=S)Nc2nc3ccc(Cl)cc3s2)cc1 ZINC000103201218 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@@H](C[C@H]12)[C@H]3CC[C@H](C)OC(=O)CCc1ccccc1 ZINC000103201658 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@@H](C[C@H]12)[C@H]3CC[C@@H](C)OC(=O)CCc1ccccc1 ZINC000103201660 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@H](C)OC(=O)CCc4ccccc4)[C@@H]3C[C@H]12 ZINC000103201662 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@@H](C)OC(=O)CCc4ccccc4)[C@@H]3C[C@H]12 ZINC000103201663 GI Annotated Mild CCN(CC)SN(C(=O)NC(=O)c1c(F)cccc1F)c1ccccc1 ZINC000103201970 GI Annotated Anodyne O=C(NC(=O)N(SN1CCCCC1)c1ccccc1)c1c(F)cccc1F ZINC000103202030 GI Annotated Anodyne CC1=NN(c2nc3ccc(Cl)cc3s2)C(=O)/C1=N/Nc1ccc(C)cc1 ZINC000103202051 GI Annotated Mild CC1=NN(c2nc3ccc(Cl)cc3s2)C(=O)/C1=N/Nc1ccccc1C ZINC000103202053 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@@H](C[C@H]12)[C@H]3CC[C@H](C)OC(=O)c1cccnc1Cl ZINC000103202568 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@@H](C[C@H]12)[C@H]3CC[C@@H](C)OC(=O)c1cccnc1Cl ZINC000103202570 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@H](C)OC(=O)c4cccnc4Cl)[C@@H]3C[C@H]12 ZINC000103202573 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@@H](C)OC(=O)c4cccnc4Cl)[C@@H]3C[C@H]12 ZINC000103202574 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@@H](C[C@H]12)[C@H]3CC[C@H](C)OC(=O)c1ccc(C#N)cc1 ZINC000103203010 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@@H](C[C@H]12)[C@H]3CC[C@@H](C)OC(=O)c1ccc(C#N)cc1 ZINC000103203013 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@H](C)OC(=O)c4ccc(C#N)cc4)[C@@H]3C[C@H]12 ZINC000103203015 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@@H](C)OC(=O)c4ccc(C#N)cc4)[C@@H]3C[C@H]12 ZINC000103203018 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@@H](C[C@H]12)[C@H]3CC[C@H](C)OC(=O)c1ccccc1OC ZINC000103203030 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@@H](C[C@H]12)[C@H]3CC[C@@H](C)OC(=O)c1ccccc1OC ZINC000103203031 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@H](C)OC(=O)c4ccccc4OC)[C@@H]3C[C@H]12 ZINC000103203034 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@@H](C)OC(=O)c4ccccc4OC)[C@@H]3C[C@H]12 ZINC000103203035 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@@H](C[C@H]12)[C@H]3CC[C@H](C)OC(=O)c1cccc(OC)c1 ZINC000103203038 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@@H](C[C@H]12)[C@H]3CC[C@@H](C)OC(=O)c1cccc(OC)c1 ZINC000103203041 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@H](C)OC(=O)c4cccc(OC)c4)[C@@H]3C[C@H]12 ZINC000103203043 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@@H](C)OC(=O)c4cccc(OC)c4)[C@@H]3C[C@H]12 ZINC000103203046 GI Annotated Mild S=C1COc2ccccc2CN1c1ccc(I)cc1 ZINC000103203231 GI Annotated Anodyne Cc1nnc2c(C#N)c(-c3cccn3C)cc(-c3ccc(Br)cc3)n12 ZINC000103203272 GI Annotated Mild COc1ccc(N/N=C2/C(=O)N(c3nc4ccc(Cl)cc4s3)N=C2C)cc1 ZINC000103203426 GI Annotated Mild CC1=NN(c2nc3ccc(Cl)cc3s2)C(=O)/C1=N/Nc1ccc(F)cc1 ZINC000103203432 GI Annotated Mild O=C1CCCCCC[C@H]1S(=O)(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000103204518 GI Annotated Anodyne O=C1CCCCCC[C@@H]1S(=O)(=O)Nc1ccc(Cl)cc1C(F)(F)F ZINC000103204520 GI Annotated Anodyne COc1ccc(-c2nnc(-n3c(-c4ccccc4)nc4ccccc4c3=O)o2)cc1 ZINC000103204760 GI Annotated Anodyne Cc1ccc(-c2nnc(-n3c(-c4ccccc4)nc4ccccc4c3=O)o2)cc1 ZINC000103204762 GI Annotated Anodyne CC[C@@H](C)O/N=C/c1ccc(NC(=O)NC(=O)c2c(F)cccc2F)cc1 ZINC000103205280 GI Annotated Mild CC[C@H](C)O/N=C/c1ccc(NC(=O)NC(=O)c2c(F)cccc2F)cc1 ZINC000103205282 GI Annotated Mild CCC[C@@H](C)O/N=C/c1ccc(NC(=O)NC(=O)c2c(F)cccc2F)cc1 ZINC000103205284 GI Annotated Mild CCC[C@H](C)O/N=C/c1ccc(NC(=O)NC(=O)c2c(F)cccc2F)cc1 ZINC000103205286 GI Annotated Mild COc1ccc(/C=N/c2nnc3c(Cl)nc4ccc(C)cc4n23)cc1OC ZINC000103205761 GI Annotated Mild O=S(=O)(Nc1ccc(Cl)cc1C(F)(F)F)[C@@H]1CCCCCC[C@@H]1O ZINC000103205813 GI Annotated Anodyne O=S(=O)(Nc1ccc(Cl)cc1C(F)(F)F)[C@H]1CCCCCC[C@@H]1O ZINC000103205817 GI Annotated Anodyne O=S(=O)(Nc1ccc(Cl)cc1C(F)(F)F)[C@@H]1CCCCCC[C@H]1O ZINC000103205818 GI Annotated Anodyne O=S(=O)(Nc1ccc(Cl)cc1C(F)(F)F)[C@H]1CCCCCC[C@H]1O ZINC000103205821 GI Annotated Anodyne Nc1nc(-c2cccc(Br)c2)cc(-c2cc3ccccc3oc2=O)n1 ZINC000103206064 GI Annotated Anodyne Nc1nc(-c2ccccc2Br)cc(-c2cc3ccccc3oc2=O)n1 ZINC000103206066 GI Annotated Anodyne O=c1c2ccccc2nc(-c2ccccc2)n1-c1nnc(-c2ccc(F)cc2)o1 ZINC000103206123 GI Annotated Anodyne Cc1ccc(S(=O)(=O)NCCN2CCCCCCCCCCCC2=O)cc1 ZINC000103206312 GI Annotated Anodyne O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(/C=N/OC2CCCC2)cc1 ZINC000103206596 GI Annotated Mild C[C@@]12CCCC(COC(=O)c3ccc(C#N)cc3)=C1C(=O)O[C@H]2c1ccoc1 ZINC000103206718 GI Annotated Mild COc1cc([C@@H]2C=C(c3ccc(N)cc3)N=C(SCCCC#N)N2)ccc1O ZINC000103207071 GI Annotated Mild COc1cc([C@H]2C=C(c3ccc(N)cc3)N=C(SCCCC#N)N2)ccc1O ZINC000103207074 GI Annotated Mild COc1ccc([C@@H]2C=C(c3ccc(N)cc3)N=C(SCCCC#N)N2)cc1 ZINC000103207087 GI Annotated Mild COc1ccc([C@H]2C=C(c3ccc(N)cc3)N=C(SCCCC#N)N2)cc1 ZINC000103207089 GI Annotated Mild CN(C)c1ccc([C@@H]2C=C(c3ccc(N)cc3)N=C(SCCCC#N)N2)cc1 ZINC000103207091 GI Annotated Mild CN(C)c1ccc([C@H]2C=C(c3ccc(N)cc3)N=C(SCCCC#N)N2)cc1 ZINC000103207093 GI Annotated Mild N#CCCCSC1=NC(c2ccc(N)cc2)=C[C@@H](c2ccc([N+](=O)[O-])cc2)N1 ZINC000103208452 GI Annotated Mild N#CCCCSC1=NC(c2ccc(N)cc2)=C[C@H](c2ccc([N+](=O)[O-])cc2)N1 ZINC000103208454 GI Annotated Mild Cc1cc(Cl)cc(C(=O)NNCc2ccccc2)c1NC(=O)CC(C)(C)C ZINC000103208601 GI Annotated Reactive C=CCO[C@@H]1C2=C(CCCC2)C(=O)N1c1cc(O)c(Br)cc1F ZINC000103208653 GI Annotated Mild C=CCO[C@H]1C2=C(CCCC2)C(=O)N1c1cc(O)c(Br)cc1F ZINC000103208655 GI Annotated Mild Cc1ccc(C)c(C2=C(OC(=O)CC(C)(C)C)C3(CCC(=O)CC3)NC2=O)c1 ZINC000103210517 GI Annotated Anodyne O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(C2=NOC3(CCCC3)C2)cc1 ZINC000103210691 GI Annotated Anodyne Cc1ccn2c(CN(C)C)c(-c3ccc([N+](=O)[O-])cc3Br)nc2c1 ZINC000103211647 GI Annotated Bother Cc1cc(Cl)cc(C(=O)NNCc2ccccc2F)c1NC(=O)C(C)(C)C ZINC000103211815 GI Annotated Reactive CCOC(=O)C1=C(C)N=C2Sc3ccccc3N2[C@@H]1c1ccc(O)c(OC)c1 ZINC000103212746 GI Annotated Anodyne CCOC(=O)C1=C(C)N=C2Sc3ccccc3N2[C@H]1c1ccc(O)c(OC)c1 ZINC000103212750 GI Annotated Anodyne O=C(NC(=O)c1c(F)cccc1F)OCc1ccc(-c2ccccc2F)o1 ZINC000103212790 GI Annotated Anodyne Cc1cc(Cl)cc(C(=O)NNCc2ccc(F)cc2)c1NC(=O)C(C)(C)C ZINC000103213296 GI Annotated Reactive O=C1CCCC2=C1[C@@H](c1ccccc1[N+](=O)[O-])c1c(c3ccccc3oc1=O)O2 ZINC000103213518 GI Annotated Mild O=C1CCCC2=C1[C@H](c1ccccc1[N+](=O)[O-])c1c(c3ccccc3oc1=O)O2 ZINC000103213521 GI Annotated Mild CCOc1ccccc1NC(=O)N1C(=S)O[C@@H](c2ccc(Cl)nc2)[C@H]1C ZINC000103213737 GI Annotated Anodyne O=C1CCCC2=C1[C@@H](c1cccc([N+](=O)[O-])c1)c1c(c3ccccc3oc1=O)O2 ZINC000103214875 GI Annotated Mild O=C1CCCC2=C1[C@H](c1cccc([N+](=O)[O-])c1)c1c(c3ccccc3oc1=O)O2 ZINC000103214877 GI Annotated Mild O=C1CCCC2=C1[C@@H](c1ccc([N+](=O)[O-])cc1)c1c(c3ccccc3oc1=O)O2 ZINC000103214879 GI Annotated Mild O=C1CCCC2=C1[C@H](c1ccc([N+](=O)[O-])cc1)c1c(c3ccccc3oc1=O)O2 ZINC000103214883 GI Annotated Mild Cc1ccc2c(c1)C(=O)/C(=C\c1ccc(O)c(O)c1)[C@H](c1ccc(O)c(O)c1)O2 ZINC000103215136 GI Annotated Mild Cc1ccc2c(c1)C(=O)/C(=C\c1ccc(O)c(O)c1)[C@@H](c1ccc(O)c(O)c1)O2 ZINC000103215139 GI Annotated Mild O=C(Nn1c(S)nnc1-c1cccc2ccccc12)c1ccccc1Cl ZINC000103215157 GI Annotated Anodyne CC(C)(C)O/N=C/c1ccc(NC(=O)NC(=O)c2c(F)cccc2F)cc1 ZINC000103215502 GI Annotated Mild COP(=O)(OC)[C@@H](OC(=O)COc1cccc(C)c1C)c1ccccc1 ZINC000103215540 GI Annotated Anodyne COP(=O)(OC)[C@H](OC(=O)COc1cccc(C)c1C)c1ccccc1 ZINC000103215542 GI Annotated Anodyne COP(=O)(OC)[C@H](OC(=O)COc1ccc(F)cc1F)c1ccccc1 ZINC000103215544 GI Annotated Anodyne COP(=O)(OC)[C@@H](OC(=O)COc1ccc(F)cc1F)c1ccccc1 ZINC000103215546 GI Annotated Anodyne CC(C)(C)n1ncc(SCc2nnc(-c3ccccc3F)o2)c(Cl)c1=O ZINC000103216055 GI Annotated Anodyne Cc1cccc(-c2nnc(CSc3cnn(C(C)(C)C)c(=O)c3Cl)o2)c1 ZINC000103216059 GI Annotated Anodyne CC(C)(C)c1ccc(/C(=C/C(=O)N2CCOCC2)c2ccnc(Cl)c2)cc1 ZINC000103216889 GI Annotated Anodyne Cc1cccc(-c2nnc(COc3cnn(C(C)(C)C)c(=O)c3Cl)s2)c1 ZINC000103217194 GI Annotated Anodyne CC1(C)C[C@H](OCCI)[C@]23CC[C@@H](O)[C@@](C)(CC[C@@H]12)C3 ZINC000103218412 GI Annotated Reactive CCCc1c(-c2nnc(-c3snnc3C)o2)cnn1-c1ccc(Cl)cc1 ZINC000103218689 GI Annotated Anodyne Cc1nn(CC(F)(F)F)c(CSC2=NOC(C)(C)C2)c1Br ZINC000103220288 GI Annotated Anodyne COc1cccc2c1C(=O)C(NCc1ccc(C(F)(F)F)cc1)=C(C)C2=O ZINC000103221000 GI Annotated Mild O=C(NC(=O)c1c(F)cccc1F)OCc1ccc(-c2ccc(F)cc2)o1 ZINC000103221279 GI Annotated Anodyne COC(=O)c1cccc2nc3cc(C(=O)C(Cl)(Cl)Cl)ccc3nc12 ZINC000103221455 GI Annotated Bother Clc1ccc2c(c1)cc(-c1nc3cc(Br)ccc3[nH]1)c1nnnn12 ZINC000103221804 GI Annotated Anodyne Oc1ccccc1/C=N\NC(=S)N(Cc1ccccc1)Cc1ccccc1 ZINC000103222167 GI Annotated Mild O=[N+]([O-])c1ccc(/C=N\NC(=S)N(Cc2ccccc2)Cc2ccccc2)o1 ZINC000103222171 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@@H](C[C@H]12)[C@H]3CC[C@H](C)OC(=O)c1ccc(OC)cc1 ZINC000103223698 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)[C@@H](C[C@H]12)[C@H]3CC[C@@H](C)OC(=O)c1ccc(OC)cc1 ZINC000103223701 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@H](C)OC(=O)c4ccc(OC)cc4)[C@@H]3C[C@H]12 ZINC000103223705 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@@H](C)OC(=O)c4ccc(OC)cc4)[C@@H]3C[C@H]12 ZINC000103223707 GI Annotated Mild O=c1c2ccc(Cl)cc2nc(-c2ccccc2)n1/N=C/c1ccc(O)cc1 ZINC000103223802 GI Annotated Mild O=c1c2ccc(Cl)cc2nc(-c2ccccc2)n1/N=C/c1ccccc1O ZINC000103223805 GI Annotated Mild NC(=O)N/N=C/c1c(-c2ccccc2)n(CC(=O)c2ccccc2)c2ccccc12 ZINC000103224022 GI Annotated Reactive Oc1cc(CSc2cccc(F)c2F)nc2nc(CCc3ccccc3)nn12 ZINC000103224604 GI Annotated Anodyne O=[N+]([O-])c1cccc(-c2cnnc(N3CC[C@H](c4cccc(Cl)c4)C3)n2)c1 ZINC000103226909 GI Annotated Bother O=[N+]([O-])c1cccc(-c2cnnc(N3CC[C@@H](c4cccc(Cl)c4)C3)n2)c1 ZINC000103226913 GI Annotated Bother O=[N+]([O-])c1ccc(-c2cnnc(N3CC[C@@H](c4cccc(Cl)c4)C3)n2)cc1 ZINC000103226915 GI Annotated Bother O=[N+]([O-])c1ccc(-c2cnnc(N3CC[C@H](c4cccc(Cl)c4)C3)n2)cc1 ZINC000103226918 GI Annotated Bother COc1ccc(-c2cnnc(N3CC[C@H](c4cccc(Cl)c4)C3)n2)cc1OC ZINC000103227072 GI Annotated Anodyne COc1ccc(-c2cnnc(N3CC[C@@H](c4cccc(Cl)c4)C3)n2)cc1OC ZINC000103227078 GI Annotated Anodyne N#CC(=C\c1ccccc1)/C=C1\SC(=S)N(c2ccc(C(=O)O)cc2)C1=O ZINC000103228432 GI Annotated Reactive N#CC(=C\c1cccs1)/C=C1\SC(=S)N(c2ccc(C(=O)O)cc2)C1=O ZINC000103228469 GI Annotated Reactive COc1c2c(cc(/C=C(\C)[N+](=O)[O-])c1-c1ccccc1/C=C(\C)[N+](=O)[O-])OCO2 ZINC000103228562 GI Annotated Anodyne COc1cc(/C=C(\C)[N+](=O)[O-])c(-c2ccccc2/C=C(\C)[N+](=O)[O-])c2c1OCO2 ZINC000103228564 GI Annotated Anodyne COc1cc(C=C(C#N)C#N)c(-c2ccccc2C=C(C#N)C#N)c(OC)c1OC ZINC000103228584 GI Annotated Reactive COc1cc(-c2nn(CNc3ccccc3C)c(=S)o2)cc(OC)c1OC ZINC000103228941 GI Annotated Anodyne COc1cc(/C=C2\OC(=O)C(Cl)=C2Cl)ccc1OCCc1ccccn1 ZINC000103229244 GI Annotated Anodyne COc1cc(/C=C2\OC(=O)C(Cl)=C2Cl)ccc1OCc1ccccn1 ZINC000103229247 GI Annotated Anodyne COc1ccc(-c2cn3nc(-c4ccc(N(C)C)c([N+](=O)[O-])c4)sc3n2)cc1 ZINC000103230618 GI Annotated Bother CC(C)(C)C(=O)Nc1nnc(-c2ccc(NC3CCCC3)c([N+](=O)[O-])c2)s1 ZINC000103231245 GI Annotated Bother COc1ccc(CN(CC2CCC2)C(=O)c2cc(Br)c[nH]2)cc1 ZINC000103232604 GI Annotated Anodyne O=C(c1cc(C(F)(F)F)n[nH]1)N(Cc1cccc2[nH]ccc12)CC1CCC1 ZINC000103232639 GI Annotated Anodyne Cc1oc(COc2ccc(F)c(C(N)=O)c2F)nc1-c1ccc(Cl)cc1 ZINC000103234517 GI Annotated Anodyne COc1ccc([C@@H]2C(c3ccccc3)=NO[C@@]23C(=O)N(C)c2ccccc23)cc1 ZINC000103236538 GI Annotated Anodyne O=C(/C(=C/c1ccccc1)n1cncn1)c1ccc(F)cc1N1CCCCC1 ZINC000103237257 GI Annotated Mild C/C(=N\NC(=O)COc1ccc(C)cc1)c1ccc(-n2c(C)ccc2C)cc1 ZINC000103238064 GI Annotated Reactive C/C(=N\NS(=O)(=O)c1ccc(C)cc1)c1ccc(-n2c(C)ccc2C)cc1 ZINC000103238082 GI Annotated Mild CC/C(O)=C1/C(=O)N(O)c2cc(NC(=O)/C=C/c3ccccc3Cl)ccc21 ZINC000103238396 GI Annotated Anodyne COc1ccc(C[C@H]2COc3ccccc3CN2Cc2ccc(O)cc2)cc1 ZINC000103241348 GI Annotated Anodyne CC(=O)O[C@@]1(C)CCC(=O)[C@@H](C)CCC[C@]2(C)O[C@H]2C(=O)C(=C(C)C)CC1 ZINC000103241562 GI Annotated Mild CC(=O)O[C@@]1(C)CCC(=O)[C@H](C)CCC[C@]2(C)O[C@H]2C(=O)C(=C(C)C)CC1 ZINC000103241564 GI Annotated Mild CC(=O)O[C@@]1(C)CCC(=O)/C(C)=C/CC[C@]2(C)O[C@H]2C(=O)C(=C(C)C)CC1 ZINC000103241566 GI Annotated Mild CC(=O)O[C@]1(C)CCC(=C(C)C)C(=O)[C@@H]2O[C@@]2(C)CC/C=C(\C)[C@H](O)CC1 ZINC000103241569 GI Annotated Mild CC(=O)O[C@@]1(C)C/C=C2\O[C@H](C[C@@H]2C)C[C@]2(C)O[C@H]2C(=O)C(=C(C)C)CC1 ZINC000103241571 GI Annotated Mild CCCCN(CCCC)Cc1cccc(/C(C)=N/NC(=O)c2ccncc2)c1O ZINC000103242066 GI Annotated Reactive Cc1nnc(-c2ccc(Oc3ccc4c(c3)CCN(C3CCC3)CC4)nc2)o1 ZINC000103242314 GI Annotated Anodyne CCCN(C(=O)Nc1nc(C)cs1)c1ccc(OC(C)(C)C(=O)O)cc1 ZINC000103242853 GI Annotated Anodyne COc1ccc(C(=O)CSc2nc(C)c(C)n2Nc2ccc(OO)cc2)cc1 ZINC000103243306 GI Annotated Reactive COc1ccc(Nn2c(SCC(=O)c3cccc(F)c3)nc(C)c2C)cc1 ZINC000103244271 GI Annotated Anodyne COc1ccc(Nn2c(SCC(=O)c3ccc(F)cc3)nc(C)c2C)cc1 ZINC000103244273 GI Annotated Anodyne Cc1ccccc1C1=Nc2nc3ccccn3c2C(=O)[C@H](Cc2ccccc2)N1 ZINC000103245043 GI Annotated Anodyne CCOP(=O)(OCC)[C@H](Nc1ccccc1O)c1ccc2c(c1)OCO2 ZINC000103246201 GI Annotated Anodyne CCOP(=O)(OCC)[C@@H](Nc1ccccc1O)c1ccc2c(c1)OCO2 ZINC000103246204 GI Annotated Anodyne COc1cc2c(=O)n(CCc3cccc(Cl)c3)ccc2cc1-n1cnc(C)c1 ZINC000103247219 GI Annotated Anodyne COc1c(-n2cnc(C)c2)ccc2c(=O)n(CCc3cccc(Cl)c3)ccc12 ZINC000103247221 GI Annotated Anodyne CC[C@H](C)n1ccnc1/C=C1\CN(C)C/C(=C\c2nccn2[C@H](C)CC)C1=O ZINC000103248388 GI Annotated Mild CC[C@@H](C)n1ccnc1/C=C1\CN(C)C/C(=C\c2nccn2[C@H](C)CC)C1=O ZINC000103248389 GI Annotated Mild CC[C@H](C)n1ccnc1/C=C1\CN(C)C/C(=C\c2nccn2[C@@H](C)CC)C1=O ZINC000103248390 GI Annotated Mild Fc1cccc2c1nc(OCC1CCN(CC(F)F)CC1)c1cccnc12 ZINC000103248561 GI Annotated Bother Cc1ccc(Cn2cc(C(=O)NCCc3ccncc3)c3ncccc32)c(C)c1 ZINC000103248959 GI Annotated Anodyne O=S(=O)(/C=C/c1ccc(OC(F)F)c(OC(F)F)c1)Nc1ccccc1 ZINC000103250079 GI Annotated Anodyne CC[C@@H](Cc1ccc(O)c(C)c1C)NS(=O)(=O)c1c(C)cc(C)cc1C ZINC000103251310 GI Annotated Anodyne CC[C@H](Cc1ccc(O)c(C)c1C)NS(=O)(=O)c1c(C)cc(C)cc1C ZINC000103251377 GI Annotated Anodyne CC[C@@H](Cc1cc(C)c(O)c(C)c1)NS(=O)(=O)c1c(C)cc(C)cc1C ZINC000103251384 GI Annotated Anodyne CC[C@H](Cc1cc(C)c(O)c(C)c1)NS(=O)(=O)c1c(C)cc(C)cc1C ZINC000103251387 GI Annotated Anodyne O=C(Nc1ccc(-c2cc(F)cc(F)c2)cn1)[C@H]1CC[C@@H](N2CCCC2=O)CC1 ZINC000103254486 GI Annotated Anodyne O=C(Nc1ccc(-c2cc(F)cc(F)c2)cn1)[C@@H]1CC[C@@H](N2CCCC2=O)CC1 ZINC000103254488 GI Annotated Anodyne CC(=O)N1CCc2c(c3cc(Br)ccc3n2C(=O)OC(C)(C)C)C1 ZINC000103255623 GI Annotated Anodyne CCN(Cc1c2ccccc2c(Cl)c2ccccc12)C(=O)[C@@H](N)CCCCN ZINC000103256871 GI Annotated Bother O[C@@H](CNc1cc(-c2ccc(OC(F)(F)F)c(F)c2)ncn1)c1ccccc1 ZINC000103260543 GI Annotated Anodyne N=C1NC(c2ccc(Cl)cc2)=C(CC(=O)O)[C@@H](c2ccc(Cl)cc2)N1 ZINC000103262263 GI Annotated Anodyne N=C1NC(c2ccc(Cl)cc2)=C(CC(=O)O)[C@H](c2ccc(Cl)cc2)N1 ZINC000103262265 GI Annotated Anodyne CNc1nc(NCCCN(C)C)c2sc(-c3cccc4cnccc34)cc2n1 ZINC000103263114 GI Annotated Anodyne CNS(=O)(=O)c1cccc(C=C2c3ccccc3CCc3ccccc32)c1 ZINC000103263159 GI Annotated Clean Nc1ccc2c(c1)c(OCc1cccc3ccccc13)nn2CCN1CCCC1 ZINC000103263963 GI Annotated Anodyne Cc1ccc2oc(=O)cc(COc3ccccc3I)c2c1 ZINC000103264179 GI Annotated Anodyne Cc1ccc(-c2cc(C(=O)N3C[C@H](CC(C)C)NC(=O)[C@@H]3CC(C)C)no2)cc1 ZINC000103265317 GI Annotated Anodyne O=C1c2ccccc2C(=O)c2c1ccc1nc(SC(=O)N3CCCCC3)[nH]c21 ZINC000103265445 GI Annotated Clean Cc1cccc(-c2nnc([C@H](Cc3ccccc3)N3C(=O)CSC3=S)o2)c1 ZINC000103265669 GI Annotated Clean CC(C)C[C@H]1CN(C(=O)/C=C/c2ccc(Cl)cc2)[C@@H](CC(C)C)C(=O)N1 ZINC000103267089 GI Annotated Anodyne CC(C)C[C@H]1CN(C(=O)/C=C/c2cccc(Cl)c2)[C@@H](CC(C)C)C(=O)N1 ZINC000103267091 GI Annotated Anodyne CC(C)C[C@H]1CN(C(=O)/C=C/c2ccccc2Cl)[C@@H](CC(C)C)C(=O)N1 ZINC000103267093 GI Annotated Anodyne CC(C)C[C@H]1CN(C(=O)c2ccc(-c3ccccc3)o2)[C@@H](CC(C)C)C(=O)N1 ZINC000103267102 GI Annotated Anodyne CC(C)C[C@H]1CN(C(=O)c2csc(-c3ccccc3)n2)[C@@H](CC(C)C)C(=O)N1 ZINC000103267105 GI Annotated Anodyne CC(C)c1ccc(-c2cc(-c3cccs3)n(COCCO)c(=O)c2C#N)cc1 ZINC000103267962 GI Annotated Mild N#Cc1cc2cnc(Nc3cccc4cccnc34)nc2n(C2CCCC2)c1=O ZINC000103269253 GI Annotated Mild O=C1c2cc(OCCO)ccc2COc2cc(Nc3ccc(F)cc3F)ccc21 ZINC000103271958 GI Annotated Anodyne CCOC(=O)/N=c1/sc(Br)cn1-c1cccc(C(F)(F)F)c1 ZINC000103272195 GI Annotated Anodyne CN(C)CC1CSC(C(=O)c2ccccc2)(C(=O)c2ccccc2)SC1 ZINC000103274538 GI Annotated Anodyne CCCCCCCCc1cn(-c2ccc(CCN3CCC(O)CC3)cc2)nn1 ZINC000103275252 GI Annotated Mild CCc1nn(C)c(C(=O)NCc2ccc(Oc3ccc(C)cc3)cc2)c1OC ZINC000103275538 GI Annotated Anodyne CCN(CC)C(=O)c1[nH]c(-c2ccc(Cl)cc2)c(C#N)c1Br ZINC000103275573 GI Annotated Mild CCc1nn(C)c(C(=O)NCc2ccc(Cc3ccc(C)cc3)cc2)c1Cl ZINC000103275612 GI Annotated Anodyne CCc1nn(C)c(C(=O)NCc2ccc(COc3ccc(C)cc3)cc2)c1Cl ZINC000103275617 GI Annotated Anodyne CCCC(CCC)C1=C(Br)c2nc3ccccn3c2C(=O)C1=O ZINC000103275981 GI Annotated Mild COC(=O)[C@]1(c2ccccc2)C(=O)N(C(C)(C)c2cccc(Cl)c2)C=C1C ZINC000103276677 GI Annotated Anodyne COC(=O)[C@@]1(c2ccccc2)C(=O)N(C(C)(C)c2cccc(Cl)c2)C=C1C ZINC000103276679 GI Annotated Anodyne COC(=O)[C@]1(c2ccccc2)C(=O)N(C(C)(C)c2cc(F)cc(F)c2)C=C1C ZINC000103277988 GI Annotated Anodyne COC(=O)[C@@]1(c2ccccc2)C(=O)N(C(C)(C)c2cc(F)cc(F)c2)C=C1C ZINC000103277991 GI Annotated Anodyne O=C(CN1C(=O)C[C@H](C2c3ccccc3-c3ccccc32)C1=O)c1ccccc1 ZINC000103278056 GI Annotated Anodyne O=C(CN1C(=O)C[C@@H](C2c3ccccc3-c3ccccc32)C1=O)c1ccccc1 ZINC000103278058 GI Annotated Anodyne COc1cc(-n2c(-c3ccc(O)c(O)c3)csc2=S)cc(OC)c1OC ZINC000103278342 GI Annotated Clean COc1ccc([C@@H]2N[C@H](c3ccc(OC)cc3)C(C)(C)c3nnsc32)cc1 ZINC000103278523 GI Annotated Anodyne COc1ccc([C@H]2N[C@H](c3ccc(OC)cc3)C(C)(C)c3nnsc32)cc1 ZINC000103278525 GI Annotated Anodyne COc1ccc([C@@H]2N[C@@H](c3ccc(OC)cc3)C(C)(C)c3nnsc32)cc1 ZINC000103278527 GI Annotated Anodyne COc1ccc([C@@H]2N[C@H](c3ccc(OC)cc3)c3snnc3C2(C)C)cc1 ZINC000103278529 GI Annotated Anodyne Cc1cc(=O)c(-c2nnc(Nc3ccccc3)s2)nn1-c1ccccc1Cl ZINC000103282330 GI Annotated Anodyne [O-][N+]1=N[C@@H]2C[C@H]1[C@H]1[C@@H]2[C@@]2(Cl)C(Cl)=C(Cl)[C@]1(Cl)C2(Cl)Cl ZINC000103282638 GI Annotated Anodyne Cc1cc(=O)c(-c2nnc(Nc3ccccc3F)o2)nn1-c1ccccc1Cl ZINC000103284515 GI Annotated Anodyne Cc1ccc(-n2nc(-c3nnc(Nc4ccccc4F)o3)c(=O)cc2C)c(C)c1 ZINC000103284626 GI Annotated Anodyne O=C(c1ccc(Oc2nccnc2N2CCCCC2)cc1)c1nc2ccccc2[nH]1 ZINC000103285377 GI Annotated Anodyne Cc1cc(=O)c(-c2nnc(Nc3ccccc3F)o2)nn1-c1ccc(Cl)cc1 ZINC000103286449 GI Annotated Anodyne CCOC(=O)N1c2ccccc2N(C(=O)OCC)C1CC(=O)c1ccccc1 ZINC000103286493 GI Annotated Anodyne CCOC(=O)N1c2ccccc2N(C(=O)OCC)C1CC(=O)Cc1ccccc1 ZINC000103286556 GI Annotated Anodyne CCCNc1cc2c(cc1[N+](=O)[O-])C(=O)C[C@@H]1[C@]2(C)CCC[C@@]1(C)C(=O)OC ZINC000103287589 GI Annotated Bother Clc1ccc(C2=NO[C@H](c3c[nH]c4ccccc34)[C@@H]2CN2CCOCC2)cc1 ZINC000103287882 GI Annotated Anodyne Clc1ccc(C2=NO[C@@H](c3c[nH]c4ccccc34)[C@@H]2CN2CCOCC2)cc1 ZINC000103287886 GI Annotated Anodyne Clc1ccc(C2=NO[C@H](c3c[nH]c4ccccc34)[C@H]2CN2CCOCC2)cc1 ZINC000103287890 GI Annotated Anodyne Clc1ccc(C2=NO[C@@H](c3c[nH]c4ccccc34)[C@H]2CN2CCOCC2)cc1 ZINC000103287892 GI Annotated Anodyne C[C@@]12CCCC(/C=N/NC(=O)c3cccc(Cl)c3)=C1C(=O)O[C@H]2c1ccoc1 ZINC000103288532 GI Annotated Reactive C[C@@]12CCCC(/C=N/Nc3ccc([N+](=O)[O-])cc3)=C1C(=O)O[C@H]2c1ccoc1 ZINC000103288595 GI Annotated Mild C[C@@]12CCCC(/C=N/Nc3ccccc3[N+](=O)[O-])=C1C(=O)O[C@H]2c1ccoc1 ZINC000103288596 GI Annotated Mild Cc1cccc(C(=O)N/N=C/C2=C3C(=O)O[C@@H](c4ccoc4)[C@]3(C)CCC2)c1 ZINC000103288606 GI Annotated Reactive CCCN(CC)C(=O)c1cn(C)nc1O[C@@H](C)c1cccc(Br)c1 ZINC000103289035 GI Annotated Anodyne CCCN(CC)C(=O)c1cn(C)nc1O[C@H](C)c1cccc(Br)c1 ZINC000103289037 GI Annotated Anodyne Cc1nccn1-c1ccc(NS(=O)(=O)c2cc(Cl)cc(Cl)c2)cc1 ZINC000103290254 GI Annotated Anodyne COC(=O)[C@]1(C)CCC[C@]2(C)c3cc(NC(C)C)c([N+](=O)[O-])cc3C(=O)C[C@H]21 ZINC000103290375 GI Annotated Bother CC1=C2C(=O)O[C@@H](c3ccoc3)[C@]2(C)CC/C1=N\Nc1ccc([N+](=O)[O-])cc1 ZINC000103290946 GI Annotated Mild CC1=C2C(=O)O[C@@H](c3ccoc3)[C@]2(C)CC/C1=N\Nc1ccccc1[N+](=O)[O-] ZINC000103290948 GI Annotated Mild Cc1ccc(C)c(N2CCN(C(=O)c3oc(C)nc3-c3cccc(F)c3)CC2)c1 ZINC000103291400 GI Annotated Anodyne COc1cc2c(c(OC)c1O)CCCC=C2c1cc(OC)c(OC)c(OC)c1 ZINC000103291469 GI Annotated Anodyne COc1cc(C2=CCCCc3c2cc(OC)c(OC)c3O)cc(OC)c1OC ZINC000103291481 GI Annotated Anodyne CC1=C2C(=O)O[C@@H](c3ccoc3)[C@]2(C)CC/C1=N\NC(=O)c1cccc(Cl)c1 ZINC000103292360 GI Annotated Reactive COP(=O)(OC)[C@H](OC(=O)COc1ccc(Cl)cc1)c1ccccc1 ZINC000103292584 GI Annotated Anodyne COP(=O)(OC)[C@@H](OC(=O)COc1ccc(Cl)cc1)c1ccccc1 ZINC000103292586 GI Annotated Anodyne CN(C)C[C@@H]1CCSC(C(=O)c2ccccc2)(C(=O)c2ccccc2)S1 ZINC000103292696 GI Annotated Anodyne COc1cc(OC)c(C2=CCN(C)CC2)c(OC)c1/C=C/C(=O)c1cccs1 ZINC000103294556 GI Annotated Mild CO[P@](=O)(O)[C@H](OC(=O)COc1ccc(Cl)cc1Cl)c1ccco1 ZINC000103295117 GI Annotated Anodyne CO[P@](=O)(O)[C@@H](OC(=O)COc1ccc(Cl)cc1Cl)c1ccco1 ZINC000103295119 GI Annotated Anodyne Cc1noc(C)c1Cn1cc(-c2ccnc(N)n2)c2cc(Br)ccc21 ZINC000103297226 GI Annotated Anodyne COc1ccccc1-c1csc(NS(=O)(=O)c2cccc(Cl)c2)n1 ZINC000103299493 GI Annotated Clean O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccccc2)cc2c1Nc1ccccc1O2 ZINC000103299684 GI Annotated Bother O=[N+]([O-])c1cc(S(=O)(=O)NC2CCCCC2)cc2c1Nc1ccccc1O2 ZINC000103299696 GI Annotated Bother CCN(Cc1ccccn1)c1cccc(C(=O)N2CCc3ccc(O)cc3C2)c1 ZINC000103300984 GI Annotated Anodyne CCN(Cc1cccnc1)c1cccc(C(=O)N2CCc3ccc(O)cc3C2)c1 ZINC000103300986 GI Annotated Anodyne Fc1ccc(CCNc2ccc3nnc(-c4ccc(OC(F)F)cc4)n3n2)cc1 ZINC000103302936 GI Annotated Anodyne FC(F)Oc1ccc(-c2nnc3n2[C@H](CCCc2ccccc2)CNC3)cc1 ZINC000103303068 GI Annotated Anodyne FC(F)Oc1ccc(-c2nnc3n2[C@@H](CCCc2ccccc2)CNC3)cc1 ZINC000103303070 GI Annotated Anodyne C[C@@H]([C@@H](C)O)N1CCC(N(c2ccc(C(F)(F)F)cc2)c2cccnc2)CC1 ZINC000103303278 GI Annotated Anodyne C[C@@H](O)[C@@H](C)N1CCC(N(c2ccc(C(F)(F)F)cc2)c2cccnc2)CC1 ZINC000103303279 GI Annotated Anodyne C[C@H](O)[C@H](C)N1CCC(N(c2ccc(C(F)(F)F)cc2)c2cccnc2)CC1 ZINC000103303281 GI Annotated Anodyne C[C@H](O)[C@@H](C)N1CCC(N(c2ccc(C(F)(F)F)cc2)c2cccnc2)CC1 ZINC000103303283 GI Annotated Anodyne Fc1ccc(Nc2cn3c(-c4ccc(OC(F)F)cc4)nnc3cn2)cc1F ZINC000103303391 GI Annotated Anodyne Fc1ccc(Oc2cn3c(-c4ccc(OC(F)F)cc4)nnc3cn2)cc1F ZINC000103303407 GI Annotated Anodyne Fc1ccc(CCNc2cn3c(-c4ccc(OC(F)F)cc4)nnc3cn2)cc1 ZINC000103303411 GI Annotated Anodyne CC(=O)c1ccc(OCc2cc(C(=O)N3C[C@H]4C[C@@H]5C[C@H](C4)C[C@H]3C5)no2)cc1 ZINC000103342808 GI Annotated Anodyne CCOC(=O)C(/C=N/c1ccc(NC2=NCC(C)(C)S2)cc1)=C(/O)OCC ZINC000103345683 GI Annotated Mild CCOC(=O)C1=C(CC)N=C2CCCC(O)=C2[C@H]1c1ccc(OC)c(OC)c1 ZINC000103351563 GI Annotated Anodyne CCOC(=O)C1=C(CC)N=C2CCCC(O)=C2[C@@H]1c1ccc(OC)c(OC)c1 ZINC000103351566 GI Annotated Anodyne CCOC(=O)C1=C(C)N=C2CCCC(O)=C2[C@@H]1c1coc2ccccc2c1=O ZINC000103351611 GI Annotated Anodyne CCOC(=O)C1=C(C)N=C2CCCC(O)=C2[C@H]1c1coc2ccccc2c1=O ZINC000103351615 GI Annotated Anodyne COCCO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@@H]1c1ccccc1Cl ZINC000103522951 GI Annotated Mild COCCO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@H]1c1ccccc1Cl ZINC000103522953 GI Annotated Mild COc1ccc(-c2cnn3c(O)cc(Cc4ccc(F)cc4C)nc23)c(OC)c1 ZINC000103526012 GI Annotated Anodyne CCC(=O)C[C@@H](c1ccc([N+](=O)[O-])cc1)c1c(O)sc2ccccc2c1=O ZINC000103527114 GI Annotated Bother CCC(=O)C[C@H](c1ccc([N+](=O)[O-])cc1)c1c(O)sc2ccccc2c1=O ZINC000103527118 GI Annotated Bother Cc1ccc(-n2nc(C)c(/C=N/c3ccc(Br)cn3)c2O)cc1C ZINC000103530185 GI Annotated Mild COc1ccc(OC)c([C@@H]2/C(=C(\O)OC3CCCCC3)C(C)=Nc3ncnn32)c1 ZINC000103531175 GI Annotated Anodyne COc1ccc(OC)c([C@H]2/C(=C(\O)OC3CCCCC3)C(C)=Nc3ncnn32)c1 ZINC000103531181 GI Annotated Anodyne CCOc1ccccc1[C@@H]1/C(=C(\O)OC2CCCCC2)C(C)=Nc2ncnn21 ZINC000103531692 GI Annotated Anodyne CCOc1ccccc1[C@H]1/C(=C(\O)OC2CCCCC2)C(C)=Nc2ncnn21 ZINC000103531699 GI Annotated Anodyne CCC[C@@H]1c2[cH-]cnc2C=C[C@H]1C(=O)CC(=O)CCc1ccc(O)c(OC)c1 ZINC000103531708 GI Annotated Anodyne in-vitro biogenic O=S1(=O)C(/C=N/c2cccnc2)=C(O)c2sccc2N1Cc1ccccc1 ZINC000103537077 GI Annotated Mild Cc1ccc(CN2c3ccsc3C(O)=C(/C=N/C(C)C)S2(=O)=O)cc1 ZINC000103537166 GI Annotated Mild Cc1ccccc1-n1c(SCc2c(F)cccc2F)nc2nncc-2c1O ZINC000103538037 GI Annotated Anodyne COc1ccc(-n2c(SCc3ccccc3Cl)nc3nncc-3c2O)cc1 ZINC000103538126 GI Annotated Anodyne CCOc1ccc([C@@H]2C3=C(O)CCCC3=Nc3nc(SC)nn32)cc1OC ZINC000103539535 GI Annotated Anodyne CCOc1ccc([C@H]2C3=C(O)CCCC3=Nc3nc(SC)nn32)cc1OC ZINC000103539536 GI Annotated Anodyne CC1=C(C(=O)N2CCOCC2)[C@H](c2ccc(Cl)cc2)C2=C(O)CCCC2=N1 ZINC000103539729 GI Annotated Anodyne CC1=C(C(=O)N2CCOCC2)[C@@H](c2ccc(Cl)cc2)C2=C(O)CCCC2=N1 ZINC000103539733 GI Annotated Anodyne COc1ccc(CC/N=C/C2=C(O)C[C@@H](c3ccccc3)CC2=O)cc1OC ZINC000103539994 GI Annotated Mild CCO/C(O)=C1\C(C)=Nc2nc(-c3cccs3)nn2[C@H]1c1ccc(C#N)cc1 ZINC000103541842 GI Annotated Mild CCO/C(O)=C1\C(C)=Nc2nc(-c3cccs3)nn2[C@@H]1c1ccc(C#N)cc1 ZINC000103541846 GI Annotated Mild C=CCOC(=O)C1=C(C)N=C2CCCC(O)=C2[C@H]1c1ccc(C(=O)OC)cc1 ZINC000103543420 GI Annotated Mild C=CCOC(=O)C1=C(C)N=C2CCCC(O)=C2[C@@H]1c1ccc(C(=O)OC)cc1 ZINC000103543425 GI Annotated Mild CCO/C(O)=C1\C(CC)=NC2=C(C(=O)CCC2)[C@@H]1c1ccc(OC)cc1OC ZINC000103543526 GI Annotated Mild CCO/C(O)=C1\C(CC)=NC2=C(C(=O)CCC2)[C@H]1c1ccc(OC)cc1OC ZINC000103543530 GI Annotated Mild COCCO/C(O)=C1/C(C)=NC2=C(C(=O)CCC2)[C@@H]1c1ccc(Cl)cc1 ZINC000103543750 GI Annotated Mild COCCO/C(O)=C1/C(C)=NC2=C(C(=O)CCC2)[C@H]1c1ccc(Cl)cc1 ZINC000103543758 GI Annotated Mild COCCO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@@H]1c1ccccc1OC(C)C ZINC000103544457 GI Annotated Mild COCCO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@H]1c1ccccc1OC(C)C ZINC000103544463 GI Annotated Mild COc1ccccc1[C@@H]1C2=C(O)CCCC2=NC(C)=C1C(=O)OC[C@@H]1CCCO1 ZINC000103544863 GI Annotated Anodyne COc1ccccc1[C@H]1C2=C(O)CCCC2=NC(C)=C1C(=O)OC[C@@H]1CCCO1 ZINC000103544877 GI Annotated Anodyne COc1ccccc1[C@@H]1C2=C(O)CCCC2=NC(C)=C1C(=O)OC[C@H]1CCCO1 ZINC000103544884 GI Annotated Anodyne COc1ccccc1[C@H]1C2=C(O)CCCC2=NC(C)=C1C(=O)OC[C@H]1CCCO1 ZINC000103544894 GI Annotated Anodyne COc1cc2c(cc1OC)-c1c(c(C=O)cc3ccc(O)c(OC)c13)/C2=C/O ZINC000103571860 GI Annotated Anodyne in-vitro biogenic CSc1nc2n(n1)[C@H](c1cccc(Br)c1)C1=C(O)CCCC1=N2 ZINC000103579385 GI Annotated Anodyne CSc1nc2n(n1)[C@@H](c1cccc(Br)c1)C1=C(O)CCCC1=N2 ZINC000103579390 GI Annotated Anodyne O=C(NCCc1ccccc1)c1ccc(CSc2nc3cc[nH]cc-3n2)cc1 ZINC000103584647 GI Annotated Anodyne O=S(=O)(Cl)c1cc(OCc2ccccc2)cc(OCc2ccccc2)n1 ZINC000103605182 GI Annotated Unstable O=S(=O)(Cl)c1cc(OCc2ccccc2)nc(OCc2ccccc2)c1 ZINC000103605834 GI Annotated Unstable COC(=O)c1c[nH]n2c(NC3CCCCCC3)c(-c3ccc(OC)cc3)nc12 ZINC000103618810 GI Annotated Anodyne CCOc1cc([C@@H]2C=C(c3cccc(C)c3)Nc3nnnn32)ccc1OC(F)F ZINC000103621960 GI Annotated Anodyne CCOc1cc([C@H]2C=C(c3cccc(C)c3)Nc3nnnn32)ccc1OC(F)F ZINC000103621963 GI Annotated Anodyne Cc1ccc(-n2c(SCc3ccccn3)nc3nnc(C)c-3c2N)cc1Cl ZINC000103623422 GI Annotated Anodyne C/N=c1\c(N/C(O)=N/c2ccccc2C(F)(F)F)c(O)oc2ccccc12 ZINC000103632483 GI Annotated Mild CCC/N=c1\c(/N=C(\O)Cc2ccc(OC)c(OC)c2)c(O)oc2ccccc12 ZINC000103636775 GI Annotated Mild CC1=N[C@]2(C)C[C@H](/C1=C(\O)OCc1ccc3c(c1)OCO3)c1ccccc1O2 ZINC000103638278 GI Annotated Anodyne CC1=C(C(=O)N2CCOCC2)[C@H](c2ccccc2Cl)C2=C(O)CCCC2=N1 ZINC000103646555 GI Annotated Anodyne CC1=C(C(=O)N2CCOCC2)[C@@H](c2ccccc2Cl)C2=C(O)CCCC2=N1 ZINC000103646561 GI Annotated Anodyne CCC/N=c1\c(N/C(O)=N/c2ccc(OC)c(OC)c2)c(O)oc2ccccc12 ZINC000103654861 GI Annotated Mild CCC/N=c1\c(N/C(O)=N/c2ccc(OC)cc2OC)c(O)oc2ccccc12 ZINC000103655226 GI Annotated Mild CCC/N=c1\c(N/C(O)=N/c2cc(OC)cc(OC)c2)c(O)oc2ccccc12 ZINC000103655286 GI Annotated Mild COc1ccc(CN(C)Cc2cc(O)n3nc(-c4cccc(C)c4)cc3n2)cc1 ZINC000103657037 GI Annotated Anodyne CC/N=c1\c(/N=C(\O)c2ccccc2Br)c(O)oc2ccccc12 ZINC000103667779 GI Annotated Anodyne CO/C(O)=C1/C(C)=Nc2nc3ccccc3n2[C@@H]1c1ccc(OC)c(OC)c1 ZINC000103683502 GI Annotated Anodyne CO/C(O)=C1/C(C)=Nc2nc3ccccc3n2[C@H]1c1ccc(OC)c(OC)c1 ZINC000103683506 GI Annotated Anodyne COc1ccc(/N=C(\O)CCc2c(C)nn(-c3ccc(F)cc3)c2O)cc1OC ZINC000103699723 GI Annotated Mild CCC/N=c1\c(NC(=O)c2ccc(Br)o2)c(O)oc2ccccc12 ZINC000103705690 GI Annotated Anodyne C=C(C)COC1=CC(=O)/C(=C2\N=CNC(C(F)(F)F)=C2c2ccccc2)C=C1 ZINC000103726847 GI Annotated Mild COc1ccc(Cc2[nH]n3c(=O)c4c(nc3c2-c2ccccc2)CCCC4)cc1 ZINC000103746514 GI Annotated Anodyne O[C@@H](c1cccc(OCc2ccccc2)c1)c1n[nH]/c(=N/c2ccccc2)s1 ZINC000103774745 GI Annotated Anodyne C/C(NOCc1ccccc1)=C1\C(=O)C=C(C(C)C)N(c2ccccc2)C1=O ZINC000103821333 GI Annotated Mild CO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@@H]1c1ccc(Br)s1 ZINC000103868178 GI Annotated Mild CO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@H]1c1ccc(Br)s1 ZINC000103868185 GI Annotated Mild CCON/C(C)=C1/C(=O)C(CC)=C(c2ccccc2)N(c2ccccc2)C1=O ZINC000103871732 GI Annotated Mild CO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@@H]1c1ccccc1Br ZINC000103895422 GI Annotated Anodyne CO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@H]1c1ccccc1Br ZINC000103895427 GI Annotated Anodyne CC1=C(C(=O)N2CCOCC2)[C@H](c2ccc(F)cc2)C2=C(O)CC(C)(C)CC2=N1 ZINC000103897109 GI Annotated Anodyne CC1=C(C(=O)N2CCOCC2)[C@@H](c2ccc(F)cc2)C2=C(O)CC(C)(C)CC2=N1 ZINC000103897113 GI Annotated Anodyne CCOc1ccccc1N1C(=O)[C@H]2[C@@H]3C(Cl)=C[C@H](c4ccccc43)[C@H]2C1=O ZINC000103907973 GI Annotated Anodyne CCOc1ccccc1N1C(=O)[C@H]2[C@@H]3C=C(Cl)[C@H](c4ccccc43)[C@@H]2C1=O ZINC000103907977 GI Annotated Anodyne COC1=C/C(=C/C(C(=O)c2cccs2)=C2Nc3ccccc3N2)C=CC1=O ZINC000103916189 GI Annotated Mild COC1=CC(=O)/C(=C2\C(c3csc(C)n3)=C(C)NN2c2ccccc2C)C=C1 ZINC000103917827 GI Annotated Mild CCO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@H]1c1cc(OC)c(O)cc1Cl ZINC000103931780 GI Annotated Anodyne CCO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@@H]1c1cc(OC)c(O)cc1Cl ZINC000103931786 GI Annotated Anodyne CCO/C(O)=C1\C(C)=NC(S)=N[C@H]1c1c(OC)ccc2ccc(OC)cc12 ZINC000103935304 GI Annotated Anodyne CCO/C(O)=C1\C(C)=NC(S)=N[C@@H]1c1c(OC)ccc2ccc(OC)cc12 ZINC000103935307 GI Annotated Anodyne COc1ccc([C@@H]2/C(=C(\O)OC3CCCCC3)C(C)=Nc3ncnn32)c(OC)c1 ZINC000103943417 GI Annotated Anodyne COc1ccc([C@H]2/C(=C(\O)OC3CCCCC3)C(C)=Nc3ncnn32)c(OC)c1 ZINC000103943419 GI Annotated Anodyne COc1ccc([C@@H]2/C(=C(\O)OC3CCCCC3)C(C)=Nc3ncnn32)cc1OC ZINC000103943484 GI Annotated Anodyne COc1ccc([C@H]2/C(=C(\O)OC3CCCCC3)C(C)=Nc3ncnn32)cc1OC ZINC000103943488 GI Annotated Anodyne COc1ccc([C@H]2C3=C(O)CCCC3=Nc3nc(SC)nc(O)c32)cc1OC ZINC000103954172 GI Annotated Anodyne COc1ccc([C@@H]2C3=C(O)CCCC3=Nc3nc(SC)nc(O)c32)cc1OC ZINC000103954178 GI Annotated Anodyne CCSc1nc(O)c2c(n1)N=C1CCCC(O)=C1[C@H]2c1ccc([N+](=O)[O-])cc1 ZINC000103954564 GI Annotated Anodyne CCSc1nc(O)c2c(n1)N=C1CCCC(O)=C1[C@@H]2c1ccc([N+](=O)[O-])cc1 ZINC000103954569 GI Annotated Anodyne O=C(COc1cccc(Br)c1)/N=N/c1c(O)[nH]c2ccc(F)cc12 ZINC000103960919 GI Annotated Clean COc1ccc([C@H]2C3=C(O)CC(C)(C)CC3=Nc3nc(S)nc(O)c32)cc1 ZINC000103962065 GI Annotated Anodyne COc1ccc([C@@H]2C3=C(O)CC(C)(C)CC3=Nc3nc(S)nc(O)c32)cc1 ZINC000103962068 GI Annotated Anodyne Cc1ccc(S(=O)(=O)/N=N/c2c(O)[nH]c3ccc(Br)cc23)cc1 ZINC000103966392 GI Annotated Clean CCOc1ccccc1-n1c(SCc2ccccc2F)nc2nncc-2c1O ZINC000103969932 GI Annotated Anodyne COc1ccc(OC)c(-c2cc(C(=O)/N=N/c3c(O)[nH]c4ccccc34)[nH]n2)c1 ZINC000103970381 GI Annotated Clean O=C(/N=N/c1c(O)[nH]c2ccccc12)C(=O)Nc1cc(Cl)ccc1Cl ZINC000103977914 GI Annotated Clean CO/C(O)=C1\C(C)=NC2=C(C(=O)CC(C)(C)C2)[C@@H]1c1cc(OC)ccc1OC ZINC000103992440 GI Annotated Mild CO/C(O)=C1\C(C)=NC2=C(C(=O)CC(C)(C)C2)[C@H]1c1cc(OC)ccc1OC ZINC000103992445 GI Annotated Mild CO/C(O)=C1\C(C)=NC2=C(C(=O)CC(C)(C)C2)[C@@H]1c1cc(OC)cc(OC)c1 ZINC000103993061 GI Annotated Mild CO/C(O)=C1\C(C)=NC2=C(C(=O)CC(C)(C)C2)[C@H]1c1cc(OC)cc(OC)c1 ZINC000103993068 GI Annotated Mild CO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@@H]1c1cc(Cl)c(O)c(OC)c1 ZINC000103993385 GI Annotated Mild CO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@H]1c1cc(Cl)c(O)c(OC)c1 ZINC000103993388 GI Annotated Mild CCO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@H]1c1cc(Cl)c(O)c(OC)c1 ZINC000103993392 GI Annotated Mild CCO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@@H]1c1cc(Cl)c(O)c(OC)c1 ZINC000103993397 GI Annotated Mild COc1ccc([C@@H]2C3=C(O)CCCC3=NC(C)=C2C(=O)OC(C)C)c(OC)c1 ZINC000103996444 GI Annotated Anodyne COc1ccc([C@H]2C3=C(O)CCCC3=NC(C)=C2C(=O)OC(C)C)c(OC)c1 ZINC000103996451 GI Annotated Anodyne CC1=NC2=C(C(=O)CC(C)(C)C2)[C@H](c2ccccn2)/C1=C(/O)OCCOC(C)C ZINC000103998121 GI Annotated Mild CC1=NC2=C(C(=O)CC(C)(C)C2)[C@@H](c2ccccn2)/C1=C(/O)OCCOC(C)C ZINC000103998127 GI Annotated Mild O=C1CCCC2=C1[C@H](c1cc([N+](=O)[O-])ccc1O)C1=C(O)c3ccccc3C1=N2 ZINC000104001700 GI Annotated Mild O=C1CCCC2=C1[C@@H](c1cc([N+](=O)[O-])ccc1O)C1=C(O)c3ccccc3C1=N2 ZINC000104001706 GI Annotated Mild C=C(C)COC1=CC(=O)/C(=C2\NC=NC=C2c2ccc(Br)cc2)C=C1 ZINC000104004071 GI Annotated Mild CC1=NC2=C(C(=O)CCC2)[C@H](c2ccc(O)cc2)/C1=C(/O)OCCOC(C)C ZINC000104004754 GI Annotated Mild CC1=NC2=C(C(=O)CCC2)[C@@H](c2ccc(O)cc2)/C1=C(/O)OCCOC(C)C ZINC000104004758 GI Annotated Mild CCCOCCO/C(O)=C1/C(C)=NC2=C(C(=O)CC(C)(C)C2)[C@H]1c1ccncc1 ZINC000104006643 GI Annotated Mild CCCOCCO/C(O)=C1/C(C)=NC2=C(C(=O)CC(C)(C)C2)[C@@H]1c1ccncc1 ZINC000104006649 GI Annotated Mild CO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@@H]1c1coc2ccc(Cl)cc2c1=O ZINC000104006672 GI Annotated Mild CO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@H]1c1coc2ccc(Cl)cc2c1=O ZINC000104006676 GI Annotated Mild CCO/C(O)=C1\C(C)=NC2=C(C(=O)CC(C)(C)C2)[C@H]1c1ccc2c(c1)OCCO2 ZINC000104007201 GI Annotated Mild CCO/C(O)=C1\C(C)=NC2=C(C(=O)CC(C)(C)C2)[C@@H]1c1ccc2c(c1)OCCO2 ZINC000104007204 GI Annotated Mild O=C1C=CC(Cl)=C/C1=C1\C=C(C(F)(F)C(F)F)NC(c2ccccc2)=N1 ZINC000104016202 GI Annotated Mild COC(=O)c1ccc([C@@H]2C3=C(CCCC3=O)N=C3C2=C(O)c2ccccc23)cc1 ZINC000104016918 GI Annotated Mild COC(=O)c1ccc([C@H]2C3=C(CCCC3=O)N=C3C2=C(O)c2ccccc23)cc1 ZINC000104016926 GI Annotated Mild CC1=CC=C/C(=C\Nc2sc3c(c2C(=O)OC(C)(C)C)CCN(C)C3)C1=O ZINC000104020123 GI Annotated Mild CC1=CC(=O)/C(=C/Nc2sc3c(c2C(=O)OC(C)(C)C)CCN(C)C3)C=C1 ZINC000104020795 GI Annotated Mild CCOC(=O)c1c(N/C=C2\C(=O)C=Cc3ccccc32)sc(C(C)=O)c1C ZINC000104024826 GI Annotated Mild CCOc1cc([C@H]2C(C(=O)OC)=C(C)N=C3C2=C(O)c2ccccc23)ccc1O ZINC000104027346 GI Annotated Anodyne CCOc1cc([C@@H]2C(C(=O)OC)=C(C)N=C3C2=C(O)c2ccccc23)ccc1O ZINC000104027350 GI Annotated Anodyne CSc1nc2n(n1)[C@@H](c1ccc([N+](=O)[O-])cc1)C1=C(O)CC(C)(C)CC1=N2 ZINC000104038764 GI Annotated Bother CSc1nc2n(n1)[C@H](c1ccc([N+](=O)[O-])cc1)C1=C(O)CC(C)(C)CC1=N2 ZINC000104038770 GI Annotated Bother COc1ccc(OC)c([C@H]2C3=C(O)CCCC3=Nc3nc(SC)nc(O)c32)c1 ZINC000104038936 GI Annotated Anodyne COc1ccc(OC)c([C@@H]2C3=C(O)CCCC3=Nc3nc(SC)nc(O)c32)c1 ZINC000104038942 GI Annotated Anodyne O=C1[C@@H]2CCCN2[C@H](c2ccc(Br)cc2)N1c1ccc(F)cc1 ZINC000104039799 GI Annotated Anodyne O=C1[C@@H]2CCCN2[C@H](c2cccc(Br)c2)N1c1ccc(F)cc1 ZINC000104041781 GI Annotated Anodyne COc1cc([C@H]2C3=C(O)CC(C)(C)CC3=Nc3ncnn32)ccc1OC(F)F ZINC000104059873 GI Annotated Anodyne COc1cc([C@@H]2C3=C(O)CC(C)(C)CC3=Nc3ncnn32)ccc1OC(F)F ZINC000104059878 GI Annotated Anodyne CCO/C(O)=C1/C(C)=Nc2ncnn2[C@H]1c1cc(Cl)ccc1OC(F)F ZINC000104060008 GI Annotated Anodyne CCO/C(O)=C1/C(C)=Nc2ncnn2[C@@H]1c1cc(Cl)ccc1OC(F)F ZINC000104060013 GI Annotated Anodyne CSc1ccc([C@@H]2/C(=C(\O)OC3CCCCC3)C(C)=Nc3nnnn32)cc1 ZINC000104060163 GI Annotated Anodyne CSc1ccc([C@H]2/C(=C(\O)OC3CCCCC3)C(C)=Nc3nnnn32)cc1 ZINC000104060169 GI Annotated Anodyne COc1ccc(OC)c([C@@H]2C3=C(O)CCCC3=NC(C)=C2C(=O)OC(C)C)c1 ZINC000104070852 GI Annotated Anodyne COc1ccc(OC)c([C@H]2C3=C(O)CCCC3=NC(C)=C2C(=O)OC(C)C)c1 ZINC000104070858 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2C3=C(O)CCCC3=NC(C)=C2C(=O)OC(C)C)cc1 ZINC000104074254 GI Annotated Anodyne COC(=O)c1ccc([C@H]2C3=C(O)CCCC3=NC(C)=C2C(=O)OC(C)C)cc1 ZINC000104074257 GI Annotated Anodyne CC1=C(C(=O)OC[C@@H]2CCCO2)[C@H](c2cccnc2)C2=C(O)CC(C)(C)CC2=N1 ZINC000104075670 GI Annotated Anodyne CC1=C(C(=O)OC[C@@H]2CCCO2)[C@@H](c2cccnc2)C2=C(O)CC(C)(C)CC2=N1 ZINC000104075674 GI Annotated Anodyne CC1=C(C(=O)OC[C@H]2CCCO2)[C@H](c2cccnc2)C2=C(O)CC(C)(C)CC2=N1 ZINC000104075678 GI Annotated Anodyne CC1=C(C(=O)OC[C@H]2CCCO2)[C@@H](c2cccnc2)C2=C(O)CC(C)(C)CC2=N1 ZINC000104075683 GI Annotated Anodyne CC1=C(C(=O)OC[C@@H]2CCCO2)[C@H](c2ccccn2)C2=C(O)CC(C)(C)CC2=N1 ZINC000104076652 GI Annotated Anodyne CC1=C(C(=O)OC[C@@H]2CCCO2)[C@@H](c2ccccn2)C2=C(O)CC(C)(C)CC2=N1 ZINC000104076655 GI Annotated Anodyne CC1=C(C(=O)OC[C@H]2CCCO2)[C@H](c2ccccn2)C2=C(O)CC(C)(C)CC2=N1 ZINC000104076660 GI Annotated Anodyne CC1=C(C(=O)OC[C@H]2CCCO2)[C@@H](c2ccccn2)C2=C(O)CC(C)(C)CC2=N1 ZINC000104076663 GI Annotated Anodyne C=CCO/C(O)=C1\C(C)=NC(SCC)=C(C#N)[C@@H]1c1ccc(O)c(OC)c1 ZINC000104087857 GI Annotated Reactive C=CCO/C(O)=C1\C(C)=NC(SCC)=C(C#N)[C@H]1c1ccc(O)c(OC)c1 ZINC000104087861 GI Annotated Reactive Cc1ccc(C(=O)Oc2ccccc2N2C(=O)[C@H]3CC[C@H](C)C[C@H]3C2=O)cc1 ZINC000104096877 GI Annotated Anodyne O=[N+]([O-])c1ccc(-n2nc(C(F)(F)F)c(/C=N/C3CCCCC3)c2O)cc1 ZINC000104103103 GI Annotated Mild CCCCO/C(O)=C1/C(C)=Nc2ncnn2[C@H]1c1cccc(Br)c1 ZINC000104115559 GI Annotated Anodyne CCCCO/C(O)=C1/C(C)=Nc2ncnn2[C@@H]1c1cccc(Br)c1 ZINC000104115564 GI Annotated Anodyne CCCCO/C(O)=C1/C(C)=Nc2ncnn2[C@H]1c1ccc(Br)cc1 ZINC000104115678 GI Annotated Anodyne CCCCO/C(O)=C1/C(C)=Nc2ncnn2[C@@H]1c1ccc(Br)cc1 ZINC000104115683 GI Annotated Anodyne CCCCO/C(O)=C1/C(C)=Nc2ncnn2[C@H]1c1ccccc1OC(F)F ZINC000104115907 GI Annotated Anodyne CCCCO/C(O)=C1/C(C)=Nc2ncnn2[C@@H]1c1ccccc1OC(F)F ZINC000104115912 GI Annotated Anodyne CCCCCCCO/C(O)=C1\C(C)=Nc2nnnn2[C@H]1c1ccc(OC)cc1 ZINC000104116019 GI Annotated Mild CCCCCCCO/C(O)=C1\C(C)=Nc2nnnn2[C@@H]1c1ccc(OC)cc1 ZINC000104116024 GI Annotated Mild CCN(CC)CCSc1nc(=O)c(-c2ccccc2)c(O)n1-c1ccccc1 ZINC000104273801 GI Annotated Anodyne COC(=O)[C@@]1(OC(C)=O)C[C@]23CC[C@@H]4[C@@](C)(C=O)CCC[C@]4(C)[C@@H]2CC[C@@H]1C3 ZINC000104361056 GI Annotated Mild in-man COC(=O)[C@]1(OC(C)=O)C[C@]23CC[C@@H]4[C@@](C)(C=O)CCC[C@]4(C)[C@@H]2CC[C@@H]1C3 ZINC000104361061 GI Annotated Mild in-man CN(C)c1ccc([C@H]2C3=C(O)CC(C)(C)CC3=Nc3nc(S)nc(N)c32)cc1 ZINC000104689658 GI Annotated Anodyne CN(C)c1ccc([C@@H]2C3=C(O)CC(C)(C)CC3=Nc3nc(S)nc(N)c32)cc1 ZINC000104689660 GI Annotated Anodyne COC(=O)[C@@]1(/C=C2/c3ccc(F)cc3[C@@H](OC)[C@@H]2C)[C@@H]2Oc3ccccc3[C@@H]21 ZINC000104691693 GI Annotated Anodyne CC/C=C1\C(=O)[C@@]2(C(=O)c3ccccc3)C[C@H]3CC[C@@](CCC)(C2=O)[C@@]13OC ZINC000104691887 GI Annotated Mild COc1ccc([C@@H]2CC(=O)C(/C=N/c3ccc(OC)c(OC)c3)=C(O)C2)cc1 ZINC000104693312 GI Annotated Mild CCN(CC)C(=O)c1ccc(/N=C/c2c(C)nn(-c3ccc(C)cc3)c2O)cc1 ZINC000104694674 GI Annotated Mild CCCc1nn(-c2ccc(F)cc2)c(O)c1/C=N/Cc1ccc2c(c1)OCO2 ZINC000104702774 GI Annotated Mild Cc1ccccc1NC(=O)CSc1n[nH]c2c3cc(Cl)ccc3nc-2n1 ZINC000104996323 GI Annotated Anodyne CC[C@@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@@H](C)C2)nc1-c1ccccc1F ZINC000105179411 GI Annotated Anodyne CC[C@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@@H](C)C2)nc1-c1ccccc1F ZINC000105179417 GI Annotated Anodyne CC[C@@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@H](C)C2)nc1-c1ccccc1F ZINC000105179422 GI Annotated Anodyne CC[C@H](Br)[C@H]1CC=CC[C@@H]2O[C@H](C=C=CBr)C[C@@H]2O1 ZINC000105395527 GI Annotated Reactive COc1ccc([C@@H]2[C@@H]3CCC[C@H](C3=O)[C@@H](c3ccc(OC)cc3)N2N=O)cc1 ZINC000105481803 GI Annotated Anodyne COc1ccc([C@@H]2[C@H]3CCC[C@@H](C3=O)[C@@H](c3ccc(OC)cc3)N2N=O)cc1 ZINC000105481808 GI Annotated Anodyne O=C1[C@H]2c3[nH]c4ccccc4c3[C@H]3CCSC[C@H]3[C@@H]2C(=O)N1c1ccccc1 ZINC000105482390 GI Annotated Anodyne CCc1cccc([C@H](C)CC)c1NC(=O)C[C@H]1C(=O)Nc2ccccc2[S@@]1=O ZINC000105490137 GI Annotated Anodyne COc1cccc(N2C(=O)[C@@H]3c4[nH]c5ccccc5c4[C@@H]4CCC[C@@H]4[C@H]3C2=O)c1 ZINC000105514621 GI Annotated Anodyne CCCCCCCCCCCC[C@@H]1NC(=N)N[C@@]2(CCCO2)[C@H]1C(=O)OC ZINC000105517724 GI Annotated Mild C[C@@H]1[C@H](c2ccc3c(c2)OCO3)c2cc3c(cc2O[C@H]1N1CCCCC1)OCO3 ZINC000105518548 GI Annotated Anodyne CC[C@@H]1[C@H](c2cccc(OC)c2O)c2cc3c(cc2O[C@H]1N1CCCC1)OCO3 ZINC000105518573 GI Annotated Anodyne C[C@@H]1[C@H](c2ccc(N(C)C)cc2)c2cc3c(cc2O[C@H]1N1CCCC1)OCO3 ZINC000105518632 GI Annotated Anodyne O=C1c2ccccc2NC(=O)[C@@H]2[C@@H]1[C@@H](c1ccccc1)C[C@]2(O)c1ccccc1 ZINC000105520103 GI Annotated Anodyne COc1cccc([C@@H]2c3cc4c(cc3O[C@@H](N3CCCCC3)[C@H]2C)OCO4)c1O ZINC000105520989 GI Annotated Anodyne COc1cccc([C@@H]2c3cc4c(cc3O[C@@H](N3CCCCC3)[C@@H]2C)OCO4)c1O ZINC000105520992 GI Annotated Anodyne N#Cc1ccc([C@@H]2NN=C[C@@]23C(=O)c2ccccc2O[C@@H]3c2ccccc2)cc1 ZINC000105525277 GI Annotated Mild N#Cc1ccc([C@@H]2NN=C[C@]23C(=O)c2ccccc2O[C@@H]3c2ccccc2)cc1 ZINC000105525280 GI Annotated Mild N#Cc1ccc([C@@H]2NN=C[C@@]23C(=O)c2ccccc2O[C@H]3c2ccccc2)cc1 ZINC000105525282 GI Annotated Mild N#Cc1ccc([C@@H]2NN=C[C@]23C(=O)c2ccccc2O[C@H]3c2ccccc2)cc1 ZINC000105525284 GI Annotated Mild C/C=C(/C)C(=O)O[C@@H]1C[C@H](C)[C@@H]2CC(=O)C(C)=C2C[C@@H]1C(C)(C)OC(C)=O ZINC000106839256 GI Annotated Mild O=C(O)c1cccc(/C=C2/C[C@@H]3[C@H](C[C@H](O)[C@@H]3/C=C\[C@H](O)C3CCCCC3)O2)c1 ZINC000111389988 GI Annotated Anodyne O=C(O)c1cccc(/C=C2\C[C@@H]3[C@H](C[C@H](O)[C@@H]3/C=C\[C@H](O)C3CCCCC3)O2)c1 ZINC000111389991 GI Annotated Anodyne O=C(O)c1cccc(/C=C2/C[C@@H]3[C@H](C[C@H](O)[C@@H]3/C=C/[C@H](O)C3CCCCC3)O2)c1 ZINC000111389993 GI Annotated Anodyne Cc1ccc(-c2ccn(-c3ccc4c5c(n(C)c4c3)C[C@@H]3CC[C@@H]5N3)c(=O)c2)cn1 ZINC000113221811 GI Annotated Anodyne Cc1ccc(-c2ccn(-c3ccc4c5c(n(C)c4c3)C[C@@H]3CC[C@H]5N3)c(=O)c2)cn1 ZINC000113221813 GI Annotated Anodyne Cc1ccc(-c2ccn(-c3ccc4c5c(n(C)c4c3)C[C@H]3CC[C@@H]5N3)c(=O)c2)cn1 ZINC000113221815 GI Annotated Anodyne Cc1ccc(-c2ccn(-c3ccc4c5c(n(C)c4c3)C[C@H]3CC[C@H]5N3)c(=O)c2)cn1 ZINC000113221817 GI Annotated Anodyne CC(=O)N[C@@H](C)Cc1ccc(C#Cc2cnc(-c3ccc(Cl)cc3)cn2)cc1 ZINC000113409392 GI Annotated Mild CC(=O)N[C@H](C)Cc1ccc(C#Cc2cnc(-c3ccc(Cl)cc3)cn2)cc1 ZINC000113409393 GI Annotated Mild CCOc1ccc(C#Cc2ccc(C[C@@H](C)NC(=O)c3cncs3)cc2)cc1 ZINC000113411426 GI Annotated Mild CCOc1ccc(C#Cc2ccc(C[C@H](C)NC(=O)c3cncs3)cc2)cc1 ZINC000113411428 GI Annotated Mild CC(=O)N[C@@H](C)Cc1ccc(C#Cc2ccc(-c3ccc(Cl)cc3)nn2)cc1 ZINC000113411521 GI Annotated Mild CC(=O)N[C@H](C)Cc1ccc(C#Cc2ccc(-c3ccc(Cl)cc3)nn2)cc1 ZINC000113411524 GI Annotated Mild CCOc1ccc(C#Cc2ccc(C[C@@H](C)NC(=O)c3ocnc3C)cc2)cc1 ZINC000113411572 GI Annotated Mild CCOc1ccc(C#Cc2ccc(C[C@H](C)NC(=O)c3ocnc3C)cc2)cc1 ZINC000113411575 GI Annotated Mild COc1cccc(-c2cn(C)c(CSc3nc4cc(C)cc(C)n4n3)n2)c1 ZINC000113421381 GI Annotated Anodyne COc1ccc(-c2cn(C)c(CSc3nc4cc(C)cc(C)n4n3)n2)cc1 ZINC000113421420 GI Annotated Anodyne COc1ccccc1-c1cn(C)c(CSc2nc3cc(C)cc(C)n3n2)n1 ZINC000113422559 GI Annotated Anodyne COc1cccc(-c2cn(C)c(SCc3cn4c(C)cc(C)nc4n3)n2)c1 ZINC000113423616 GI Annotated Anodyne NC(=O)c1ccc2nc(-c3ccc(C4(N)CCC4)cc3)c(-c3ccccc3)n2c1 ZINC000113654034 GI Annotated Anodyne NC(=O)c1cccn2c(-c3ccccc3)c(-c3ccc(C4(N)CCC4)cc3)nc12 ZINC000113654680 GI Annotated Anodyne Cc1cc(C(N)=O)c2nc(-c3ccc(C4(N)CCC4)cc3)c(-c3ccccc3)n2c1 ZINC000113654748 GI Annotated Anodyne NC(=O)Nc1ccn2c(-c3ccccc3)c(-c3ccc(C4(N)CCC4)cc3)nc2c1 ZINC000113655805 GI Annotated Anodyne NC1(c2ccc(-c3nc4cc(C(=O)NO)ccn4c3-c3ccccc3)cc2)CCC1 ZINC000113656408 GI Annotated Anodyne NC1(c2ccc(-c3nc4ccc(C(=O)NO)cn4c3-c3ccccc3)cc2)CCC1 ZINC000113656477 GI Annotated Anodyne CNC(=O)c1ccc2nc(-c3ccc(C4(N)CCC4)cc3)c(-c3ccccc3)n2c1 ZINC000113656940 GI Annotated Anodyne Cc1cc(C(N)=O)cn2c(-c3ccccc3)c(-c3ccc(C4(N)CCC4)cc3)nc12 ZINC000113657628 GI Annotated Anodyne CNC(=O)c1ccn2c(-c3ccccc3)c(-c3ccc(C4(N)CCC4)cc3)nc2c1 ZINC000113678748 GI Annotated Anodyne CC(C)(C)C#Cc1cc(N2C(=O)COC[C@H]2C2CCCCC2)c(C(=O)O)s1 ZINC000113826680 GI Annotated Anodyne O=C(O)c1cc(C2CC2)ccc1Nc1cnc(-c2c(F)cc(O)cc2F)nc1 ZINC000113898729 GI Annotated Anodyne ClC1=C(Cl)[C@]2(Cl)[C@H]3[C@@H]([C@H](Cl)[C@@H]4O[C@H]34)[C@]1(Cl)C2(Cl)Cl ZINC000113904624 GI Annotated Reactive ClC1=C(Cl)[C@]2(Cl)[C@H]3[C@@H]([C@@H](Cl)[C@@H]4O[C@H]34)[C@]1(Cl)C2(Cl)Cl ZINC000113904626 GI Annotated Reactive ClC1=C(Cl)[C@]2(Cl)[C@H]3[C@@H]([C@H](Cl)[C@H]4O[C@@H]43)[C@]1(Cl)C2(Cl)Cl ZINC000113904628 GI Annotated Reactive ClC1=C(Cl)[C@]2(Cl)[C@H]3[C@@H]([C@@H](Cl)[C@H]4O[C@@H]43)[C@]1(Cl)C2(Cl)Cl ZINC000113904629 GI Annotated Reactive CCc1ccc([C@@H]2C[C@H](NC(=O)C(C)(C)C)CN(C(=O)C3CCCC3)C2)cc1 ZINC000113934371 GI Annotated Anodyne CCc1ccc([C@H]2C[C@H](NC(=O)C(C)(C)C)CN(C(=O)C3CCCC3)C2)cc1 ZINC000113934374 GI Annotated Anodyne CCc1ccc([C@@H]2C[C@@H](NC(=O)C(C)(C)C)CN(C(=O)C3CCCC3)C2)cc1 ZINC000113934375 GI Annotated Anodyne CCc1ccc([C@H]2C[C@@H](NC(=O)C(C)(C)C)CN(C(=O)C3CCCC3)C2)cc1 ZINC000113934376 GI Annotated Anodyne O=c1ccn(-c2cccc(C(F)(F)F)c2)nc1-c1ccnn1-c1ccccc1 ZINC000114006401 GI Annotated Anodyne in-vitro COc1cc(NS(=O)(=O)c2ccccn2)ccc1-c1cncc2ccccc12 ZINC000114026639 GI Annotated Anodyne CS(=O)(=O)Nc1ccc(-c2cncc3ccccc23)c(OCC(F)(F)F)c1 ZINC000114028237 GI Annotated Anodyne CS(=O)(=O)Nc1ccc(-c2cncc3ccccc23)c(OC(F)(F)F)c1 ZINC000114029334 GI Annotated Anodyne COc1ccc(-c2nn3c(-c4cnc(N)c(C(F)(F)F)c4)cnc3s2)cc1 ZINC000114041248 GI Annotated Anodyne CC(C)CN(Cc1ccc2c(c1)OCCCO2)C(=O)CCNCc1ccccc1 ZINC000114099625 GI Annotated Anodyne CC(C)CN(Cc1ccc2c(c1)OCCCO2)C(=O)[C@H](C)NCc1ccccc1 ZINC000114100449 GI Annotated Anodyne CC(C)CN(Cc1ccc2c(c1)OCCCO2)C(=O)[C@@H](C)NCc1ccccc1 ZINC000114100733 GI Annotated Anodyne CC(C)CN(Cc1cc(Cl)c2c(c1)OCCCO2)C(=O)CC[C@@H]1CCCN1 ZINC000114100735 GI Annotated Anodyne CC(C)CN(Cc1cc(Cl)c2c(c1)OCCCO2)C(=O)CC[C@H]1CCCN1 ZINC000114100737 GI Annotated Anodyne COc1ccc(S(=O)(=O)n2ccc3cccc(-c4ccc(C#N)cc4)c32)cc1 ZINC000114320310 GI Annotated Mild CCc1ccc([C@@H]2C[C@H](NC(=O)NC(C)(C)C)CN(C(=O)C3CCCC3)C2)cc1 ZINC000114341266 GI Annotated Anodyne CCc1ccc([C@H]2C[C@H](NC(=O)NC(C)(C)C)CN(C(=O)C3CCCC3)C2)cc1 ZINC000114341268 GI Annotated Anodyne CCc1ccc([C@@H]2C[C@@H](NC(=O)NC(C)(C)C)CN(C(=O)C3CCCC3)C2)cc1 ZINC000114341270 GI Annotated Anodyne CCc1ccc([C@H]2C[C@@H](NC(=O)NC(C)(C)C)CN(C(=O)C3CCCC3)C2)cc1 ZINC000114341272 GI Annotated Anodyne Cc1ccnc(Nc2cccc([C@@H](C)Nc3ncnc4c(C(N)=O)cccc34)c2)c1 ZINC000114346604 GI Annotated Anodyne Cc1ccnc(Nc2cccc([C@H](C)Nc3ncnc4c(C(N)=O)cccc34)c2)c1 ZINC000114346606 GI Annotated Anodyne Nc1cnc(-c2ccc3c(c2)CN2CCC3(c3ccc(Cl)cc3)CC2)cn1 ZINC000114347781 GI Annotated Anodyne O=c1ccccn1-c1ccc2c(c1)CN1CCC2(c2ccc(Cl)cc2)CC1 ZINC000114348492 GI Annotated Anodyne Nc1cnc(Oc2ccc3c(c2)CN2CCC3(c3ccc(Cl)cc3)CC2)cn1 ZINC000114349453 GI Annotated Anodyne COc1cc2sc(-c3c(-c4cccnc4Cl)n[nH]c3N)nc2cc1F ZINC000114400276 GI Annotated Anodyne NC(=O)c1ccc(-c2cc3c(cc2F)[C@H](c2ccc(Cl)cc2)CNC3)cc1 ZINC000114516602 GI Annotated Anodyne NC(=O)c1ccc(-c2cc3c(cc2F)[C@@H](c2ccc(Cl)cc2)CNC3)cc1 ZINC000114516604 GI Annotated Anodyne OCc1ccc(-c2noc(-c3cnn(C4CCCCC4)c3[C@@H]3CCCO3)n2)cc1 ZINC000114562886 GI Annotated Anodyne OCc1ccc(-c2noc(-c3cnn(C4CCCCC4)c3[C@H]3CCCO3)n2)cc1 ZINC000114562888 GI Annotated Anodyne N#Cc1cnc(Nc2cc(N)ncn2)c2sc(-c3c(F)cccc3Cl)nc12 ZINC000114603509 GI Annotated Mild Cc1nn(C2CCCCC2)c2sc(C(=O)NC3CCC(C(=O)O)CC3)cc12 ZINC000114711726 GI Annotated Anodyne Cc1nn(C2CCCCC2)c2sc(C(=O)NC3CCC(CO)CC3)cc12 ZINC000114712904 GI Annotated Anodyne COC(=O)c1ccc(NC(=O)c2cc3c(C)nn(C4CCCCC4)c3s2)cn1 ZINC000114713478 GI Annotated Anodyne CC(C)n1cc2ccc(-c3n[nH]c4ccnc(OC5CCOCC5)c34)cc2n1 ZINC000114750146 GI Annotated Anodyne CC(C)n1cnc2ccc(-c3n[nH]c4ccnc(OC5CCOCC5)c34)cc21 ZINC000114758945 GI Annotated Anodyne CC(C)Oc1nccc2[nH]nc(-c3cc(C(=O)N4CCCCC4)n(C(C)C)c3)c12 ZINC000114771838 GI Annotated Anodyne CC(C)Oc1nccc2[nH]nc(-c3cc(C(=O)N4CCCC4)n(C(C)C)c3)c12 ZINC000114773182 GI Annotated Anodyne Cc1nc(C)c(CNc2nc(OCCc3ccccn3)nc(Cl)c2C)s1 ZINC000114805762 GI Annotated Anodyne in-vitro CC(=O)NCCOc1ccc2c(c1)[C@@H](C1(c3ccc(Cl)cc3)CCC1)NCC2 ZINC000114978305 GI Annotated Anodyne CC(=O)NCCOc1ccc2c(c1)[C@H](C1(c3ccc(Cl)cc3)CCC1)NCC2 ZINC000114978307 GI Annotated Anodyne Cc1ccc(N2CCc3ncnc(N[C@H](C)c4ccc(F)cc4F)c3C2)nc1 ZINC000114993175 GI Annotated Anodyne Cc1ccc(N2CCc3ncnc(N[C@@H](C)c4ccc(F)cc4F)c3C2)nc1 ZINC000114993177 GI Annotated Anodyne Cc1ccc(N2CCc3ncnc(N[C@H](C)c4cc(F)cc(F)c4)c3C2)nc1 ZINC000114995139 GI Annotated Anodyne Cc1ccc(N2CCc3ncnc(N[C@@H](C)c4cc(F)cc(F)c4)c3C2)nc1 ZINC000114995141 GI Annotated Anodyne COc1ccc([C@@H](C)Nc2ncnc3c2CN(c2ccc(C)cn2)CC3)cc1F ZINC000114997488 GI Annotated Anodyne COc1ccc([C@H](C)Nc2ncnc3c2CN(c2ccc(C)cn2)CC3)cc1F ZINC000114997490 GI Annotated Anodyne COCc1ccc(C(=O)N2CCC[C@@H](C(=O)c3ccc(Cl)cc3C)C2)o1 ZINC000011662653 GI Annotated Anodyne COCc1ccc(C(=O)N2CCC[C@H](C(=O)c3ccc(Cl)cc3C)C2)o1 ZINC000011662654 GI Annotated Anodyne CCN1CC[C@H](CN(C)Cc2c[nH]nc2-c2ccc3cc(OC)ccc3c2)C1 ZINC000011663634 GI Annotated Anodyne CCN1CC[C@@H](CN(C)Cc2c[nH]nc2-c2ccc3cc(OC)ccc3c2)C1 ZINC000011663635 GI Annotated Anodyne Cc1ccc2[nH]nc(C(=O)N3CCC[C@H](C(=O)c4ccc(Cl)cc4)C3)c2c1 ZINC000011664326 GI Annotated Anodyne Cc1ccc2[nH]nc(C(=O)N3CCC[C@@H](C(=O)c4ccc(Cl)cc4)C3)c2c1 ZINC000011664327 GI Annotated Anodyne C=CC[C@@H]1CC=C[C@@H](C)N1C(=O)c1cc(COc2cccc(C(C)=O)c2)on1 ZINC000011713028 GI Annotated Mild O=C(Nc1ccccc1Oc1cccnc1)[C@@H]1CCCN(C(=O)C2=CCCC2)C1 ZINC000011753604 GI Annotated Anodyne O=C(Nc1ccccc1Oc1cccnc1)[C@H]1CCCN(C(=O)C2=CCCC2)C1 ZINC000011753605 GI Annotated Anodyne COc1cc(Cl)c(CN2CCC[C@](CO)(Cc3ccccc3)C2)cc1OC ZINC000011759364 GI Annotated Anodyne COc1cc(Cl)c(CN2CCC[C@@](CO)(Cc3ccccc3)C2)cc1OC ZINC000011759368 GI Annotated Anodyne CSc1ccccc1OCc1cc(C(=O)N[C@@H]2CCc3ccccc32)no1 ZINC000011774579 GI Annotated Anodyne CSc1ccccc1OCc1cc(C(=O)N[C@H]2CCc3ccccc32)no1 ZINC000011774589 GI Annotated Anodyne CCN(Cc1ccncc1)C(=O)c1cc(COc2ccc(F)cc2Cl)on1 ZINC000011816689 GI Annotated Anodyne Cc1ccc(-n2ncc3c2CC(C)(C)C[C@@H]3NC(=O)CCc2ccncc2)cc1 ZINC000011821373 GI Annotated Anodyne Cc1ccc(-n2ncc3c2CC(C)(C)C[C@H]3NC(=O)CCc2ccncc2)cc1 ZINC000011821374 GI Annotated Anodyne COc1ccc(CC2(CO)CCN(C/C=C/c3ccccc3OC)CC2)cc1 ZINC000011873617 GI Annotated Anodyne COc1cccc(C[C@]2(CO)CCCN(Cc3ccc(OC(F)F)cc3)C2)c1 ZINC000011873676 GI Annotated Anodyne COc1cccc(C[C@@]2(CO)CCCN(Cc3ccc(OC(F)F)cc3)C2)c1 ZINC000011873677 GI Annotated Anodyne Cc1nc([C@H](C)NC(=O)c2cc(COc3ccc(C)c(C)c3)on2)c(C)s1 ZINC000011874729 GI Annotated Anodyne Cc1nc([C@@H](C)NC(=O)c2cc(COc3ccc(C)c(C)c3)on2)c(C)s1 ZINC000011874730 GI Annotated Anodyne CCc1nc(C)c(CN2CCOc3ccc([C@@H](O)C4CCCCC4)cc3C2)[nH]1 ZINC000011881010 GI Annotated Anodyne CCc1nc(C)c(CN2CCOc3ccc([C@H](O)C4CCCCC4)cc3C2)[nH]1 ZINC000011881011 GI Annotated Anodyne COc1cccc(CC2(CO)CCN(Cc3ccc4cccc(F)c4n3)CC2)c1 ZINC000011937535 GI Annotated Anodyne O=C(c1ccc2ccccc2c1)[C@@H]1CCCN(C(=O)c2noc3c2CCCC3)C1 ZINC000011950661 GI Annotated Anodyne O=C(c1ccc2ccccc2c1)[C@H]1CCCN(C(=O)c2noc3c2CCCC3)C1 ZINC000011950667 GI Annotated Anodyne Cn1cc(CN2CCC([C@@H](O)c3cccs3)CC2)c(-c2ccccc2F)n1 ZINC000011954678 GI Annotated Anodyne Cn1cc(CN2CCC([C@H](O)c3cccs3)CC2)c(-c2ccccc2F)n1 ZINC000011954681 GI Annotated Anodyne Cc1cccnc1-c1cccc2c1O[C@H](CNC(=O)/C=C/c1cccs1)C2 ZINC000011975925 GI Annotated Anodyne Cc1cccnc1-c1cccc2c1O[C@@H](CNC(=O)/C=C/c1cccs1)C2 ZINC000011975932 GI Annotated Anodyne O=C(N[C@@H]1CCc2ccccc21)c1cc(COc2ccc(F)cc2Cl)on1 ZINC000011998716 GI Annotated Anodyne O=C(N[C@H]1CCc2ccccc21)c1cc(COc2ccc(F)cc2Cl)on1 ZINC000011998718 GI Annotated Anodyne O=C1CC(=O)N(C2CCN(C3CCCCCCC3)CC2)c2cc(F)ccc2N1 ZINC000115712423 GI Annotated Anodyne COCCOc1ccc(-c2nnc(S)n2-c2cccc3ccccc23)c(O)c1 ZINC000115807458 GI Annotated Anodyne Cc1nnsc1C(=O)Nc1ccc(-n2nc(C3CC3)cc2C2CC2)c(F)c1 ZINC000116815186 GI Annotated Anodyne Cc1oncc1C(=O)Nc1ccc(-n2nc(C(F)(F)F)cc2C2CC2)c(F)c1 ZINC000116816772 GI Annotated Anodyne Cc1cccc(N2C[C@H]3CN(C(=O)c4ccccc4-c4ccccc4)C[C@H]3C2)n1 ZINC000116822960 GI Annotated Anodyne Cc1cccc(N2C[C@H]3CN(C(=O)c4ccccc4-c4ccccc4)C[C@@H]3C2)n1 ZINC000116822963 GI Annotated Anodyne Cc1cccc(N2C[C@@H]3CN(C(=O)c4ccccc4-c4ccccc4)C[C@H]3C2)n1 ZINC000116822965 GI Annotated Anodyne Cc1ccnc(N2C[C@H]3CN(C(=O)c4ccccc4-c4cccs4)C[C@H]3C2)c1 ZINC000116825599 GI Annotated Anodyne Cc1ccnc(N2C[C@H]3CN(C(=O)c4ccccc4-c4cccs4)C[C@@H]3C2)c1 ZINC000116825601 GI Annotated Anodyne Cc1ccnc(N2C[C@@H]3CN(C(=O)c4ccccc4-c4cccs4)C[C@H]3C2)c1 ZINC000116825602 GI Annotated Anodyne Cc1cccc(N2C[C@H]3CN(C(=O)c4ccccc4-c4cccs4)C[C@H]3C2)n1 ZINC000116826379 GI Annotated Anodyne Cc1cccc(N2C[C@H]3CN(C(=O)c4ccccc4-c4cccs4)C[C@@H]3C2)n1 ZINC000116826381 GI Annotated Anodyne Cc1cccc(N2C[C@@H]3CN(C(=O)c4ccccc4-c4cccs4)C[C@H]3C2)n1 ZINC000116826383 GI Annotated Anodyne Cc1cc(Nc2ccc(C(F)(F)F)c(F)c2)n2nc(C(C)(F)F)nc2n1 ZINC000116844123 GI Annotated Anodyne O=C(O)CCCOc1cc(Cl)c2c(c1)[C@](O)(C(F)(F)F)c1ccccc1-2 ZINC000116910523 GI Annotated Anodyne O=C(O)CCCOc1cc(Cl)c2c(c1)[C@@](O)(C(F)(F)F)c1ccccc1-2 ZINC000116910525 GI Annotated Anodyne O=C1NC(=O)N(c2ccc3[nH]cnc3c2)[C@H]1c1ccc(Cl)c(C(F)(F)F)c1 ZINC000116911792 GI Annotated Anodyne O=C1NC(=O)N(c2ccc3[nH]cnc3c2)[C@@H]1c1ccc(Cl)c(C(F)(F)F)c1 ZINC000116911794 GI Annotated Anodyne Cc1cc(NC(=O)NCc2cccs2)ccc1N1CC[C@@H](N2CCC[C@H]2C)C1 ZINC000116950410 GI Annotated Anodyne NS(=O)(=O)c1ccccc1-c1ccc2[nH]c(/C=C/c3ccc(F)cc3)nc2c1 ZINC000117150666 GI Annotated Anodyne Cc1ncc(Cl)cc1C(=O)N[C@@H]1CC[C@@H](Cn2nc(C)c(Cl)c2C)CC1 ZINC000117313209 GI Annotated Anodyne O=C(Cc1ccccc1F)Nc1onc(-c2ccc(F)cc2)c1-c1ccncn1 ZINC000117404954 GI Annotated Anodyne O=C(Cc1ccccc1)Nc1onc(-c2c(F)cccc2F)c1-c1ccncn1 ZINC000117412970 GI Annotated Anodyne Cc1nnsc1C(=O)Nc1ccc(-n2nc(C(F)(F)F)cc2C2CC2)cc1 ZINC000117416598 GI Annotated Anodyne Cc1oncc1C(=O)Nc1ccc(-n2nc(C(F)(F)F)cc2C2CC2)cc1 ZINC000117419817 GI Annotated Anodyne Cc1ncncc1C(=O)Nc1ccc(-n2nc(C3CC3)cc2C2CC2)c(F)c1 ZINC000117423667 GI Annotated Anodyne O=C(Cn1nnc2ccccc21)Nc1ccc(-n2nc(C3CC3)cc2C2CC2)cc1 ZINC000117439194 GI Annotated Anodyne O=C(c1ccc2[nH]cnc2c1)N1CCC[C@@H]2c3cc(Br)ccc3C[C@@H]21 ZINC000117626644 GI Annotated Anodyne O=C(c1ccc2[nH]cnc2c1)N1CCC[C@H]2c3cc(Br)ccc3C[C@@H]21 ZINC000117626648 GI Annotated Anodyne CC(C)(O)c1ccc2c(c1)CC[C@H]1[C@H]2CCCN1C(=O)c1ccc2[nH]cnc2c1 ZINC000117630963 GI Annotated Anodyne CC(C)(O)c1ccc2c(c1)CC[C@H]1[C@@H]2CCCN1C(=O)c1ccc2[nH]cnc2c1 ZINC000117630966 GI Annotated Anodyne CCC1(COc2cccc3ccc(-c4nnc5ccccn45)nc23)CCNCC1 ZINC000117667258 GI Annotated Anodyne CCN1C[C@@H](c2ccccc2)OC(=O)[C@@H]1CC(=O)Nc1ccc(C(C)C)cc1 ZINC000117770849 GI Annotated Anodyne CCN1C[C@@H](c2ccccc2)OC(=O)[C@H]1CC(=O)Nc1ccc(C(C)C)cc1 ZINC000117770854 GI Annotated Anodyne CCN1C[C@H](c2ccccc2)OC(=O)[C@@H]1CC(=O)Nc1ccc(C(C)C)cc1 ZINC000117777799 GI Annotated Anodyne CCN1C[C@H](c2ccccc2)OC(=O)[C@H]1CC(=O)Nc1ccc(C(C)C)cc1 ZINC000117777801 GI Annotated Anodyne CC(C)c1ccc(NC(=O)C[C@H]2C(=O)OC(C)(C)CN2c2ccccc2)cc1 ZINC000117779783 GI Annotated Anodyne CC(C)c1ccc(NC(=O)C[C@@H]2C(=O)OC(C)(C)CN2c2ccccc2)cc1 ZINC000117779786 GI Annotated Anodyne CC(C)c1ccc(NC(=O)C[C@H]2C(=O)OC(C)(C)CN2Cc2ccccc2)cc1 ZINC000117786424 GI Annotated Anodyne CC(C)c1ccc(NC(=O)C[C@@H]2C(=O)OC(C)(C)CN2Cc2ccccc2)cc1 ZINC000117786427 GI Annotated Anodyne C[C@@H]1OCc2sc(NC(=O)C3C(C)(C)C3(C)C)c(C(=O)N3CC(F)(F)C3)c21 ZINC000118200348 GI Annotated Anodyne C[C@H]1OCc2sc(NC(=O)C3C(C)(C)C3(C)C)c(C(=O)N3CC(F)(F)C3)c21 ZINC000118200351 GI Annotated Anodyne CC[C@@H](Nc1cc(CN2CC(C(=O)O)C2)c(F)cn1)c1ccc(Cl)c(C)c1 ZINC000118401756 GI Annotated Anodyne CC(C)(C)C(=O)Nc1cnn2ccc(N3CCC[C@@H]3c3cc(F)ccc3F)nc12 ZINC000118401891 GI Annotated Anodyne N#Cc1cccc(-c2nc(N)c3cc(CN4CCCC(F)(F)C4)sc3n2)c1 ZINC000118592890 GI Annotated Mild Nc1nc(-c2ccc(Cl)o2)nc2sc(CN3CCCC(F)(F)C3)cc12 ZINC000118593129 GI Annotated Anodyne Nc1nc(-c2ccc(C(F)F)o2)nc2sc(CN3CCC(F)CC3)cc12 ZINC000118601624 GI Annotated Anodyne CCN(CC)CCNc1cnn(C2CC(C)(C)CC(C)(C)C2)c(=O)c1Cl ZINC000118636496 GI Annotated Anodyne Cc1ncc(Cl)cc1C(=O)N[C@@H]1CC[C@@H](Cn2cc3c(n2)CCCC3)CC1 ZINC000118639932 GI Annotated Anodyne CCc1cc(CC)n(C[C@@H]2CC[C@@H](NC(=O)c3cc(Cl)cnc3C)CC2)n1 ZINC000118643215 GI Annotated Anodyne CCc1nc2cc(Cl)ccn2c1C(=O)NCc1ccc(-c2ccc[nH]2)cc1 ZINC000118860647 GI Annotated Anodyne C[C@]12CC[C@H]3[C@@H](CC[C@]45O[C@H]4C(=O)CC[C@]35C)[C@@H]1CC[C@@]2(O)Cc1ccccn1 ZINC000118921552 GI Annotated Anodyne C[C@]12CC[C@H]3[C@@H]([C@@H]4C[C@@H]4C4=CC(=O)C[C@H](S)[C@@]43C)[C@@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000118922702 GI Annotated Mild C[C@@]12C(=CC(=O)C[C@@H]1C#N)[C@H]1C[C@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000118930332 GI Annotated Mild CC1=C[C@@]2(C)C(=CC1=O)[C@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000118930338 GI Annotated Mild CC1=C[C@@]2(C)C(=CC1=O)[C@@H]1C[C@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000118930339 GI Annotated Mild CC1=C[C@@]2(C)C(=CC1=O)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000118930340 GI Annotated Mild C=C1C[C@@]2(C)C(=CC1=O)[C@H]1C[C@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12 ZINC000118934057 GI Annotated Mild C[C@@]12C(=CC(=O)[C@@H]3C[C@@H]31)[C@H]1C[C@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000118934061 GI Annotated Mild CS/C(Nc1cccc([C@H]2CN3CCSC3=N2)c1)=[N+](/C)c1ccccc1 ZINC000118936148 GI Annotated Mild C=C1[C@@H](NC)CC[C@]23C[C@@]24CC[C@]2(C)[C@@H]([C@H](C)NC)[C@H](O)C[C@@]2(C)[C@@H]4CC[C@@H]13 ZINC000119076846 GI Annotated Mild C=C1[C@@H](NC)CC[C@]23C[C@@]24CC[C@]2(C)[C@@H]([C@@H](C)NC)[C@H](O)C[C@@]2(C)[C@@H]4CC[C@@H]13 ZINC000119076947 GI Annotated Mild C=C1[C@@H](NC)CC[C@]23C[C@@]24CC[C@]2(C)[C@@H]([C@H](C)NC)[C@@H](O)C[C@@]2(C)[C@@H]4CC[C@@H]13 ZINC000119077054 GI Annotated Mild C=C1[C@@H](NC)CC[C@]23C[C@@]24CC[C@]2(C)[C@@H]([C@@H](C)NC)[C@@H](O)C[C@@]2(C)[C@@H]4CC[C@@H]13 ZINC000119077140 GI Annotated Mild Cc1nc(C)c(C(=O)N2CCC[C@@H](C(=O)c3ccc(Cl)cc3C)C2)s1 ZINC000012005033 GI Annotated Anodyne Cc1nc(C)c(C(=O)N2CCC[C@H](C(=O)c3ccc(Cl)cc3C)C2)s1 ZINC000012005036 GI Annotated Anodyne CC[C@@H]1CN(Cc2c[nH]nc2-c2ccc(F)cc2)Cc2cc(OC)ccc2O1 ZINC000012031067 GI Annotated Anodyne CC[C@H]1CN(Cc2c[nH]nc2-c2ccc(F)cc2)Cc2cc(OC)ccc2O1 ZINC000012031071 GI Annotated Anodyne COc1ccc(OCc2cc(C(=O)N3CCCCCCC3)no2)c(Cl)c1 ZINC000012075824 GI Annotated Anodyne OCC1(Cc2ccccc2)CCN(C2CCN(c3ccccc3F)CC2)CC1 ZINC000012076579 GI Annotated Anodyne Cc1ccc2nc(N3CCC(N[C@@H](C)Cc4cccs4)CC3)nc(C)c2c1 ZINC000012097147 GI Annotated Anodyne Cc1ccc2nc(N3CCC(N[C@H](C)Cc4cccs4)CC3)nc(C)c2c1 ZINC000012097148 GI Annotated Anodyne CCCC[C@@H]1CN(C(=O)c2cc(=O)c3ccccc3o2)Cc2ccccc2O1 ZINC000012126475 GI Annotated Anodyne CCCC[C@H]1CN(C(=O)c2cc(=O)c3ccccc3o2)Cc2ccccc2O1 ZINC000012126482 GI Annotated Anodyne OCC1(Cc2cccc(F)c2)CCN(Cc2ccc3cccc(F)c3n2)CC1 ZINC000012193083 GI Annotated Anodyne O=C(Nc1cccc(-n2cccn2)c1)[C@@H]1CCCN(Cc2cc3ccccc3[nH]2)C1 ZINC000012195112 GI Annotated Anodyne O=C(Nc1cccc(-n2cccn2)c1)[C@H]1CCCN(Cc2cc3ccccc3[nH]2)C1 ZINC000012195121 GI Annotated Anodyne C[C@H](c1ccon1)N(C)C(=O)c1ccc2oc(CCc3ccccc3)nc2c1 ZINC000012203735 GI Annotated Anodyne C[C@@H](c1ccon1)N(C)C(=O)c1ccc2oc(CCc3ccccc3)nc2c1 ZINC000012203741 GI Annotated Anodyne COc1ccc(CN2CCC[C@@](CO)(Cc3cccc(Cl)c3)C2)cc1OC ZINC000012207300 GI Annotated Anodyne COc1ccc(CN2CCC[C@](CO)(Cc3cccc(Cl)c3)C2)cc1OC ZINC000012207307 GI Annotated Anodyne C[C@@H](NC(=O)c1ccc2nc(Cc3cccc(Cl)c3)oc2c1)c1ccncn1 ZINC000012224949 GI Annotated Anodyne C[C@H](NC(=O)c1ccc2nc(Cc3cccc(Cl)c3)oc2c1)c1ccncn1 ZINC000012224961 GI Annotated Anodyne Cc1cccc(CN2CCC[C@@]3(CCN(C(=O)CC4=CCCCC4)C3)C2=O)c1 ZINC000012225620 GI Annotated Anodyne Cc1cccc(CN2CCC[C@]3(CCN(C(=O)CC4=CCCCC4)C3)C2=O)c1 ZINC000012225631 GI Annotated Anodyne O=C(Cc1ccsc1)NC[C@@H]1Cc2cc(Cl)cc(-c3ccncc3)c2O1 ZINC000012243369 GI Annotated Anodyne O=C(Cc1ccsc1)NC[C@H]1Cc2cc(Cl)cc(-c3ccncc3)c2O1 ZINC000012243370 GI Annotated Anodyne COc1cc(Cl)ccc1OCc1cc(C(=O)N[C@@H]2CCc3ccccc32)no1 ZINC000012298489 GI Annotated Anodyne COc1cc(Cl)ccc1OCc1cc(C(=O)N[C@H]2CCc3ccccc32)no1 ZINC000012298490 GI Annotated Anodyne OCC1(CCOc2ccccc2)CCN(Cc2c[nH]nc2-c2ccccc2)CC1 ZINC000012300399 GI Annotated Anodyne CSc1ccccc1OCc1cc(C(=O)N(C)[C@@H](C)c2ccccn2)no1 ZINC000012304356 GI Annotated Anodyne CSc1ccccc1OCc1cc(C(=O)N(C)[C@H](C)c2ccccn2)no1 ZINC000012304358 GI Annotated Anodyne OCC1(CCOc2ccccc2)CCN(Cc2ccc3cccc(F)c3n2)CC1 ZINC000012305300 GI Annotated Anodyne CSc1ccccc1OCc1cc(C(=O)N[C@@H](C)Cc2cccc(C)n2)no1 ZINC000012305437 GI Annotated Anodyne CSc1ccccc1OCc1cc(C(=O)N[C@H](C)Cc2cccc(C)n2)no1 ZINC000012305439 GI Annotated Anodyne Cc1ccccc1-n1ncc([C@@H](C)NS(=O)(=O)c2ccccc2Cl)c1C ZINC000012314353 GI Annotated Anodyne Cc1ccccc1-n1ncc([C@H](C)NS(=O)(=O)c2ccccc2Cl)c1C ZINC000012314354 GI Annotated Anodyne CCN(Cc1ccncc1)[C@@H]1CCCN(C(=O)Nc2ccccc2SC)C1 ZINC000012320001 GI Annotated Anodyne CCN(Cc1ccncc1)[C@H]1CCCN(C(=O)Nc2ccccc2SC)C1 ZINC000012320003 GI Annotated Anodyne O=C1N(Cc2ccc(Oc3ccc(C4CCCC4)cc3)cc2)CCS1(=O)=O ZINC000012341144 GI Annotated Anodyne c1ccc2c(c1)N=C(N1CCN(C[C@H]3CCCO3)CC1)c1ccccc1S2 ZINC000012356207 GI Annotated Anodyne c1ccc2c(c1)N=C(N1CCN(C[C@@H]3CCCO3)CC1)c1ccccc1S2 ZINC000012356208 GI Annotated Anodyne CCCCCN1C(=O)[C@@H](CCOc2ccccc2CC(=O)O)Oc2ccccc21 ZINC000012358367 GI Annotated Anodyne CCCCCN1C(=O)[C@H](CCOc2ccccc2CC(=O)O)Oc2ccccc21 ZINC000012358368 GI Annotated Anodyne C=CCC1(CC=C)CCCN1C(=O)c1cc(COc2cncc(Cl)c2)on1 ZINC000012385326 GI Annotated Mild CN(Cc1cccc(-n2cccn2)c1)Cc1cn(C)nc1-c1ccccc1F ZINC000012386511 GI Annotated Anodyne CCCN(CC1CC1)C(=O)c1cc(COc2ccc(OC)cc2Cl)on1 ZINC000012387308 GI Annotated Anodyne O=C(NCCc1ccccc1C(F)(F)F)c1cc(COc2ccccc2)on1 ZINC000012430517 GI Annotated Anodyne O=C(c1cc(COc2ccc(F)cc2Cl)on1)N1CCc2sccc2C1 ZINC000012431474 GI Annotated Anodyne Cn1cc(CN2C[C@]3(C)C[C@H]2CC(C)(C)C3)c(-c2ccc3c(c2)OCCO3)n1 ZINC000012432926 GI Annotated Anodyne CC(C)N(Cc1nccn1C)C(=O)c1ccc2oc(Cc3ccccc3)nc2c1 ZINC000012444830 GI Annotated Anodyne O=C(c1coc(Cn2cnc3ccccc32)n1)N1CC=C(c2ccccc2)CC1 ZINC000012448249 GI Annotated Anodyne O=C(Nc1ccc(Oc2ccccc2)nc1)C1CCN(Cc2ccco2)CC1 ZINC000012448300 GI Annotated Anodyne Cc1ncsc1C(=O)N(Cc1cccnc1)CC1CCN(C2CCCC2)CC1 ZINC000012448487 GI Annotated Anodyne Oc1ccc(-c2ccc3c(c2)OCO3)cc1CNC[C@@H]1C[C@H]2C=C[C@@H]1C21CC1 ZINC000012451899 GI Annotated Clean Oc1ccc(-c2ccc3c(c2)OCO3)cc1CNC[C@H]1C[C@H]2C=C[C@@H]1C21CC1 ZINC000012451901 GI Annotated Clean CCCCNC(=O)c1onc(CSc2ccccc2)c1C(=O)NCCCC ZINC000012466419 GI Annotated Anodyne COc1cccc([C@@H]2C[C@@H](c3c(Cl)cccc3Cl)n3nc(N)nc3N2)c1 ZINC000012469452 GI Annotated Anodyne aggregator COc1cccc([C@H]2C[C@@H](c3c(Cl)cccc3Cl)n3nc(N)nc3N2)c1 ZINC000012469457 GI Annotated Anodyne aggregator COc1cccc([C@H]2C[C@H](c3c(Cl)cccc3Cl)n3nc(N)nc3N2)c1 ZINC000012469464 GI Annotated Anodyne aggregator C[C@@H](NS(=O)(=O)OCC(Cl)(Cl)Cl)c1ccc(C(C)(C)C)cc1 ZINC000012472580 GI Annotated Anodyne C[C@H](NS(=O)(=O)OCC(Cl)(Cl)Cl)c1ccc(C(C)(C)C)cc1 ZINC000012472587 GI Annotated Anodyne CCCN1CCC(=O)N([C@H](CSc2ccccc2)Cc2ccccc2)CC1 ZINC000012474597 GI Annotated Anodyne COc1cc2sc3ccc(C#CC4(O)CCCCC4)cc3c(=O)c2cc1OC ZINC000012476721 GI Annotated Mild C[C@@]1(c2nnc(-c3cccc(Cl)c3)o2)CC(c2ccc([N+](=O)[O-])cc2)=NO1 ZINC000012476751 GI Annotated Bother C[C@]1(c2nnc(-c3cccc(Cl)c3)o2)CC(c2ccc([N+](=O)[O-])cc2)=NO1 ZINC000012476756 GI Annotated Bother COc1cc2sc3ccc(C#Cc4ccc(N)cc4)cc3c(=O)c2cc1OC ZINC000012477062 GI Annotated Mild COC(=O)c1ccc(C2=NO[C@@](C)(c3nnc(-c4cccc(Cl)c4)o3)C2)cc1 ZINC000012477167 GI Annotated Anodyne COC(=O)c1ccc(C2=NO[C@](C)(c3nnc(-c4cccc(Cl)c4)o3)C2)cc1 ZINC000012477172 GI Annotated Anodyne COc1ccc(N2C(=O)c3ccccc3N/C2=C\C=C2\C=CC(=O)C(O)=C2)cc1 ZINC000012478194 GI Annotated Mild COc1ccc(NC(=O)[C@@H]2CC=C[C@@H]3CCN(C4CCCCC4)C(=O)[C@@H]32)cc1 ZINC000012478681 GI Annotated Anodyne CC(=O)C[C@H]1c2cc(C(F)(F)F)ccc2S(=O)(=O)N1C1CCCCC1 ZINC000012479383 GI Annotated Anodyne COC(=O)C1=C(c2cc3ccccc3o2)C[C@@H]2CC[C@H]1N2C(=O)N1CCCCC1 ZINC000012479637 GI Annotated Anodyne COC(=O)C1=C(c2cc3ccccc3s2)C[C@@H]2CC[C@H]1N2C(=O)NCC1CC1 ZINC000012479984 GI Annotated Anodyne COC(=O)C1=C(c2cc3ccccc3s2)C[C@@H]2CC[C@H]1N2C(=O)NC(C)C ZINC000012480213 GI Annotated Anodyne COC(=O)C1=C(c2cc3ccccc3s2)C[C@@H]2CC[C@H]1N2C(=O)N1CCCC1 ZINC000012480278 GI Annotated Anodyne CCCNC(=O)N1[C@H]2CC[C@@H]1C(C(=O)OC)=C(c1cc3ccccc3s1)C2 ZINC000012480396 GI Annotated Anodyne C=CCOC(=O)C1=C[C@H](C2CCCCC2)C[C@H](OCc2ccc(CO)cc2)O1 ZINC000012482633 GI Annotated Mild C=CCOC(=O)C1=C[C@H](c2csc3ccccc23)C[C@H](OCCCCO)O1 ZINC000012482664 GI Annotated Mild C=CCOC(=O)C1=C[C@@H](c2csc3ccccc23)C[C@@H](OCCCCO)O1 ZINC000012482731 GI Annotated Mild Cc1csc(N[C@H](C)c2nc3cc(C(F)(F)F)ccc3n2CCCO)n1 ZINC000012489782 GI Annotated Anodyne Cc1csc(N[C@@H](C)c2nc3cc(C(F)(F)F)ccc3n2CCCO)n1 ZINC000012489789 GI Annotated Anodyne CN1/C(=C\C=N\NC(=O)c2ccccc2Br)C(C)(C)c2ccccc21 ZINC000012511453 GI Annotated Reactive C/C(=N\OCC(=O)Nc1ccccc1C(C)(C)C)c1ccc2c(c1)OCCO2 ZINC000012528718 GI Annotated Mild Cc1cc(OCc2cc(C(=O)N(C)CC3CCOCC3)no2)cc(C)c1Cl ZINC000012572045 GI Annotated Anodyne Cc1ncc(CN2CCC[C@@H](C(=O)Nc3ccc(-c4cscn4)cc3)C2)s1 ZINC000012574873 GI Annotated Anodyne Cc1ncc(CN2CCC[C@H](C(=O)Nc3ccc(-c4cscn4)cc3)C2)s1 ZINC000012574881 GI Annotated Anodyne CCC(C)(C)n1nnnc1[C@H](c1ccc2ncccc2c1)N1CCC[C@@H](C)C1 ZINC000012642190 GI Annotated Anodyne CC(=O)c1ccc(OCc2cc(C(=O)N3CC[C@@H]4CCCC[C@H]4C3)no2)cc1 ZINC000012703538 GI Annotated Anodyne OCC1(CCc2ccccc2)CCN(Cc2cc(F)ccc2-n2cccn2)CC1 ZINC000012713858 GI Annotated Anodyne CC(C)=CCC[C@H](C)CN1CCC(N2CCC(C(=O)N3CCCC3)CC2)CC1 ZINC000012714488 GI Annotated Anodyne CC(C)=CCC[C@@H](C)CN1CCC(N2CCC(C(=O)N3CCCC3)CC2)CC1 ZINC000012714491 GI Annotated Anodyne Cc1cc(C)c(C(=O)N[C@@H]2CC(C)(C)Cc3c2cnn3-c2cccc(F)c2)[nH]1 ZINC000012718613 GI Annotated Anodyne Cc1cc(C)c(C(=O)N[C@H]2CC(C)(C)Cc3c2cnn3-c2cccc(F)c2)[nH]1 ZINC000012718614 GI Annotated Anodyne C[C@@]1(c2nnc(Cc3ccccc3)o2)CC(c2ccc(Br)cc2)=NO1 ZINC000012725949 GI Annotated Anodyne C[C@]1(c2nnc(Cc3ccccc3)o2)CC(c2ccc(Br)cc2)=NO1 ZINC000012725952 GI Annotated Anodyne C[C@@]1(c2nnc(Cc3ccccc3)o2)CC(c2ccccc2Br)=NO1 ZINC000012726027 GI Annotated Anodyne C[C@]1(c2nnc(Cc3ccccc3)o2)CC(c2ccccc2Br)=NO1 ZINC000012726029 GI Annotated Anodyne Clc1nc2ccccc2cc1-c1nnn(-c2ccccc2Br)n1 ZINC000012726064 GI Annotated Anodyne O=C1NC[C@@H](Cc2cccc3ccccc23)N(CCCCC2CCCCC2)C1=O ZINC000012726241 GI Annotated Anodyne O=C(/N=C1\N=C2C=CC(Br)=CN2Cc2ccccc21)c1cccs1 ZINC000012728413 GI Annotated Mild COc1ccc(C(=O)N[C@@H]2CC(C)(C)Cc3c2cnn3-c2ccccc2C)o1 ZINC000012751055 GI Annotated Anodyne COc1ccc(C(=O)N[C@H]2CC(C)(C)Cc3c2cnn3-c2ccccc2C)o1 ZINC000012751059 GI Annotated Anodyne Cc1nc(-c2nc(NCCc3cnccn3)ncc2-c2ccsc2)sc1C ZINC000012751710 GI Annotated Anodyne COc1ccc(-n2cc(CNC3CCC(O)CC3)c(-c3cccc(F)c3)n2)cc1 ZINC000012754376 GI Annotated Anodyne Cc1nnsc1C(=O)N[C@@H]1CCCc2c1cnn2-c1ccc(C(C)(C)C)cc1 ZINC000012836114 GI Annotated Anodyne Cc1nnsc1C(=O)N[C@H]1CCCc2c1cnn2-c1ccc(C(C)(C)C)cc1 ZINC000012836116 GI Annotated Anodyne CC(C)=CCC[C@H](C)CN1CCC(N2CCC(C(=O)NC(C)C)CC2)CC1 ZINC000012836969 GI Annotated Anodyne CC(C)=CCC[C@@H](C)CN1CCC(N2CCC(C(=O)NC(C)C)CC2)CC1 ZINC000012836972 GI Annotated Anodyne C[C@@H](OC(=O)c1ccc(-c2ccc(O)cc2)cc1)C(=O)N[C@H]1CCCC[C@H]1C ZINC000012918344 GI Annotated Anodyne C[C@H]1CCCC[C@@H]1NC(=O)[C@@H](C)OC(=O)c1ccc(-c2ccc(O)cc2)cc1 ZINC000012918346 GI Annotated Anodyne C[C@@H](OC(=O)c1ccc(-c2ccc(O)cc2)cc1)C(=O)N[C@@H]1CCCC[C@H]1C ZINC000012918350 GI Annotated Anodyne C[C@H]1CCCC[C@H]1NC(=O)[C@@H](C)OC(=O)c1ccc(-c2ccc(O)cc2)cc1 ZINC000012918353 GI Annotated Anodyne CCOC(=O)[C@@H](/N=C(\O)c1ccccc1)c1c(C)nn(-c2ccccc2)c1C ZINC000012936477 GI Annotated Anodyne CCOC(=O)[C@H](/N=C(\O)c1ccccc1)c1c(C)nn(-c2ccccc2)c1C ZINC000012936484 GI Annotated Anodyne C[C@@H]1C[C@@H](C)CN(C(=O)c2ccc(CSc3nc4ccncc4[nH]3)cc2)C1 ZINC000013118723 GI Annotated Anodyne C[C@H]1C[C@H](C)CN(C(=O)c2ccc(CSc3nc4ccncc4[nH]3)cc2)C1 ZINC000013118726 GI Annotated Anodyne O=c1c2ccccc2nc(COc2ccccc2)n1N/C=C1\C=Nc2ccccc21 ZINC000013119364 GI Annotated Anodyne O=C1C=CC(=CNNc2nc(-c3ccc(Cl)cc3)cc(C(F)(F)F)n2)C=C1 ZINC000013122645 GI Annotated Mild CNC[C@@H](O)c1cc(F)c(OCc2ccccc2)c(OCc2ccccc2)c1F ZINC000013122933 GI Annotated Anodyne CNC[C@H](O)c1cc(F)c(OCc2ccccc2)c(OCc2ccccc2)c1F ZINC000013122934 GI Annotated Anodyne COc1ccc(/C=C/C(O)=C2\C(=O)N(C)[C@@]3(C)C[C@@H]2c2ccccc2O3)cc1 ZINC000013123680 GI Annotated Anodyne CN(C)c1ccc(/C=C/C(O)=C2\C(=O)N(C)[C@@]3(C)C[C@@H]2c2ccccc2O3)cc1 ZINC000013123769 GI Annotated Clean Cc1cccc(NC(=O)c2cc3n(n2)[C@H](C(F)(F)F)C[C@H](C2CC2)N3)c1C ZINC000013123784 GI Annotated Anodyne aggregator Cc1cccc(NC(=O)c2cc3n(n2)[C@H](C(F)(F)F)C[C@@H](C2CC2)N3)c1C ZINC000013123785 GI Annotated Anodyne aggregator Cc1cccc(NC(=O)c2cc3n(n2)[C@@H](C(F)(F)F)C[C@H](C2CC2)N3)c1C ZINC000013123786 GI Annotated Anodyne aggregator Cc1cccc(NC(=O)c2cc3n(n2)[C@@H](C(F)(F)F)C[C@@H](C2CC2)N3)c1C ZINC000013123787 GI Annotated Anodyne aggregator COc1cccc(N2C(=O)c3ccccc3N/C2=C\C=C2\C=CC(=O)C(O)=C2)c1 ZINC000013124173 GI Annotated Mild Cc1cc([C@@H]2NC(N)=Nc3nc4ccccc4n32)c(C)n1-c1ccccc1Cl ZINC000013124421 GI Annotated Clean Cc1cc([C@H]2NC(N)=Nc3nc4ccccc4n32)c(C)n1-c1ccccc1Cl ZINC000013124422 GI Annotated Clean O=C(NN/C=C1\C=Nc2ccccc21)c1cc(-c2ccc3ccccc3c2)n[nH]1 ZINC000013125005 GI Annotated Reactive CN(N/C=C1\C=CC(=O)C=C1O)c1nc(-c2ccccc2)cc(-c2ccccc2)n1 ZINC000013125107 GI Annotated Mild CCOC(=O)c1ccc2c(c1)n(CC)c(/C=C/N(C)c1ccccc1)[n+]2CC ZINC000013125120 GI Annotated Clean O=C(NN/C=C1\C=Nc2ccccc21)[C@@H]1CC1(c1ccccc1)c1ccccc1 ZINC000013125158 GI Annotated Reactive C=C(C)COC1=CC(=O)/C(=C2\NNC(C)=C2c2ccc(Br)cc2)C=C1 ZINC000013125497 GI Annotated Mild COc1ccc(CNC(=O)C23C[C@@H]4C[C@@H](CC(Br)(C4)C2)C3)cc1 ZINC000013129003 GI Annotated Anodyne COc1ccc([C@@H]2C[C@@H](c3ccc(Cl)cc3Cl)n3nc(N)nc3N2)cc1 ZINC000013131581 GI Annotated Anodyne COc1ccc([C@H]2C[C@@H](c3ccc(Cl)cc3Cl)n3nc(N)nc3N2)cc1 ZINC000013131582 GI Annotated Anodyne COc1ccc([C@H]2C[C@H](c3ccc(Cl)cc3Cl)n3nc(N)nc3N2)cc1 ZINC000013131586 GI Annotated Anodyne COc1cccc([C@@H]2C[C@@H](c3ccc(Cl)cc3Cl)n3nc(N)nc3N2)c1 ZINC000013131670 GI Annotated Anodyne COc1cccc([C@H]2C[C@@H](c3ccc(Cl)cc3Cl)n3nc(N)nc3N2)c1 ZINC000013131671 GI Annotated Anodyne COc1cccc([C@H]2C[C@H](c3ccc(Cl)cc3Cl)n3nc(N)nc3N2)c1 ZINC000013131674 GI Annotated Anodyne COc1ccc([C@@H]2C[C@@H](c3c(Cl)cccc3Cl)n3nc(N)nc3N2)cc1 ZINC000013132261 GI Annotated Anodyne aggregator COc1ccc([C@H]2C[C@@H](c3c(Cl)cccc3Cl)n3nc(N)nc3N2)cc1 ZINC000013132262 GI Annotated Anodyne aggregator COc1ccc([C@H]2C[C@H](c3c(Cl)cccc3Cl)n3nc(N)nc3N2)cc1 ZINC000013132264 GI Annotated Anodyne aggregator COc1ccccc1[C@@H]1C[C@@H](c2ccc(Cl)cc2Cl)Nc2nc(N)nn21 ZINC000013132283 GI Annotated Anodyne COc1ccccc1[C@@H]1C[C@H](c2ccc(Cl)cc2Cl)Nc2nc(N)nn21 ZINC000013132285 GI Annotated Anodyne COc1ccccc1[C@H]1C[C@H](c2ccc(Cl)cc2Cl)Nc2nc(N)nn21 ZINC000013132286 GI Annotated Anodyne Cc1ccc(N/C(=N/c2ccc(Br)cc2)N2CCOCC2)cc1C ZINC000013135796 GI Annotated Mild O=C1N=C(N/N=C\c2cccs2)S[C@H]1Cc1ccc(Cl)c(Cl)c1 ZINC000013137016 GI Annotated Mild O=C1N=C(N/N=C\c2cccs2)S[C@@H]1Cc1ccc(Cl)c(Cl)c1 ZINC000013137017 GI Annotated Mild Fc1ccccc1-c1cs/c(=N\c2cccnc2)n1CCCn1ccnc1 ZINC000013139001 GI Annotated Anodyne CC1(C)[C@]2(C(=O)NCc3ccccc3Cl)CC[C@@]1(C)C(=O)[C@@H]2Br ZINC000013139440 GI Annotated Reactive CC1(C)CC(=O)C=C(NNC(=O)CCCOc2ccc(Cl)cc2Cl)C1 ZINC000013140448 GI Annotated Reactive CCC[C@@H]1S/C(=N\N=C/c2ccc(OC)cc2)N(Cc2ccccc2)C1=O ZINC000013142901 GI Annotated Mild C[C@@H]1CCC[C@@H](NC(=O)[C@H]2c3ccccc3C(=O)N2Cc2cccs2)[C@@H]1C ZINC000013144256 GI Annotated Anodyne C[C@H]1CCC[C@@H](NC(=O)[C@H]2c3ccccc3C(=O)N2Cc2cccs2)[C@@H]1C ZINC000013144257 GI Annotated Anodyne C[C@@H]1CCC[C@H](NC(=O)[C@H]2c3ccccc3C(=O)N2Cc2cccs2)[C@@H]1C ZINC000013144258 GI Annotated Anodyne C[C@H]1CCC[C@H](NC(=O)[C@H]2c3ccccc3C(=O)N2Cc2cccs2)[C@@H]1C ZINC000013144259 GI Annotated Anodyne C[C@@H]1C(=NO)[C@H](C)[C@H](c2ccc(N(C)C)cc2)N[C@@H]1c1ccc(N(C)C)cc1 ZINC000013150404 GI Annotated Mild C/C(=N/Nc1cc(N2CCCCC2)nc(C)n1)c1ccc(Br)cc1 ZINC000013152440 GI Annotated Mild CCOP(=O)(OCC)C(F)(F)Cc1cnc(C)c2c1COC(C)(C)O2 ZINC000013214993 GI Annotated Anodyne COc1ccc(-c2c(CN3CCOCC3)sc3nc4ccccc4n23)cc1 ZINC000013219696 GI Annotated Anodyne COc1ccc([C@H]2C(=O)c3c(OC)cc(OC)cc3O[C@H]2c2cccnc2)cc1 ZINC000013220573 GI Annotated Anodyne COc1ccc([C@H]2C(=O)c3c(OC)cc(OC)cc3O[C@@H]2c2cccnc2)cc1 ZINC000013220583 GI Annotated Anodyne COc1ccc([C@@H]2C(=O)c3c(OC)cc(OC)cc3O[C@H]2c2cccnc2)cc1 ZINC000013220592 GI Annotated Anodyne COc1ccc([C@@H]2C(=O)c3c(OC)cc(OC)cc3O[C@@H]2c2cccnc2)cc1 ZINC000013220601 GI Annotated Anodyne CC1=NC(C)=C(C(=O)OCCSc2ccccc2)[C@@H](C)[C@@H]1C(=O)OC(C)C ZINC000013294315 GI Annotated Anodyne CCC(=O)Oc1c2c(c(COC(=O)C(C)C)c3c(C)coc13)[C@@H](C)C[C@H](O)C2 ZINC000013300465 GI Annotated Anodyne CC(=O)OC/C=C(\C)CC[C@@H](O)[C@]1(C)CCC=C(CCC=C(C)C)C(=O)O1 ZINC000013304099 GI Annotated Anodyne COc1ccc2c(c1O)[C@H](CC(C)=O)N(C)c1c-2ccc2cc3c(cc12)OCO3 ZINC000013304750 GI Annotated Clean C=CCc1cc(OC)c(O[C@@H](C)Cc2cc(OC)c3c(c2)OCO3)c(OC)c1 ZINC000013311392 GI Annotated Mild CC(C)=CC[C@H](OC(=O)CC(C)=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000013328107 GI Annotated Mild in-vitro biogenic CC(C)=CC[C@@H](OC(=O)CC(C)=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000013328109 GI Annotated Mild C=C(C)/C=C/CC(=O)O[C@H](CC=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000013328117 GI Annotated Mild CC(=O)O[C@H]1CC[C@@]2(C)[C@H](CC[C@@H](C)CC(=O)O)C(C)=CC[C@@H]2[C@]1(C)CO ZINC000013330284 GI Annotated Anodyne CC(=O)OC[C@]1(C)[C@@H](O)CC[C@@]2(C)[C@H](CC[C@@H](C)CC(=O)O)C(C)=CC[C@@H]21 ZINC000013330292 GI Annotated Anodyne C=C1[C@H](O)C[C@@H]2[C@](C)(CCC[C@@]2(C)COC(C)=O)[C@H]1CC[C@@H](C)CC(=O)O ZINC000013330405 GI Annotated Mild CC(=O)Cc1cc2cccc3c(C(=O)c4c(C)cc(O)cc4O)c(O)cc(o1)c23 ZINC000013334583 GI Annotated Anodyne C=C1[C@H]2CC(=O)[C@H]([C@@H](C)OC(C)=O)[C@@H]2[C@@H](C(C)C)C[C@H]1OC(=O)/C=C(\C)CC ZINC000013337093 GI Annotated Mild in-man C=C1[C@H]2CC(=O)[C@H]([C@@H](C)OC(C)=O)[C@@H]2[C@H](C(C)C)C[C@H]1OC(=O)/C=C(\C)CC ZINC000013337095 GI Annotated Mild in-man C=C1[C@@H](OC(=O)/C=C(\C)CC)C[C@@H](C(C)C)[C@@H]2[C@@H]1CC(=O)[C@@H]2[C@@H](C)OC(C)=O ZINC000013337097 GI Annotated Mild in-man CC(=O)OCC/C=C/C=C/C=C/CCc1ccc(OC(C)=O)c(OC(C)=O)c1 ZINC000013339823 GI Annotated Anodyne O=C(CSc1nc2ccccc2s1)Nc1cc(C(=O)O)ccc1Cl ZINC000013356439 GI Annotated Anodyne COc1cc2c3cc(OC)c(OC)cc3c3c[n+]4c(cc3c2cc1OC)CCC4 ZINC000013360263 GI Annotated Bother C/C(=C\Cc1c(O)cc(C)c(C=O)c1O)CC/C=C(\C)CC[C@H](O)C(C)(C)O ZINC000013368472 GI Annotated Anodyne COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)[C@@H](O)[C@H]1CCC[N+]1([O-])C3 ZINC000013370341 GI Annotated Bother in-vitro biogenic COc1c2c(c(OC)c3occc13)O[C@@H](c1ccc3c(c1)OCO3)C[C@H]2OC ZINC000013376244 GI Annotated Anodyne C=C1C(=O)C=CC(C)(C)[C@]12C[C@@H](Br)[C@](C)(Cl)C[C@@H]2OC(C)=O ZINC000013379348 GI Annotated Reactive in-vitro biogenic COc1c(O)ccc2c(C3=CC(=O)c4c(O)cc(C)cc4C3=O)c(C)cc(O)c12 ZINC000013384391 GI Annotated Mild O=C1C[C@H](c2ccccc2)c2c(O)cc(O)c(C(=O)/C=C/c3ccccc3)c2O1 ZINC000013397190 GI Annotated Mild O=C1C[C@@H](c2ccccc2)c2c(O)cc(O)c(C(=O)/C=C/c3ccccc3)c2O1 ZINC000013397194 GI Annotated Mild O=C1C[C@H](c2ccccc2)c2c(O)cc(O)c(C(=O)CCc3ccccc3)c2O1 ZINC000013397210 GI Annotated Anodyne O=C1C[C@@H](c2ccccc2)c2c(O)cc(O)c(C(=O)CCc3ccccc3)c2O1 ZINC000013397213 GI Annotated Anodyne CC(C)=CCC[C@]1(C)Oc2c(c(O)cc(O)c2C(=O)c2ccccc2)C[C@@H]1O ZINC000013403662 GI Annotated Anodyne CCC(=O)N1Cc2cc(OC)ccc2C(Cc2c(Cl)cncc2Cl)=N1 ZINC000013436004 GI Annotated Anodyne COc1ccc2c(c1)CN(C(=O)C(C)C)N=C2Cc1c(Cl)cncc1Cl ZINC000013436006 GI Annotated Anodyne O=c1c(-c2cccc([N+](=O)[O-])c2)cccn1[C@@H](CN1CCCC1)c1ccccc1 ZINC000013436630 GI Annotated Bother O=c1c(-c2cccc([N+](=O)[O-])c2)cccn1[C@H](CN1CCCC1)c1ccccc1 ZINC000013436633 GI Annotated Bother COc1ccc(F)cc1-c1cccn([C@@H](CN2CCCC2)c2ccccc2)c1=O ZINC000013436660 GI Annotated Anodyne COc1ccc(F)cc1-c1cccn([C@H](CN2CCCC2)c2ccccc2)c1=O ZINC000013436663 GI Annotated Anodyne O=c1c(-c2cc(F)ccc2F)cccn1[C@@H](CN1CCCC1)c1ccccc1 ZINC000013436682 GI Annotated Anodyne O=c1c(-c2cc(F)ccc2F)cccn1[C@H](CN1CCCC1)c1ccccc1 ZINC000013436686 GI Annotated Anodyne COc1ccc([C@@H](C)Cn2ccnc2NC#N)cc1OC1Cc2ccccc2C1 ZINC000013438984 GI Annotated Anodyne CCN1CCc2c(sc(NC(=O)C(C)C)c2[C@@H](O)c2ccccc2Cl)C1 ZINC000013442812 GI Annotated Anodyne CCN1CCc2c(sc(NC(=O)C(C)C)c2[C@H](O)c2ccccc2Cl)C1 ZINC000013442814 GI Annotated Anodyne COc1ccc(-n2nc3c4ccccc4c[n+](Cc4ccccc4)c3c2O)cc1 ZINC000013448365 GI Annotated Anodyne O=[S@](Cc1cc(OCc2ccc(F)cc2)ccn1)c1nc2cscc2[nH]1 ZINC000013448741 GI Annotated Anodyne O=[S@@](Cc1cc(OCc2ccc(F)cc2)ccn1)c1nc2cscc2[nH]1 ZINC000013448744 GI Annotated Anodyne O=[S@@](Cc1cc(Oc2ccc(F)cc2F)ccn1)c1nc2cscc2[nH]1 ZINC000013448783 GI Annotated Anodyne Cc1sc(C)c2[nH]c([S@](=O)Cc3nccc(OC(C)C)c3Cl)nc12 ZINC000013448861 GI Annotated Anodyne Cc1sc(C)c2[nH]c([S@@](=O)Cc3nccc(OC(C)C)c3Cl)nc12 ZINC000013448864 GI Annotated Anodyne C=CC[C@H]1C(=O)N(CCN(C)C)c2ccccc2C[C@H]1c1ccc(OC)cc1 ZINC000013450645 GI Annotated Mild COc1cc(-c2cc(C(=O)O)cc3c2oc2cc(O)c(OC)cc23)ccc1O ZINC000013452399 GI Annotated Anodyne CCCc1cc2c(cc1O)C(C)(C)[C@H](CCc1ccc(S(C)(=O)=O)cc1)O2 ZINC000013453246 GI Annotated Anodyne CCCc1cc2c(cc1O)C(C)(C)[C@@H](CCc1ccc(S(C)(=O)=O)cc1)O2 ZINC000013453251 GI Annotated Anodyne COc1c(O)c(O)c2c(oc3oc(/C=C/c4ccccc4)cc(=O)c32)c1OC ZINC000013453942 GI Annotated Clean O=C(N[C@H]1C[C@H](C(=O)O)Nc2cc(Cl)cc(Cl)c21)OCc1ccccc1 ZINC000013455346 GI Annotated Anodyne COc1cc(OC)c2c(c1OC)CN(C)c1c-2ccc2cc3c(cc12)OCO3 ZINC000013458983 GI Annotated Anodyne COc1ccc2c(c1O)CCc1c(Cc3ccc(O)cc3)c(O)cc(OC)c1-2 ZINC000013460632 GI Annotated Anodyne CCCC(=O)OCOC(=O)CCCCCC1=C(C)C(=O)c2ccccc2C1=O ZINC000013470366 GI Annotated Mild COc1ccc([C@H]2c3sc(=O)[nH]c3S[C@H]3[C@H]4CC[C@H](C4)[C@@H]23)cc1OC ZINC000013471258 GI Annotated Anodyne COc1ccc([C@@H]2c3sc(=O)[nH]c3S[C@H]3[C@H]4CC[C@H](C4)[C@H]32)cc1OC ZINC000013471260 GI Annotated Anodyne COc1ccc([C@H]2c3sc(=O)[nH]c3S[C@H]3[C@H]4CC[C@H](C4)[C@H]23)cc1OC ZINC000013471262 GI Annotated Anodyne COc1ccc([C@@H]2c3sc(=O)[nH]c3S[C@H]3[C@H]4CC[C@H](C4)[C@@H]32)cc1OC ZINC000013471264 GI Annotated Anodyne O[C@@H]1c2ccc(F)cc2C[C@H]1N1CCC(c2cc(F)cc3c2OCCC3)CC1 ZINC000013471805 GI Annotated Anodyne c1ccc(-c2cc(-c3ccccc3)[n+](-c3nnn[nH]3)c(-c3ccccc3)c2)cc1 ZINC000013472134 GI Annotated Anodyne CN(C)Cc1ccccc1Sc1ccc(I)cc1N ZINC000013472752 GI Annotated Anodyne CC1(C)C(=O)NC(=O)c2c1ccc1[nH]c(Nc3c(Cl)cccc3Cl)nc21 ZINC000013475179 GI Annotated Anodyne CC1(C)C(=O)NC(=O)c2c1ccc1[nH]c(Nc3ccc(Cl)cc3Cl)nc21 ZINC000013475181 GI Annotated Anodyne CC1(C)C(=O)NC(=O)c2c1ccc1[nH]c(Cc3c(Cl)cccc3Cl)nc21 ZINC000013475189 GI Annotated Anodyne CCOC(=O)Cc1csc(NC(=S)N[C@@H](C)c2cccc3ccccc23)n1 ZINC000013477188 GI Annotated Anodyne CCOC(=O)Cc1csc(NC(=S)N[C@H](C)c2cccc3ccccc23)n1 ZINC000013477189 GI Annotated Anodyne C[C@@]1(c2nnc(-c3ccncc3)o2)CC(c2c(Cl)cccc2Cl)=NO1 ZINC000013478326 GI Annotated Anodyne C[C@]1(c2nnc(-c3ccncc3)o2)CC(c2c(Cl)cccc2Cl)=NO1 ZINC000013478328 GI Annotated Anodyne COc1cc2ccc3c(c2cc1OC)N(C)Cc1c(OC)c(OC)cc(OC)c1-3 ZINC000013480262 GI Annotated Anodyne CC1(C)CC(O)=C(/C(S)=N\c2ccccc2)/C(=N\CCN2CCOCC2)C1 ZINC000013482873 GI Annotated Mild C=C1C(=O)O[C@@]2(C)CC[C@H]1C[C@@H](OC(C)=O)/C(C)=C/C/C=C(\C)CC[C@H]2O ZINC000013483448 GI Annotated Mild Cc1nnn(C23C[C@H]4C[C@H](CC(CC(=O)Nc5ccc(C)c(Cl)c5)(C4)C2)C3)n1 ZINC000013483485 GI Annotated Anodyne C=C1[C@@H](O)CC[C@@H]2[C@@](C)([C@@H](C/C(C)=C/C(=O)O)OC(C)=O)[C@H](C)CC[C@@]12C ZINC000013484028 GI Annotated Mild CC(=O)OC/C(=C\C(=O)O)CC[C@@]1(C)[C@H](C)CC[C@@]2(C)C(CO)=CCC[C@H]12 ZINC000013484087 GI Annotated Anodyne CCN1C(=O)/C(=C/c2ccc(-c3ccsc3C(=O)OC)o2)SC1=S ZINC000013487532 GI Annotated Clean CN[C@@H]1CCc2ccc(-c3cc(O)c4cc(-c5cnco5)c(OC)cc4n3)cc21 ZINC000013487620 GI Annotated Anodyne CN[C@H]1CCc2ccc(-c3cc(O)c4cc(-c5cnco5)c(OC)cc4n3)cc21 ZINC000013487621 GI Annotated Anodyne O=C1c2ccccc2CCCN1CCN1CCC(n2ccc3ccccc32)CC1 ZINC000013488311 GI Annotated Anodyne CN(C)c1ccc(-c2cc3ncccc3c(NCc3cccc(CN)c3)n2)cc1 ZINC000013489192 GI Annotated Anodyne O=S(=O)(c1ccccc1)c1cc(Cl)cc(OCCNc2ccncc2)c1 ZINC000013494022 GI Annotated Anodyne C[C@H]1C[C@@H](C)CN(C(=O)c2ccc(CSc3nc4cc[nH]cc-4n3)cc2)C1 ZINC000013496466 GI Annotated Anodyne O=C(NCC[C@@H]1CN=C(c2ccccc2)c2ccccc2N1)c1cccs1 ZINC000013525928 GI Annotated Anodyne O=C(NCC[C@H]1CN=C(c2ccccc2)c2ccccc2N1)c1cccs1 ZINC000013525932 GI Annotated Anodyne O=C(NCC[C@@H]1CN=C(c2ccccc2)c2ccccc2N1)c1ccccc1F ZINC000013525941 GI Annotated Anodyne O=C(NCC[C@H]1CN=C(c2ccccc2)c2ccccc2N1)c1ccccc1F ZINC000013525944 GI Annotated Anodyne O=C(CCl)c1c(Br)sc(Br)c1Br ZINC000013528244 GI Annotated Reactive c1ccc(C(CCc2nc(CCNCCc3cnc[nH]3)c[nH]2)c2ccccc2)cc1 ZINC000013530305 GI Annotated Anodyne CCCOC(=O)c1c(C)c(C(=O)OC(C)(C)C)c(C)n1CN1CCCCC1 ZINC000013533568 GI Annotated Anodyne CCCOC(=O)c1c(C)c(C(=O)OC(C)(C)C)c(C)n1C(=O)OC(C)(C)C ZINC000013533587 GI Annotated Anodyne CCOc1ccc2c(c1)[nH]c1c3ccc4ccn(C)c4c3c3c(c21)C(=O)NC3=O ZINC000013534987 GI Annotated Bother COc1ccc2c(c1)[nH]c1c2c2c(c3c1c(C)cc1ccn(C)c13)C(=O)NC2=O ZINC000013535038 GI Annotated Bother CCCN(CCC)c1c(C)nc(-c2c(C)cc(C)cc2OC)n(CCF)c1=O ZINC000013536136 GI Annotated Anodyne C[C@]12CC[C@@H](O)C=C1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)CC[C@]12O ZINC000013545527 GI Annotated Anodyne CCOCC1=Cc2ccc(OC)cc2O[C@@H]1c1cc(OC)c(OC)c(OC)c1 ZINC000013553834 GI Annotated Anodyne CCOCC1=Cc2ccc(OC)cc2O[C@H]1c1cc(OC)c(OC)c(OC)c1 ZINC000013553835 GI Annotated Anodyne COc1cccc2c1cc1n2C(=O)[C@H](SSCc2ccccc2)N(C)C1=O ZINC000013553910 GI Annotated Reactive Cc1ncc(CO)c(/C=N/Nc2nc(Cl)c(Cl)c(Cl)c2Cl)c1O ZINC000013556333 GI Annotated Mild Cc1cccc(Oc2sc(C(=O)c3ccc([N+](=O)[O-])cc3)c(N)c2C#N)c1 ZINC000013556997 GI Annotated Mild CO[P@](=O)(c1ccccc1)N1CCCC(c2ccc(Br)cc2)=N1 ZINC000013557131 GI Annotated Anodyne CO[P@@](=O)(c1ccccc1)N1CCCC(c2ccc(Br)cc2)=N1 ZINC000013557132 GI Annotated Anodyne CCCC/C(=C\Cn1oc(=O)[nH]c1=O)c1cccc(Oc2ccc(OC)cc2)c1 ZINC000013558163 GI Annotated Anodyne NC1=N[C@@H](c2ccc(Oc3ccccc3)cc2)N(c2cccc(Cl)c2)C(N)=N1 ZINC000013559310 GI Annotated Anodyne NC1=N[C@H](c2ccc(Oc3ccccc3)cc2)N(c2cccc(Cl)c2)C(N)=N1 ZINC000013559311 GI Annotated Anodyne NC1=N[C@@H](c2cccc(Oc3ccccc3)c2)N(c2cccc(Cl)c2)C(N)=N1 ZINC000013559314 GI Annotated Anodyne NC1=N[C@H](c2cccc(Oc3ccccc3)c2)N(c2cccc(Cl)c2)C(N)=N1 ZINC000013559315 GI Annotated Anodyne CC1(C)OC(c2ccc(S(C)(=O)=O)c(F)c2)=C(c2cccc(Cl)c2)C1=O ZINC000013559400 GI Annotated Mild CCC(CC)N1CCN(C(=O)CCC(=O)c2ccc(C(F)(F)F)cc2)CC1 ZINC000013561112 GI Annotated Anodyne COc1ccc(Cn2c(N)c3cc(OC)c(OC)cc3nc2=S)cc1Cl ZINC000013571549 GI Annotated Anodyne CC(C)Oc1ccccc1OC[C@@H]1CN(Cc2ccc(Cl)cc2)CCO1 ZINC000013579630 GI Annotated Anodyne CC(C)Oc1ccccc1OC[C@H]1CN(Cc2ccc(Cl)cc2)CCO1 ZINC000013579632 GI Annotated Anodyne O=C1CCCC2=C1[C@@H](c1ccc(F)c(Br)c1)C1=C(O)OCCC1=N2 ZINC000013579971 GI Annotated Mild O=C1CCCC2=C1[C@H](c1ccc(F)c(Br)c1)C1=C(O)OCCC1=N2 ZINC000013579973 GI Annotated Mild O=C1CCC2=C1[C@@H](c1ccc(F)c(Br)c1)C1=C(O)CSCC1=N2 ZINC000013580006 GI Annotated Mild O=C1CCC2=C1[C@H](c1ccc(F)c(Br)c1)C1=C(O)CSCC1=N2 ZINC000013580008 GI Annotated Mild Cc1cccc(COc2nn3c(-c4ccco4)nnc3c3c2C2CCC3CC2)n1 ZINC000013580821 GI Annotated Anodyne CCCN(CCC)c1cc(C)nc2c(-c3ncc(N(C)C)cc3C)c(C)nn12 ZINC000013583108 GI Annotated Anodyne CCCN(CCC)c1cc(C)nc2c(-c3ccc(N(C)C)nc3C)c(C)nn12 ZINC000013583111 GI Annotated Anodyne CCCN(CC1CC1)c1cc(C)nc2c(-c3cnc(N(C)C)cc3C)c(C)nn12 ZINC000013583156 GI Annotated Anodyne CN1CC[C@H](c2ccc(Cl)cc2)[C@@H](CSCC(=O)N2CCCCC2)C1 ZINC000013584865 GI Annotated Anodyne CSc1nn(-c2c(Cl)cc(Cl)cc2Cl)c2nc(C)[nH]c(=O)c12 ZINC000013585086 GI Annotated Anodyne Cc1nc2c(c(C(F)(F)F)nn2-c2c(Cl)cc(Cl)cc2Cl)c(=O)[nH]1 ZINC000013585092 GI Annotated Anodyne CSc1nn(-c2c(Cl)cc(Cl)cc2Cl)c2nc(CF)[nH]c(=O)c12 ZINC000013585150 GI Annotated Anodyne O=c1[nH]c(-c2ccc(C(F)(F)F)c(Cl)c2)nn1-c1cc(Cl)ccc1O ZINC000013587050 GI Annotated Anodyne CNC(=S)[C@@]1(c2cccnc2)CCCC[C@@H]1CCNC(=O)c1ccc(F)cc1 ZINC000013590025 GI Annotated Anodyne COc1ccc(CCN[C@@]2(Cc3ccccc3)C[C@@H](C)N(C)C[C@@H]2C)cc1OC ZINC000013590279 GI Annotated Anodyne COc1ccc(CCN[C@]2(Cc3ccccc3)C[C@@H](C)N(C)C[C@@H]2C)cc1OC ZINC000013590280 GI Annotated Anodyne COc1ccc(CCN[C@]2(Cc3ccccc3)C[C@H](C)N(C)C[C@@H]2C)cc1OC ZINC000013590281 GI Annotated Anodyne Cc1nn(C)c(C)c1CN(Cc1nc(-c2cc(F)ccc2F)oc1C)C1CC1 ZINC000013593145 GI Annotated Anodyne COc1cccc(C[C@@]2(CO)CCCN(C/C=C/c3ccccc3OC)C2)c1 ZINC000013594387 GI Annotated Anodyne COc1cccc(C[C@]2(CO)CCCN(C/C=C/c3ccccc3OC)C2)c1 ZINC000013594389 GI Annotated Anodyne COc1ccc2c(c1)C=C(CN1CCC(CO)(CCc3ccccc3)CC1)CO2 ZINC000013596182 GI Annotated Anodyne COc1cccc(C[C@@]2(CO)CCCN(Cc3cn(C)c4ccccc34)C2)c1 ZINC000013596618 GI Annotated Anodyne COc1cccc(C[C@]2(CO)CCCN(Cc3cn(C)c4ccccc34)C2)c1 ZINC000013596621 GI Annotated Anodyne Cc1ccccc1C[C@@]1(CO)CCCN(C(=O)c2cc(-c3ccccc3)no2)C1 ZINC000013596660 GI Annotated Anodyne Cc1ccccc1C[C@]1(CO)CCCN(C(=O)c2cc(-c3ccccc3)no2)C1 ZINC000013596662 GI Annotated Anodyne Cc1cc2nc(C3CCN(C(=S)NCCCOC(C)C)CC3)[nH]c2cc1C ZINC000013598925 GI Annotated Anodyne CC(C)Cn1c(=O)n(C)c(=O)c2cc(NCc3ccc(C(C)(C)C)cc3)ccc21 ZINC000013603219 GI Annotated Anodyne CC(C)CNC(=O)c1cccnc1[S@@](=O)C(c1ccccc1)c1ccccc1 ZINC000013605223 GI Annotated Anodyne CC(C)CNC(=O)c1cccnc1[S@](=O)C(c1ccccc1)c1ccccc1 ZINC000013605225 GI Annotated Anodyne Oc1noc(C2CCNCC2)c1Cc1ccc2ccccc2c1Br ZINC000013607799 GI Annotated Anodyne Oc1noc(C2CCNCC2)c1Cc1ccc2cccc(Br)c2c1 ZINC000013607802 GI Annotated Anodyne Oc1noc(C2CCNCC2)c1Cc1ccc2ccc(Br)cc2c1 ZINC000013607805 GI Annotated Anodyne Oc1noc(C2CCNCC2)c1Cc1ccc2c(Br)cccc2c1 ZINC000013607806 GI Annotated Anodyne Cn1c(-c2ccc([S@@](C)=O)cc2)nc2c(Sc3ccc(F)cc3)ncnc21 ZINC000013608651 GI Annotated Anodyne Cn1c(-c2ccc([S@](C)=O)cc2)nc2c(Sc3ccc(F)cc3)ncnc21 ZINC000013608655 GI Annotated Anodyne Oc1cccnc1COc1nn2c(-c3ccccc3)nnc2c2c1C1CCC2CC1 ZINC000013610257 GI Annotated Anodyne O=C(Nc1ccccn1)c1nn2c(-c3ccccc3)nnc2c2c1C1CCC2CC1 ZINC000013610326 GI Annotated Anodyne CCS(=O)(=O)c1ccc(OC)c(Nc2ncc(-c3cccc(F)c3)o2)c1 ZINC000013611302 GI Annotated Anodyne CCS(=O)(=O)c1ccc(OC)c(Nc2ncc(-c3ccc(F)cc3)o2)c1 ZINC000013611311 GI Annotated Anodyne CCc1cccc(-c2cnc(Nc3cc(S(=O)(=O)CC)ccc3OC)o2)c1 ZINC000013611318 GI Annotated Anodyne CN(c1ccc2ncsc2c1)c1nc(O)nc(NC(C)(C)c2ccccc2)n1 ZINC000013611479 GI Annotated Anodyne CN(C)CCn1ccc2c(NS(=O)(=O)c3cccc4ccccc34)cccc21 ZINC000013611667 GI Annotated Anodyne C=CCOC(=O)C1=C[C@@H](C2CCCCC2)C[C@@H](OCc2ccc(CO)cc2)O1 ZINC000013634558 GI Annotated Mild O=C(O)C1=C[C@@H](c2csc3ccccc23)C[C@@H](OCc2ccc(CO)cc2)O1 ZINC000013634632 GI Annotated Anodyne O=C(O)C1=C[C@H](c2csc3ccccc23)C[C@H](OCc2ccc(CO)cc2)O1 ZINC000013634735 GI Annotated Anodyne CCO[C@@H]1OC(C(=O)Nc2ccccc2)=C[C@H](c2ccccc2)[C@H]1CCCO ZINC000013635005 GI Annotated Anodyne Oc1[nH]c2ccc(Br)cc2c1/N=N\C(S)=N/C[C@@H]1CCCO1 ZINC000013639007 GI Annotated Mild CC1=CS[C@@](OCC(C)C)(c2ccc(Br)cc2)c2noc(=O)n21 ZINC000013641917 GI Annotated Anodyne CC1=CS[C@](OCC(C)C)(c2ccc(Br)cc2)c2noc(=O)n21 ZINC000013641920 GI Annotated Anodyne CCCCO[C@@]1(c2ccc(Br)cc2)SC=C(C)n2c1noc2=O ZINC000013641952 GI Annotated Anodyne CCCCO[C@]1(c2ccc(Br)cc2)SC=C(C)n2c1noc2=O ZINC000013641955 GI Annotated Anodyne CC1=CS[C@@](OCc2ccccc2)(c2ccc(Cl)cc2)c2noc(=O)n21 ZINC000013642027 GI Annotated Anodyne CC1=CS[C@](OCc2ccccc2)(c2ccc(Cl)cc2)c2noc(=O)n21 ZINC000013642030 GI Annotated Anodyne COc1ccc(C[C@@H]2c3c(Br)cccc3CC[N+]2(C)C)cc1OC ZINC000013648601 GI Annotated Bother COc1ccc(C[C@H]2c3c(Br)cccc3CC[N+]2(C)C)cc1OC ZINC000013648604 GI Annotated Bother COc1ccc(C[C@@H]2c3cccc(Br)c3CC[N+]2(C)C)cc1OC ZINC000013648610 GI Annotated Bother COc1ccc(C[C@H]2c3cccc(Br)c3CC[N+]2(C)C)cc1OC ZINC000013648612 GI Annotated Bother CC(=O)Oc1ccc2c(c1)C[C@@H](C)n1c-2c(C=O)c2ccc(OC(C)=O)cc21 ZINC000013650945 GI Annotated Anodyne CC(=O)Oc1ccc2c(c1)C[C@H](C)n1c-2c(C=O)c2ccc(OC(C)=O)cc21 ZINC000013650946 GI Annotated Anodyne CC(=O)Oc1ccc2c(c1)C[C@@H](C)n1c-2c(C=O)c2cc(OC(C)=O)ccc21 ZINC000013650947 GI Annotated Anodyne CC(=O)Oc1ccc2c(c1)C[C@H](C)n1c-2c(C=O)c2cc(OC(C)=O)ccc21 ZINC000013650948 GI Annotated Anodyne CC[C@@H]1Cc2cc(OC(C)=O)ccc2-c2c(C=O)c3ccc(OC(C)=O)cc3n21 ZINC000013650949 GI Annotated Anodyne CC[C@H]1Cc2cc(OC(C)=O)ccc2-c2c(C=O)c3ccc(OC(C)=O)cc3n21 ZINC000013650950 GI Annotated Anodyne CC[C@@H]1Cc2cc(OC(C)=O)ccc2-c2c(C=O)c3cc(OC(C)=O)ccc3n21 ZINC000013650951 GI Annotated Anodyne CC[C@H]1Cc2cc(OC(C)=O)ccc2-c2c(C=O)c3cc(OC(C)=O)ccc3n21 ZINC000013650952 GI Annotated Anodyne CN(CCc1ccccc1)C[C@@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651082 GI Annotated Anodyne CN(CCc1ccccc1)C[C@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651083 GI Annotated Anodyne CC(C)(F)c1nccn1C[C@@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651110 GI Annotated Anodyne CC(C)(F)c1nccn1C[C@H]1CC(c2ccccc2)(c2ccccc2)C(=O)O1 ZINC000013651111 GI Annotated Anodyne CN(C)CCCOc1cc2oc3c(c2cc1Cl)C(=O)c1ccccc1C3=O ZINC000013651667 GI Annotated Clean CN(C)CCOc1cc2oc3c(c2c2ccccc12)C(=O)c1ccccc1C3=O ZINC000013651668 GI Annotated Clean CCCC(CCC)N1CCn2c(=O)n(-c3ccc(Cl)cn3)c3nc(C)cc1c32 ZINC000013652925 GI Annotated Anodyne C=CCCN(Cc1ccccc1)S(=O)(=O)c1ccccc1Br ZINC000013660024 GI Annotated Mild C[C@@]1(c2nnc(-c3ccc(Cl)cc3)o2)CC(c2ccc([N+](=O)[O-])cc2)=NO1 ZINC000013660344 GI Annotated Bother C[C@]1(c2nnc(-c3ccc(Cl)cc3)o2)CC(c2ccc([N+](=O)[O-])cc2)=NO1 ZINC000013660346 GI Annotated Bother O=C(Nc1nc2c(ccc3onc(-c4ccccc4[N+](=O)[O-])c32)s1)C1CC1 ZINC000013660913 GI Annotated Bother CC(C)C[C@@H](CSc1ccc(Br)cc1)N1CCN(C)CCC1=O ZINC000013661692 GI Annotated Anodyne CCCN1CCC(=O)N([C@H](CSc2ccc(OC)cc2)CC(C)C)CC1 ZINC000013661747 GI Annotated Anodyne COc1ccc([C@@H]2C[C@@](O)(c3ccccc3)Oc3cc(OC)cc(OC)c32)cc1 ZINC000013661767 GI Annotated Anodyne COc1ccc([C@H]2C[C@@](O)(c3ccccc3)Oc3cc(OC)cc(OC)c32)cc1 ZINC000013661769 GI Annotated Anodyne COc1ccc([C@@H]2C[C@](O)(c3ccccc3)Oc3cc(OC)cc(OC)c32)cc1 ZINC000013661771 GI Annotated Anodyne COc1ccc([C@H]2C[C@](O)(c3ccccc3)Oc3cc(OC)cc(OC)c32)cc1 ZINC000013661775 GI Annotated Anodyne CCCC[C@@H]1CN=C(N)N1CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000013662130 GI Annotated Anodyne CC[C@@H](C)[C@H]1CN=C(N)N1CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000013662153 GI Annotated Anodyne CC[C@H](C)[C@H]1CN=C(N)N1CCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000013662155 GI Annotated Anodyne O=C(C(=O)c1cc(Br)cs1)c1cc(Br)cs1 ZINC000013671725 GI Annotated Clean O=C(C(=O)c1ccc(Br)s1)c1ccc(Br)s1 ZINC000013671727 GI Annotated Clean CN1CC[C@@H](c2ccc(Cl)cc2)[C@H](CSCC(=O)N2CCCCC2)C1 ZINC000013677476 GI Annotated Anodyne CN1CC[C@@H](c2ccc(Cl)cc2)[C@@H](CSCC(=O)N2CCCCC2)C1 ZINC000013677497 GI Annotated Anodyne CN1CC[C@H](c2ccc(Cl)cc2)[C@H](CSCC(=O)N2CCCCC2)C1 ZINC000013677522 GI Annotated Anodyne CC(C)(O)c1ccn2c(-c3ccc(F)c(-c4ccc(F)cc4C#N)c3)cnc2n1 ZINC000013678277 GI Annotated Mild CC(C)COc1ccc(C(=O)c2ccc(OCC(C)C)c(CCC(N)=O)c2)cc1 ZINC000013678374 GI Annotated Anodyne CC(=O)Nc1cccc(-c2cncc(Nc3ccc4c(c3)OCCCO4)n2)c1 ZINC000013679256 GI Annotated Anodyne O=C1c2c(c3c4ccccc4[nH]c3c3ccccc23)C(=O)N1CCc1cnc[nH]1 ZINC000013679835 GI Annotated Bother COc1ccc2c(c1)C[C@@H](n1c(CCNCc3ccccc3)c[nH]c1=S)CO2 ZINC000013681210 GI Annotated Anodyne Nc1c(C(=O)c2cccc(-c3ccncc3)c2)cnn1-c1ccc(F)cc1F ZINC000013683057 GI Annotated Anodyne Nc1c(C(=O)c2cccc(CCC3(O)CCCC3)c2)cnn1-c1ccc(F)cc1 ZINC000013683081 GI Annotated Anodyne O=C(O)CCCCCCCn1nc(-c2ccccc2)n(-c2ccccc2)c1=O ZINC000013727532 GI Annotated Anodyne CN(C)/C(N)=N/c1nc(-c2cc(C(C)(C)C)c(O)c(C(C)(C)C)c2)ns1 ZINC000013727703 GI Annotated Mild C[C@@]1(O)CC(=O)O[C@@H](CSc2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)C1 ZINC000013730465 GI Annotated Anodyne C[C@]1(O)CC(=O)O[C@@H](CSc2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)C1 ZINC000013730468 GI Annotated Anodyne CCN/C(N)=N/c1nc(-c2ccc(OC)cc2)c(-c2ccc(OC)cc2)s1 ZINC000013735784 GI Annotated Mild COc1ccc(-c2nc(/N=C(\N)NC(C)C)sc2-c2ccc(OC)cc2)cc1 ZINC000013735787 GI Annotated Mild COc1ccc(-c2nc(/N=C(\N)N(C)C)sc2-c2ccc(OC)cc2)cc1 ZINC000013735790 GI Annotated Mild COc1ccc(-c2nc(C3=NNC(=O)CC3)sc2-c2ccc(OC)cc2)cc1 ZINC000013735880 GI Annotated Anodyne COc1cc(CCNCc2ccc(Cl)cc2)c(OC)cc1Br ZINC000013737381 GI Annotated Anodyne O=C(c1ccc2ccccc2c1)n1c2cc(O)c(O)cc2c2ccc(O)c(O)c21 ZINC000013737765 GI Annotated Clean CC(C)c1cccc(C(C)C)c1OC(=O)NC(=O)SCCN1CCOCC1 ZINC000013738036 GI Annotated Anodyne CN(C(=O)Cc1ccccc1N=C=S)[C@H](CN1CCCC1)c1ccccc1 ZINC000013738409 GI Annotated Reactive CN(C(=O)Cc1cccc(N=C=S)c1)[C@H](CN1CCCC1)c1ccccc1 ZINC000013738410 GI Annotated Reactive COc1cc(-c2cc3cc([C@@H](C)N(O)C(C)=O)ccc3o2)cc(OC)c1OC ZINC000013738946 GI Annotated Anodyne COc1cc(-c2cc3cc([C@H](C)N(O)C(C)=O)ccc3o2)cc(OC)c1OC ZINC000013738947 GI Annotated Anodyne O=C(NCC1CCCCC1)[C@H]1C2c3ccccc3C(c3ccccc32)[C@H]1C(=O)O ZINC000013738982 GI Annotated Anodyne CCCCCC(=O)O[C@H](CC=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000013740806 GI Annotated Mild CCC/C=C/C(=O)O[C@H](CC=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000013740807 GI Annotated Mild CC/C=C/CC(=O)O[C@H](CC=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000013740808 GI Annotated Mild C=CCC/C=C/C(=O)O[C@H](CC=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000013740811 GI Annotated Mild C=CCCCCC(=O)O[C@H](CC=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000013740812 GI Annotated Mild COc1ccc(Br)cc1-c1ncc(CN(C)Cc2ccccc2)[nH]1 ZINC000013741823 GI Annotated Anodyne CN(CCOCCNC(=S)Nc1cccc2ccccc12)Cc1ccccc1 ZINC000013742431 GI Annotated Anodyne COc1ccc(CCN[C@@H]2CCCc3c2ccc(=O)n3CC=C(C)C)cc1OC ZINC000013743313 GI Annotated Anodyne COc1ccc(CCN[C@H]2CCCc3c2ccc(=O)n3CC=C(C)C)cc1OC ZINC000013743314 GI Annotated Anodyne CC(C)c1ccc(Sc2cc3c(cc2NS(C)(=O)=O)CCC3=O)cc1 ZINC000013744802 GI Annotated Anodyne O=C1c2ccccc2COc2ccc(CCC(=O)N(O)C3CCCCC3)cc21 ZINC000013745518 GI Annotated Anodyne O=C([C@@H]1C2CCC(CC2)N1C(=O)CCCCC(C1CC1)C1CC1)N1CCCC1 ZINC000013756417 GI Annotated Anodyne O=C([C@@H]1C2CCC(CC2)N1C(=O)CCCC=C(C1CC1)C1CC1)N1CCCC1 ZINC000013756434 GI Annotated Anodyne O=C([C@@H]1C2CCC(CC2)N1C(=O)CC/C=C/C(C1CC1)C1CC1)N1CCCC1 ZINC000013756436 GI Annotated Anodyne CCOc1ccc(F)c(CCNC(=S)Nc2ccc(Cl)cn2)c1Cl ZINC000013759861 GI Annotated Anodyne COc1cccc2c1CCC[C@H]2CN(C)CCc1ccc2c(c1)C=CS2(=O)=O ZINC000013761425 GI Annotated Anodyne COc1cccc2c1CCC[C@H]2CN(C)CCc1ccc2nc(N)sc2c1 ZINC000013761444 GI Annotated Anodyne COc1ccc(CCCCNCCOc2cc(OC)cc3c2OCCC3)cc1 ZINC000013761779 GI Annotated Anodyne CCc1cccc(N(C)C(=N)Nc2ccccc2I)c1 ZINC000013776045 GI Annotated Anodyne CCC(C)(C)/N=C(\NC#N)Nc1ccc(I)c(N=[N+]=[N-])c1 ZINC000013777075 GI Annotated Mild O=C1CCOc2c(OCCNCCCCc3ccc(Cl)cc3)cc(F)cc21 ZINC000013780400 GI Annotated Anodyne CCN(CC)CCn1nc2c3cc(OC)ccc3sc3c(CN)ccc1c32 ZINC000013781157 GI Annotated Bother CCN(CC)C(=O)/C=C(\C)c1ccc(CCc2ccccc2)c(OCC(=O)O)c1 ZINC000013782716 GI Annotated Anodyne CCOC(=O)OC[C@@H]1O[C@H](c2ccccc2)C=C[C@@H]1Oc1cccc(N(C)C)c1 ZINC000013783037 GI Annotated Anodyne CCOC(=O)OC[C@H]1O[C@H](c2ccccc2)C=C[C@@H]1Oc1cccc(N(C)C)c1 ZINC000013783038 GI Annotated Anodyne CCOC(=O)OC[C@@H]1O[C@H](c2cc(C)cc(C)c2)C=C[C@@H]1OC(=O)OCC ZINC000013783132 GI Annotated Anodyne CCOC(=O)OC[C@H]1O[C@H](c2cc(C)cc(C)c2)C=C[C@@H]1OC(=O)OCC ZINC000013783133 GI Annotated Anodyne COc1ccc(O[C@@H]2C=C[C@@H](C#Cc3ccc(C(C)(C)C)cc3)O[C@@H]2CO)cc1 ZINC000013783136 GI Annotated Mild COc1ccc(O[C@H]2C=C[C@@H](C#Cc3ccc(C(C)(C)C)cc3)O[C@@H]2CO)cc1 ZINC000013783137 GI Annotated Mild COc1ccc(O[C@@H]2C=C[C@H](C#Cc3ccc(C(C)(C)C)cc3)O[C@@H]2CO)cc1 ZINC000013783138 GI Annotated Mild COc1ccc(O[C@H]2C=C[C@H](C#Cc3ccc(C(C)(C)C)cc3)O[C@@H]2CO)cc1 ZINC000013783139 GI Annotated Mild OC[C@H]1O[C@@H](c2ccc3c(c2)OCO3)C=C[C@@H]1Oc1cc(Cl)cc(Cl)c1 ZINC000013783162 GI Annotated Anodyne OC[C@H]1O[C@H](c2ccc3c(c2)OCO3)C=C[C@@H]1Oc1cc(Cl)cc(Cl)c1 ZINC000013783163 GI Annotated Anodyne CC(C)n1cc2c3c(cccc31)[C@H]1C=C(COC(=O)C3CCC3)CN(C)[C@@H]1C2 ZINC000013793986 GI Annotated Anodyne CCN(c1nc(C)cc(C)n1)c1c(Br)cc(N(C)C)cc1OC ZINC000013794413 GI Annotated Anodyne CCCCN(CCC#N)c1nc(C)nc(N(CC)c2ccc(N(C)C)cc2C)n1 ZINC000013794592 GI Annotated Mild COc1cc(Br)c(-n2cc(C#N)c3c(C)cc(C)nc32)c(OC)c1 ZINC000013794631 GI Annotated Mild COc1ccc(C(=O)c2ccc3c(c2)C(n2ccccc2=O)=CC(C)(C)O3)cc1 ZINC000013795368 GI Annotated Anodyne CC1(C)C=C(n2ccccc2=O)c2cc(C(=O)c3ccccc3F)ccc2O1 ZINC000013795380 GI Annotated Anodyne CC1(C)C=C(n2ccccc2=O)c2cc(C(=O)c3c(F)cccc3F)ccc2O1 ZINC000013795392 GI Annotated Anodyne CC1(C)C=C(n2ccccc2=O)c2cc(OCC(=O)c3ccccc3)ccc2O1 ZINC000013795411 GI Annotated Anodyne O=C([C@@H]1CCCN1)N1CCC[C@@H]1P1(=O)Oc2ccccc2-c2ccccc2O1 ZINC000013795537 GI Annotated Anodyne O=C([C@@H]1CCCN1)N1CCC[C@H]1P1(=O)Oc2ccccc2-c2ccccc2O1 ZINC000013795540 GI Annotated Anodyne O=C(c1ccc(Cl)c(Cl)c1)N1CCC(F)(CNCc2ccccn2)CC1 ZINC000013797238 GI Annotated Anodyne CCOC(=O)c1c(CC)c(C(=O)SCC)c(CC)[n+](C)c1C1CCCC1 ZINC000013801295 GI Annotated Anodyne O=C(c1cccc2ccccc12)N1CCN(Cc2ncc[nH]2)c2ccccc2C1 ZINC000013803043 GI Annotated Anodyne CCN1CCc2cc(Br)cc(OC)c2[C@@H]1Cc1ccccc1O ZINC000013805157 GI Annotated Anodyne CCN1CCc2cc(Br)cc(OC)c2[C@H]1Cc1ccccc1O ZINC000013805159 GI Annotated Anodyne CCN1CCc2cc(OC)cc(Br)c2[C@@H]1Cc1ccccc1O ZINC000013805164 GI Annotated Anodyne CCN1CCc2cc(OC)cc(Br)c2[C@H]1Cc1ccccc1O ZINC000013805167 GI Annotated Anodyne COc1ccccc1[C@H]1C(c2ccc(F)cc2)=NN(c2ccccc2)[C@@H]1CO ZINC000013813876 GI Annotated Anodyne aggregator CCOC(=O)[C@@H]1Oc2ccccc2C(c2cccc3ccccc23)=C1C(=O)OC ZINC000013814598 GI Annotated Anodyne CCOC(=O)[C@H]1Oc2ccccc2C(c2cccc3ccccc23)=C1C(=O)OC ZINC000013814600 GI Annotated Anodyne Cc1cc2c(c(C)c1Br)[C@H](c1ccc3c(c1)OCO3)CC(=O)O2 ZINC000013814850 GI Annotated Anodyne aggregator Cc1cc2c(c(C)c1Br)[C@@H](c1ccc3c(c1)OCO3)CC(=O)O2 ZINC000013814854 GI Annotated Anodyne aggregator CCCCC1=CC2=CC(=O)[C@@](C)(OC(=O)CC)C(=O)C2=CN1Cc1ccccc1 ZINC000013816969 GI Annotated Mild CCCCC1=CC2=CC(=O)[C@](C)(OC(=O)CC)C(=O)C2=CN1Cc1ccccc1 ZINC000013816973 GI Annotated Mild CCCCC1=CC2=CC(=O)[C@@](C)(OC(=O)CC)C(=O)C2=CN1C1CCCCC1 ZINC000013817027 GI Annotated Mild CCCCC1=CC2=CC(=O)[C@](C)(OC(=O)CC)C(=O)C2=CN1C1CCCCC1 ZINC000013817031 GI Annotated Mild CCCCC1=CC2=CC(=O)[C@@](C)(OC(=O)CC)C(=O)C2=CN1c1ccccc1 ZINC000013817359 GI Annotated Mild CCCCC1=CC2=CC(=O)[C@](C)(OC(=O)CC)C(=O)C2=CN1c1ccccc1 ZINC000013817361 GI Annotated Mild CCCCc1nc2c(c3c1C[C@H](C)OC3)CN(C(=O)Cc1cccs1)CC2 ZINC000013817461 GI Annotated Anodyne COC(=O)C[C@H]1c2ccccc2[C@H](Cc2ccc(OC)cc2)[C@H](C)N1C(=O)OC ZINC000013817731 GI Annotated Anodyne COC(=O)C[C@@H]1c2ccccc2[C@H](Cc2ccc(OC)cc2)[C@H](C)N1C(=O)OC ZINC000013817734 GI Annotated Anodyne COC(=O)C[C@H]1c2ccccc2[C@H](Cc2ccc(OC)cc2)[C@@H](C)N1C(=O)OC ZINC000013817737 GI Annotated Anodyne COC(=O)C[C@@H]1c2ccccc2[C@H](Cc2ccc(OC)cc2)[C@@H](C)N1C(=O)OC ZINC000013817740 GI Annotated Anodyne COC(=O)C[C@H]1c2ccccc2C(Cc2ccc(OC)cc2)=C(C)N1C(=O)OC ZINC000013817743 GI Annotated Anodyne COC(=O)C[C@@H]1c2ccccc2C(Cc2ccc(OC)cc2)=C(C)N1C(=O)OC ZINC000013817746 GI Annotated Anodyne COc1cc2cc(C(=O)CCC3CC[N+](C)(CC#N)CC3)sc2cc1OC ZINC000013818064 GI Annotated Mild COc1cc2cc(C(=O)CCc3cc[n+](CC4CC4)cc3)sc2cc1OC ZINC000013818079 GI Annotated Anodyne CCSc1ccnc(C[S@@](=O)c2nc3ccccc3n2CSC)c1C ZINC000013820826 GI Annotated Anodyne CCSc1ccnc(C[S@](=O)c2nc3ccccc3n2CSC)c1C ZINC000013820828 GI Annotated Anodyne O=S1(=O)c2cccc3cccc(c23)N1CCN1CC=C(c2ccccc2)CC1 ZINC000013823498 GI Annotated Anodyne CN(C)CC#CCCC(=O)[C@@](O)(c1ccccc1)C12CC3CC(CC(C3)C1)C2 ZINC000013825147 GI Annotated Mild CN(C)CC#CCCC(=O)[C@](O)(c1ccccc1)C12CC3CC(CC(C3)C1)C2 ZINC000013825149 GI Annotated Mild CC(C)c1occc1S(=O)(=O)c1ccc(OCCCNC(C)(C)C)cc1 ZINC000013827207 GI Annotated Anodyne CC(C)Cc1c(C(=O)O)c(C(F)F)nc(C(F)(F)F)c1C1=NCCS1 ZINC000013827923 GI Annotated Anodyne COCCn1cnc2c1-c1ccc(OC)c(c1)OC/C=C\COc1cccc-2c1 ZINC000013829238 GI Annotated Anodyne CCCN1CCC(=O)N([C@@H](CSc2ccc(OC)cc2)CC(C)C)CC1 ZINC000013830573 GI Annotated Anodyne CC(C)C[C@H](CSc1ccc(Br)cc1)N1CCN(C)CCC1=O ZINC000013830689 GI Annotated Anodyne CC(C)(C)n1ncc2c(=O)n(Cc3ccccc3SC(F)(F)F)cnc21 ZINC000013831294 GI Annotated Anodyne CC(C)(C)n1ncc2c(=O)n(Cc3ccc(SC(F)(F)F)cc3)cnc21 ZINC000013831302 GI Annotated Anodyne CC(=O)O[C@@H]1c2ccc(Br)cc2C(n2ccccc2=O)=CC1(C)C ZINC000013832195 GI Annotated Anodyne CC(=O)O[C@H]1c2ccc(Br)cc2C(n2ccccc2=O)=CC1(C)C ZINC000013832196 GI Annotated Anodyne CCOC(=O)c1c(C)oc2c1c(/C=N/C[C@@H]1CCCO1)c(O)c1ccccc12 ZINC000013837645 GI Annotated Mild CCOC(=O)c1c(C)oc2c1c(/C=N/C[C@H]1CCCO1)c(O)c1ccccc12 ZINC000013837648 GI Annotated Mild COc1cc2[nH]cc(C(=O)O)/c(=N\c3ccc(Cl)cc3Cl)c2cc1OC ZINC000013862193 GI Annotated Anodyne C[C@H]([C@@H](O)c1ccccc1)N(C)/C(=N/c1ccc(Cc2ccccc2)cc1)NC#N ZINC000013863337 GI Annotated Mild O=S(=O)(O)c1cc(O)c(/N=C/c2c(O)ccc3ccccc23)c2ccccc12 ZINC000013864585 GI Annotated Mild O=S(=O)(O)c1cc(O)c(NCc2c(O)ccc3ccccc23)c2ccccc12 ZINC000013864586 GI Annotated Clean COCC/N=c1\scc(-c2ccccc2)n1/N=C/c1c[nH]c2ccccc12 ZINC000013865520 GI Annotated Mild COc1ccc(O)c(/C=N/n2c(-c3ccco3)cs/c2=N\c2cccnc2)c1 ZINC000013878654 GI Annotated Mild CC(=N)[C@H](C#N)C(=O)CSc1nn(-c2ccc(Cl)cc2)c(=S)s1 ZINC000013879037 GI Annotated Mild CCS(=O)(=O)c1ccc(OC)c(-c2ccc([C@@H](C)N3CCCCC3)[nH]2)c1 ZINC000013904798 GI Annotated Anodyne CC[C@H](C)/C=C(\C)C1=Cc2cc3c(c(O)c2[C@@H](OC)O1)C(=O)C(=O)C(OC)=C3 ZINC000013915778 GI Annotated Mild in-vitro CC[C@H](C)/C=C(\C)C1=Cc2cc3c(c(O)c2[C@H](OC)O1)C(=O)C(=O)C(OC)=C3 ZINC000013915779 GI Annotated Mild in-vitro N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@@H](O)c2cccc(C#N)c2)c1 ZINC000013917537 GI Annotated Reactive C=C[C@H]1O[C@@]1(C)C[C@@H](C)/C(C)=C/C=C(C)\C=C(OC)\C(=C/C(=O)OC)OC ZINC000013917926 GI Annotated Mild CN(CC1CC1)[C@@H](c1cccc(O)c1)C(C)(C)C(=O)NCCc1ccccc1 ZINC000013917993 GI Annotated Anodyne C/C=C(\C)[C@@H]1C(C)=C[C@@H]2C[C@H](C)C[C@H](C)[C@@H]2[C@@H]1C(=O)C1=C[C@@](C)(OC)NC1=O ZINC000013918788 GI Annotated Mild O=C(C[C@H]1CN2CCC1CC2)Nc1cc2ccc(Br)cc2s1 ZINC000013974847 GI Annotated Anodyne CCC[C@H](CO)NC(=O)c1cnc(-c2ccc(C)cc2)c(-c2ccc(C)cc2)n1 ZINC000013979851 GI Annotated Anodyne CCN1CCN(C(=O)c2cn3c4c(cccc24)CC[C@H]3C2CCCCC2)CC1 ZINC000013983276 GI Annotated Anodyne CCCCCCCCCCCCCC[C@H](O)[C@@]1(O)C(=O)C=C[C@@H]1OC(C)=O ZINC000135665098 GI Annotated Mild C/C1=C/CC(C)(C)/C=C\C[C@@]2(C)Oc3cc(O)c(=O)cc(C)c3C[C@@H]2C[C@H]1O ZINC000135733817 GI Annotated Anodyne CCO[C@@]1(C(F)(F)F)O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@]42OO3 ZINC000135739182 GI Annotated Reactive CCO[C@@]1(C(F)(F)F)O[C@@H]2O[C@]3(C)CC[C@H]4[C@H](C)CC[C@H]([C@H]1C)[C@]42OO3 ZINC000135739223 GI Annotated Reactive COc1cc2ccc3c(CC[N+](C)(C)C)cc(OC)c(OC)c3c2cc1OC ZINC000135876791 GI Annotated Bother O=C1C=CC(NC(=O)C2(c3ccccc3)CCCC2)=C/C1=C1/Nc2ccccc2O1 ZINC000135937537 GI Annotated Mild CC/C=C/C[C@@H](Br)[C@H]1C[C@H]2O[C@H](C=C=CBr)C[C@H]2O1 ZINC000136350951 GI Annotated Reactive S=c1[nH]nc(-c2cc(-c3ccccc3)n[nH]2)n1N/C=C1\C=Nc2ccccc21 ZINC000136374353 GI Annotated Anodyne C=CCON/C(C)=C1\C(=O)C(CC)=C(c2ccccc2)N(c2ccccc2)C1=O ZINC000136379251 GI Annotated Mild CC(=O)O[C@@H]1C[C@H](Br)C(C)(C)C=C1[C@@H](Br)CCl ZINC000136387780 GI Annotated Reactive CN(C)CCCSc1nc2c(Br)cc(Br)cc2[nH]1 ZINC000136496832 GI Annotated Anodyne COc1ccccc1NC(=O)C1=C(C)N=C2CCCC(=O)[C@H]2[C@@H]1c1ccc(C)o1 ZINC000136650765 GI Annotated Anodyne COc1ccccc1NC(=O)C1=C(C)N=C2CCCC(=O)[C@H]2[C@H]1c1ccc(C)o1 ZINC000136650828 GI Annotated Anodyne Clc1ccc2nc(CSC3=NN/C(=C4\C=Nc5ccccc54)O3)cn2c1 ZINC000136836497 GI Annotated Anodyne CCCCCc1ccc(C(=O)NCC(=O)N[C@@H]2CCCc3ccccc32)cc1 ZINC000136970536 GI Annotated Anodyne CCCCCc1ccc(C(=O)NCC(=O)N[C@H]2CCCc3ccccc32)cc1 ZINC000136970582 GI Annotated Anodyne COC(=O)[C@]1(OC(C)=O)C[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C=O)[C@H]2CC[C@H]1C3 ZINC000137081507 GI Annotated Mild in-man endogenous CC[C@H](Br)[C@H]1CC=CC[C@@H]2O[C@@H](C=C=CBr)C[C@@H]2O1 ZINC000137129903 GI Annotated Reactive O=C(Nc1ccc(F)cc1Cl)c1n[nH]c(C(F)(F)F)c1C(F)(F)F ZINC000137134391 GI Annotated Anodyne C[C@H]([C@H]1CC[C@H]2[C@@H]3CC[C@H]4C(=O)C(NC=O)=CC[C@]4(C)[C@H]3CC[C@@]21C)N(C)C ZINC000137366756 GI Annotated Mild COc1ccc(-c2ccc(CCCNc3ccc(CN(C)C)cc3)nn2)cc1 ZINC000137451178 GI Annotated Anodyne CC(=O)OC/C(=C/C(=O)O)CC[C@@H]1[C@@H](C=O)C=C[C@@H]2C(C)(C)CCC[C@@]12C ZINC000137463623 GI Annotated Mild Oc1ccc(Cl)c2c1CN[C@H](CN1CCC3(CCc4ccccc43)CC1)C2 ZINC000137466734 GI Annotated Anodyne Oc1ccc(Cl)c2c1CN[C@@H](CN1CCC3(CCc4ccccc43)CC1)C2 ZINC000137466796 GI Annotated Anodyne O=C1[C@@H]2[C@@H](C(=O)N1c1ccncc1)[C@H](c1ccccc1)C=C[C@H]2c1ccccc1 ZINC000137570940 GI Annotated Anodyne C=C[C@H]1O[C@H]2CC=CC[C@H](C=C=CBr)O[C@H]2C[C@@H]1Br ZINC000137579650 GI Annotated Reactive C=C(C)[C@@H](CC/C(C)=C/COc1c(OC)cc(/C=C/CO)cc1OC)OO ZINC000137701826 GI Annotated Reactive O=C1[C@@H]2[C@@H](C(=O)N1c1cccnc1)[C@H](c1ccccc1)C=C[C@H]2c1ccccc1 ZINC000137771921 GI Annotated Anodyne O=C1[C@H]2[C@@H](c3ccccc3)C=C[C@@H](c3ccccc3)[C@@H]2C(=O)N1c1ccncc1 ZINC000137865674 GI Annotated Anodyne O=C1CCn2c(nc3ccccc32)[C@@H]1C(=O)Nc1ccc(-c2ccccc2)cc1 ZINC000138106111 GI Annotated Anodyne Cc1cc(F)ccc1Oc1ccc2c(-c3cc(C(N)=O)ccc3C)nncc2n1 ZINC000138255600 GI Annotated Anodyne Cc1cn(CCCn2c(=S)[nH]c3sc(-c4ccccc4)cc3c2=O)cn1 ZINC000138362265 GI Annotated Anodyne Cc1cn(CCCn2c(=S)[nH]c3sc4c(c3c2=O)CCCCCC4)cn1 ZINC000138362871 GI Annotated Anodyne Cc1cn(CCCn2c(=S)[nH]c3sc(Cc4ccccc4)cc3c2=O)cn1 ZINC000138385280 GI Annotated Anodyne COc1ccc2c3c(c4cc5c(cc4c2c1OC)OCO5)C[C@H]1CCCN1C3 ZINC000138503730 GI Annotated Bother CN[C@@H](Cc1ccccc1)[C@@H]1c2[nH]c3cc(Br)ccc3c2CCN1C ZINC000138505043 GI Annotated Anodyne COc1ccc([C@@]2(C)Cc3cc(OCC(=O)O)c(Cl)c(Cl)c3C2=O)cc1 ZINC000138765412 GI Annotated Anodyne COc1ccc([C@]2(C)Cc3cc(OCC(=O)O)c(Cl)c(Cl)c3C2=O)cc1 ZINC000138765517 GI Annotated Anodyne CC1=CC[C@@H]([C@@](C)(Cl)CCl)O[C@@H]1C(Br)Br ZINC000138783309 GI Annotated Reactive O=C(Oc1ccccc1)N1c2ccccc2[C@@]23O[C@]24CCC[C@H]3C#C/C=C/C#C[C@H]14 ZINC000138786883 GI Annotated Mild CC[C@H](C)Cn1c(-c2c(F)cc(F)cc2F)c(Cl)nc(-n2cccn2)c1=O ZINC000138936480 GI Annotated Anodyne CC1(C)[C@@H](Br)CC[C@]2(C)O[C@@H](CBr)C(CO)=CC[C@@H]12 ZINC000138981980 GI Annotated Reactive c1ccc(CCNc2nccnc2Oc2ccc(Nc3ccccn3)cc2)nc1 ZINC000139164548 GI Annotated Anodyne c1ccc(Nc2ccc(Oc3nccnc3NCCc3cccnc3)cc2)nc1 ZINC000139164666 GI Annotated Anodyne c1ccc(Nc2ccc(Oc3nccnc3NCCc3ccncc3)cc2)nc1 ZINC000139196195 GI Annotated Anodyne CC[C@@H](COC)NC(=O)c1cccnc1Oc1ccc(Nc2ccccn2)cc1 ZINC000139250283 GI Annotated Anodyne CC[C@H](COC)NC(=O)c1cccnc1Oc1ccc(Nc2ccccn2)cc1 ZINC000139250398 GI Annotated Anodyne CC(=O)c1cccc(-c2nccnc2C2CN(c3ccc4ccccc4n3)C2)c1 ZINC000139332979 GI Annotated Anodyne CN(C)c1ccc(-c2nccnc2C2CN(c3ccc4ccccc4n3)C2)cc1 ZINC000139347436 GI Annotated Anodyne O=C(c1cccnc1Oc1ccc(Nc2ccccn2)cc1)N1CCSC1 ZINC000139348256 GI Annotated Anodyne CCCCCOc1ccc(C(=O)NCC(=O)N[C@@H]2CCCc3ccccc32)cc1 ZINC000139455356 GI Annotated Anodyne CCCCCOc1ccc(C(=O)NCC(=O)N[C@H]2CCCc3ccccc32)cc1 ZINC000139455499 GI Annotated Anodyne C=C1CC/C=C(/C)CC[C@H](/C(=C/C=C/C(C)(C)O)COC(C)=O)[C@H]1C(=O)OC ZINC000139460118 GI Annotated Mild O=C(NCCCCl)c1cccnc1Oc1ccc(Nc2ccccn2)cc1 ZINC000139482681 GI Annotated Reactive CC(=O)O[C@H]1O[C@@H]2OC(=O)[C@@H]3CC[C@@H]4[C@@]5(C)CCCC(C)(C)[C@@H]5CC[C@]14[C@H]23 ZINC000139561155 GI Annotated Anodyne C[N+]12CCC(OC(=O)Nc3ncsc3-c3cccc(Cl)c3)(CC1)CC2 ZINC000139562396 GI Annotated Bother O=c1ccc(-c2cc3c(cc2F)[C@H](c2ccc(Cl)c(Cl)c2)CNC3)n[nH]1 ZINC000139623464 GI Annotated Anodyne O=c1ccc(-c2cc3c(cc2F)[C@@H](c2ccc(Cl)c(Cl)c2)CNC3)n[nH]1 ZINC000139623561 GI Annotated Anodyne NC1=N[C@@H](CCc2ccc(N[C@@H](c3ccc(Cl)cn3)C(F)(F)F)cc2)CO1 ZINC000139693962 GI Annotated Anodyne NC1=N[C@@H](CCc2ccc(N[C@H](c3ccc(Cl)cn3)C(F)(F)F)cc2)CO1 ZINC000139694112 GI Annotated Anodyne CC1=C[C@@H]2/C=C(\C)CCCC(=O)CCC(=O)[C@]23C(=O)N[C@@H](CC(C)C)[C@@H]3[C@@H]1C ZINC000139744841 GI Annotated Anodyne COc1cccc(-c2nccnc2C2CN(c3ccc4ccc(F)cc4n3)C2)c1 ZINC000139793597 GI Annotated Anodyne C=C1CCC[C@@H]2[C@]1(C)CC[C@H](C)[C@@]2(C)CC/C(C)=C/C(=O)OC(CO)CO ZINC000139914920 GI Annotated Mild Cc1ccc(O)cc1Nc1ccnc2ccc(C(=O)NCC3CCOCC3)cc12 ZINC000139938544 GI Annotated Anodyne CCN1CCN(C(=O)c2cn3c4c(cccc24)CC[C@@H]3C2CCCCC2)CC1 ZINC000014025036 GI Annotated Anodyne CCC[C@@H](CO)NC(=O)c1cnc(-c2ccc(C)cc2)c(-c2ccc(C)cc2)n1 ZINC000014209219 GI Annotated Anodyne CO[C@H]1O[C@@]2(C)CC[C@H]3CCC[C@@H](CCOCc4ccc(F)cc4)[C@@]13OO2 ZINC000014293495 GI Annotated Reactive CC(=O)Nc1ccc(C(=O)N(C2=N[C@H](C)CS2)c2ccc(Cl)cc2)cc1 ZINC000014381453 GI Annotated Anodyne CC(=O)Nc1ccc(C(=O)N(C2=N[C@@H](C)CS2)c2ccc(Cl)cc2)cc1 ZINC000014381454 GI Annotated Anodyne COc1cc([C@H]2c3cc(OC)c(O)c(OC)c3C=C(C)[C@@H]2C)cc(OC)c1O ZINC000014435366 GI Annotated Anodyne in-vitro biogenic COc1cc([C@@H]2c3cc(OC)c(O)c(OC)c3C=C(C)[C@H]2C)cc(OC)c1O ZINC000014435371 GI Annotated Anodyne COc1ccc(C(=O)O[C@@H]2C[C@@H]3[C@@H](C=C2C)C(C)(C)CCC[C@@]3(C)O)cc1O ZINC000014439380 GI Annotated Anodyne COC[C@@H]1C(=O)O[C@H]2C/C(C)=C/C/C=C(\C(=O)OC)CC/C=C(\C)CC[C@@H]21 ZINC000014445709 GI Annotated Anodyne COc1cc(O)c(C(=O)O)c(CC(=O)CCCCCCCCCCCO)c1 ZINC000014488259 GI Annotated Anodyne CC(C)=C[C@H](O)C(=O)/C(C)=C/CC/C(C)=C/C[C@@]1(O)Oc2cccc(C)c2C1=O ZINC000014492202 GI Annotated Mild CC(C)=C[C@@H](O)C(=O)/C(C)=C/CC/C(C)=C/C[C@]1(O)Oc2cccc(C)c2C1=O ZINC000014492208 GI Annotated Mild C/C(=C\C[C@@]1(O)Oc2cccc(C)c2C1=O)CC/C=C(\C)C(=O)/C=C/C(C)(C)O ZINC000014492211 GI Annotated Mild C/C(=C\C[C@]1(O)Oc2cccc(C)c2C1=O)CC/C=C(\C)C(=O)/C=C/C(C)(C)O ZINC000014492214 GI Annotated Mild CC(=O)OC/C(=C/C(=O)O)CC[C@@H]1[C@@H](C(=O)O)C=C[C@@H]2C(C)(C)CCC[C@@]12C ZINC000014499641 GI Annotated Anodyne CC(C)S(=O)(=O)c1ccc2nccc(Nc3n[nH]c4ccc(F)cc34)c2c1 ZINC000140004931 GI Annotated Anodyne C=C(CCl)[C@@H]1CCC2=C[C@@H](OC2=O)[C@@H](C(=C)C)c2cc(C(=O)OC)c(o2)C1 ZINC000140022770 GI Annotated Reactive COc1cc(-c2nccnc2C2CN(c3ccc4ccccc4n3)C2)ccc1F ZINC000140118318 GI Annotated Anodyne COc1ccc(-c2nccnc2C2CN(c3ccc4ccccc4n3)C2)cc1F ZINC000140121454 GI Annotated Anodyne COc1ccc(CNc2nccnc2C2CN(c3ccc4ccccc4n3)C2)cc1 ZINC000140124300 GI Annotated Anodyne COc1cccc(-c2nccnc2C2CN(c3nc4ccccc4cc3C#N)C2)c1 ZINC000140138725 GI Annotated Anodyne N#Cc1ccc(-c2nccnc2C2CN(c3ccc4ccccc4n3)C2)cc1F ZINC000140140191 GI Annotated Anodyne CC(=O)c1ccc(-c2nccnc2C2CN(c3ccc4ccccc4n3)C2)cc1 ZINC000140141332 GI Annotated Anodyne c1ccc2nc(N3CC(c4nccnc4-c4ccc5cc[nH]c5c4)C3)ncc2c1 ZINC000140145414 GI Annotated Anodyne N#Cc1cc(-c2nccnc2C2CN(c3ccc4ccccc4n3)C2)ccc1F ZINC000140183280 GI Annotated Anodyne CN(C)c1cccc(-c2nccnc2C2CN(c3ccc4ccccc4n3)C2)c1 ZINC000140184239 GI Annotated Anodyne COc1cccc(-c2nccnc2C2CN(c3nccc(-c4ccccc4)n3)C2)c1 ZINC000140185540 GI Annotated Anodyne Cn1ccc2ccc(-c3nccnc3C3CN(c4ncc5ccccc5n4)C3)cc21 ZINC000140202596 GI Annotated Anodyne Cn1ccc2cc(-c3nccnc3C3CN(c4ncc5ccccc5n4)C3)ccc21 ZINC000140224731 GI Annotated Anodyne CC(C)[C@@H]1C[C@H]2C[C@@]13CC[C@]1(C)[C@@H](Br)CC[C@@](C)(O)[C@H]1[C@@H]3[C@H]2O ZINC000140402202 GI Annotated Reactive CC(C)[C@H]1C[C@H]2C[C@@]13CC[C@]1(C)[C@@H](Br)CC[C@@](C)(O)[C@H]1[C@@H]3[C@H]2O ZINC000140402378 GI Annotated Reactive COc1cc(/C=C/CO)cc(OC)c1OC/C=C(\C)C/C=C/C(C)(C)OO ZINC000140444981 GI Annotated Reactive CC(=O)O[C@@H]1O[C@H]2OC(=O)C[C@@H]1[C@@H]2[C@]12CC[C@H]3C(C)(C)CCC[C@]3(C)[C@H]1C2 ZINC000140541314 GI Annotated Anodyne C/C=C\[C@@H]1C[C@@H]1C1=C(Br)[C@H]2O[C@H](C=C=CBr)C[C@H]2O1 ZINC000140606279 GI Annotated Anodyne Cc1nnc([C@@H]2CCCN2C(=O)OC(C)(C)C)n1Cc1ccc(Cl)cc1 ZINC000140678063 GI Annotated Anodyne CC[C@H](C)COc1ccc([C@H](CO)NC(=O)[C@H]2C[C@@H]2c2cccs2)c(C)c1 ZINC000140905664 GI Annotated Anodyne O=C(O)C[C@@H]1CCN([C@@H]2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 ZINC000140968528 GI Annotated Anodyne COC1CCC2(CC1)Cc1ccc(CC3CCCCC3)cc1[C@]21N=C(N)N(C)O1 ZINC000141079014 GI Annotated Anodyne COC1CCC2(CC1)Cc1ccc(CC3CCCCC3)cc1[C@@]21N=C(N)N(C)O1 ZINC000141079228 GI Annotated Anodyne C/C1=C\CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)[C@@H](CNCc3ccc4occc4c3)[C@@H]2CC1 ZINC000141169575 GI Annotated Anodyne C/C1=C\CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)[C@@H](CN[C@H]3CCCc4ccccc43)[C@@H]2CC1 ZINC000141169763 GI Annotated Anodyne Cc1onc(-c2ccc(F)cc2F)c1COc1ccc(C(=O)NC(C)C)cn1 ZINC000141352957 GI Annotated Anodyne Cc1onc(-c2cc(F)ccc2F)c1COc1ccc(C(=O)NC(C)C)cn1 ZINC000141363893 GI Annotated Anodyne COc1cc(-c2nc(/C=C/c3ccc(F)cc3)n(C)n2)ccc1-n1cnc(C)c1 ZINC000141405765 GI Annotated Anodyne CC[C@H](C)COc1ccc([C@H](CN)NC(=O)[C@H]2C[C@@H]2c2cccs2)c(C)c1 ZINC000141407501 GI Annotated Anodyne Cc1onc(-c2ccc(F)c(F)c2)c1COc1ccc(C(=O)NC(C)C)cn1 ZINC000141429034 GI Annotated Anodyne CC[C@@H](C)C(=O)OC/C=C/c1c(OC)cc(OC(=O)[C@H](C)CC)cc1OC ZINC000141606439 GI Annotated Anodyne Cc1cnc(-c2cccc(Cn3nc(-c4cc(F)cc(F)c4)ccc3=O)c2)o1 ZINC000141749815 GI Annotated Anodyne CCCc1c(-c2ccc(OC)c(OC)c2)[nH]c2c(OC)ccc(OC)c2c1=O ZINC000141822347 GI Annotated Anodyne COc1cccc(-c2cc(N[C@H](CCO)c3cccc(OC)c3)nc(C)n2)c1 ZINC000142010352 GI Annotated Anodyne COc1cccc(-c2cc(N[C@@H](CCO)c3cccc(OC)c3)nc(C)n2)c1 ZINC000142010545 GI Annotated Anodyne CC(=O)OC[C@@H](CCO)CC[C@@]1(C)[C@H](C)CC[C@@]2(C)C(C(=O)O)=CCC[C@H]12 ZINC000142044468 GI Annotated Anodyne CCC(=O)Nc1ccc(-c2nnc3n2-c2cccnc2Nc2ccccc2-3)cc1 ZINC000142044599 GI Annotated Anodyne COc1cccc([C@H](C)Nc2nccc(N3C(=O)OC[C@H]3c3ccccc3)n2)c1 ZINC000142052899 GI Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](C)c2nc3ccccc3s2)n1 ZINC000142077903 GI Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@H](C)c2nc3ccccc3s2)n1 ZINC000142078098 GI Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](C)c2ccc3cccnc3c2)n1 ZINC000142087172 GI Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](C)c2ccc3ncccc3c2)n1 ZINC000142087857 GI Annotated Anodyne CC(C)c1cc(F)c([C@H](C)Nc2ncc(F)c(N3CCOC3=O)n2)cc1F ZINC000142096627 GI Annotated Anodyne C[C@H](Nc1nccc(N2CCOC2=O)n1)c1ccc(Oc2ccccc2)cc1 ZINC000142122549 GI Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](C)c2cc(CC(C)(C)C)on2)n1 ZINC000142123336 GI Annotated Anodyne COc1cccc([C@H](C)Nc2nccc(N3C(=O)OC[C@@H]3c3ccccc3)n2)c1 ZINC000142130169 GI Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](C)c2ccc(C3(C)CC3)nc2)n1 ZINC000142136054 GI Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](C)c2cccc(-n3cccc3)c2)n1 ZINC000142151168 GI Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@H](C)c2cccc(-n3cccc3)c2)n1 ZINC000142151375 GI Annotated Anodyne Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)N2CCCCC2)cn1 ZINC000142188311 GI Annotated Anodyne O=C(CNc1ccccc1)Nc1nc2c(C(F)(F)F)cc3[nH]ncc3c2s1 ZINC000142280454 GI Annotated Anodyne COc1cccc(NC(C)(C)C(=O)Nc2nc3ccc4[nH]ncc4c3s2)c1 ZINC000142299604 GI Annotated Anodyne COc1ccc(NC(C)(C)C(=O)Nc2nc3ccc4[nH]ncc4c3s2)cc1 ZINC000142311121 GI Annotated Anodyne Cc1cccc2c1cc(C)n2-c1nc2c(c(NCc3ccccc3)n1)CNCC2 ZINC000142459802 GI Annotated Anodyne COC(=O)c1ccc(OCc2c(-c3ccccc3)noc2C(F)(F)F)nc1 ZINC000142476951 GI Annotated Anodyne Oc1ccc(-c2cnc(-c3cc(O)c(O)cc3Br)s2)cc1O ZINC000142482254 GI Annotated Anodyne Oc1ccc(-c2ncc(-c3cc(O)c(O)cc3Br)s2)cc1O ZINC000142487655 GI Annotated Anodyne Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2c(F)cccc2F)s1 ZINC000142566068 GI Annotated Anodyne Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccccc2Cl)s1 ZINC000142566518 GI Annotated Anodyne Cc1ccc(-c2noc(C)c2COc2ccc(C(=O)NC(C)C)cn2)c(F)c1 ZINC000142593555 GI Annotated Anodyne Cn1nc(-c2nccs2)cc1-c1ccc(C(=O)Nc2ncccc2F)s1 ZINC000142593940 GI Annotated Anodyne Cn1nc(C(F)(F)F)cc1-c1sc(C(=O)Nc2ccccc2F)cc1N ZINC000142601432 GI Annotated Anodyne COC[C@@H](C)NC(=O)c1cc(NC(=O)c2ccco2)cc(-c2ccc(C)cc2)c1 ZINC000142608394 GI Annotated Anodyne COC[C@H](C)NC(=O)c1cc(NC(=O)c2ccco2)cc(-c2ccc(C)cc2)c1 ZINC000142608599 GI Annotated Anodyne CCN(C(=O)CC(C)C)c1cc(C(=O)N[C@@H](C)CO)cc(-c2ccc(C)cc2)c1 ZINC000142639516 GI Annotated Anodyne CCN(C(=O)CC(C)C)c1cc(C(=O)N[C@H](C)CO)cc(-c2ccc(C)cc2)c1 ZINC000142639684 GI Annotated Anodyne Cn1nc(C(F)(F)F)cc1-c1ncc(NC(=O)c2ccccc2Cl)s1 ZINC000142654457 GI Annotated Anodyne Cn1nc(-c2nccs2)cc1-c1ccc(C(=O)Nc2ccncc2F)s1 ZINC000142665703 GI Annotated Anodyne Cn1nc(-c2ccco2)cc1-c1ccc(C(=O)Nc2c(F)cncc2F)s1 ZINC000142668743 GI Annotated Anodyne Cn1nc(C(F)(F)F)cc1-c1cnc(NC(=O)c2ccc(Cl)cc2)s1 ZINC000142675203 GI Annotated Anodyne Cn1nc(C(F)(F)F)cc1-c1ccc(NC(=O)c2c(F)cncc2F)s1 ZINC000142677147 GI Annotated Anodyne Cc1cc2c(cc1-c1cnc(NC(=O)c3ccncc3F)s1)OC(F)(F)O2 ZINC000142681650 GI Annotated Anodyne C=C1CC[C@@H]2O[C@@]2(C)CC[C@@H]2/C(=C/C=C/C(C)(C)OC)[C@@H](OC)O[C@H](OC)[C@@H]12 ZINC000142730908 GI Annotated Mild C=C1CC(=O)/C=C(/C)CC[C@@H]2/C(=C/C=C/C(C)(C)OC)[C@@H](OC)O[C@H](OC)[C@@H]12 ZINC000142731116 GI Annotated Mild COC(=O)[C@]1(Cc2ccccc2C(F)(F)F)CC(=O)O[C@@H]1c1ccccc1 ZINC000142736397 GI Annotated Anodyne COC(=O)[C@@]1(Cc2ccccc2C(F)(F)F)CC(=O)O[C@@H]1c1ccccc1 ZINC000142736584 GI Annotated Anodyne COC(=O)[C@]1(Cc2ccccc2C(F)(F)F)CC(=O)O[C@H]1c1ccccc1 ZINC000142736804 GI Annotated Anodyne COC(=O)[C@@]1(Cc2ccccc2C(F)(F)F)CC(=O)O[C@H]1c1ccccc1 ZINC000142736998 GI Annotated Anodyne COc1cc(-c2cc(=O)n3ncc(-c4noc5ccccc45)c3[nH]2)ccc1Cl ZINC000142737434 GI Annotated Anodyne Cc1csc(-c2cnn3c(=O)cc(-c4ccc(Cl)c(Cl)c4)[nH]c23)n1 ZINC000142758408 GI Annotated Anodyne Cc1cc(NC(=O)c2ccc(-c3noc(C(F)(F)F)n3)cc2F)cc(C)n1 ZINC000142987481 GI Annotated Anodyne COc1cc(-c2cc(=O)n3ncc(-c4nc5ccccc5o4)c3[nH]2)ccc1Cl ZINC000143150365 GI Annotated Anodyne O=C(Nc1cc[nH]c(=O)c1)c1ccc(C(F)(F)F)cc1OC1CCCCC1 ZINC000143163400 GI Annotated Anodyne O=C(Nc1cc[nH]c(=O)c1)c1cc(OC(F)(F)F)ccc1OCC1CCCC1 ZINC000143164050 GI Annotated Anodyne CC1(C)C[C@@H]1COc1ccc(C(F)(F)F)cc1C(=O)Nc1cc[nH]c(=O)c1 ZINC000143183742 GI Annotated Anodyne CC1(C)C[C@H]1COc1ccc(C(F)(F)F)cc1C(=O)Nc1cc[nH]c(=O)c1 ZINC000143183945 GI Annotated Anodyne N#Cc1cccc(-c2cc(-c3n[nH]c4ccnc(OC5CCOCC5)c34)ccn2)c1 ZINC000143197317 GI Annotated Mild O=C(Nc1cc[nH]c(=O)c1)c1ccc(C(F)(F)F)cc1O[C@@H]1C[C@H]2CC[C@H]1C2 ZINC000143200349 GI Annotated Anodyne N#Cc1ccc(-c2cc(-c3n[nH]c4ccnc(OC5CCOCC5)c34)ccn2)cc1 ZINC000143212668 GI Annotated Mild COC(=O)c1ccc(OCc2c(-c3ccc(F)cc3)noc2C(F)(F)F)nc1 ZINC000143249430 GI Annotated Anodyne COc1cc(-c2cc(=O)n3nc(-c4ccc(Cl)cc4)nc3[nH]2)ccc1Cl ZINC000143318752 GI Annotated Anodyne O=S(=O)(c1cc(Cl)cc(Cl)c1)c1ccc2oc3c(c2c1)CNCC3 ZINC000143342553 GI Annotated Anodyne CN1C(=O)CCc2ccc(NC(=O)N[C@@H]3CC(C)(C)Oc4c(F)cccc43)cc21 ZINC000143349566 GI Annotated Anodyne CN1Cc2ccc(NC(=O)N[C@@H]3CC(C)(C)Oc4c(F)cccc43)cc2NC1=O ZINC000143441250 GI Annotated Anodyne FC(F)(F)c1ccc(N[C@@H]2C[C@H](Oc3ncccc3C3CCOCC3)C2)nc1 ZINC000143455409 GI Annotated Anodyne COc1cc(CN2CC(C(=O)O)C2)ccc1OCc1ccc(Cl)cc1Cl ZINC000143456804 GI Annotated Anodyne CC1(C)NCCc2oc3c(Cl)cc(S(=O)(=O)c4ccccc4)cc3c21 ZINC000143462992 GI Annotated Anodyne O=S(=O)(c1cccc(Cl)c1)c1cc(Cl)c2oc3c(c2c1)CNCC3 ZINC000143471063 GI Annotated Anodyne O=S(=O)(c1ccc(Cl)cc1)c1cc(Cl)c2oc3c(c2c1)CNCC3 ZINC000143481630 GI Annotated Anodyne O=S(=O)(c1ccccc1)c1cc(Cl)c2oc3c(c2c1)[C@H](CF)NCC3 ZINC000143507494 GI Annotated Anodyne O=S(=O)(c1ccccc1)c1cc(Cl)c2oc3c(c2c1)[C@@H](CF)NCC3 ZINC000143507707 GI Annotated Anodyne C#Cc1c(OC)cc2c(c1C)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC(=O)[C@@]21C ZINC000143523538 GI Annotated Mild [C-]#[N+]c1ccc(N[C@@H](c2nnc(-c3ccc(CO)cc3)o2)[C@@H](C)O)c(C)c1Cl ZINC000143524594 GI Annotated Anodyne Cc1onc(-c2cccc(F)c2F)c1COc1ccc(C(=O)NC(C)C)cn1 ZINC000143561184 GI Annotated Anodyne O=C(O)C1CN(Cc2ccc(OCc3ccc(Cl)c(Cl)c3)c(F)c2)C1 ZINC000143565002 GI Annotated Anodyne O=C(Nc1ccn(-c2ccccc2F)n1)[C@@H]1CC[C@@H](Nc2cccc(F)n2)CC1 ZINC000143623012 GI Annotated Anodyne CCCC[C@@](C)(O)CCC[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC ZINC000143630998 GI Annotated Anodyne CCCC[C@](C)(O)CCC[C@H]1[C@H](O)CC(=O)[C@@H]1CCCCCCC(=O)OC ZINC000143631187 GI Annotated Anodyne CC1(C)C[C@@H](NC(=O)Nc2ccc3c(c2)NC(=O)CC3)c2cccc(F)c2O1 ZINC000143654635 GI Annotated Anodyne O=C(Cc1ccc(Cl)c(Cl)c1)c1ccc(CN2CC[C@@H](C(=O)O)C2)cc1 ZINC000143750177 GI Annotated Anodyne O=C(Cc1ccc(Cl)c(Cl)c1)c1ccc(CN2CC[C@H](C(=O)O)C2)cc1 ZINC000143750356 GI Annotated Anodyne Cc1[nH]n(-c2ccc(Br)cc2)c(=O)c1C(=O)c1ccc(Cl)cc1 ZINC000143775754 GI Annotated Anodyne c1cc2cc(-c3ccc4oc(C5=NCCCN5)cc4c3)[nH]c2cc1C1=NCCCN1 ZINC000143822281 GI Annotated Anodyne c1cc2cc(-c3ccc4cc(C5=NCCCN5)oc4c3)[nH]c2cc1C1=NCCCN1 ZINC000143829451 GI Annotated Anodyne c1cc2cc(-c3ccc4cc(C5=NCCCN5)[nH]c4c3)oc2cc1C1=NCCCN1 ZINC000143832714 GI Annotated Anodyne CCn1c([C@@H](C)NS(=O)(=O)c2ccccc2)nc2ccc(C(F)(F)F)cc21 ZINC000143895913 GI Annotated Anodyne COc1cc(C2=C(c3ccc(OC)c(OC)c3)C[C@@H]3CCCN3C2)ccc1O ZINC000144074067 GI Annotated Anodyne Cc1ccc(-c2cc(C(=O)N[C@@H](C)CO)cc3c2ccn3-c2ccccc2)nc1 ZINC000144081574 GI Annotated Anodyne CC(C)(C)n1c(-c2cccc(C(=O)O)c2)nc2cc(-c3cnc(N)nc3)ccc21 ZINC000144123661 GI Annotated Anodyne CC(C)Nc1nc2cnccc2nc1N1CCC(Oc2ccc(F)cc2F)CC1 ZINC000144183450 GI Annotated Anodyne Cc1ccccc1C(=O)C1CCN(c2nc3cnccc3nc2NC2CC2)CC1 ZINC000144184285 GI Annotated Anodyne c1ccc2nc(N3CC(c4nccnc4-c4ccc5scnc5c4)C3)ncc2c1 ZINC000144192957 GI Annotated Anodyne CCn1c([C@@H](C)NS(=O)(=O)c2ccc(Cl)cc2)nc2cccc(Cl)c21 ZINC000144211529 GI Annotated Anodyne Clc1cccc(CN2CCN(c3nc4ccccc4nc3NC3CC3)CC2)c1 ZINC000144307040 GI Annotated Anodyne CC(C)(C)NC(=O)[C@@H](c1cccnc1)N(C(=O)c1ccco1)C1CCCCC1 ZINC000144320875 GI Annotated Anodyne CC(C)(C)NC(=O)[C@H](c1cccnc1)N(C(=O)c1ccco1)C1CCCCC1 ZINC000144321056 GI Annotated Anodyne O=C1N(c2cc(Cl)nc(C(F)(F)F)c2)CCN1c1cnccc1C1CC1 ZINC000144329917 GI Annotated Anodyne Cc1ccc(F)cc1-c1cc2cnc(NC(=O)C3CC3)cc2c(CN(C)C)n1 ZINC000144337676 GI Annotated Anodyne Cc1ccc(F)cc1-c1cc2cnc(NC(=O)C3CC3)cc2c(C(C)(C)O)n1 ZINC000144357682 GI Annotated Anodyne O=C(Nc1cc2cnc(-c3ccccc3OC(F)(F)F)cc2cn1)[C@@H]1C[C@@H]1F ZINC000144380514 GI Annotated Anodyne Cc1cc(C(C)(C)O)ncc1-c1ccc2cc(NC(=O)[C@@H]3C[C@@H]3F)ncc2c1 ZINC000144386292 GI Annotated Anodyne c1ccc2nc(N3CCN(Cc4coc5ccccc45)CC3)c(NC3CC3)nc2c1 ZINC000144396328 GI Annotated Anodyne Cc1c(-c2ccc3cc(NC(=O)[C@@H]4C[C@@H]4F)ncc3c2)cnc(C(C)(C)O)c1F ZINC000144397284 GI Annotated Anodyne O=C1CCc2ccc(NC(=O)N[C@H]3CC4(CCC4)Oc4ccc(F)cc43)cc2N1 ZINC000144412152 GI Annotated Anodyne O=C1CCc2ccc(NC(=O)N[C@@H]3CC4(CCC4)Oc4ccc(F)cc43)cc2N1 ZINC000144423782 GI Annotated Anodyne CCCC(=O)OCc1cc2c(c(COC(C)=O)c1CCCl)CC(C)(C)C2 ZINC000144581743 GI Annotated Reactive Cc1cc(C(=O)O)c2c(c1)nc(-c1ccc(-c3ccc(O)cc3)cc1)n2CCO ZINC000144707781 GI Annotated Anodyne C[C@H](Nc1nccc(Nc2cc(C3CC3)[nH]n2)n1)c1nc2cc[nH]c2cc1F ZINC000144710014 GI Annotated Anodyne Cc1cccc(CN2CCN(c3nc4ccccc4nc3NC3CC3)CC2)c1C ZINC000144717852 GI Annotated Anodyne CNC(=O)c1cccc(-c2ccc3c(c2)[C@](O)(C(F)(F)F)c2ccccc2-3)c1 ZINC000144728780 GI Annotated Anodyne CNC(=O)c1cccc(-c2ccc3c(c2)[C@@](O)(C(F)(F)F)c2ccccc2-3)c1 ZINC000144728961 GI Annotated Anodyne CN(C)C(=O)CCCCOc1ccc2c(c1)[C@](O)(C(F)(F)F)c1ccccc1-2 ZINC000144791679 GI Annotated Anodyne CN(C)C(=O)CCCCOc1ccc2c(c1)[C@@](O)(C(F)(F)F)c1ccccc1-2 ZINC000144791886 GI Annotated Anodyne COC(=O)c1cc(Br)c2c(c1)[C@](O)(C(F)(F)F)c1ccccc1-2 ZINC000144861395 GI Annotated Anodyne COC(=O)c1cc(Br)c2c(c1)[C@@](O)(C(F)(F)F)c1ccccc1-2 ZINC000144861578 GI Annotated Anodyne Cn1cc(-c2cc(C(C)(C)O)c3c(c2)[C@](O)(C(F)(F)F)c2ccccc2-3)cn1 ZINC000144902131 GI Annotated Anodyne Cn1cc(-c2cc(C(C)(C)O)c3c(c2)[C@@](O)(C(F)(F)F)c2ccccc2-3)cn1 ZINC000144902334 GI Annotated Anodyne CC(C)n1cc(-c2ccc3c(c2)[C@](O)(C(F)(F)F)c2cccc(CO)c2-3)cn1 ZINC000144903601 GI Annotated Anodyne CC(C)n1cc(-c2ccc3c(c2)[C@@](O)(C(F)(F)F)c2cccc(CO)c2-3)cn1 ZINC000144903797 GI Annotated Anodyne CC(C)n1cc(-c2cc(CO)c3c(c2)[C@@](O)(C(F)(F)F)c2ccccc2-3)cn1 ZINC000144911266 GI Annotated Anodyne CC(C)n1cc(-c2cc(CO)c3c(c2)[C@](O)(C(F)(F)F)c2ccccc2-3)cn1 ZINC000144911500 GI Annotated Anodyne O=C(COc1ccc2ccccc2c1)NCc1nnc(Nc2ccccc2)s1 ZINC000144970574 GI Annotated Anodyne Cc1cc(O)cc(O)c1C(=O)O[C@@H]1C[C@@]2(C)[C@H]1C(C=O)=C[C@H]1CC(C)(C)C[C@H]12 ZINC000014507510 GI Annotated Reactive in-man endogenous CC(C)=CCC[C@@](C)(O)[C@@H](O)CC/C(C)=C/Cc1cc(C(=O)O)ccc1O ZINC000014511571 GI Annotated Anodyne CC(C)=CCC[C@](C)(O)[C@@H](O)CC/C(C)=C/Cc1cc(C(=O)O)ccc1O ZINC000014511574 GI Annotated Anodyne CC(C)=CCC[C@@](C)(O)[C@H](O)CC/C(C)=C/Cc1cc(C(=O)O)ccc1O ZINC000014511577 GI Annotated Anodyne CC(C)=CCC[C@](C)(O)[C@H](O)CC/C(C)=C/Cc1cc(C(=O)O)ccc1O ZINC000014511580 GI Annotated Anodyne C/C(=C\Cc1cc(C(=O)O)ccc1O)CC/C=C(\C)CC[C@@H](O)C(C)(C)O ZINC000014511583 GI Annotated Anodyne C/C(=C\Cc1cc(C(=O)O)ccc1O)CC/C=C(\C)CC[C@H](O)C(C)(C)O ZINC000014511586 GI Annotated Anodyne COc1cc(C2=CC(=O)c3c(O)cc(C)cc3C2=O)c(O)c2cc(C)cc(O)c12 ZINC000014558297 GI Annotated Mild C=CC(C)(C)c1[nH]c2ccc(CC=C(C)C)cc2c1/C=C1/NC(=O)[C@H](C)NC1=O ZINC000014559571 GI Annotated Mild CC[C@H]1O[C@@H]2C[C@@H](C=C=CBr)O[C@@H]2C/C=C\C[C@@H]1Br ZINC000014560137 GI Annotated Reactive CC(=O)O[C@H]1O[C@@H]2OC(=O)C[C@@H]2[C@@H]1[C@]1(C)CC[C@@H]2C(=CCCC2(C)C)[C@H]1C ZINC000014584409 GI Annotated Anodyne CC(=O)O[C@H]1O[C@@H]2OC(=O)C[C@@H]2[C@@H]1[C@]1(C)CC[C@H]2C(=CCCC2(C)C)[C@H]1C ZINC000014584413 GI Annotated Anodyne CC[C@@H](O)c1cc(=O)oc2c(C(=O)CC(C)C)c(O)c(CC=C(C)C)c(O)c12 ZINC000014586039 GI Annotated Anodyne in-vitro biogenic CC[C@H](O)c1cc(=O)oc2c(C(=O)CC(C)C)c(O)c(CC=C(C)C)c(O)c12 ZINC000014586040 GI Annotated Anodyne COc1cc2c3c(c4ccc(OC)c(O)c4c2cc1O)C[C@]1(C)CCCN1C3 ZINC000014593902 GI Annotated Bother Cc1ccc(-c2nc3nc(CNc4cc(Cl)ccc4C)cc(O)n3n2)cc1 ZINC000014609031 GI Annotated Anodyne Cc1ccc(-c2nc3nc(CNc4ccc(C)c(Cl)c4)cc(O)n3n2)cc1 ZINC000014609045 GI Annotated Anodyne CC(=O)OCC(COC(C)=O)OC(=O)/C=C(\C)CCC1=C(C)CCCC1(C)C ZINC000014609773 GI Annotated Anodyne C=CC(C)(C)c1[nH]c2cc(CC=C(C)C)ccc2c1/C=C1\NC(=O)[C@@H](C)NC1=O ZINC000014612875 GI Annotated Mild CCC(=O)C1=CN(CCc2ccccc2)[C@H](/C(C)=C/[C@@H](C)CC)[C@](C)(O)C1=O ZINC000014613309 GI Annotated Mild Cc1ccc2c(c1C1=C(O)C(=O)c3ccccc3C1=O)C(=O)c1ccccc1C2=O ZINC000014613520 GI Annotated Mild in-vitro biogenic CC(C)(O)CCc1ccc(O)c2oc3cc4c(c(O)c3c(=O)c12)C=CC(C)(C)O4 ZINC000014613749 GI Annotated Bother in-vitro biogenic CC(C)(O)CCc1ccc(O)c2oc3cc4c(c(O)c3c(=O)c12)CCC(C)(C)O4 ZINC000014613750 GI Annotated Bother in-vitro biogenic COc1c([C@@H](CC=C(C)C)OC(=O)C=C(C)C)cc(O)c2c1C(=O)C=CC2=O ZINC000014618201 GI Annotated Mild COc1cc(OC)c([C@@H]2CCCc3c(OC)cc(OC)c(OC)c32)cc1OC ZINC000014635682 GI Annotated Anodyne Cc1c(O)c(Cl)c(C)c2c1OC(=O)c1c(C)c(Cl)c(O)c(C=O)c1O2 ZINC000014636962 GI Annotated Anodyne COc1cc2cc3c4c(c(OC)c(OC)c(OC)c4c2cc1OC)CCN3C ZINC000014639554 GI Annotated Bother COc1c(-c2cc3cc4c(cc3oc2=O)OC(C)(C)C=C4)ccc2c1OCO2 ZINC000014650006 GI Annotated Anodyne COc1cc([C@@H]2c3ccc(O)cc3CCc3cc(O)cc(OC)c32)ccc1O ZINC000014660023 GI Annotated Anodyne in-vitro biogenic COC(=O)c1ccc(Br)cc1-[n+]1ccc2c(c1)[nH]c1ccccc12 ZINC000014685492 GI Annotated Anodyne C[C@@H]1Oc2c(c3c(c4oc5c(O)c(O)ccc5c(=O)c24)C(C)(C)[C@@H](C)O3)C1(C)C ZINC000014686348 GI Annotated Clean COc1c2c(cc3oc(=O)c(-c4ccc5c(c4)OCO5)c(O)c13)OC(C)(C)C=C2 ZINC000014687503 GI Annotated Anodyne COc1c(O)cc2c(c1OC)-c1c(cc3c(c1OC)OCO3)C[C@H](C)[C@H](C)C2 ZINC000014688819 GI Annotated Anodyne COc1c(O)cc2c(c1OC)-c1c(cc3c(c1OC)OCO3)C[C@H](C)[C@@H](C)C2 ZINC000014688821 GI Annotated Anodyne in-vitro biogenic COc1c(O)cc2c(c1OC)-c1c(cc3c(c1OC)OCO3)C[C@@H](C)[C@@H](C)C2 ZINC000014688825 GI Annotated Anodyne in-vitro biogenic COc1cc(OC)c(-c2coc3c4c(ccc3c2=O)O[C@@H]2[C@H]4C2(C)C)cc1OC ZINC000014691106 GI Annotated Anodyne COC(=O)c1ccc(Br)cc1-n1ccc2c([nH]c3ccccc32)c1=O ZINC000014694154 GI Annotated Anodyne C[N+](C)([O-])CCc1c2c(c3nccc4c5ccccc5[nH]c1c34)NC(=O)CS2 ZINC000014697402 GI Annotated Bother Cc1c2c(c(O)c3c(=O)cc(-c4cc(O)c5c(c4)C=CC(C)(C)O5)oc13)OCO2 ZINC000014708743 GI Annotated Anodyne COc1cc(/C=C\COC(=O)CC(C)C)cc(OC)c1OC(=O)CC(C)C ZINC000014709473 GI Annotated Anodyne in-vitro biogenic CC(C)=CCC/C(C)=C/CC[C@]1(C)Oc2c(c(O)cc3c2CNC3=O)C[C@@H]1O ZINC000014714654 GI Annotated Anodyne in-vivo COc1c([C@@H](O)CC(C)C)ccc(Oc2c(O)cc(C)cc2C=O)c1C(=O)O ZINC000014721421 GI Annotated Anodyne COc1c([C@H](O)CC(C)C)ccc(Oc2c(O)cc(C)cc2C=O)c1C(=O)O ZINC000014721423 GI Annotated Anodyne CC(C)(O)CCc1c2c(c(O)c3c(=O)c4cccc(O)c4oc13)CCC(C)(C)O2 ZINC000014768871 GI Annotated Bother in-vitro biogenic Cn1c(Br)c(C=O)c2cc(Br)c(Br)cc21 ZINC000014769634 GI Annotated Anodyne COc1c(O)c(Cl)c(O)c2c(=O)c3c(C)c(Cl)c(O)c(Cl)c3oc12 ZINC000014769882 GI Annotated Bother C=C(C)C[C@@H](O)C/C(C)=C/COc1cc(O)c(C(=O)c2ccccc2)c(O)c1 ZINC000014775924 GI Annotated Mild in-vitro biogenic C=C(C)C[C@H](O)C/C(C)=C/COc1cc(O)c(C(=O)c2ccccc2)c(O)c1 ZINC000014775927 GI Annotated Mild COc1cc(O)c(C(=O)CCc2ccccc2)c(O)c1Cc1ccccc1O ZINC000014811034 GI Annotated Anodyne CCCCC(=O)O[C@H]1Oc2c(O)cccc2-c2c1oc1cc(O)c(C)cc1c2=O ZINC000014814552 GI Annotated Anodyne C=C(C)[C@@H]1CC(=O)c2c(O)c(C(C)C)c(OC)c(O)c2[C@@]1(C)CCC(=O)O ZINC000014817256 GI Annotated Mild COc1ccc(C2=C(c3cccc(OC(C)=O)c3)CN3CCC[C@@]3(C)C2)cc1O ZINC000014824724 GI Annotated Anodyne COc1cc2c(cc1O)c1c(c3cc(OC)c(OC)cc32)C[C@H]2CCC[N+]2([O-])C1 ZINC000014824791 GI Annotated Bother COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[N+]1([O-])CCC[C@H]1[C@@H]3O ZINC000014824803 GI Annotated Bother in-vitro biogenic COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[N+]1([O-])CCC[C@H]1[C@H]3O ZINC000014824805 GI Annotated Bother COc1ccc2c(ccc3c(CC[N+](C)(C)[O-])cc(OC)c(OC)c32)c1OC ZINC000014826904 GI Annotated Bother COc1cc2c([C@@H]3CCCN3C)cnc(Cc3ccc4c(c3)OCO4)c2cc1O ZINC000014855809 GI Annotated Anodyne Cc1cccc2c(NCc3ccccc3F)nc(CNC(=O)c3ccco3)nc12 ZINC000014878728 GI Annotated Anodyne O=C(CC[C@@]1(Cc2cccc3ccccc23)CCC(=O)N1)NCc1ccccc1 ZINC000014881319 GI Annotated Anodyne O=C(CC[C@]1(Cc2cccc3ccccc23)CCC(=O)N1)NCc1ccccc1 ZINC000014881320 GI Annotated Anodyne CCCCOC(=O)N1c2ccccc2NC(=O)[C@@]1(C#CC1CC1)C(F)(F)F ZINC000014943949 GI Annotated Mild CCCCOC(=O)N1c2ccccc2NC(=O)[C@]1(C#CC1CC1)C(F)(F)F ZINC000014943951 GI Annotated Mild C=C(C)OC(=O)N1c2cc(Cl)ccc2NC(=O)[C@@]1(C#CC1CC1)C(F)(F)F ZINC000014943966 GI Annotated Mild C=C(C)OC(=O)N1c2cc(Cl)ccc2NC(=O)[C@]1(C#CC1CC1)C(F)(F)F ZINC000014943968 GI Annotated Mild O=C1NC(=O)c2c1c1c([nH]c3cccc(F)c31)c1c2c2cccc3c2n1CCC3 ZINC000014945574 GI Annotated Bother O=C(Nc1ccc(OC(F)(F)Cl)cc1)c1scnc1CCc1cnoc1 ZINC000014946549 GI Annotated Anodyne COC(=O)c1cc(OC)c2cc(O)c3c(c2c1O)[C@@H]1[C@H]2[C@H](CC[C@@]2(C)O3)C1(C)C ZINC000014950955 GI Annotated Anodyne O=C(Nc1ccnn1C1CCN(Cc2cccc(F)c2F)CC1)C1CCCC1 ZINC000014954386 GI Annotated Anodyne COc1cc(C(=O)O[C@H]2CC(C)=CC[C@@]3(C)CC[C@@](O)(C(C)C)[C@@H]23)ccc1O ZINC000014956452 GI Annotated Anodyne in-vitro biogenic N[C@@H](Cc1cccc2ccccc12)C(=O)Nc1cncc(/C=C/c2ccncc2)c1 ZINC000014957702 GI Annotated Anodyne N[C@H]1CN(c2nccc(-c3ccsc3)n2)C[C@@H]1c1ccc(Cl)cc1Cl ZINC000014958710 GI Annotated Anodyne N[C@H]1CN(c2ccnc(-c3ccsc3)n2)C[C@@H]1c1ccc(Cl)cc1Cl ZINC000014958714 GI Annotated Anodyne Nc1c(C(=O)c2cccc(Oc3cccnc3)c2)cnn1-c1ccc(F)cc1F ZINC000014959500 GI Annotated Anodyne Clc1ccc(C2(c3ccc(-c4ncnc5nc[nH]c45)cc3)CCNCC2)cc1 ZINC000014961053 GI Annotated Anodyne in-vivo C/C=C\[C@H]1C[C@H]1C1=C(Br)[C@@H]2O[C@@H](C=C=CBr)C[C@@H]2O1 ZINC000014962863 GI Annotated Anodyne CCOC(=O)[C@@]1(C/C=C/c2ccccc2)CCCN(C(=O)c2cscn2)C1 ZINC000014963868 GI Annotated Anodyne CCOC(=O)[C@]1(C/C=C/c2ccccc2)CCCN(C(=O)c2cscn2)C1 ZINC000014963872 GI Annotated Anodyne CC1=C(Br)C[C@@]23[C@H](C1)O[C@@](Br)(C=C[C@@]2(C)O)C3(C)C ZINC000014966320 GI Annotated Anodyne CC[C@@H]1COc2cc3[nH]c(=O)cc(C(F)(F)F)c3cc2N1CC(F)(F)F ZINC000014967376 GI Annotated Anodyne CC[C@H]1COc2cc3[nH]c(=O)cc(C(F)(F)F)c3cc2N1CC(F)(F)F ZINC000014967380 GI Annotated Anodyne CC(C)[C@@H]1COc2cc3[nH]c(=O)cc(C(F)(F)F)c3cc2N1CC(F)(F)F ZINC000014967383 GI Annotated Anodyne O=c1cc(C(F)(F)F)c2cc(N(CC(F)F)CC(F)(F)Cl)ccc2[nH]1 ZINC000014968405 GI Annotated Mild Cc1ccc(C(C)(C)NC(=O)c2cc3[nH]c4ccccc4c(=O)c3cc2F)cn1 ZINC000014970345 GI Annotated Bother Clc1ccc(-c2[nH]nc(N3CCN4CCC[C@H]4C3)c2-c2ccncc2)cc1 ZINC000014970891 GI Annotated Anodyne CCN(CCNC(=O)Nc1ccccc1Br)c1ccccc1C ZINC000014973940 GI Annotated Anodyne CCN(CCNC(=O)Nc1ccccc1Br)c1ccc(C)cc1 ZINC000014973944 GI Annotated Anodyne CCN(CCNC(=O)Nc1ccccc1Br)c1cccc(F)c1 ZINC000014973948 GI Annotated Anodyne CCN(CCNC(=O)Nc1ccccc1Br)c1ccc(F)c(F)c1 ZINC000014973951 GI Annotated Anodyne CC[C@@H](CO)Nc1cc(C)nc(Oc2c(C)cc(Cl)cc2C)c1C(=O)OC ZINC000014975034 GI Annotated Anodyne CCO[C@@H](c1ccccc1)c1ccc2c(c1)CN(Cc1cn(C)nc1C)CCO2 ZINC000014987012 GI Annotated Anodyne CCO[C@H](c1ccccc1)c1ccc2c(c1)CN(Cc1cn(C)nc1C)CCO2 ZINC000014987014 GI Annotated Anodyne CN(Cc1nc2c(s1)CCCC2)C(=O)c1cc(CCc2ccccc2)no1 ZINC000014988164 GI Annotated Anodyne Cc1c(C(=O)N(C)Cc2ccon2)sc2ncnc(N3CCCCCCC3)c12 ZINC000014994764 GI Annotated Anodyne CC(C)OCCNC(=O)c1cccnc1Oc1ccc(Nc2ccccn2)cc1 ZINC000145115435 GI Annotated Anodyne CCOCCCNC(=O)c1cccnc1Oc1ccc(Nc2ccccn2)cc1 ZINC000145238934 GI Annotated Anodyne CC(=O)O[C@@H]1O[C@H]2OC(=O)C[C@@H]1[C@@H]2[C@]1(C)CCC2=C(CCCC2(C)C)[C@H]1C ZINC000145353530 GI Annotated Anodyne CC(C)COc1ccc([C@@H](NC(=O)[C@@H](C)c2ccccc2)[C@H]2CCCN2)cc1 ZINC000145382582 GI Annotated Anodyne C/C=C\[C@@H]1C[C@@H]1[C@@H]1OC2=C(Br)C[C@@H](C=C=CBr)O[C@H]21 ZINC000145384076 GI Annotated Anodyne CC/C=C/C[C@H](Br)[C@H]1C[C@H]2O[C@H](C=C=CBr)C[C@H]2O1 ZINC000145384913 GI Annotated Reactive O=C(O)CNCc1cnc(Oc2ccc3c(c2)CC[C@@H](c2ccccc2)O3)s1 ZINC000145474848 GI Annotated Anodyne OCCNCc1cnc(Oc2ccc3c(c2)CC[C@@H](c2ccccc2)O3)s1 ZINC000145598440 GI Annotated Anodyne OCCNCc1cnc(Oc2ccc3c(c2)CC[C@H](c2ccccc2)O3)s1 ZINC000145598795 GI Annotated Anodyne CSCCNC(=O)c1cccnc1Oc1ccc(Nc2ccccn2)cc1 ZINC000145701132 GI Annotated Anodyne Cc1cnccc1-c1nccnc1O[C@@H]1C[C@@H](Nc2nc3ccccc3s2)C1 ZINC000145901131 GI Annotated Anodyne FC(F)(F)c1ccc(N[C@@H]2C[C@@H](Oc3ncccc3C3CCOCC3)C2)nc1 ZINC000145912512 GI Annotated Anodyne O=C1CCC2(CC1)CCN(C1(c3ccc(Br)cc3)CC1)C(=O)O2 ZINC000145943219 GI Annotated Anodyne COc1ccc(Nc2nccc(Oc3cccc4c3C(=O)CC4)n2)c(OC)c1 ZINC000145986372 GI Annotated Anodyne Cc1ncccc1-c1nccnc1O[C@@H]1C[C@@H](Nc2nc3ccccc3s2)C1 ZINC000146046218 GI Annotated Anodyne Cc1ccc(-c2nccnc2O[C@@H]2C[C@@H](Nc3nc4ccccc4s3)C2)cn1 ZINC000146088222 GI Annotated Anodyne Cc1cc(-c2nccnc2O[C@@H]2C[C@@H](Nc3nc4ccccc4s3)C2)ccn1 ZINC000146123660 GI Annotated Anodyne C[C@@H](Oc1cc(-c2ccc3ncccc3c2)cc2ncccc12)[C@H]1CNC(=O)C1 ZINC000146141159 GI Annotated Anodyne C[C@@H]1CCCN(c2nccnc2O[C@@H]2C[C@@H](Nc3nc4ccccc4s3)C2)C1 ZINC000146206828 GI Annotated Anodyne C[C@H]1CCCN(c2nccnc2O[C@@H]2C[C@@H](Nc3nc4ccccc4s3)C2)C1 ZINC000146207026 GI Annotated Anodyne Cc1ccc(S(=O)(=O)/N=C(\Nc2ccc(Cl)cc2)NC(C)(C)C)cc1 ZINC000146211797 GI Annotated Mild O=C(NNC(=O)c1occ(-c2ccccc2)c1-c1ccccc1)c1ccc(O)cc1 ZINC000146247419 GI Annotated Reactive O=C1OC2(CCC(O)CC2)CCN1[C@H](c1ccc(Br)cc1)C1CC1 ZINC000146283202 GI Annotated Anodyne CC(C)(c1ccc(Br)cc1)N1CCC2(CCC(O)CC2)OC1=O ZINC000146333527 GI Annotated Anodyne Cc1cc(Nc2cc(-c3ccc(OC4CCOCC4)c(C#N)c3)ccn2)no1 ZINC000146471905 GI Annotated Anodyne [C-]#[N+]c1ccc(N[C@@H](c2nnc(-c3cccc(O)c3)o2)[C@H](C)O)c(C)c1Cl ZINC000146536103 GI Annotated Anodyne [C-]#[N+]c1ccc(N[C@@H](c2nnc(-c3ccc(O)cc3)o2)[C@H](C)O)c(C)c1Cl ZINC000146537829 GI Annotated Anodyne [C-]#[N+]c1ccc(N[C@@H](c2nnc(-c3cccc(O)c3)o2)[C@@H](C)O)c(C)c1Cl ZINC000146538632 GI Annotated Anodyne [C-]#[N+]c1ccc(N[C@@H](c2nnc(-c3ccc(O)cc3)o2)[C@@H](C)O)c(C)c1Cl ZINC000146539041 GI Annotated Anodyne O=C(Nc1ccn(-c2ccccc2F)n1)[C@@H]1CC[C@H](Nc2cccc(F)n2)CC1 ZINC000146707731 GI Annotated Anodyne CCCCCOc1c(OC)ccc2c1CCN(CCc1ccc(O)cc1)C2=O ZINC000146813149 GI Annotated Anodyne Cc1cc(-c2c(C)ccc3[nH]ncc23)nc2c1CN(c1cc(C3CC3)nn1C)CC2 ZINC000146944466 GI Annotated Anodyne Fc1ccc(-c2cc(NCCNc3cc(-c4ccc(F)cc4)[nH]n3)n[nH]2)cc1 ZINC000147046305 GI Annotated Anodyne in-vivo O=C(NCc1ccc(-c2cc[nH]c(=O)c2)cc1F)c1c(Cl)cccc1Cl ZINC000147260082 GI Annotated Anodyne C=C[C@@]1(C)CC=C2[C@@H](CC[C@@H]3C(C)(C)[C@H](OC(=O)C(=O)NO)CC[C@@]23C)C1 ZINC000147265784 GI Annotated Mild CC(C)(C)c1cc(NC(=O)[C@@H]2CCC(=O)N2c2ccc(C(F)(F)F)cc2)on1 ZINC000147455175 GI Annotated Anodyne O=S(=O)(c1ccc2[nH]ccc2c1)c1cc(Cl)c2oc3c(c2c1)CNCC3 ZINC000147489679 GI Annotated Anodyne O=S(=O)(c1cc(Cl)c2oc3c(c2c1)CNCC3)c1ccccc1Cl ZINC000147496555 GI Annotated Anodyne O=S(=O)(c1cccc(C(F)(F)F)c1)c1cc(F)c2oc3c(c2c1)CNCC3 ZINC000147510397 GI Annotated Anodyne COc1cc(S(=O)(=O)c2ccc3sccc3c2)cc2c3c(oc12)CCNC3 ZINC000147537172 GI Annotated Anodyne COc1cc(S(=O)(=O)c2csc3ccccc23)cc2c3c(oc12)CCNC3 ZINC000147537455 GI Annotated Anodyne Cc1cc(S(=O)(=O)c2ccc3sccc3c2)cc2c3c(oc12)CCNC3 ZINC000147613199 GI Annotated Anodyne COc1c(F)cc(-c2cc(O[C@H](C)[C@H]3CNC(=O)C3)c3cccnc3c2)cc1F ZINC000147809652 GI Annotated Anodyne C[C@@H](Oc1cc(-c2ccc3ccccc3n2)cc2ncccc12)[C@H]1CNC(=O)C1 ZINC000147810894 GI Annotated Anodyne O=C(Nc1ncccn1)c1cccnc1Oc1ccc(Nc2ccccn2)cc1 ZINC000147820383 GI Annotated Anodyne C[C@@H](Oc1cc(-c2ccc(C(F)F)nc2)cc2ncccc12)[C@H]1CNC(=O)C1 ZINC000147828846 GI Annotated Anodyne Cc1cc(S(=O)(=O)c2cccc(C(F)(F)F)c2)cc2c3c(oc12)CCNC3 ZINC000147929398 GI Annotated Anodyne COC(=O)c1cc2c3c(ccc4c3c1-c1cccc(OC)c1C4=O)[C@@H](O)[C@H](C)C2 ZINC000147969941 GI Annotated Anodyne COc1cccc(Cn2[nH]c(C(F)(F)F)c(Cc3ccc(Cl)cc3)c2=O)c1 ZINC000148070668 GI Annotated Anodyne O=C(NN1CCCCC1)c1cccnc1Oc1ccc(Nc2ccccn2)cc1 ZINC000148133476 GI Annotated Anodyne COc1ccc(Nc2ccc(Oc3nccnc3C3CCOCC3)cc2)nc1 ZINC000148150701 GI Annotated Anodyne CSCCCNC(=O)c1cccnc1Oc1ccc(Nc2ccccn2)cc1 ZINC000148307514 GI Annotated Anodyne Cc1ccc([C@H]2C[C@@H]2COc2cc(Oc3ccc(C)nc3)n3nccc3n2)nc1 ZINC000148572446 GI Annotated Anodyne CNCCc1ccc(-c2c(O)cc(C)c3[nH]c(=O)c4sccc4c23)cc1F ZINC000149236887 GI Annotated Anodyne Cc1c(N2CCN(c3ccc4ncsc4c3)C2=O)cncc1C(F)(F)F ZINC000149253531 GI Annotated Anodyne Cc1nn(-c2ccccc2)c2nc(-c3ccc(NC4CCNCC4)cc3)cc(O)c12 ZINC000149583784 GI Annotated Anodyne C[C@@H](Cc1ccc(C2CN(c3ccc(OCC4CC4)cc3)C2)cc1)NC(=O)CF ZINC000149639707 GI Annotated Clean C[C@H](Cc1ccc(C2CN(c3ccc(OCC4CC4)cc3)C2)cc1)NC(=O)CF ZINC000149639915 GI Annotated Clean Cc1cccc(C)c1NC(=O)N/N=C/c1ccc(I)cc1 ZINC000149719799 GI Annotated Reactive O=C([C@@H]1CNC[C@]12CCSc1ccccc12)N1CCC(c2ccccc2)CC1 ZINC000149734899 GI Annotated Anodyne NCC1(c2ccc(-c3c(O)ccc4[nH]c(=O)c5sccc5c34)cc2)CCC1 ZINC000149784393 GI Annotated Anodyne Cc1cc(C)n(C[C@@H]2CC[C@@H](NC(=O)c3cc(C(F)(F)F)cnc3C)CC2)n1 ZINC000149798022 GI Annotated Anodyne CSc1nn(-c2ccccc2)c2cc(NC(=O)C[C@@H]3CCCCN3)ccc12 ZINC000149851267 GI Annotated Anodyne CSc1nn(-c2ccccc2)c2cc(NC(=O)C[C@H]3CCCCN3)ccc12 ZINC000149851467 GI Annotated Anodyne C[C@H](NC(=O)CC#N)c1ccc(C2CN(c3ccc(OCC4CC4)cc3)C2)cc1 ZINC000149936119 GI Annotated Mild CC(=O)N[C@@H](C)CCc1ccc(C2CN(c3cccc(C(F)(F)F)n3)C2)cc1 ZINC000149959593 GI Annotated Anodyne CC(=O)N[C@H](C)CCc1ccc(C2CN(c3cccc(C(F)(F)F)n3)C2)cc1 ZINC000149959818 GI Annotated Anodyne Cn1cc(/C=N/n2cnc3scc(-c4ccccc4)c3c2=O)c2ccccc21 ZINC000001508108 GI Annotated Mild CC(C)=CCC/C(C)=C/CC/C(C)=C/CC(P(=O)(O)O)P(=O)(O)O ZINC000001534685 GI Annotated Anodyne in-vitro COCc1cc(CCCOc2c(Cl)cc(-c3noc(C)n3)cc2Cl)on1 ZINC000001535254 GI Annotated Anodyne CC[C@@H](C)/C=C(\C)C1=Cc2cc3c(c(O)c2[C@@H](OC)O1)C(=O)C(=O)C(OC)=C3 ZINC000001547432 GI Annotated Mild in-vitro N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@H](O)c2cccc(C#N)c2)c1 ZINC000001549349 GI Annotated Reactive CN(CC1CC1)[C@H](c1cccc(O)c1)C(C)(C)C(=O)NCCc1ccccc1 ZINC000001549676 GI Annotated Anodyne CCCCn1c2c(cc(C(=O)NCCc3ccccc3)c1=O)CCCCCC2 ZINC000001553380 GI Annotated Anodyne CN(CCCCOCC(=O)O)c1cnc(-c2ccccc2)c(-c2ccccc2)n1 ZINC000001553985 GI Annotated Anodyne CCOc1cc2c(cc1OC)c[n+](C)c1c3cc(OC)c(OC)cc3ccc21 ZINC000001557692 GI Annotated Bother COc1cc2c[n+](C)c3c4cc(OC)c(OC)cc4c(OC)cc3c2cc1OC ZINC000001580045 GI Annotated Bother C1=CN2C[n+]3cccc(OCc4ccccc4)c3N=C2C(OCc2ccccc2)=C1 ZINC000001612304 GI Annotated Anodyne CN(C)CC(C)(C)C(=O)/C=C/c1ccc(/C=C/C(=O)C(C)(C)CN(C)C)cc1 ZINC000001613981 GI Annotated Mild CC[N+]1(C)CC[C@@](O)(/C=C/c2ccccc2)[C@H](C(=O)/C=C/c2ccccc2)C1 ZINC000001613991 GI Annotated Mild COc1cc(Br)c(C2OCCCO2)cc1OCc1ccccc1 ZINC000001614415 GI Annotated Anodyne COC(=O)CCC1(NS(=O)(=O)c2ccc(C)cc2)CCC(C(C)(C)C)CC1 ZINC000001615490 GI Annotated Anodyne COc1cc2c(c3oc(-c4ccc5c(c4)OCO5)c(O)c(=O)c13)CCC(C)(C)O2 ZINC000001617167 GI Annotated Anodyne N#C[C@@]12Cc3cc4c(cc3-c3cccc(c31)CCN2C(=O)c1ccccc1)OCO4 ZINC000001619791 GI Annotated Mild N#C[C@]12Cc3ccc4c(c3-c3cccc(c31)CCN2C(=O)c1ccccc1)OCO4 ZINC000001619792 GI Annotated Mild COc1ccc2c3c([nH]c2c1[N+](=O)[O-])[C@@H](C)N(Cc1ccc([N+](=O)[O-])cc1)CC3 ZINC000001620063 GI Annotated Bother COc1ccc2c3c([nH]c2c1[N+](=O)[O-])[C@H](C)N(C(=O)/C=C/c1ccccc1)CC3 ZINC000001620064 GI Annotated Bother COc1ccc2c3c([nH]c2c1[N+](=O)[O-])[C@@H](C)N(C(=O)/C=C/c1ccccc1)CC3 ZINC000001620066 GI Annotated Bother C[C@@H]1SC2=NC3=C(c4ccccc4C3=O)[C@H](c3ccc(Cl)cc3)N2C1=O ZINC000001626646 GI Annotated Mild C[C@H]1SC2=NC3=C(c4ccccc4C3=O)[C@H](c3ccc(Cl)cc3)N2C1=O ZINC000001626647 GI Annotated Mild C[C@@H]1SC2=NC3=C(c4ccccc4C3=O)[C@@H](c3ccc(Cl)cc3)N2C1=O ZINC000001626648 GI Annotated Mild C[C@H]1SC2=NC3=C(c4ccccc4C3=O)[C@@H](c3ccc(Cl)cc3)N2C1=O ZINC000001626649 GI Annotated Mild O=C1C2=C(c3ccccc31)[C@@H](c1ccccc1Cl)N1C(=O)CCSC1=N2 ZINC000001626654 GI Annotated Mild O=C1C2=C(c3ccccc31)[C@@H](c1ccc(Cl)cc1)N1C(=O)CCSC1=N2 ZINC000001626655 GI Annotated Mild CN1c2ccccc2N(C(=O)c2ccc(Cl)cc2)[C@@H](CC(=O)O)c2cccn21 ZINC000001629075 GI Annotated Anodyne COC[n+]1cc2cc(OC)c(OC)cc2c2ccc3cc(OC)c(OC)cc3c21 ZINC000001629548 GI Annotated Bother CCOc1cc2c[n+](C)c3c4cc(OC)c(OC)cc4ccc3c2cc1OC ZINC000001629550 GI Annotated Bother Nc1ccc(Nc2nc(F)nc(-c3c4ccccc4c4n3CCS4)n2)cc1 ZINC000001631755 GI Annotated Clean CC1=C2CN(C(=O)OCC(C)C)CC[C@H]2C2=C(C(=O)c3ccccc3C2=O)[C@H]1C ZINC000001638070 GI Annotated Mild CC1=C2CN(C(=O)OCC(C)C)CC[C@H]2C2=C(C(=O)c3ccccc3C2=O)[C@@H]1C ZINC000001638071 GI Annotated Mild CC(=O)OC/C=C(/CCl)CC[C@H](Br)C(C)(C)Br ZINC000001638721 GI Annotated Reactive CC(=O)OC/C=C(/CCl)CC[C@@H](Br)C(C)(C)Br ZINC000001638723 GI Annotated Reactive O=C1/C(=C/c2ccc([N+](=O)[O-])cc2)C(=O)N(c2ccccc2)[C@H]1c1ccccc1 ZINC000001638913 GI Annotated Mild O=C1/C(=C/c2ccc([N+](=O)[O-])cc2)C(=O)N(c2ccccc2)[C@@H]1c1ccccc1 ZINC000001638915 GI Annotated Mild CCSc1nc(N)c2c(-c3ccc(OC)c(OC)c3)c3c(nc2n1)CCCC3 ZINC000001642449 GI Annotated Anodyne O=C1c2ccccc2NC(=O)[C@@H]2[C@@H]1[C@H](c1ccccc1)C[C@@]2(O)c1ccccc1 ZINC000001642573 GI Annotated Anodyne CCOP(=O)(OCC)[C@@](C)(CC)NC(=O)C(C(F)(F)F)C(F)(F)F ZINC000001643722 GI Annotated Anodyne COCCN(C(C)=O)[C@@H]1CCC2(SCCS2)c2[nH]c3ccccc3c21 ZINC000001645610 GI Annotated Anodyne COC(=O)c1ccc2c(c1)C[C@]1(C2)Cc2cc3c(c(C(=O)OC)c2C1)CCCC3 ZINC000001646195 GI Annotated Anodyne O=C(O)Cc1cccc2c1O[C@@H](c1ccccc1)[C@@H](C(=O)c1ccccc1)C2=O ZINC000001646827 GI Annotated Anodyne O=C(O)Cc1cccc2c1O[C@H](c1ccccc1)[C@@H](C(=O)c1ccccc1)C2=O ZINC000001646828 GI Annotated Anodyne O=C(O)Cc1cccc2c1O[C@H](c1ccccc1)[C@H](C(=O)c1ccccc1)C2=O ZINC000001646830 GI Annotated Anodyne O=c1c(-c2ccc(Cl)cc2)nnc2n(Cc3ccccc3)c3ccccc3n12 ZINC000001647483 GI Annotated Anodyne FC(F)(F)c1cccc(NC2=NC[C@@H](CI)S2)c1 ZINC000001649989 GI Annotated Reactive CC(C)Oc1c(O)c2c3c(oc(=O)n3C=C[C@@H]2c2ccccc2)c1OC(C)C ZINC000001650067 GI Annotated Anodyne O=c1c2ncn([C@@H]3CCCO3)c2n(-c2ccccc2)c(=S)n1-c1ccccc1 ZINC000001651042 GI Annotated Anodyne N#CC1(C#N)[C@H](c2ccc([N+](=O)[O-])cc2)C=C[C@H](c2ccccc2)C1(C#N)C#N ZINC000001652585 GI Annotated Mild N#CC1(C#N)[C@H](c2ccccc2)C=C[C@@H](c2ccc([N+](=O)[O-])cc2)C1(C#N)C#N ZINC000001652586 GI Annotated Mild N#CC1(C#N)[C@@H](c2ccccc2)C=C[C@H](c2ccc([N+](=O)[O-])cc2)C1(C#N)C#N ZINC000001652587 GI Annotated Mild N#CC1(C#N)[C@H](c2ccccc2)C=C[C@H](c2ccc([N+](=O)[O-])cc2)C1(C#N)C#N ZINC000001652588 GI Annotated Mild Cn1c(=O)n(-c2c3ccccc3c(Cl)c3ccccc23)n(C(C)(C)C)c1=O ZINC000001652838 GI Annotated Bother COc1cc(OC)nc(Nc2c(C#N)c3nc4ccccc4n3c3ccccc23)n1 ZINC000001653326 GI Annotated Mild Nc1ccc2[nH]c(C(=O)N3C[C@@H](CCl)c4c3cc(N)c3ccccc43)cc2c1 ZINC000001653498 GI Annotated Reactive CCOC(=O)c1cc([C@@H]2CCN(C[C@H](C)CC)C2=S)c(-c2cc(C)no2)[nH]1 ZINC000001653956 GI Annotated Anodyne CCOC(=O)c1cc([C@@H]2CCN(C[C@@H](C)CC)C2=S)c(-c2cc(C)no2)[nH]1 ZINC000001653957 GI Annotated Anodyne CCOC(=O)c1cc([C@H]2CCN(C[C@H](C)CC)C2=S)c(-c2cc(C)no2)[nH]1 ZINC000001653958 GI Annotated Anodyne CCOC(=O)c1cc([C@H]2CCN(C[C@@H](C)CC)C2=S)c(-c2cc(C)no2)[nH]1 ZINC000001653959 GI Annotated Anodyne Cc1cccc(-c2cccc(COCc3cccc(-c4cccc(CO)n4)n3)n2)n1 ZINC000001654060 GI Annotated Anodyne CCOC(=O)c1nc2ccc(C(F)(F)F)cc2nc1Oc1ccc(C#N)cc1 ZINC000001654502 GI Annotated Mild COc1cc([C@H]2c3cccc4cccc(c34)[C@H]3CCC(=O)N23)cc(OC)c1O ZINC000001654635 GI Annotated Anodyne COc1cc([C@@H]2c3cccc4cccc(c34)[C@H]3CCC(=O)N32)cc(OC)c1O ZINC000001654636 GI Annotated Anodyne COc1cc([C@H]2c3cccc4cccc(c34)[C@@H]3CCC(=O)N32)cc(OC)c1O ZINC000001654637 GI Annotated Anodyne COc1cc([C@@H]2c3cccc4cccc(c34)[C@@H]3CCC(=O)N32)cc(OC)c1O ZINC000001654638 GI Annotated Anodyne COc1cc2c(c(O)c1OC)C[C@H]1CCC(=O)N1[C@H]2c1cccc2ccccc12 ZINC000001654660 GI Annotated Anodyne COc1cc2c(c(O)c1OC)C[C@H]1CCC(=O)N1[C@@H]2c1cccc2ccccc12 ZINC000001654661 GI Annotated Anodyne COc1cc2c(c(O)c1OC)C[C@@H]1CCC(=O)N1[C@H]2c1cccc2ccccc12 ZINC000001654662 GI Annotated Anodyne COc1cc2c(c(O)c1OC)C[C@@H]1CCC(=O)N1[C@@H]2c1cccc2ccccc12 ZINC000001654663 GI Annotated Anodyne N#Cc1c(-c2ccccc2)c(CN2CCCCC2)c(=O)n2c1[nH]c1ccccc12 ZINC000001654912 GI Annotated Mild NCCCC[C@H](N)C(=O)Nc1ccc(-c2nc3ccccc3s2)cc1Cl ZINC000001655286 GI Annotated Anodyne Cc1ccc2c(ccc3[nH]cc(CNc4ccc(NS(C)(=O)=O)cc4)c32)n1 ZINC000001657717 GI Annotated Anodyne CCO[C@H]1OC(=O)c2cc3ccc4c(c3c(-c3ccc5c(c3)OCO5)c21)OCO4 ZINC000001658033 GI Annotated Anodyne C=CCSc1nnc2cc(CN3CCCC3)c(-c3ccc(Cl)cc3)nn12 ZINC000001659245 GI Annotated Mild c1cc2c(cc1C1=NCCN1)c1cc(C3=NCCN3)ccc1n2CC1CCCCC1 ZINC000001660296 GI Annotated Anodyne COc1ccccc1[C@@H]1Nn2c(nc3ccccc3c2=O)N1c1ccc(C)cc1 ZINC000001660472 GI Annotated Anodyne COC(=O)c1sc2c(c1C(=O)OC)/C(=N/C(C)(C)C)S/C2=N\C(C)(C)C ZINC000001661032 GI Annotated Mild O=C(c1ccccc1)c1cc(-c2ccccc2)c(-c2ccccc2)[nH]c(=O)c1=O ZINC000001661046 GI Annotated Anodyne O=C1O/C(=C\c2ccc(O)cc2)C(c2ccc(O)c(Cl)c2)=C1Br ZINC000001663382 GI Annotated Anodyne ClC1=C(Cl)[C@]2(Cl)[C@H]3[C@@H]4C[C@@H]([C@@H]5O[C@H]45)[C@@H]3[C@@]1(Cl)C2(Cl)Cl ZINC000001851055 GI Annotated Anodyne in-man CCc1cc2c(cc1CCCC(=O)O)C[C@@]1(Cc3ccc(C(=O)O)cc3C1)C2 ZINC000001855347 GI Annotated Anodyne COC(=O)c1c2c(cc3c1C[C@@]1(Cc4cc5c(c(C=O)c4C1)CCC5)C3)CCC2 ZINC000001855688 GI Annotated Anodyne Cc1ccc(SC[C@@H](CF)O[C@@H](C)n2cnc3c(Cl)nc(N)nc32)cc1 ZINC000001855770 GI Annotated Anodyne Cc1ccc(SC[C@H](CF)O[C@@H](C)n2cnc3c(Cl)nc(N)nc32)cc1 ZINC000001855772 GI Annotated Anodyne Cc1ccc(SC[C@@H](CF)O[C@H](C)n2cnc3c(Cl)nc(N)nc32)cc1 ZINC000001855776 GI Annotated Anodyne Cc1ccc(SC[C@H](CF)O[C@H](C)n2cnc3c(Cl)nc(N)nc32)cc1 ZINC000001855779 GI Annotated Anodyne N#Cc1ccc([C@H]2NN=C[C@@]23C(=O)c2ccccc2O[C@@H]3c2ccccc2)cc1 ZINC000001856340 GI Annotated Mild O=C(O)C1=CN(c2ccncc2)C(c2ccco2)=C[C@H]1c1ccccc1[N+](=O)[O-] ZINC000001858588 GI Annotated Bother COc1ccc2oc(C(=O)N3C[C@H](CCl)c4ccc([N+](=O)[O-])cc43)cc2c1 ZINC000001859582 GI Annotated Reactive CCOC(=O)c1nc2cc(C(F)(F)F)ccc2nc1Oc1ccc(C#N)cc1 ZINC000001859652 GI Annotated Mild N#Cc1c2ccc([N+](=O)[O-])cc2c(=O)n2c1sc1ccc(C(F)(F)F)cc12 ZINC000001861468 GI Annotated Mild CCOC(=O)c1cn(-c2ccc([N+](=O)[O-])cc2)c(=S)n2c1nc1ccccc12 ZINC000001862319 GI Annotated Bother COc1cc([C@@H]2SCC(=O)N2c2cccc(Cl)c2)cc(OC)c1OC ZINC000001862914 GI Annotated Anodyne COc1cc([C@@H]2SCC(=O)N2c2ccccc2Cl)cc(OC)c1OC ZINC000001862919 GI Annotated Anodyne COP(=O)(/C=C/[C@H](NC(=O)C(Cl)(Cl)Cl)c1ccccc1)OC ZINC000001863476 GI Annotated Anodyne COP(=O)(/C=C/[C@@H](NC(=O)C(Cl)(Cl)Cl)c1ccccc1)OC ZINC000001863478 GI Annotated Anodyne Cc1cc2c3c(ccc4[nH]cc(c43)CN2c2ccc(NS(C)(=O)=O)cc2)n1 ZINC000001863792 GI Annotated Anodyne COc1cc(OC)cc(Oc2nc3cc(N)cc(N)c3nc2-c2ccccc2)c1 ZINC000001866578 GI Annotated Anodyne Sc1nnc(-c2cc(-c3ccccc3)n[nH]2)n1N=Cc1cccc(Cl)c1 ZINC000001894706 GI Annotated Anodyne C=CC[n+]1c(-c2ccc(OC)cc2)csc1NNC(=O)Nc1ccccc1 ZINC000001958654 GI Annotated Reactive aggregator CC(=O)/C=C/[C@@H]1C(COC(C)=O)=C[C@H](OC(C)=O)[C@@H]2C(C)(C)CCC[C@@]12C ZINC000015053154 GI Annotated Mild Cc1cc(C(=O)N[C@@H]2CCCc3c2cnn3-c2ccc(C(C)(C)C)cc2)nn1C ZINC000015072919 GI Annotated Anodyne Cc1cc(C(=O)N[C@H]2CCCc3c2cnn3-c2ccc(C(C)(C)C)cc2)nn1C ZINC000015072921 GI Annotated Anodyne C=C1[C@H](OC(=O)/C=C(\C)CC)C[C@@H](C(C)C)[C@H]2[C@@H]([C@@H](C)OC(C)=O)C(=O)C[C@@H]12 ZINC000015107417 GI Annotated Mild in-man C=C1[C@@H](OC(=O)/C=C(\C)CC)C[C@@H](C(C)C)[C@H]2[C@@H]([C@@H](C)OC(C)=O)C(=O)C[C@@H]12 ZINC000015107420 GI Annotated Mild in-man C=C1[C@H](OC(=O)/C=C(\C)CC)C[C@H](C(C)C)[C@H]2[C@@H]([C@@H](C)OC(C)=O)C(=O)C[C@@H]12 ZINC000015107423 GI Annotated Mild in-man C=C1[C@@H](OC(=O)/C=C(\C)CC)C[C@H](C(C)C)[C@H]2[C@@H]([C@@H](C)OC(C)=O)C(=O)C[C@@H]12 ZINC000015107426 GI Annotated Mild in-man C=C(CCC=C(C)C)[C@H](O)Cc1c(O)cc(O)c(C(=O)c2ccccc2)c1O ZINC000015120689 GI Annotated Mild C=C(C)[C@H](O)CC/C(C)=C/Cc1c(O)cc(O)c(C(=O)c2ccccc2)c1O ZINC000015120691 GI Annotated Mild COc1c(O)c2c(c3occ(-c4ccc5c(c4)OCO5)c(=O)c13)C=CC(C)(C)O2 ZINC000015148526 GI Annotated Anodyne in-vitro biogenic COC(=O)/C1=C\CC[C@]2(C)O[C@H]2CC/C(C(=O)OC)=C/C=C(/C(C)C)CC1 ZINC000015154320 GI Annotated Anodyne CC(=O)O[C@@H]1[C@H](C(C)C)CC/C(C)=C/C[C@H](OC(=O)C=C(C)C)[C@@]2(C)O[C@H]12 ZINC000015160710 GI Annotated Anodyne CSC[C@H](c1nccc2c1[nH]c1ccc(O)c(Br)c12)N(C)C ZINC000015209766 GI Annotated Anodyne COc1cc2c3c(c4cc5c(cc4c2cc1OC)OCO5)C[C@H]1CCCN1C3 ZINC000015216026 GI Annotated Bother COc1cc2c3c(c4cc5c(cc4c2cc1OC)OCO5)C[C@@H]1CCCN1C3 ZINC000015216028 GI Annotated Bother C/C=C(/C)C(=O)OC/C1=C\[C@H](O)[C@H](C(C)C)[C@@H](OC(C)=O)C/C(C)=C/CC1 ZINC000015254821 GI Annotated Anodyne CN(C)c1nc2c([nH]1)c(C(=O)c1c[nH]c3ccccc13)nc1[nH]c3ccccc3c12 ZINC000015264119 GI Annotated Bother CC[C@](C)(O)c1cc(O)c(C)c2c1Oc1c(Cl)c(O)cc(C)c1C(=O)O2 ZINC000015266335 GI Annotated Anodyne Brc1cccc2nc(Nc3ccc([C@H]4CNCCO4)cc3)ccc12 ZINC000150021361 GI Annotated Anodyne Cc1cc(O)c(-c2ccc(C3(CN)CC3)cc2)c2c1[nH]c(=O)c1sccc12 ZINC000150070142 GI Annotated Anodyne Cc1cc(F)ccc1-c1nc(-c2ccc3[nH]c(=O)n(CCN(C)C)c3c2)cs1 ZINC000150104862 GI Annotated Anodyne CC(C)(CN)c1ccc(-c2c(O)ccc3[nH]c(=O)c4sccc4c23)cc1F ZINC000150161168 GI Annotated Anodyne Cc1ccc2c(c1)N(CC(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C)C(=O)c1cccnc1O2 ZINC000015879069 GI Annotated Anodyne Cc1ccc2c(c1)N(CC(=O)N[C@@H]1CCC[C@H](C)[C@H]1C)C(=O)c1cccnc1O2 ZINC000015879071 GI Annotated Anodyne Cc1ccc2c(c1)N(CC(=O)N[C@H]1CCC[C@@H](C)[C@H]1C)C(=O)c1cccnc1O2 ZINC000015879073 GI Annotated Anodyne Cc1ccc2c(c1)N(CC(=O)N[C@H]1CCC[C@H](C)[C@H]1C)C(=O)c1cccnc1O2 ZINC000015879075 GI Annotated Anodyne O=[N+]([O-])c1cc([N+](=O)[O-])c(Oc2cc(F)ccc2F)cc1NN1CCCCC1 ZINC000015936250 GI Annotated Bother O=[N+]([O-])c1cc([N+](=O)[O-])c(Oc2ccc(F)cc2F)cc1NN1CCCCC1 ZINC000015936253 GI Annotated Bother Cc1c[nH]c(CN(C)C(=O)c2ccc3oc(Cc4ccc(Cl)cc4)nc3c2)n1 ZINC000015936582 GI Annotated Anodyne O=[N+]([O-])c1cc([N+](=O)[O-])c(Oc2cncc(Cl)c2)cc1NN1CCCCC1 ZINC000015936803 GI Annotated Bother O=[N+]([O-])c1cc([N+](=O)[O-])c(Oc2cc(F)cc(F)c2)cc1NN1CCCCC1 ZINC000015936806 GI Annotated Bother O=[N+]([O-])c1cc([N+](=O)[O-])c(Oc2ccc(F)cc2)cc1NN1CCCCC1 ZINC000015936823 GI Annotated Bother O=[N+]([O-])c1cc([N+](=O)[O-])c(Oc2c(F)cccc2F)cc1NN1CCCCC1 ZINC000015936825 GI Annotated Bother O=[N+]([O-])c1cc([N+](=O)[O-])c(Oc2ccccc2F)cc1NN1CCCCC1 ZINC000015936827 GI Annotated Bother C[C@@]1(c2nnc(-c3cccc(Cl)c3)o2)CC(c2cccc([N+](=O)[O-])c2)=NO1 ZINC000015937324 GI Annotated Bother C[C@]1(c2nnc(-c3cccc(Cl)c3)o2)CC(c2cccc([N+](=O)[O-])c2)=NO1 ZINC000015937325 GI Annotated Bother CCCCNC(=O)O[C@H]1C[C@@H]2CCN3C(=O)CCC[C@@H]([C@H]23)[C@H]1Cc1ccccc1 ZINC000015937336 GI Annotated Anodyne CCCCC[C@H]1CN(CCCC)C(=O)[C@@H]1CC(=O)NCc1ccc(OC)cc1 ZINC000015937363 GI Annotated Anodyne CCN1C(N(C)CCc2cccs2)=N[C@@H](c2ccccc2)C(C(=O)OC)=C1C ZINC000015937388 GI Annotated Anodyne CCN1C(NCC(C)C)=N[C@@H](c2cccc(C(F)(F)F)c2)C(C(=O)OC)=C1C ZINC000015937431 GI Annotated Anodyne COC(=O)C1=C(C)N(Cc2ccccc2)C(NCC(C)C)=N[C@H]1c1ccccc1 ZINC000015937434 GI Annotated Anodyne CC1=C(C(=O)Nc2cc(C(=O)N(C)Cc3ccccc3)ccc2C)SCCO1 ZINC000015941617 GI Annotated Anodyne Cc1ccc(CNC(=O)c2ccc3c(=O)c(O)c(-c4ccc(C)cc4)[nH]c3c2)cc1 ZINC000015952300 GI Annotated Anodyne CCC(CC)c1nn2c(N)c(/C=C3\C(C)=Nc4ccccc43)c(=O)nc2s1 ZINC000015952628 GI Annotated Anodyne Cc1ccc(-c2cc(C(=O)N/N=C\C(Br)=C\c3ccccc3)[nH]n2)o1 ZINC000015961307 GI Annotated Reactive CCC(=O)c1cn([C@@H](CCC(OC)OC)CC(=O)OC(C)(C)C)cc1CC ZINC000015973913 GI Annotated Anodyne CN(N/C=C1/C=CC(=O)C(O)=C1)c1nc(-c2ccccc2)cc(-c2ccccc2)n1 ZINC000015974370 GI Annotated Mild O=C(NCC1CC1)c1ccc(Nc2nc3cc(Br)ccc3[nH]2)cc1 ZINC000015974459 GI Annotated Anodyne CCC(=O)c1cn(/C(=C\C(=O)OC(C)(C)C)CCC(OC)OC)cc1CC ZINC000015974644 GI Annotated Anodyne CCC(=O)c1cn([C@H](CCC(OC)OC)CC(=O)OC(C)(C)C)cc1CC ZINC000015974652 GI Annotated Anodyne O=[N+]([O-])c1ccccc1/C=C/C=N\n1c(S)nnc1-c1ccc(Cl)cc1 ZINC000015979109 GI Annotated Mild Sc1nnc(-c2cc(-c3ccccc3)n[nH]2)n1/N=C\c1cccc(Cl)c1 ZINC000015987709 GI Annotated Mild Sc1nnc(-c2cc(-c3ccccc3)n[nH]2)n1/N=C\c1ccc(Cl)cc1 ZINC000015987718 GI Annotated Mild Cc1ccc(-c2cc(C(=O)N/N=C\c3cnn(C)c3C)c3ccccc3n2)c(C)c1 ZINC000015989775 GI Annotated Reactive Cc1c(/N=C/C=C2/N(C)c3ccccc3C2(C)C)c(=O)n(-c2ccccc2)n1C ZINC000015989927 GI Annotated Mild COc1cc([C@H]2[C@@H]3CCCC[C@@]3(O)CCN2Cc2ccccc2F)ccc1O ZINC000016009702 GI Annotated Anodyne COc1cc([C@H]2[C@@H]3CCCC[C@@]3(O)CCN2Cc2cccc(F)c2)ccc1O ZINC000016012132 GI Annotated Anodyne Cc1ccn(-c2ccc3c(c2)NCC3(C)C)c(=O)c1-c1ccc2nc(N)ncc2c1 ZINC000016052723 GI Annotated Anodyne in-vivo CN(C)CCc1ccc(-c2c(O)ccc3[nH]c(=O)c4sccc4c23)cc1F ZINC000164890173 GI Annotated Anodyne COc1cc(C)c2[nH]c(=O)c3sccc3c2c1-c1ccc(CCN)c(F)c1 ZINC000164900108 GI Annotated Anodyne NC(=O)c1ccc(COC(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1 ZINC000016817215 GI Annotated Anodyne CC[N+]1(C)CC[C@](O)(/C=C/c2ccccc2)[C@@H](C(=O)/C=C/c2ccccc2)C1 ZINC000016952807 GI Annotated Mild CCc1cccc([C@H](C)CC)c1NC(=O)C[C@@H]1C(=O)Nc2ccccc2[S@@]1=O ZINC000016957318 GI Annotated Anodyne COc1cccc(N2C(=O)[C@@H]3c4[nH]c5ccccc5c4[C@@H]4CCC[C@H]4[C@H]3C2=O)c1 ZINC000016958491 GI Annotated Anodyne C[C@@H]1[C@@H](c2ccc3c(c2)OCO3)c2cc3c(cc2O[C@H]1N1CCCCC1)OCO3 ZINC000016958563 GI Annotated Anodyne C[C@@H]1[C@@H](c2ccc(N(C)C)cc2)c2cc3c(cc2O[C@H]1N1CCCC1)OCO3 ZINC000016958572 GI Annotated Anodyne CC(=O)Oc1ccc2[nH]c(=O)c3sccc3c2c1-c1ccc([C@@H](C)N)cc1 ZINC000165022501 GI Annotated Anodyne CC(=O)Oc1ccc2[nH]c(=O)c3sccc3c2c1-c1ccc([C@H](C)N)cc1 ZINC000165022606 GI Annotated Anodyne NCCc1ccc(-c2c(O)cc(Cl)c3[nH]c(=O)c4sccc4c23)cc1F ZINC000165187518 GI Annotated Anodyne C=C(CCCC(C)=O)[C@H]1[C@@H]2CC(=O)O[C@@H](CC=C(C)C)C2=CO[C@@H]1OC(C)=O ZINC000165696887 GI Annotated Mild CC(=O)OC/C=C(\C)CC[C@@]1(C)[C@H](C)C[C@H](O)[C@@]2(C)C(C(=O)O)=CCC[C@H]12 ZINC000165774665 GI Annotated Anodyne CCCCCCCCCCCCCC[C@H](O)[C@]1(O)C(=O)C=C[C@@H]1OC(C)=O ZINC000167122112 GI Annotated Mild CCc1nn(Cc2ccc(NC(=O)C3CCCCC3)cc2)c(CC)c1CC(=O)O ZINC000168883091 GI Annotated Anodyne COc1cc(-c2nc3cc(-c4cnc(N)nc4)ccc3n2C(C)(C)C)c(F)cn1 ZINC000169259281 GI Annotated Anodyne CCOc1ncccc1-c1nc2cc(-c3cnc(N)nc3)ccc2n1C(C)(C)C ZINC000169259374 GI Annotated Anodyne CCCCC[C@](C)(O)/C=C/[C@H]1[C@H](O)C[C@@H]2OC(=O)C(F)(F)CC/C=C/C[C@@H]21 ZINC000169290096 GI Annotated Anodyne CCCCC[C@](C)(O)/C=C/[C@@H]1[C@H](O)C[C@@H]2OC(=O)C(F)(F)CC/C=C/C[C@@H]21 ZINC000169290097 GI Annotated Anodyne C/C1=C\CC(C)(C)/C=C\C[C@@]2(C)Oc3cc(O)c(=O)cc(C)c3C[C@@H]2C[C@H]1O ZINC000169292481 GI Annotated Anodyne C/C1=C/CC(C)(C)/C=C/C[C@@]2(C)Oc3cc(O)c(=O)cc(C)c3C[C@@H]2C[C@H]1O ZINC000169292482 GI Annotated Anodyne C=C1C(=O)O[C@]2(C)CC[C@@H]1C[C@@H](O)/C(C)=C/C/C=C(/C)CC[C@@H]2OC(C)=O ZINC000169292866 GI Annotated Mild C=C1C(=O)O[C@]2(C)CC[C@@H]1C[C@@H](O)/C(C)=C\C/C=C(/C)CC[C@@H]2OC(C)=O ZINC000169292867 GI Annotated Mild C=C1C(=O)O[C@]2(C)CC[C@@H]1C[C@@H](O)/C(C)=C\C/C=C(\C)CC[C@@H]2OC(C)=O ZINC000169292868 GI Annotated Mild COc1ccc([C@@H]2/C=C/CN(CC(C)C)CC(=O)N2Cc2ccc(F)cc2)cc1 ZINC000169295065 GI Annotated Anodyne CC(=O)CC[C@@H]1[C@@H]2[C@@H](O)[C@@H](C(C)C)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@]21C ZINC000169295093 GI Annotated Anodyne CC(=O)CC[C@H]1[C@@H]2[C@@H](O)[C@@H](C(C)C)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@@]12C ZINC000169295094 GI Annotated Anodyne CC(=O)CC[C@@H]1[C@H]2[C@@H](O)[C@@H](C(C)C)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@@]12C ZINC000169295095 GI Annotated Anodyne CC(=O)CC[C@H]1[C@H]2[C@@H](O)[C@@H](C(C)C)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@@]12C ZINC000169295096 GI Annotated Anodyne CC1(C)O[C@H]2C3=C4[C@@H](CCCC[C@@]42O1)[C@H](C1(O)CCCCC1)C=C/C=C/3CO ZINC000169296448 GI Annotated Anodyne CC1(C)O[C@H]2C3=C4[C@@H](CCCC[C@@]42O1)[C@H](C1(O)CCCCC1)/C=C/C=C3CO ZINC000169296449 GI Annotated Anodyne CC1(C)O[C@H]2C3=C4[C@@H](CCCC[C@@]42O1)[C@H](C1(O)CCCCC1)/C=C/C=C/3CO ZINC000169296450 GI Annotated Anodyne CC1(C)O[C@H]2C3=C([C@H]2O1)[C@@H](c1ccccc1)[C@H](C1(O)CCCC1)/C=C/C=C3CO ZINC000169296514 GI Annotated Anodyne CC1(C)O[C@H]2C3=C([C@H]2O1)[C@@H](c1ccccc1)[C@H](C1(O)CCCC1)C=C/C=C/3CO ZINC000169296515 GI Annotated Anodyne CC1(C)O[C@H]2C3=C([C@H]2O1)[C@@H](c1ccccc1)[C@H](C1(O)CCCC1)/C=C/C=C/3CO ZINC000169296516 GI Annotated Anodyne CC1(C)[C@H]2CC[C@@]1(C)[C@@H](/N=C(\N)Nc1ccccc1I)C2 ZINC000169296531 GI Annotated Mild CC1(C)[C@@H]2CC[C@]1(C)[C@@H](/N=C(\N)Nc1ccccc1I)C2 ZINC000169296533 GI Annotated Mild COc1ccc([C@H]2[C@H]3CCCCC3=NN2S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000169296944 GI Annotated Anodyne COc1ccc([C@@H]2/C=C/CN(CC(C)C)CC(=O)N2Cc2cccc(F)c2)cc1 ZINC000169298284 GI Annotated Anodyne COC(=O)N1C2=C(c3ccccc3[C@@H]1CC(=O)O)[C@@H]1O[C@@H](C2)c2ccccc21 ZINC000169299232 GI Annotated Anodyne COC(=O)N1C2=C(c3ccccc3[C@H]1CC(=O)O)[C@@H]1O[C@@H](C2)c2ccccc21 ZINC000169299233 GI Annotated Anodyne CC[C@@H]1/C(=N/N=C2\NC(=O)CS2)C[C@H](c2ccccc2)N[C@@H]1c1ccccc1 ZINC000169300336 GI Annotated Mild CC[C@H]1/C(=N/N=C2\NC(=O)CS2)C[C@H](c2ccccc2)N[C@@H]1c1ccccc1 ZINC000169300338 GI Annotated Mild CCOC(=O)[C@@H]1CCCN([C@H](c2ccccn2)c2c(C)[nH]c3ccccc23)C1 ZINC000169300794 GI Annotated Anodyne CCOC(=O)[C@H]1CCCN([C@H](c2ccccn2)c2c(C)[nH]c3ccccc23)C1 ZINC000169300795 GI Annotated Anodyne Cc1cc(NC(=O)[C@H]2C[C@@H]3CC[C@@H]2C3)ccc1N1CC[C@@H](N2CCC[C@@H]2C)C1 ZINC000169301293 GI Annotated Anodyne Cc1cc(NC(=O)[C@@H]2C[C@H]3CC[C@@H]2C3)ccc1N1CC[C@@H](N2CCC[C@@H]2C)C1 ZINC000169301295 GI Annotated Anodyne Cc1cc(NC(=O)[C@H]2C[C@H]3CC[C@@H]2C3)ccc1N1CC[C@@H](N2CCC[C@@H]2C)C1 ZINC000169301296 GI Annotated Anodyne CC1(C)C[C@@H]2[C@@H]1CC[C@]1(CBr)CC[C@@H]3[C@@H](CC(=O)O)C(=O)O[C@]23C1 ZINC000169301966 GI Annotated Reactive C[C@H]1C(=NO)[C@H](C)[C@@H](c2ccc(N(C)C)cc2)N[C@@H]1c1ccc(N(C)C)cc1 ZINC000169302522 GI Annotated Mild CCN(CC)CCCCNC1=C(Nc2ccccc2)C(=O)c2ccccc2C1=O ZINC000169302760 GI Annotated Mild N#Cc1ccnc(N2CCC(C(=O)N(CC3CC3)c3ccc(Cl)cc3)CC2)c1 ZINC000169302860 GI Annotated Mild O=C1[C@H]2[C@@H](c3ccccc3)C=C[C@H](c3ccccc3)[C@@H]2C(=O)N1c1ccncc1 ZINC000169302928 GI Annotated Anodyne O=C1[C@H]2[C@@H](c3ccccc3)C=C[C@H](c3ccccc3)[C@H]2C(=O)N1c1ccncc1 ZINC000169302930 GI Annotated Anodyne CC(C)c1ccccc1-c1ncc(F)c(NC[C@@H]2CCN(c3cnccn3)C2)n1 ZINC000169302978 GI Annotated Anodyne CC(C)c1ccccc1-c1ncc(F)c(NC[C@H]2CCN(c3cnccn3)C2)n1 ZINC000169302979 GI Annotated Anodyne N#Cc1cccnc1N1CCC(C(=O)N(CC2CC2)c2ccc(Cl)cc2)CC1 ZINC000169303348 GI Annotated Mild O=C1C(Nc2cccc(Br)c2)=C(N2CCCC2)C(=O)c2ccccc21 ZINC000169303606 GI Annotated Mild N#C/C(C(=O)c1ccc(Cl)cc1Cl)=C1/NC(=O)c2ccc(Cl)cc2N1 ZINC000169303799 GI Annotated Reactive N#C/C(C(=O)c1ccc(Cl)cc1Cl)=C1\NC(=O)c2ccc(Cl)cc2N1 ZINC000169303800 GI Annotated Reactive Cc1cnc(-c2ccccc2C(C)C)nc1NCC1CCN(C2COC2)CC1 ZINC000169304001 GI Annotated Anodyne COC(=O)c1cc(-c2ccccc2)cnc1N1CCC(NC2CCCCC2)CC1 ZINC000169304017 GI Annotated Anodyne Nc1nc2ccc(Cl)cc2cc1C(=O)NCc1ccccc1Br ZINC000169304025 GI Annotated Anodyne CCO/C(O)=C(\c1nc2ccccc2[nH]1)n1c(-c2cnccn2)nc2ccccc21 ZINC000169304410 GI Annotated Anodyne CCO/C(O)=C(/c1nc2ccccc2[nH]1)n1c(-c2cnccn2)nc2ccccc21 ZINC000169304412 GI Annotated Anodyne CC1(C)CC(NC(=O)[C@]23CC[C@@](C)([C@H]2Br)C3(C)C)CC(C)(C)N1 ZINC000169304438 GI Annotated Reactive CC1(C)CC(NC(=O)[C@]23CC[C@](C)([C@H]2Br)C3(C)C)CC(C)(C)N1 ZINC000169304440 GI Annotated Reactive CC1(C)CC(NC(=O)[C@@]23CC[C@](C)([C@H]2Br)C3(C)C)CC(C)(C)N1 ZINC000169304442 GI Annotated Reactive CCN(C(=O)c1cc(COc2cccc(C(C)=O)c2)on1)[C@@H](C)c1ccccn1 ZINC000169304796 GI Annotated Anodyne CCN(C(=O)c1cc(COc2cccc(C(C)=O)c2)on1)[C@H](C)c1ccccn1 ZINC000169304797 GI Annotated Anodyne C[C@H]1/C(=N/N=C2\NC(=O)CS2)C[C@H](c2ccccc2)N(C)[C@@H]1c1ccccc1 ZINC000169304902 GI Annotated Mild CN(c1ccc(OCc2ccccc2)cc1)c1nc(=O)c2cccnc2s1 ZINC000169305448 GI Annotated Anodyne CC1(C)CC(=O)[C@@H]2[C@@H](c3ccc(F)c(Br)c3)n3nccc3N[C@@H]2C1 ZINC000169305717 GI Annotated Anodyne CC1(C)CC(=O)[C@H]2[C@H](C1)Nc1ccnn1[C@@H]2c1ccc(F)c(Br)c1 ZINC000169305719 GI Annotated Anodyne CN1c2c(ccc(Cl)c2Cl)N(CCOc2ccc(Cl)cc2)[C@@H]1NC#N ZINC000169307014 GI Annotated Anodyne CN1c2ccccc2Sc2ccc([C@]3(O)CN(C)[C@H]4CCCC[C@H]4O3)cc21 ZINC000169307100 GI Annotated Clean CN1c2ccccc2Sc2ccc([C@@]3(O)CN(C)[C@H]4CCCC[C@H]4O3)cc21 ZINC000169307102 GI Annotated Clean O=C(OCCc1ccccc1)c1sc2ccccc2c1OC1CCNCC1 ZINC000169307388 GI Annotated Anodyne O=C(NCCc1ccccc1)c1sc2ccccc2c1OC1CCNCC1 ZINC000169307398 GI Annotated Anodyne c1ccc(Cc2n[nH]c(-c3sc4ccccc4c3OC3CCNCC3)n2)cc1 ZINC000169307410 GI Annotated Anodyne COc1ccc(-c2nn(C(N)=S)c(O)c2/N=N/c2cccc(Cl)c2)cc1 ZINC000169307452 GI Annotated Clean NC(=O)n1nc(-c2ccc([N+](=O)[O-])cc2)c(/N=N/c2cccc(Cl)c2)c1O ZINC000169307456 GI Annotated Clean NC(=O)n1nc(-c2ccc([N+](=O)[O-])cc2)c(/N=N/c2ccc(Cl)cc2)c1O ZINC000169307458 GI Annotated Clean COc1ccc(-c2nnc([C@@H](NCc3ccc(F)cc3)c3ccc[nH]3)o2)cc1 ZINC000169307909 GI Annotated Anodyne COc1ccc(-c2nnc([C@H](NCc3ccc(F)cc3)c3ccc[nH]3)o2)cc1 ZINC000169307910 GI Annotated Anodyne ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@@H]4C[C@@H]([C@@H]5O[C@@H]54)[C@@H]3[C@@]1(Cl)C2(Cl)Cl ZINC000169308985 GI Annotated Anodyne in-man ClC1=C(Cl)[C@@]2(Cl)[C@@H]3[C@H]([C@@H]4C[C@H]3[C@@H]3O[C@H]43)[C@@]1(Cl)C2(Cl)Cl ZINC000169308988 GI Annotated Anodyne in-man CCCCCCCCCCC/C(NCCCOC(C)C)=C1\C(=O)CNC1=O ZINC000169309165 GI Annotated Mild CC(=O)O[C@@]1(C)C/C=C2/O[C@H](C[C@@H]2C)C[C@]2(C)O[C@H]2C(=O)C(=C(C)C)CC1 ZINC000169310498 GI Annotated Mild COc1cc2c(c(OC)c1OC)/C(=C\c1c(Cl)[nH]c3ccccc13)C(=O)N2 ZINC000169310826 GI Annotated Clean C[C@@](O)(c1cccc(Br)c1)c1ccnc(Nc2ccc(C#N)cc2)n1 ZINC000169310975 GI Annotated Mild C[C@](O)(c1cccc(Br)c1)c1ccnc(Nc2ccc(C#N)cc2)n1 ZINC000169310976 GI Annotated Mild O=C(c1ccn(-c2ccc(O)c(F)c2)c1)c1ccc(Br)cc1F ZINC000169311953 GI Annotated Anodyne O=C(c1ccccc1)c1cc(C(=O)C(F)(F)F)n(-c2ccc(O)c(F)c2)c1 ZINC000169311964 GI Annotated Anodyne NC[C@H]1CN(c2ccc(C(F)(F)F)cc2)C(=O)C[C@@H]1c1cc(F)ccc1F ZINC000169312403 GI Annotated Anodyne NC[C@H]1CN(Cc2ccc(C(F)(F)F)cc2)C(=O)C[C@@H]1c1cc(F)ccc1F ZINC000169312411 GI Annotated Anodyne COc1ccc2c(c1)c(C(=O)/C=C(\O)C(=O)O)cn2Cc1c(C)cc(C)cc1C ZINC000169312662 GI Annotated Mild Cc1cc(C)c(Cn2cc(C(=O)C3=C(O)C(=O)OC3)c3cc(F)ccc32)c(C)c1 ZINC000169312678 GI Annotated Mild CCCS(=O)(=O)Nc1ccc(F)c(Nc2ccc3ncccc3c2)c1F ZINC000169312823 GI Annotated Anodyne CCCS(=O)(=O)Nc1ccc(F)c(Nc2ccc3nccnc3c2)c1Cl ZINC000169312825 GI Annotated Anodyne C[C@@]12C(=CC(=O)C[C@@H]1C#N)[C@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000169313945 GI Annotated Mild C[C@@]12C(=CC(=O)C[C@@H]1C#N)[C@@H]1C[C@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000169313946 GI Annotated Mild C[C@@]12C(=CC(=O)C[C@@H]1C#N)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000169313947 GI Annotated Mild CCCCC(C)(C)[C@H](O)/C=C/[C@@H]1CCC(=O)[C@@H]1CCCCOCC(=O)OCC ZINC000169316651 GI Annotated Anodyne CCCCC(C)(C)[C@H](O)/C=C/[C@H]1CCC(=O)[C@@H]1CCCCOCC(=O)OCC ZINC000169316653 GI Annotated Anodyne CCCCC(C)(C)[C@@H](O)/C=C/[C@@H]1CCC(=O)[C@@H]1CCCCOCC(=O)OCC ZINC000169316654 GI Annotated Anodyne CCCCC(C)(C)[C@@H](O)/C=C/[C@H]1CCC(=O)[C@@H]1CCCCOCC(=O)OCC ZINC000169316656 GI Annotated Anodyne CC1=CC[C@H]([C@@](C)(Cl)CCl)O[C@@H]1C(Br)Br ZINC000169318219 GI Annotated Reactive Cc1[nH]n(-c2ccccc2)c(=O)c1/N=N/c1c(O)cc(C(=O)O)c2ccccc12 ZINC000169319690 GI Annotated Clean Cc1nnc(CN(C)C)n1-c1ccc(Cl)cc1C(=O)c1ccccc1Cl ZINC000169319849 GI Annotated Anodyne O[C@]1(c2cccnc2)CCN2C[C@@H]3c4ccccc4CCc4cccc(c43)[C@H]2C1 ZINC000169319893 GI Annotated Anodyne CN(C(=O)Nc1nonc1-c1ccc(O)cc1)c1ccc(C(F)(F)F)cc1 ZINC000169320945 GI Annotated Anodyne FC1(F)CCN(C2CCC3(CC2)OOC2(OO3)C3CC4CC(C3)CC2C4)CC1 ZINC000169321465 GI Annotated Reactive CCCCC[C@](C)(O)/C=C/[C@@H]1CCC(=O)[C@@H]1CCCCOCC(=O)OCC ZINC000169321625 GI Annotated Anodyne CCCCC[C@](C)(O)/C=C/[C@H]1CCC(=O)[C@@H]1CCCCOCC(=O)OCC ZINC000169321627 GI Annotated Anodyne OCc1ccc(-c2nn(Cc3c(F)c(F)cc(F)c3F)c3ccccc23)o1 ZINC000169322388 GI Annotated Anodyne CCN(CC)CC(=O)Nc1cc(OC)ccc1Cc1nccc2ccccc12 ZINC000169323659 GI Annotated Anodyne CCOC(=O)c1c[nH]c2ccc(Oc3ccc(OC(F)(F)F)cc3)cc2c1=O ZINC000169323680 GI Annotated Anodyne CCOC(=O)c1c[nH]c2cc(Oc3ccc(OC(F)(F)F)cc3)ccc2c1=O ZINC000169323682 GI Annotated Anodyne CCOC(=O)c1c[nH]c2ccc(Cc3ccc(OC(F)(F)F)cc3)cc2c1=O ZINC000169323684 GI Annotated Anodyne CCOC(=O)c1c[nH]c2cc(Cc3ccc(OC(F)(F)F)cc3)ccc2c1=O ZINC000169323686 GI Annotated Anodyne Cn1/c(=N\N/C=C/c2sc3ccc(Cl)cc3[n+]2C)sc2ccccc21 ZINC000169323933 GI Annotated Anodyne CCO[C@@]1(C(F)(F)F)O[C@@H]2O[C@@]3(C)CC[C@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@]42OO3 ZINC000169324574 GI Annotated Reactive COc1ccc(Cl)c2c1CCC(CN1CCC(C(=O)N3CCCC3)CC1)=C2 ZINC000169324739 GI Annotated Anodyne COc1cc(SC#N)ccc1/N=C/c1c(C)[nH]n(-c2ccc(C)c(C)c2)c1=O ZINC000169325937 GI Annotated Reactive COc1cc(C2=CCCCc3c2ccc(OC)c3[N+](=O)[O-])cc(OC)c1OC ZINC000169326606 GI Annotated Bother Fc1ccc(CN(CCBr)CCn2cnc3ccccc32)c(F)c1 ZINC000169327037 GI Annotated Reactive O=C(c1cccc(Br)c1)c1ncccc1OCCCc1ccncc1 ZINC000169327084 GI Annotated Anodyne COc1ccc(COc2ccc3cc(OC)cc(N[C@@H](C)CCCN)c3n2)cc1 ZINC000169327342 GI Annotated Anodyne COc1ccc(COc2ccc3cc(OC)cc(N[C@H](C)CCCN)c3n2)cc1 ZINC000169327343 GI Annotated Anodyne OC[C@@H](COc1cccc2cnccc12)NCc1ccc(Cl)cc1Cl ZINC000169328840 GI Annotated Anodyne OC[C@H](COc1cccc2cnccc12)NCc1ccc(Cl)cc1Cl ZINC000169328841 GI Annotated Anodyne CCOC(=O)c1sc(SC(C)C)c(C#N)c1-c1cc(O)c(O)c(O)c1 ZINC000169329722 GI Annotated Mild c1ccc(CN2C[C@@H]2COc2cccc3c[n+](Cc4ccccc4)ccc23)cc1 ZINC000169329856 GI Annotated Anodyne c1ccc(CN2C[C@H]2COc2cccc3c[n+](Cc4ccccc4)ccc23)cc1 ZINC000169329859 GI Annotated Anodyne COc1cc(SC#N)ccc1/N=C/c1c(C)[nH]n(-c2ccc(C)cc2C)c1=O ZINC000169330570 GI Annotated Reactive COc1cc(SC#N)ccc1/N=C/c1c(C)[nH]n(-c2ccc(Cl)cc2)c1=O ZINC000169330572 GI Annotated Reactive O=c1c(/C=N/OCc2ccc(Cl)cc2Cl)c[nH]n1-c1cccc(Cl)n1 ZINC000169330737 GI Annotated Mild COc1cc(SC#N)ccc1/N=C/c1c(C)[nH]n(-c2ccc(C)cc2)c1=O ZINC000169330743 GI Annotated Reactive Cc1oc2c3c(ccc2c(=O)c1C)OC[C@H]1[C@@H]3C2=C(CCCC2=O)OC1(C)C ZINC000169330917 GI Annotated Mild CCOC(=O)C1=C(C)OC(C)(C)[C@H]2COc3ccc4c(=O)c(C)c(C)oc4c3[C@@H]12 ZINC000169330937 GI Annotated Anodyne CCc1nc2cc(Cl)ccn2c1C(=O)NCc1ccc(N2CCCCC2)cc1 ZINC000169331068 GI Annotated Clean CCN(CC)CCN1N=C(c2ccc(OC)cc2)CC2=C1CC(C)(C)CC2=O ZINC000169331231 GI Annotated Mild N#Cc1ccc2c(c1)cc(C(=O)O)n2CCOc1ccc(OC(F)(F)F)cc1 ZINC000169331394 GI Annotated Mild Cc1ccc([C@@H]2C[C@@H](n3cc(C4CC4)nn3)[C@@H](O)CN2Cc2cccs2)cc1 ZINC000169331495 GI Annotated Anodyne Cc1ccc([C@H]2C[C@@H](n3cc(C4CC4)nn3)[C@@H](O)CN2Cc2cccs2)cc1 ZINC000169331496 GI Annotated Anodyne Cc1ccc([C@@H]2C[C@H](n3cc(C4CC4)nn3)[C@@H](O)CN2Cc2cccs2)cc1 ZINC000169331497 GI Annotated Anodyne CC(C)(C)c1cc(I)c2c(c1)CN[C@]1(O2)C2C[C@@H]3C1[C@H]3C2 ZINC000169332027 GI Annotated Anodyne CC(C)(C)c1cc(I)c2c(c1)CN[C@@]1(O2)C2C[C@@H]3C1[C@H]3C2 ZINC000169332028 GI Annotated Anodyne O=C(O)C1=C[C@H](O)[C@@H]2C[C@H]3[C@H](CCCCCc4ccc(O)cc4)[C@H]4C=C[C@@H]1[C@@H]2[C@@H]34 ZINC000169332708 GI Annotated Anodyne O=C(O)CCC[C@@H]1[C@H]2CCCN3CCC[C@H](CN1Cc1cccc(Cl)c1)[C@@H]23 ZINC000169333612 GI Annotated Anodyne O=C(O)CCC[C@@H]1[C@H]2CCCN3CCC[C@H](CN1Cc1ccc(Cl)cc1)[C@@H]23 ZINC000169333615 GI Annotated Anodyne OCCCC[C@@H]1[C@H]2CCCN3CCC[C@H](CN1Cc1ccccc1Cl)[C@@H]23 ZINC000169333636 GI Annotated Anodyne OCCCC[C@@H]1[C@H]2CCCN3CCC[C@H](CN1Cc1ccc(Cl)cc1)[C@@H]23 ZINC000169333637 GI Annotated Anodyne O=C(C[C@@H](C(=O)NC1CCCCC1)n1ccnc1)c1cccc2c1CCCC2 ZINC000169333848 GI Annotated Anodyne O=C(C[C@H](C(=O)NC1CCCCC1)n1ccnc1)c1cccc2c1CCCC2 ZINC000169333850 GI Annotated Anodyne CCS(=O)(=O)Nc1ccc(Nc2c3ccccc3[n+](C)c3ccccc23)cc1 ZINC000169334184 GI Annotated Clean Cc1cccc(C)c1NC(=O)N/N=C/c1c(F)cc(Br)cc1F ZINC000169335074 GI Annotated Reactive C#CCN1[C@H]2CC[C@@H](OC(=O)C(O)(C3CCCCC3)C3CCCCC3)[C@H]1CC2 ZINC000169336903 GI Annotated Mild COCCn1cnc2c1-c1ccc(OC)c(c1)OC/C=C/COc1cccc-2c1 ZINC000169337164 GI Annotated Anodyne Cn1c2ccccc2c2cc(CCOc3nccnc3-c3ccncc3)cnc21 ZINC000169337407 GI Annotated Anodyne Cn1c2ccccc2c2cc(CCOc3ncccc3-c3cncnc3)cnc21 ZINC000169337413 GI Annotated Anodyne OCCCC[C@@H]1[C@H]2CCCN3CCC[C@@H](CN1Cc1ccc(Cl)cc1)[C@@H]23 ZINC000169338723 GI Annotated Anodyne Brc1ccc(-n2cc(CSc3nc4ccccc4o3)nn2)cc1 ZINC000169340317 GI Annotated Anodyne Brc1ccccc1-n1cc(CSc2nc3ccccc3o2)nn1 ZINC000169340322 GI Annotated Anodyne O=C(O)c1ccc(O)c2ncc(N3CCCC[C@@H]3CCc3ccccn3)cc12 ZINC000169340465 GI Annotated Anodyne O=C(O)c1ccc(O)c2ncc(N3CCCC[C@H]3CCc3ccccn3)cc12 ZINC000169340467 GI Annotated Anodyne Cc1ccnc(N2CCN(C(=O)N(CC3CC3)c3ccc(Cl)cc3)CC2)c1 ZINC000169340555 GI Annotated Anodyne CS(=O)(=O)c1cc(C(=O)O)c(NCc2ccccc2)cc1Oc1ccccc1 ZINC000169341352 GI Annotated Anodyne CCCCSc1cc(C(=O)O)cc(S(C)(=O)=O)c1Oc1ccccc1 ZINC000169341359 GI Annotated Anodyne Fc1cnc(-c2ccccc2C(F)F)nc1NCc1ccc(-n2ccnn2)cc1 ZINC000169341698 GI Annotated Anodyne N#Cc1ccc2oc(=O)n(CN3CCC[C@@H]3c3cccc(Br)c3)c2c1 ZINC000169341770 GI Annotated Mild N#Cc1ccc2oc(=O)n(CN3CCC[C@H]3c3cccc(Br)c3)c2c1 ZINC000169341772 GI Annotated Mild CCCc1cc(=O)oc2cc(OCCN3CCCC3)c3c(c12)OC(C)(C)C=C3 ZINC000169342058 GI Annotated Anodyne C[C@@H]1CC[C@H]2CC(=O)N(Cc3ccc(Cl)cc3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]23OO4 ZINC000169342092 GI Annotated Reactive C[C@@H]1CC[C@H]2CC(=O)N(Cc3ccc(Cl)cc3)[C@@H]3O[C@]4(C)CC[C@@H]1[C@]23OO4 ZINC000169342094 GI Annotated Reactive O=C1CS[C@@H](c2cccc(Br)c2)N1c1cccc([N+](=O)[O-])c1 ZINC000169342624 GI Annotated Bother O=C1CS[C@H](c2cccc(Br)c2)N1c1cccc([N+](=O)[O-])c1 ZINC000169342625 GI Annotated Bother CN(C)c1ccccc1N1C(=O)CS[C@@H]1c1cccc(Br)c1 ZINC000169342628 GI Annotated Anodyne CN(C)c1ccccc1N1C(=O)CS[C@H]1c1cccc(Br)c1 ZINC000169342629 GI Annotated Anodyne Cc1cc(=O)oc2cc(NC(=O)c3ccc([N+](=O)[O-])o3)c3c(c12)OC(C)(C)C=C3 ZINC000169342994 GI Annotated Bother O=CNc1cc(C(=O)O)cc(SCc2ccccc2)c1C(=O)c1ccccc1 ZINC000169343314 GI Annotated Anodyne CC[C@@H]1C(=O)c2c(cc(OCC(=O)O)c(Cl)c2Cl)[C@@H]1c1ccccn1 ZINC000169343406 GI Annotated Anodyne CC[C@H]1C(=O)c2c(cc(OCC(=O)O)c(Cl)c2Cl)[C@@H]1c1ccccn1 ZINC000169343408 GI Annotated Anodyne CC[C@@H]1C(=O)c2c(cc(OCC(=O)O)c(Cl)c2Cl)[C@H]1c1ccccn1 ZINC000169343410 GI Annotated Anodyne CC[C@H]1C(=O)c2c(cc(OCC(=O)O)c(Cl)c2Cl)[C@H]1c1ccccn1 ZINC000169343411 GI Annotated Anodyne CC[C@@H]1C(=O)c2c(cc(OCC(=O)O)c(Cl)c2Cl)[C@@H]1c1cccnc1 ZINC000169343412 GI Annotated Anodyne CC[C@H]1C(=O)c2c(cc(OCC(=O)O)c(Cl)c2Cl)[C@@H]1c1cccnc1 ZINC000169343413 GI Annotated Anodyne CC[C@@H]1C(=O)c2c(cc(OCC(=O)O)c(Cl)c2Cl)[C@H]1c1cccnc1 ZINC000169343416 GI Annotated Anodyne CC[C@H]1C(=O)c2c(cc(OCC(=O)O)c(Cl)c2Cl)[C@H]1c1cccnc1 ZINC000169343417 GI Annotated Anodyne O=C(c1cc(-n2ccc3ccccc32)c(O)cc1O)N1CCc2sccc2C1 ZINC000169343524 GI Annotated Anodyne O=C(O)c1cc(NCc2ccccc2)c2c(c1)S(=O)(=O)C=C2c1ccccc1 ZINC000169345497 GI Annotated Anodyne O=C1C(c2ccccc2)=C(c2ccccc2)[C@H]2[C@H]3CC[C@@H](C3)[C@@]12N1CCOCC1 ZINC000169345533 GI Annotated Mild CN1CCN([C@]23C(=O)C(c4ccccc4)=C(c4ccccc4)[C@H]2[C@H]2CC[C@H]3C2)CC1 ZINC000169345539 GI Annotated Mild CN(C)C[C@@H](Br)c1ccc(Br)c(Br)c1 ZINC000169345658 GI Annotated Reactive CN(C)C[C@H](Br)c1ccc(Br)c(Br)c1 ZINC000169345660 GI Annotated Reactive O=S(=O)(N[C@@H]1[C@@H]2CC[C@@H]1Cc1c(F)cccc1C2)c1ccc(Cl)s1 ZINC000169346422 GI Annotated Anodyne CCO[P@@](=O)(CC)c1cccc(Nc2cc(-c3cccc(N)c3)ncn2)c1 ZINC000169346810 GI Annotated Anodyne CCO[P@](=O)(CC)c1cccc(Nc2cc(-c3cccc(N)c3)ncn2)c1 ZINC000169346812 GI Annotated Anodyne CCO[P@@](=O)(CC)c1ccc(Nc2cc(-c3cccc(N)c3)ncn2)cc1 ZINC000169346822 GI Annotated Anodyne CCO[P@](=O)(CC)c1ccc(Nc2cc(-c3cccc(N)c3)ncn2)cc1 ZINC000169346823 GI Annotated Anodyne CCOP(=O)(OCC)c1ccc(Nc2cc(-c3cccc(N)c3)ncn2)cc1 ZINC000169346830 GI Annotated Anodyne Cn1c([N+](=O)[O-])cnc1SCCCCCCCOc1ccccc1[N+](=O)[O-] ZINC000169347002 GI Annotated Bother C[C@@H](C(=O)OCCCCN(C)C)c1ccc2c(=O)c3ccccc3ccc2c1 ZINC000169347074 GI Annotated Bother C[C@H](C(=O)OCCCCN(C)C)c1ccc2c(=O)c3ccccc3ccc2c1 ZINC000169347076 GI Annotated Bother CC1(C)c2ccccc2N2C(=O)[C@]3(C)SS[C@@]21C(=O)N3c1ccccc1 ZINC000169347698 GI Annotated Reactive CC1(C)c2ccccc2N2C(=O)[C@]3(C)SS[C@@]21C(=O)N3Cc1ccccc1 ZINC000169347712 GI Annotated Reactive Cc1cc(N/N=C/c2ccc([N+](=O)[O-])o2)n2ncc(-c3ccc(Cl)cc3)c2n1 ZINC000169347804 GI Annotated Mild OC1=C[C@@]2(O)CC/C=C\CCCCN3CC[C@@H]1[C@]1(C[C@@H]4/C=C/CCCCN4[C@@H]21)C3 ZINC000169348127 GI Annotated Anodyne OC1=C[C@@]2(O)CC/C=C/CCCCN3CC[C@@H]1[C@]1(C[C@@H]4C=CCCCCN4[C@@H]21)C3 ZINC000169348129 GI Annotated Anodyne OC1=C[C@@]2(O)CC/C=C/CCCCN3CC[C@@H]1[C@]1(C[C@@H]4/C=C/CCCCN4[C@@H]21)C3 ZINC000169348131 GI Annotated Anodyne Cc1ccc([C@H]2[C@@H]3CCC=C3C(C#N)=C(N)C23C(=O)c2ccccc2C3=O)cc1 ZINC000169348504 GI Annotated Reactive N#CC1=C(N)C2(C(=O)c3ccccc3C2=O)[C@@H](c2ccccc2F)[C@@H]2CCCC=C12 ZINC000169348509 GI Annotated Reactive N#CC1=C(N)C2(C(=O)c3ccccc3C2=O)[C@@H](c2ccccc2F)[C@@H]2CCC=C12 ZINC000169348511 GI Annotated Reactive Cc1ccc([C@H]2[C@@H]3CCCC=C3C(C#N)=C(N)[C@]23C(=O)Nc2ccccc23)cc1 ZINC000169348681 GI Annotated Reactive COc1ccc([C@H]2[C@@H]3CCCC=C3C(C#N)=C(N)[C@]23C(=O)Nc2ccccc23)cc1 ZINC000169348684 GI Annotated Reactive N#CC1=C(N)[C@]2(C(=O)Nc3ccccc32)[C@@H](c2ccccc2F)[C@@H]2CCCC=C12 ZINC000169348687 GI Annotated Reactive COc1cc2cc([C@@H]3CC[N+](C)(Cc4ccccc4)C[C@@H]3O)sc2cc1OC ZINC000169348720 GI Annotated Bother COc1cc2cc([C@H]3CC[N+](C)(Cc4ccccc4)C[C@@H]3O)sc2cc1OC ZINC000169348722 GI Annotated Bother C[C@@H](c1ccc(F)c(OC(F)(F)F)c1)N1C(=O)CSc2ncsc21 ZINC000169348919 GI Annotated Anodyne C[C@H](c1ccc(F)c(OC(F)(F)F)c1)N1C(=O)CSc2ncsc21 ZINC000169348920 GI Annotated Anodyne CC[C@@H]1C(=O)C[C@H](c2ccccc2)N(C(=O)Cn2ccnc2)[C@@H]1c1ccccc1 ZINC000169349335 GI Annotated Anodyne CC[C@H]1C(=O)C[C@H](c2ccccc2)N(C(=O)Cn2ccnc2)[C@@H]1c1ccccc1 ZINC000169349337 GI Annotated Anodyne O=C(/C=C/c1cccc2c3c([nH]c12)-c1cccnc1NC(=O)C3)Nc1ccccc1 ZINC000169349957 GI Annotated Anodyne Cc1ccc(-c2c[nH]c(Nc3cc(-c4ccc(C)cc4)n(C(N)=S)n3)n2)cc1 ZINC000169350086 GI Annotated Anodyne N#CC1=C(N)C2(C(=O)c3ccccc3C2=O)[C@@H](c2cccs2)[C@@H]2CCCC=C12 ZINC000169350442 GI Annotated Reactive COc1ccc(-c2cc(NC(=S)NNC(=O)c3ccc(C)cc3)cs2)cc1 ZINC000169350472 GI Annotated Reactive CCN[C@@H](c1ccc(/C=C/C#N)cc1)c1ccnc(Nc2ccc(C#N)cc2)n1 ZINC000169350579 GI Annotated Reactive CCN[C@H](c1ccc(/C=C/C#N)cc1)c1ccnc(Nc2ccc(C#N)cc2)n1 ZINC000169350580 GI Annotated Reactive N#C/C=C/c1ccc([C@@H](NC2CC2)c2ccnc(Nc3ccc(C#N)cc3)n2)cc1 ZINC000169350606 GI Annotated Reactive N#C/C=C/c1ccc([C@H](NC2CC2)c2ccnc(Nc3ccc(C#N)cc3)n2)cc1 ZINC000169350607 GI Annotated Reactive CC/C=C1/C(=O)[C@]2(C(=O)c3ccccc3)C[C@@H]3CC[C@@](CCC)(C2=O)[C@@]13OC ZINC000169350625 GI Annotated Mild CC/C=C1\C(=O)[C@]2(C(=O)c3ccccc3)C[C@@H]3CC[C@@](CCC)(C2=O)[C@@]13OC ZINC000169350626 GI Annotated Mild COc1ccc(C(=O)NNC(=S)Nc2csc(-c3ccc(C)cc3)c2)cc1 ZINC000169350775 GI Annotated Reactive Cc1ccc(-c2cc(NC(=S)NNC(=O)c3ccc(O)cc3)cs2)cc1 ZINC000169350778 GI Annotated Reactive Cc1cc(N2C(=O)CS[C@@H]2c2ccc(C#N)cc2)nc(C)c1Br ZINC000169351003 GI Annotated Mild Cc1cc(N2C(=O)CS[C@H]2c2ccc(C#N)cc2)nc(C)c1Br ZINC000169351004 GI Annotated Mild C#CCN(Cc1ccc(O)c2ncccc12)C1CCN(Cc2ccccc2)CC1 ZINC000169351269 GI Annotated Mild O=C1O[C@@H](CN2C=CN3CCCCC[C@H]32)CC1(c1ccccc1)c1ccccc1 ZINC000169351845 GI Annotated Anodyne O=C1O[C@H](CN2C=CN3CCCCC[C@H]32)CC1(c1ccccc1)c1ccccc1 ZINC000169351847 GI Annotated Anodyne COC(=O)[C@]1(/C=C2/c3ccc(F)cc3[C@@H](OC)[C@@H]2C)[C@@H]2Oc3ccccc3[C@@H]21 ZINC000169352588 GI Annotated Anodyne COC(=O)[C@]1(/C=C2\c3ccc(F)cc3[C@@H](OC)[C@@H]2C)[C@@H]2Oc3ccccc3[C@@H]21 ZINC000169352589 GI Annotated Anodyne O=c1c2c(-c3ccccc3)cc(-c3cccs3)nc2nc2[nH][nH]c(=S)n12 ZINC000169352769 GI Annotated Anodyne C#CCn1c(-c2cccc(F)c2)nc2c(N)nc(C#CCCCCCC)nc21 ZINC000169352931 GI Annotated Mild CCCCCCCCc1cn(C[C@H]2O[C@H](OCCC(C)C)C=CC2=O)nn1 ZINC000169353701 GI Annotated Mild CCCCCCCCc1cnnn1C[C@H]1O[C@H](OCCC(C)C)C=CC1=O ZINC000169353720 GI Annotated Mild CC(=O)S[C@@H]1CC(=O)C=C2CC[C@@H]3[C@@H]4CCC(=O)O[C@@]4(C)CC[C@@H]3[C@@]21C ZINC000169354431 GI Annotated Mild CC(=O)S[C@H]1CC(=O)C=C2CC[C@@H]3[C@@H]4CCC(=O)O[C@@]4(C)CC[C@@H]3[C@@]21C ZINC000169354432 GI Annotated Mild CC(=O)S[C@@H]1CC(=O)C=C2CC[C@H]3[C@@H]4CCC(=O)O[C@@]4(C)CC[C@@H]3[C@@]21C ZINC000169354433 GI Annotated Mild CC(=O)S[C@H]1CC(=O)C=C2CC[C@H]3[C@@H]4CCC(=O)O[C@@]4(C)CC[C@@H]3[C@@]21C ZINC000169354434 GI Annotated Mild ClC1=C(Cl)[C@@]2(Cl)[C@H]3[C@H]4O[C@H]4[C@H](Cl)[C@@H]3[C@@]1(Cl)C2(Cl)Cl ZINC000169355126 GI Annotated Reactive ClC1=C(Cl)[C@]2(Cl)[C@H]3[C@@H](Cl)[C@@H]4O[C@@H]4[C@@H]3[C@@]1(Cl)C2(Cl)Cl ZINC000169355127 GI Annotated Reactive Cc1ccc(O[C@@H]2[C@@H](O)CO[C@@H]2/C=C\C#Cc2ccc(C(C)(C)C)cc2)cc1 ZINC000169355152 GI Annotated Mild Cc1ccc(O[C@H]2[C@@H](O)CO[C@@H]2/C=C\C#Cc2ccc(C(C)(C)C)cc2)cc1 ZINC000169355153 GI Annotated Mild Cc1ccc([C@@H]2C[C@@H](n3cc(C4CC4)nn3)[C@@H](O)CN2CC2CCCCC2)cc1 ZINC000169355924 GI Annotated Anodyne Cc1ccc([C@H]2C[C@@H](n3cc(C4CC4)nn3)[C@@H](O)CN2CC2CCCCC2)cc1 ZINC000169355925 GI Annotated Anodyne Cc1ccc([C@@H]2C[C@H](n3cc(C4CC4)nn3)[C@@H](O)CN2CC2CCCCC2)cc1 ZINC000169355926 GI Annotated Anodyne Cc1ccc([C@@H]2C[C@@H](O)[C@@H](n3cc(C4CC4)nn3)CN2Cc2cccs2)cc1 ZINC000169355931 GI Annotated Anodyne Cc1ccc([C@H]2C[C@@H](O)[C@@H](n3cc(C4CC4)nn3)CN2Cc2cccs2)cc1 ZINC000169355932 GI Annotated Anodyne Cc1ccc([C@@H]2C[C@H](O)[C@@H](n3cc(C4CC4)nn3)CN2Cc2cccs2)cc1 ZINC000169355933 GI Annotated Anodyne CCN1CCN(CC)[C@@H]2c3c(C)c4cc(Br)ccc4n3CC[C@@H]21 ZINC000169356662 GI Annotated Anodyne C=CC[C@@H]1C=C[C@@H](O/N=C\[C@@H](C)[C@@H](OCc2ccccc2)C(C)C)[C@@H](CO)O1 ZINC000169357001 GI Annotated Mild C=CC[C@@H]1C=C[C@@H](O/N=C/[C@@H](C)[C@@H](OCc2ccccc2)C(C)C)[C@@H](CO)O1 ZINC000169357004 GI Annotated Mild C[C@]12CC[C@H]3[C@H]([C@@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1)[C@H]1C[C@@H]1C1=CC(=O)C[C@H](S)[C@@]13C ZINC000169358849 GI Annotated Mild C[C@]12CC[C@H]3[C@@H]([C@@H]4C[C@H]4C4=CC(=O)C[C@H](S)[C@@]43C)[C@@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000169358850 GI Annotated Mild C[C@]12CC[C@H]3[C@H]([C@@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1)[C@H]1C[C@H]1C1=CC(=O)C[C@H](S)[C@@]13C ZINC000169358851 GI Annotated Mild CCO[C@@]1(C(F)(F)F)O[C@@H]2O[C@]3(C)CC[C@@H]4[C@H](C)CC[C@@H]([C@H]1C)[C@@]24OO3 ZINC000169359025 GI Annotated Reactive C[C@H](NC(=O)Cc1ccc(C(=O)O)cc1)c1ccccc1N1CCCC[C@@H]1C ZINC000169359065 GI Annotated Anodyne O=S(=O)(N[C@@H]1[C@@H]2CC[C@@H]1Cc1cc(F)ccc1C2)c1ccc(Cl)s1 ZINC000169359323 GI Annotated Anodyne C=C1C[C@@]2(C)C(=CC1=O)[C@@H]1C[C@@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12 ZINC000169362159 GI Annotated Mild C=C1C[C@@]2(C)C(=CC1=O)[C@H]1C[C@@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12 ZINC000169362160 GI Annotated Mild C=C1C[C@@]2(C)C(=CC1=O)[C@@H]1C[C@H]1[C@H]1[C@@H]3[C@@H]4C[C@@H]4[C@@]4(CCC(=O)O4)[C@@]3(C)CC[C@@H]12 ZINC000169362161 GI Annotated Mild C[C@@]12C(=CC(=O)[C@@H]3C[C@@H]31)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000169362162 GI Annotated Mild C[C@@]12C(=CC(=O)[C@@H]3C[C@@H]31)[C@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000169362163 GI Annotated Mild C[C@@]12C(=CC(=O)[C@@H]3C[C@@H]31)[C@@H]1C[C@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000169362164 GI Annotated Mild Cc1ccc([C@@H]2N[C@@H](c3ccc(C)cc3)[C@@H]3CCC[C@@H]2C3=NNC(N)=S)cc1 ZINC000169362979 GI Annotated Mild Cc1ccc([C@H]2N[C@@H](c3ccc(C)cc3)[C@@H]3CCC[C@@H]2C3=NNC(N)=S)cc1 ZINC000169362980 GI Annotated Mild Cc1ccc([C@H]2N[C@H](c3ccc(C)cc3)[C@@H]3CCC[C@@H]2C3=NNC(N)=S)cc1 ZINC000169362981 GI Annotated Mild Brc1ccc(NCc2ccc3cc2OCC#C/C=C/C#CCO3)cc1 ZINC000169363431 GI Annotated Mild COc1ccc(Cl)cc1N1C(=O)[C@@H]2CCCN2[C@@H]1c1ccc(F)c(F)c1 ZINC000169364041 GI Annotated Anodyne CCCCCCN1C[C@@H](n2cc(C3CC3)nn2)[C@@H](O)C[C@@H]1c1ccc(C)cc1 ZINC000169365823 GI Annotated Anodyne Cc1ccc([C@@H]2C[C@@H](O)[C@@H](n3cc(C4CC4)nn3)CN2CC2CCCCC2)cc1 ZINC000169365875 GI Annotated Anodyne Cc1ccc([C@H]2C[C@@H](O)[C@@H](n3cc(C4CC4)nn3)CN2CC2CCCCC2)cc1 ZINC000169365876 GI Annotated Anodyne Cc1ccc([C@@H]2C[C@H](O)[C@@H](n3cc(C4CC4)nn3)CN2CC2CCCCC2)cc1 ZINC000169365877 GI Annotated Anodyne COc1ccc([C@H]2CC3(N(C)C)C[C@H](O)C2[C@H](c2ccc(OC)cc2)C3)cc1 ZINC000169366845 GI Annotated Anodyne COc1ccc([C@H]2CC3(N(C)C)C[C@H](O)C2[C@@H](c2ccc(OC)cc2)C3)cc1 ZINC000169366846 GI Annotated Anodyne Cc1nc(/C=C/[C@@H]2C/C=C/CCC[C@@H](C)C(=O)[C@@H](C)[C@@H](O)CC(=O)O2)cs1 ZINC000169369719 GI Annotated Anodyne Cc1nc(/C=C/[C@@H]2C/C=C/CCC[C@H](C)C(=O)[C@@H](C)[C@@H](O)CC(=O)O2)cs1 ZINC000169369720 GI Annotated Anodyne CN1C[C@@](O)(c2ccc(-c3nc4ccccc4s3)cc2)O[C@@H]2CCCC[C@@H]21 ZINC000169370231 GI Annotated Anodyne CN1C[C@](O)(c2ccc(-c3nc4ccccc4s3)cc2)O[C@@H]2CCCC[C@@H]21 ZINC000169370232 GI Annotated Anodyne C=C1C(=O)O[C@]2(C)CC[C@@H]1C[C@H](O)/C(C)=C/C/C=C(/C)CC[C@@H]2OC(C)=O ZINC000169370561 GI Annotated Mild C=C1C(=O)O[C@]2(C)CC[C@@H]1C[C@H](O)/C(C)=C\C/C=C(/C)CC[C@@H]2OC(C)=O ZINC000169370562 GI Annotated Mild C=C1C(=O)O[C@]2(C)CC[C@@H]1C[C@H](O)/C(C)=C\C/C=C(\C)CC[C@@H]2OC(C)=O ZINC000169370563 GI Annotated Mild CCN(CC)[P@@](N)(=O)O[C@H](C[C@@H]1NC(C)(C)C[C@@H](C)O1)c1ccccc1 ZINC000169371422 GI Annotated Anodyne C[C@@H]1CC[C@H]2CC(=O)N(CCCc3ccccc3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]23OO4 ZINC000169371573 GI Annotated Reactive C[C@@H]1CC[C@H]2CC(=O)N(CCCc3ccccc3)[C@@H]3O[C@]4(C)CC[C@@H]1[C@]23OO4 ZINC000169371574 GI Annotated Reactive Cc1cc(O)cc(O)c1C(=O)O[C@H]1C[C@]2(C)[C@H]3CC(C)(C)C[C@H]3C=C(C=O)[C@H]12 ZINC000169374506 GI Annotated Reactive in-man Cc1cc(O)cc(O)c1C(=O)O[C@@H]1C[C@@]2(C)[C@H]3CC(C)(C)C[C@H]3C=C(C=O)[C@H]12 ZINC000169374507 GI Annotated Reactive in-man Cc1cc(O)cc(O)c1C(=O)O[C@H]1C[C@@]2(C)[C@H]3CC(C)(C)C[C@H]3C=C(C=O)[C@H]12 ZINC000169374508 GI Annotated Reactive in-man CC(C)[C@]12C[C@H](O)[C@](C)(O1)[C@H]1CC[C@H](C)[C@@H]1[C@H]2OC(=O)/C=C/c1ccccc1 ZINC000169639849 GI Annotated Anodyne CC(=O)O[C@H]1C[C@]2(O)C[C@]3(C)CC[C@]2(C[C@@H]3Cl)C(C)(C)[C@H]1Br ZINC000169643293 GI Annotated Reactive COc1cc(C/N=N/c2nc(Cl)nc3c2cnn3-c2ccccc2)ccc1O ZINC000169685227 GI Annotated Clean c1cc(NCC2CC2)cc(-n2ncc3c(/N=N/Cc4ccncc4)ncnc32)c1 ZINC000169685241 GI Annotated Clean Brc1cccc(-n2ncc3c(/N=N/Cc4ccncc4)ncnc32)c1 ZINC000169685245 GI Annotated Clean CCCc1nn(-c2cccc(OC)c2)c2ncnc(/N=N/Cc3ccncc3)c12 ZINC000169685283 GI Annotated Clean CCOC(=O)[C@@H]1C(C)=Nc2nc3c(c(N)c2[C@@H]1c1ccc(F)cc1)CCCC3 ZINC000169686272 GI Annotated Anodyne CCOC(=O)[C@H]1C(C)=Nc2nc3c(c(N)c2[C@@H]1c1ccc(F)cc1)CCCC3 ZINC000169686273 GI Annotated Anodyne CCOC(=O)[C@@H]1C(C)=Nc2nc3c(c(N)c2[C@H]1c1ccc(F)cc1)CCCC3 ZINC000169686274 GI Annotated Anodyne CCOC(=O)[C@H]1C(C)=Nc2nc3c(c(N)c2[C@H]1c1ccc(F)cc1)CCCC3 ZINC000169686275 GI Annotated Anodyne Oc1cc(Sc2ccc(Cl)cc2)c(O)n1-c1ccc2c(c1)OCCO2 ZINC000169686806 GI Annotated Anodyne Cc1[nH]n(-c2ccccc2)c(=S)c1/C=N/c1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000169686832 GI Annotated Mild Cc1ccc2[nH]c(=O)c([C@@H]3c4ccc5cccnc5c4OC(=N)[C@@H]3C#N)cc2c1 ZINC000169687548 GI Annotated Mild Cc1ccc2[nH]c(=O)c([C@H]3c4ccc5cccnc5c4OC(=N)[C@@H]3C#N)cc2c1 ZINC000169687549 GI Annotated Mild CCc1ccc2[nH]c(=O)c([C@@H]3c4ccc5cccnc5c4OC(=N)[C@@H]3C#N)cc2c1 ZINC000169687550 GI Annotated Mild CCc1ccc2[nH]c(=O)c([C@H]3c4ccc5cccnc5c4OC(=N)[C@@H]3C#N)cc2c1 ZINC000169687551 GI Annotated Mild Cc1ccc(/N=C/c2c(O)n(-c3ccc4c(c3)OCO4)c(=O)c3ccccc23)cc1 ZINC000169687573 GI Annotated Mild O=C(c1ccco1)[C@@H](/C=N/c1ccc(Br)cc1)C(=O)C(F)(F)F ZINC000169687937 GI Annotated Mild O=C(c1ccco1)[C@H](/C=N/c1ccc(Br)cc1)C(=O)C(F)(F)F ZINC000169687938 GI Annotated Mild O=c1[nH]c2c(s1)[C@@H](c1ccccc1)c1c(c(O)n(-c3ccccc3)c1O)S2 ZINC000169687970 GI Annotated Anodyne O=c1[nH]c2c(s1)[C@H](c1ccccc1)c1c(c(O)n(-c3ccccc3)c1O)S2 ZINC000169687971 GI Annotated Anodyne CCOC(=O)[C@H](C(=O)Nc1ccccc1Cl)C1=NC(C)(C)Cc2ccccc21 ZINC000169688304 GI Annotated Anodyne C[C@@H]1CCc2c(c(O)n(-c3cc(Cl)ccc3OC(=O)c3ccco3)c2O)C1 ZINC000169688316 GI Annotated Anodyne C[C@H]1CCc2c(c(O)n(-c3cc(Cl)ccc3OC(=O)c3ccco3)c2O)C1 ZINC000169688317 GI Annotated Anodyne Cc1cc(-c2ccc(-n3c(O)ccc3O)c(C)c2)ccc1-n1c(O)ccc1O ZINC000169688355 GI Annotated Anodyne Cc1cc(C/N=N/c2ccc([N+](=O)[O-])cn2)c(C)n1-c1ccc(C(=O)O)cc1 ZINC000169688384 GI Annotated Clean O=[N+]([O-])c1ccc(C2=[N+]3N[C-](c4ccccc4)C[C@@H]3c3ccccc3O2)s1 ZINC000169688472 GI Annotated Bother O=[N+]([O-])c1ccc(C2=[N+]3N[C-](c4ccccc4)C[C@H]3c3ccccc3O2)s1 ZINC000169688473 GI Annotated Bother O=c1c(Br)cc([N+](=O)[O-])c[c-]1C/N=N/c1nc2ccccc2s1 ZINC000169688583 GI Annotated Clean CCN1CCC2=C(C#N)C(=N)C(C#N)(C#N)[C@@H](c3cc(Cl)ccc3Cl)[C@@H]2C1 ZINC000169688635 GI Annotated Reactive COc1ccc(/N=C/c2c(O)n(-c3cccc(C)n3)c(=O)c3ccccc23)cc1 ZINC000169688837 GI Annotated Mild Cc1cc(C/N=N/c2ccc([N+](=O)[O-])cn2)c(C)n1-c1cccc(C(=O)O)c1 ZINC000169688911 GI Annotated Clean O=C(c1ccccc1)[C@@H]1c2c(c(O)n(-c3ccc(F)cc3)c2O)[C@@H]2CCCN21 ZINC000169688922 GI Annotated Anodyne O=C(c1ccccc1)[C@@H]1c2c(c(O)n(-c3ccc(F)cc3)c2O)[C@H]2CCCN12 ZINC000169688923 GI Annotated Anodyne COc1ccccc1-n1c(O)cc(Sc2nnc(-c3cccc(C)c3)[nH]2)c1O ZINC000169689067 GI Annotated Anodyne CCOc1cc([C@H]2C3=C(CCCC3=O)N=C3CCCC(=O)[C@H]32)cc(Cl)c1O ZINC000169689074 GI Annotated Mild CCOc1ccc(-c2csc(/C(C#N)=C/[c-]3ccc(=O)c([N+](=O)[O-])c3)n2)cc1 ZINC000169689162 GI Annotated Reactive Cc1ccc([N+](=O)[O-])cc1-c1nc(-[c-]2ccc(=O)c(O)c2)[nH]c1-c1ccccc1 ZINC000169689267 GI Annotated Bother CCOC(=O)[C@@H]1C(COc2ccc(C)cc2)=NC(=O)N[C@@H]1c1cc(C)ccc1C ZINC000169689312 GI Annotated Anodyne CCOC(=O)[C@H]1C(COc2ccc(C)cc2)=NC(=O)N[C@@H]1c1cc(C)ccc1C ZINC000169689313 GI Annotated Anodyne CCOC(=O)[C@@H]1C(COc2ccc(C)cc2)=NC(=O)N[C@H]1c1cc(C)ccc1C ZINC000169689314 GI Annotated Anodyne CCOC(=O)[C@H]1C(COc2ccc(C)cc2)=NC(=O)N[C@H]1c1cc(C)ccc1C ZINC000169689315 GI Annotated Anodyne COc1ccc2nc(/N=C/c3c(C)[nH]n(-c4ccc(C)cc4)c3=O)sc2c1 ZINC000169689316 GI Annotated Mild CCN(CC)CCC/N=C/c1c(O)n(-c2ccc(C)cc2)c(=O)c2ccccc12 ZINC000169689332 GI Annotated Mild Cc1nn(-c2ccccc2)c(Cl)c1[C@@H]1C2=C(CCCC2=O)OC(=N)[C@@H]1C#N ZINC000169689410 GI Annotated Mild Cc1nn(-c2ccccc2)c(Cl)c1[C@H]1C2=C(CCCC2=O)OC(=N)[C@@H]1C#N ZINC000169689411 GI Annotated Mild Cc1ccc(SCc2n[nH]c3c2C2(CCSCC2)[C@@H](C#N)C(=N)O3)cc1 ZINC000169689709 GI Annotated Mild Cc1ccc(SCc2n[nH]c3c2C2(CCSCC2)[C@H](C#N)C(=N)O3)cc1 ZINC000169689710 GI Annotated Mild CCOc1ccccc1-n1c(O)cc(Sc2nnc(-c3ccccc3)[nH]2)c1O ZINC000169689774 GI Annotated Anodyne COc1ccc(-n2c(O)cc(NNc3ncc(Cl)cc3Cl)c2O)cc1 ZINC000169690025 GI Annotated Anodyne COc1cc(OC)c(OC)cc1C/N=N/c1ncnc2c1[nH]c1ccccc12 ZINC000169690447 GI Annotated Clean O=c1cc(OCc2ccc([N+](=O)[O-])cc2)cc[c-]1-c1n[nH]cc1-c1ccccc1 ZINC000169690448 GI Annotated Bother N#C[C@@H]1C(=N)n2c(nc3ccccc32)[C@@H](C#N)[C@H]1c1ccc(Br)cc1 ZINC000169690456 GI Annotated Mild N#C[C@H]1c2nc3ccccc3n2C(=N)[C@@H](C#N)[C@@H]1c1ccc(Br)cc1 ZINC000169690457 GI Annotated Mild N#C[C@@H]1C(=N)n2c(nc3ccccc32)[C@@H](C#N)[C@H]1c1cccc(Br)c1 ZINC000169690458 GI Annotated Mild N#C[C@H]1c2nc3ccccc3n2C(=N)[C@@H](C#N)[C@@H]1c1cccc(Br)c1 ZINC000169690459 GI Annotated Mild COc1ccc([C@H]2CC(=O)[C@@H]3C(=Nc4ncnn4[C@@H]3c3ccccc3C)C2)cc1 ZINC000169690502 GI Annotated Anodyne COc1ccc([C@@H]2CC(=O)[C@H]3C(=Nc4ncnn4[C@@H]3c3ccccc3C)C2)cc1 ZINC000169690503 GI Annotated Anodyne CCn1c2ccccc2c2cc([C@@H]3c4c(COC)n[nH]c4OC(=N)[C@@H]3C#N)ccc21 ZINC000169691024 GI Annotated Mild CCn1c2ccccc2c2cc([C@H]3c4c(COC)n[nH]c4OC(=N)[C@@H]3C#N)ccc21 ZINC000169691025 GI Annotated Mild Oc1cc(N2CCC(c3nc4ccccc4[nH]3)CC2)c(O)n1-c1ccccc1F ZINC000169691227 GI Annotated Anodyne COc1cc(CN=O)c(Br)cc1OCC(=O)Nc1ccccc1C ZINC000169691353 GI Annotated Anodyne CCOC(=O)[C@@H]1C(=N)Oc2ccc3ccccc3c2[C@@H]1c1ccc(O)c(OC)c1 ZINC000169691587 GI Annotated Anodyne CCOC(=O)[C@H]1C(=N)Oc2ccc3ccccc3c2[C@@H]1c1ccc(O)c(OC)c1 ZINC000169691588 GI Annotated Anodyne COc1ccc(-n2c(O)cc(Sc3nnc(-c4ccccc4)o3)c2O)cc1 ZINC000169691767 GI Annotated Anodyne COc1ccc(-n2c(O)cc(Sc3nnc(-c4ccc(C)cc4)[nH]3)c2O)cc1 ZINC000169691932 GI Annotated Anodyne CCOC1=C/C(=C\[C@@H](C#N)c2nc(-c3ccc(C)cc3)no2)C=C(Cl)C1=O ZINC000169692375 GI Annotated Mild CCOC1=C/C(=C\[C@H](C#N)c2nc(-c3ccc(C)cc3)no2)C=C(Cl)C1=O ZINC000169692376 GI Annotated Mild Cc1ccc(C)c2sc(NC(=O)c3ccc(-n4c(O)ccc4O)cc3)nc12 ZINC000169693262 GI Annotated Anodyne COc1ccc(Cn2cc(O)n(-c3cccc(Cl)c3)c2=S)cc1OC ZINC000169693315 GI Annotated Anodyne Cc1c(COc2ccccc2)c2c(O)c(/N=C/CCN(C)C)cc(O)c2n1C ZINC000169693565 GI Annotated Mild O=C1O[C@H](CCc2ccccc2)C(=O)[C@@H]1SCc1cccc(C(F)(F)F)c1 ZINC000169693688 GI Annotated Anodyne O=C1O[C@@H](CCc2ccccc2)C(=O)[C@H]1SCc1cccc(C(F)(F)F)c1 ZINC000169693689 GI Annotated Anodyne O=C1O[C@H](CCc2ccccc2)C(=O)[C@H]1SCc1cccc(C(F)(F)F)c1 ZINC000169693690 GI Annotated Anodyne O=c1c2cccc3c2c(cn1[C@H]1CN2CCC1CC2)[nH]n3-c1ccc(Cl)cc1 ZINC000169694239 GI Annotated Anodyne CN1O[C@@]2(N=C1N)c1cc(-c3cccc(C#N)c3)ccc1C[C@@]21CC=C(F)CC1 ZINC000169700362 GI Annotated Mild CN1O[C@]2(N=C1N)c1cc(-c3cccc(C#N)c3)ccc1C[C@@]21CC=C(F)CC1 ZINC000169700363 GI Annotated Mild CN1O[C@@]2(N=C1N)c1cc(-c3cccc(C#N)c3)ccc1C[C@]21CC=C(F)CC1 ZINC000169700364 GI Annotated Mild CN1O[C@]2(N=C1N)c1cc(-c3cccc(C#N)c3)ccc1C[C@]21CC=C(F)CC1 ZINC000169700365 GI Annotated Mild C#CC1=C(NC(=O)c2cccc(OCn3cc(Cl)cn3)c2)S[C@@H]2CCC[C@@H]12 ZINC000169701141 GI Annotated Mild C#CC1=C(NC(=O)c2cccc(OCn3cc(Cl)cn3)c2)S[C@H]2CCC[C@@H]12 ZINC000169701142 GI Annotated Mild C#CC1=C(NC(=O)c2cccc(OCn3cc(Cl)cn3)c2)S[C@@H]2CCC[C@H]12 ZINC000169701143 GI Annotated Mild C#CC1=C(NC(=O)c2cccc(OCn3cc(Cl)cn3)c2)S[C@H]2CCC[C@H]12 ZINC000169701144 GI Annotated Mild Cc1cc(Nc2ccc(CC[C@H]3COC(N)=N3)cc2)ccc1OC(F)(F)F ZINC000169701156 GI Annotated Anodyne NC1=N[C@@H](CCc2ccc(Nc3cc(C(F)(F)F)cc(Cl)n3)cc2)CO1 ZINC000169701179 GI Annotated Anodyne NC1=N[C@@H](CCc2ccc(N[C@@H](c3cccc(F)c3)C(F)(F)F)cc2)CO1 ZINC000169701200 GI Annotated Anodyne NC1=N[C@@H](CCc2ccc(N[C@H](c3cccc(F)c3)C(F)(F)F)cc2)CO1 ZINC000169701201 GI Annotated Anodyne [C-]#[N+]c1cccc(F)c1-c1nc2c(C#N)cnc(Nc3cc(N)ncn3)c2s1 ZINC000169701531 GI Annotated Mild CCC[C@@H]1C[C@@]2(CC[C@H]1O)CCN(c1ccc(OCC(F)(F)F)cc1)C2=O ZINC000169702040 GI Annotated Anodyne CC(C)[C@@H]1C[C@@]2(CC[C@H]1O)CCN(c1ccc(OCC(F)(F)F)cc1)C2=O ZINC000169702041 GI Annotated Anodyne CCn1ccc(Nc2ncc3c(n2)-c2c(nn(C)c2-c2ccccc2)C[C@@H]3C)n1 ZINC000169702305 GI Annotated Anodyne CCn1ccc(Nc2ncc3c(n2)-c2c(nn(C)c2-c2ccccc2)C[C@H]3C)n1 ZINC000169702306 GI Annotated Anodyne [C-]#[N+]C1=C(c2ccc(F)cc2)N=C2COC(=O)[C@@H]2[C@@H]1c1ccc2n[nH]c(C)c2c1 ZINC000169703244 GI Annotated Reactive [C-]#[N+]C1=C(c2ccc(F)cc2)N=C2COC(=O)[C@H]2[C@@H]1c1ccc2n[nH]c(C)c2c1 ZINC000169703245 GI Annotated Reactive [C-]#[N+]C1=C(c2ccc(F)cc2)N=C2COC(=O)[C@@H]2[C@H]1c1ccc2n[nH]c(C)c2c1 ZINC000169703246 GI Annotated Reactive [C-]#[N+]C1=C(c2ccc(F)cc2)N=C2COC(=O)[C@H]2[C@H]1c1ccc2n[nH]c(C)c2c1 ZINC000169703248 GI Annotated Reactive COc1cc2c(C)[nH]c(=O)c(Cc3cnc4cccc(OC)c4c3)c2cc1OC ZINC000169703367 GI Annotated Anodyne COc1ccc2cc(Cc3c(=O)[nH]c(C)c4cc(OC)c(OC)cc34)cnc2c1 ZINC000169703369 GI Annotated Anodyne COc1cc2ccn(-c3ccc(C#N)c(NC4CCC(O)CC4)c3)c2cc1OC ZINC000169703590 GI Annotated Mild OCCCNc1cc(-c2cccc(NCc3cccc(F)c3)n2)c(Cl)cn1 ZINC000169703746 GI Annotated Anodyne O=C(O)CNc1cc(-c2cccc(NCc3cccc(F)c3)n2)c(Cl)cn1 ZINC000169703786 GI Annotated Anodyne COc1cc2ncc3c(c(-c4ccc(C#N)cc4)nn3C)c2cc1OC(F)F ZINC000169704781 GI Annotated Mild COc1cc2c(cc1OC(F)F)ncc1c2c(-c2ccc(C#N)cc2)nn1C ZINC000169704795 GI Annotated Mild CCn1nc(-c2ccc(C#N)cc2F)c2c3cc(OC)c(OC)cc3ncc21 ZINC000169704830 GI Annotated Mild Cn1c(=O)ccc2c(NC(=O)N[C@@H]3CC[C@@H](c4cccc(F)c4)C3)cccc21 ZINC000169704939 GI Annotated Anodyne Cn1c(=O)ccc2c(NC(=O)N[C@H]3CC[C@@H](c4cccc(F)c4)C3)cccc21 ZINC000169704940 GI Annotated Anodyne Cn1c(=O)ccc2c(NC(=O)N[C@H]3CC[C@@H](c4ccccc4F)C3)cccc21 ZINC000169704941 GI Annotated Anodyne Cn1c(=O)ccc2c(NC(=O)N[C@@H]3CC[C@@H](c4ccccc4F)C3)cccc21 ZINC000169704942 GI Annotated Anodyne CN1C(=O)CCc2c(NC(=O)N[C@@H]3CC[C@@H](c4cccc(F)c4)C3)cccc21 ZINC000169704958 GI Annotated Anodyne CN1C(=O)CCc2c(NC(=O)N[C@H]3CC[C@@H](c4cccc(F)c4)C3)cccc21 ZINC000169704959 GI Annotated Anodyne CN1C(=O)CCc2c(NC(=O)N[C@@H]3CC[C@@H](c4ccccc4F)C3)cccc21 ZINC000169704960 GI Annotated Anodyne CN1C(=O)CCc2c(NC(=O)N[C@H]3CC[C@@H](c4ccccc4F)C3)cccc21 ZINC000169704961 GI Annotated Anodyne CN1C(=O)CCc2ccc(NC(=O)N[C@@H]3CC[C@@H](c4cccc(F)c4)C3)cc21 ZINC000169704967 GI Annotated Anodyne CN1C(=O)CCc2ccc(NC(=O)N[C@H]3CC[C@@H](c4cccc(F)c4)C3)cc21 ZINC000169704968 GI Annotated Anodyne CN1C(=O)CCc2ccc(NC(=O)N[C@@H]3CC[C@@H](c4ccccc4F)C3)cc21 ZINC000169704969 GI Annotated Anodyne CN1C(=O)CCc2ccc(NC(=O)N[C@H]3CC[C@@H](c4ccccc4F)C3)cc21 ZINC000169704970 GI Annotated Anodyne Brc1ccc(Nc2ccc([C@H]3CNCCO3)cc2)c2cccnc12 ZINC000169705275 GI Annotated Anodyne Cc1ncnc(N2CC(F)C2)c1-c1ccc(Oc2nccc3[nH]ccc23)cc1F ZINC000169705973 GI Annotated Anodyne Cc1ccncc1N1C[C@@H](C(F)(F)F)N(c2ccc3ncsc3c2)C1=O ZINC000169706608 GI Annotated Anodyne Cc1ccncc1N1C[C@H](C(F)(F)F)N(c2ccc3ncsc3c2)C1=O ZINC000169706609 GI Annotated Anodyne CCCc1cccc(-c2cc(NC(=O)[C@@H]3CNC(=O)C3)nn2C2CCCCC2)c1 ZINC000169706969 GI Annotated Anodyne CCCc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2C2CCCCC2)c1 ZINC000169706970 GI Annotated Anodyne CCCc1cccc(-c2cc(NC(=O)[C@H]3CNC(=O)C3)nn2CCC(C)(C)C)c1 ZINC000169707073 GI Annotated Anodyne CC1=N[C@@]2(N=C1N)c1cc(Br)ccc1CC21CCC(F)(F)CC1 ZINC000169708597 GI Annotated Anodyne CC1=N[C@]2(N=C1N)c1cc(Br)ccc1CC21CCC(F)(F)CC1 ZINC000169708598 GI Annotated Anodyne CC1=N[C@@]2(N=C1N)c1cc(Br)ccc1CC21CCC(C(F)F)CC1 ZINC000169708825 GI Annotated Anodyne CC1=N[C@]2(N=C1N)c1cc(Br)ccc1CC21CCC(C(F)F)CC1 ZINC000169708826 GI Annotated Anodyne O=C1N=Nc2nc(CNCCc3cccc(C(F)(F)F)c3)nc3cccc1c23 ZINC000169710144 GI Annotated Anodyne Cc1ncsc1C(=O)Nc1ccc(-n2nc(C3CC3)cc2C2CC2)c(N)c1 ZINC000169710824 GI Annotated Anodyne CC1=NC(C)=C(C(=O)OCCSc2ccccc2)[C@H](C)[C@@H]1C(=O)OC(C)C ZINC000169712621 GI Annotated Anodyne CC1=NC(C)=C(C(=O)OCCSc2ccccc2)[C@@H](C)[C@H]1C(=O)OC(C)C ZINC000169712622 GI Annotated Anodyne CC1=NC(C)=C(C(=O)OCCSc2ccccc2)[C@H](C)[C@H]1C(=O)OC(C)C ZINC000169712623 GI Annotated Anodyne C[C@@H](N=O)c1ccc(S(=O)(=O)c2cc([C@@]3(C)COC(C)(C)O3)cs2)cc1 ZINC000169713713 GI Annotated Anodyne C[C@H](N=O)c1ccc(S(=O)(=O)c2cc([C@@]3(C)COC(C)(C)O3)cs2)cc1 ZINC000169713714 GI Annotated Anodyne O=c1oc(Cc2c[nH]c3ccccc23)c(O)n1Cc1cccc(C(F)(F)F)c1 ZINC000169713924 GI Annotated Anodyne O=C1C[C@@H](c2ccc(Cl)cc2)CC2=Nc3ccc(Cl)cc3S(=O)(=O)[C@@H]12 ZINC000169715426 GI Annotated Anodyne O=C1C[C@H](c2ccc(Cl)cc2)CC2=Nc3ccc(Cl)cc3S(=O)(=O)[C@@H]12 ZINC000169715427 GI Annotated Anodyne O=C1C[C@@H](c2ccc(Cl)cc2)CC2=Nc3ccc(Cl)cc3S(=O)(=O)[C@H]12 ZINC000169715428 GI Annotated Anodyne O=C1C[C@H](c2ccc(Cl)cc2)CC2=Nc3ccc(Cl)cc3S(=O)(=O)[C@H]12 ZINC000169715429 GI Annotated Anodyne N#C[C@@H](C(=N)Sc1ccccc1O)[C@@H](C#N)C(=N)Sc1ccccc1O ZINC000169715843 GI Annotated Mild N#C[C@@H](C(=N)Sc1ccc(O)cc1)[C@@H](C#N)C(=N)Sc1ccc(O)cc1 ZINC000169715855 GI Annotated Mild N=c1ccn(Cc2ccc(CCc3ccc(Cn4ccc(=N)cc4)cc3)cc2)cc1 ZINC000169716369 GI Annotated Anodyne O=C(O)/C(Cc1c[nH]c2ccccc12)=N/c1c(Cl)c(O)c2cccnc2c1O ZINC000169717104 GI Annotated Mild CC(C)=CCC/C(C)=C/Cc1cccc2c(C3C(=O)C(=O)CC(=O)C3=O)c[nH]c12 ZINC000169717690 GI Annotated Clean N#C[C@@H]1C(=N)OC2=C(C(=O)C[C@@H](c3cccs3)C2)[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000169721883 GI Annotated Mild N#C[C@H]1C(=N)OC2=C(C(=O)C[C@@H](c3cccs3)C2)[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000169721884 GI Annotated Mild N#C[C@@H]1C(=N)OC2=C(C(=O)C[C@@H](c3ccccc3)C2)[C@@H]1c1ccc2c(c1)OCO2 ZINC000169721909 GI Annotated Mild N#C[C@H]1C(=N)OC2=C(C(=O)C[C@@H](c3ccccc3)C2)[C@@H]1c1ccc2c(c1)OCO2 ZINC000169721910 GI Annotated Mild N#C[C@@H]1C(=N)OC2=C(C(=O)C[C@@H](c3ccccc3)C2)[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000169721911 GI Annotated Mild N#C[C@H]1C(=N)OC2=C(C(=O)C[C@@H](c3ccccc3)C2)[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000169721912 GI Annotated Mild COc1ccccc1NC(=O)c1ccc(-n2c(O)c3c(c2O)[C@H]2C=C[C@@H]3C2)cc1 ZINC000169721964 GI Annotated Anodyne Oc1csc(/N=N/Cc2cc(Br)cc(Br)c2O)n1 ZINC000169723072 GI Annotated Clean O=Nc1c([C@@H]2C(=O)Nc3ccc(OC(F)(F)F)cc32)[nH]c2ccc(O)cc12 ZINC000169723359 GI Annotated Anodyne O=Nc1c([C@H]2C(=O)Nc3ccc(OC(F)(F)F)cc32)[nH]c2ccc(O)cc12 ZINC000169723360 GI Annotated Anodyne COC(=O)[C@@H]1C(C)=NC(C)=C(C(=O)OC(C)(C)C)[C@@H]1c1ccc(Cl)cc1 ZINC000169723989 GI Annotated Anodyne COC(=O)[C@H]1C(C)=NC(C)=C(C(=O)OC(C)(C)C)[C@@H]1c1ccc(Cl)cc1 ZINC000169723990 GI Annotated Anodyne COC(=O)[C@@H]1C(C)=NC(C)=C(C(=O)OC(C)(C)C)[C@H]1c1ccc(Cl)cc1 ZINC000169723991 GI Annotated Anodyne COC(=O)[C@H]1C(C)=NC(C)=C(C(=O)OC(C)(C)C)[C@H]1c1ccc(Cl)cc1 ZINC000169723992 GI Annotated Anodyne COc1ccc([C@@H]2C3=C(C[C@@H](Cc4ccccc4)CC3=O)OC(=N)[C@@H]2C#N)cc1 ZINC000169724133 GI Annotated Mild COc1ccc([C@H]2C3=C(C[C@@H](Cc4ccccc4)CC3=O)OC(=N)[C@@H]2C#N)cc1 ZINC000169724134 GI Annotated Mild CC(C)CCNC(=O)[C@H](CC(C)C)/N=C/[C@@H]1C(=O)Nc2c(Cl)cccc21 ZINC000169724585 GI Annotated Mild CC(C)CCNC(=O)[C@H](CC(C)C)/N=C/[C@H]1C(=O)Nc2c(Cl)cccc21 ZINC000169724586 GI Annotated Mild CC(C)CCNC(=O)[C@H](CC(C)C)/N=C/[C@@H]1C(=O)Nc2ccc(Cl)cc21 ZINC000169724591 GI Annotated Mild CC(C)CCNC(=O)[C@H](CC(C)C)/N=C/[C@H]1C(=O)Nc2ccc(Cl)cc21 ZINC000169724592 GI Annotated Mild CC(C)CCNC(=O)[C@H](CC(C)C)/N=C/[C@@H]1C(=O)Nc2cc(Cl)ccc21 ZINC000169724593 GI Annotated Mild CC(C)CCNC(=O)[C@H](CC(C)C)/N=C/[C@H]1C(=O)Nc2cc(Cl)ccc21 ZINC000169724594 GI Annotated Mild COc1ccc(-c2cc(=O)n3[nH]c(C(F)(F)F)c(-c4ccccc4)c3n2)cc1 ZINC000169724619 GI Annotated Anodyne O=c1cc(C(F)(F)F)nc2c(-c3ccc(Cl)cc3)c(C(F)(F)F)[nH]n12 ZINC000169724626 GI Annotated Anodyne CNC(=O)[C@@H](CCCCCCC(=O)NC1c2ccccc2-c2ccccc21)N=O ZINC000169724767 GI Annotated Anodyne CNC(=O)[C@H](CCCCCCC(=O)NC1c2ccccc2-c2ccccc21)N=O ZINC000169724768 GI Annotated Anodyne COc1ccc2cc3n(cc-2/c1=N/CC(C)C)CCc1cc2c(cc1-3)OCO2 ZINC000169725126 GI Annotated Anodyne O=C1C[C@H](c2ccccc2)NC(=O)[C@@H]1C(=O)Nc1ccc(C2CCCCC2)cc1 ZINC000169727238 GI Annotated Anodyne O=C1C[C@H](c2ccccc2)NC(=O)[C@H]1C(=O)Nc1ccc(C2CCCCC2)cc1 ZINC000169727239 GI Annotated Anodyne O=C1C[C@@H](c2ccccc2)NC(=O)[C@@H]1C(=O)Nc1ccc(C2CCCCC2)cc1 ZINC000169727240 GI Annotated Anodyne O=C1C[C@@H](c2ccccc2)NC(=O)[C@H]1C(=O)Nc1ccc(C2CCCCC2)cc1 ZINC000169727241 GI Annotated Anodyne O=C(Nc1ccc(C2CCCCC2)cc1)[C@@H]1C(=O)O[C@@H](Cc2ccccc2)C1=O ZINC000169727242 GI Annotated Anodyne O=C(Nc1ccc(C2CCCCC2)cc1)[C@H]1C(=O)O[C@@H](Cc2ccccc2)C1=O ZINC000169727243 GI Annotated Anodyne O=C(Nc1ccc(C2CCCCC2)cc1)[C@@H]1C(=O)O[C@H](Cc2ccccc2)C1=O ZINC000169727244 GI Annotated Anodyne O=C(Nc1ccc(C2CCCCC2)cc1)[C@H]1C(=O)O[C@H](Cc2ccccc2)C1=O ZINC000169727245 GI Annotated Anodyne O=C1C[C@@H](C2CCCCC2)NC(=O)[C@@H]1C(=O)Nc1ccc(C2CCCCC2)cc1 ZINC000169727299 GI Annotated Anodyne O=C1C[C@@H](C2CCCCC2)NC(=O)[C@H]1C(=O)Nc1ccc(C2CCCCC2)cc1 ZINC000169727300 GI Annotated Anodyne O=C1C[C@H](C2CCCCC2)NC(=O)[C@@H]1C(=O)Nc1ccc(C2CCCCC2)cc1 ZINC000169727301 GI Annotated Anodyne O=C1C[C@H](C2CCCCC2)NC(=O)[C@H]1C(=O)Nc1ccc(C2CCCCC2)cc1 ZINC000169727302 GI Annotated Anodyne COc1ccc(OC)c(-c2cccc3c(N)c4c(=O)n(C5CCC5)cc-4[nH]c23)c1 ZINC000169729120 GI Annotated Anodyne COc1ccc(OC)c(-c2cccc3c(N)c4c(=O)n(C5CC5)cc-4[nH]c23)c1 ZINC000169729122 GI Annotated Anodyne COc1ccc(OC)c(-c2c(F)ccc3c(N)c4c(=O)n(C5CC5)cc-4[nH]c23)c1 ZINC000169729123 GI Annotated Anodyne O=Nc1c([C@@H]2C(=O)Nc3c2cccc3C(F)(F)F)[nH]c2cc(C(=O)O)ccc12 ZINC000169729488 GI Annotated Anodyne O=Nc1c([C@H]2C(=O)Nc3c2cccc3C(F)(F)F)[nH]c2cc(C(=O)O)ccc12 ZINC000169729489 GI Annotated Anodyne O=Nc1c([C@@H]2C(=O)Nc3c2cccc3C(F)(F)F)[nH]c2ccc(C(=O)O)cc12 ZINC000169729509 GI Annotated Anodyne O=Nc1c([C@H]2C(=O)Nc3c2cccc3C(F)(F)F)[nH]c2ccc(C(=O)O)cc12 ZINC000169729510 GI Annotated Anodyne CCN1C/C(=C\c2ccc(F)cc2)C2=NC(=S)N[C@@H](c3ccc(F)cc3)[C@@H]2C1 ZINC000169730312 GI Annotated Anodyne CCN1C/C(=C\c2ccc(F)cc2)C2=NC(=S)N[C@H](c3ccc(F)cc3)[C@@H]2C1 ZINC000169730313 GI Annotated Anodyne CCN1C/C(=C\c2ccccc2F)C2=NC(=S)N[C@@H](c3ccccc3F)[C@@H]2C1 ZINC000169730321 GI Annotated Anodyne CCN1C/C(=C\c2ccccc2F)C2=NC(=S)N[C@H](c3ccccc3F)[C@@H]2C1 ZINC000169730322 GI Annotated Anodyne COc1ccc(C/C=N/c2cc(O)c3cccnc3c2O)cc1Br ZINC000169730512 GI Annotated Mild C/C(=N\Nc1cc(C)nc2ccc(C)cc12)c1cn(C)n(-c2ccccc2)c1=O ZINC000017108700 GI Annotated Mild COc1cccc([C@H]2c3cc4c(cc3O[C@](C)(N3CCCC3)[C@@H]2C)OCO4)c1O ZINC000017142516 GI Annotated Anodyne COc1cccc([C@H]2c3cc4c(cc3O[C@](C)(N3CCCC3)[C@H]2C)OCO4)c1O ZINC000017142518 GI Annotated Anodyne CC(=O)S[C@@H]1CC(=O)C=C2CC[C@@H]3[C@@H]4CCC(=O)O[C@@]4(C)CC[C@@H]3[C@]21C ZINC000017147098 GI Annotated Mild CC(=O)S[C@H]1CC(=O)C=C2CC[C@@H]3[C@@H]4CCC(=O)O[C@@]4(C)CC[C@@H]3[C@]21C ZINC000017147101 GI Annotated Mild CC(=O)S[C@@H]1CC(=O)C=C2CC[C@H]3[C@@H]4CCC(=O)O[C@@]4(C)CC[C@@H]3[C@]21C ZINC000017147104 GI Annotated Mild CC(=O)S[C@H]1CC(=O)C=C2CC[C@H]3[C@@H]4CCC(=O)O[C@@]4(C)CC[C@@H]3[C@]21C ZINC000017147106 GI Annotated Mild O=S(=O)(O)c1ccc(/N=N/c2nc(C(F)(F)F)c(C(F)(F)F)[nH]2)cc1 ZINC000017176269 GI Annotated Clean CS/C(=N\c1ccccc1)N(c1ccccc1)c1nc(=[N+](C)C)ss1 ZINC000017188907 GI Annotated Mild COc1ccc([C@@H]2[C@@H]3CCC[C@@H](C3=O)[C@@H](c3ccc(OC)cc3)N2N=O)cc1 ZINC000017192727 GI Annotated Anodyne O=C1[C@H]2[C@@H](C(=O)N1c1ccccc1)c1[nH]c3ccccc3c1[C@H]1CCSC[C@H]12 ZINC000017193030 GI Annotated Anodyne O=C1[C@H]2c3[nH]c4ccccc4c3[C@H]3CCSC[C@@H]3[C@@H]2C(=O)N1c1ccccc1 ZINC000017193033 GI Annotated Anodyne Cc1nc(=O)[nH]c(CC(O)(c2ccccc2)c2ccccc2)c1-c1ccccc1 ZINC000017195976 GI Annotated Anodyne Cn1nc(-c2ccccc2)c(C(=O)/C=C/c2ccccc2)c(N2CCCCC2)c1=O ZINC000017196016 GI Annotated Mild CCc1cccc([C@H](C)CC)c1NC(=O)C[C@@H]1C(=O)Nc2ccccc2[S@]1=O ZINC000017196746 GI Annotated Anodyne CCc1cccc([C@H](C)CC)c1NC(=O)C[C@H]1C(=O)Nc2ccccc2[S@]1=O ZINC000017196749 GI Annotated Anodyne CCN(CC)c1c(C(=O)/C=C/c2ccccc2)c(-c2ccccc2)nn(C)c1=O ZINC000017196781 GI Annotated Mild O=C(NN/C=C1\C=Nc2ccccc21)[C@H]1CC1(c1ccccc1)c1ccccc1 ZINC000017201578 GI Annotated Reactive CC(=O)O[C@H]1/C=C(/C)[C@H](OC(C)=O)C/C=C(\C)CC[C@@H]2[C@@H](/C=C\C1=O)C2(C)C ZINC000017210578 GI Annotated Mild CC(=O)O[C@H]1/C=C(/C)[C@H](OC(C)=O)C/C=C(/C)CC[C@@H]2[C@@H](/C=C\C1=O)C2(C)C ZINC000017210580 GI Annotated Mild COc1ccc(/C(Cl)=C(\C=N/O)c2ccc(OC)c(OC)c2)cc1OC ZINC000017217309 GI Annotated Mild c1ccc2c(c1)N[C@@H]([C@@H]1[C@H]([C@@H]3Nc4ccccc4S3)O[C@@H]3CCCN13)S2 ZINC000017221682 GI Annotated Anodyne c1ccc2c(c1)N[C@@H]([C@H]1O[C@@H]3CCCN3[C@@H]1[C@@H]1Nc3ccccc3S1)S2 ZINC000017221685 GI Annotated Anodyne Cc1nn(C(=O)c2ccc(Cl)cc2)c2c1[C@@H](c1ccccc1O)SC(N)=N2 ZINC000017222117 GI Annotated Anodyne Cc1nn(C(=O)c2ccc(Cl)cc2)c2c1[C@@H](c1ccc(O)cc1)SC(N)=N2 ZINC000017222126 GI Annotated Anodyne COc1cccc(N2C(=O)[C@H]3c4[nH]c5ccccc5c4[C@H]4CCC[C@H]4[C@H]3C2=O)c1 ZINC000017223974 GI Annotated Anodyne CC1=C(C(=O)O[C@@H]2C[C@@H]3CC[C@@]2(C)C3(C)C)[C@@H]2Nc3ccccc3N(C)[C@@H]2O1 ZINC000017224100 GI Annotated Anodyne CC1=C(C(=O)O[C@@H]2C[C@@H]3CC[C@@]2(C)C3(C)C)[C@@H]2Nc3ccccc3N(C)[C@H]2O1 ZINC000017224103 GI Annotated Anodyne C[C@H]1[C@@H](c2ccc3c(c2)OCO3)c2cc3c(cc2O[C@H]1N1CCCCC1)OCO3 ZINC000017250806 GI Annotated Anodyne CC[C@H]1[C@@H](c2cccc(OC)c2O)c2cc3c(cc2O[C@H]1N1CCCC1)OCO3 ZINC000017250816 GI Annotated Anodyne C[C@H]1[C@@H](c2ccc(N(C)C)cc2)c2cc3c(cc2O[C@H]1N1CCCC1)OCO3 ZINC000017250836 GI Annotated Anodyne COc1ccccc1/C=N/Nc1nnc2c3ccccc3c3ncccc3c2n1 ZINC000017253673 GI Annotated Mild COc1cccc([C@H]2c3cc4c(cc3O[C@](C)(N3CCCC3)[C@@H]2C)OCO4)c1 ZINC000017254309 GI Annotated Anodyne N=C1N(/N=C/c2ccccn2)/C(=N\c2ccccc2)C(=S)N1c1ccccc1 ZINC000017255856 GI Annotated Mild C/C=C(/C)C(=O)O[C@@H]1C[C@@H](C)[C@H]2CC(=O)C(C)=C2C[C@@H]1C(C)(C)OC(C)=O ZINC000017257978 GI Annotated Mild OC1C[C@H](c2ccccc2)C2([C@@H](O)c3ccccc3[C@H]2O)[C@@H](c2ccccc2)C1 ZINC000017259611 GI Annotated Anodyne CO[C@@H]1C=C(O[Si](C)(C)C(C)(C)C)C[C@@H]2Oc3ccccc3C(=O)[C@@]21C#N ZINC000170004560 GI Annotated Reactive CO[C@H]1C=C(O[Si](C)(C)C(C)(C)C)C[C@@H]2Oc3ccccc3C(=O)[C@]12C#N ZINC000170004564 GI Annotated Reactive Cc1nn(-c2ccccn2)c2c1[C@@H](c1ccncc1)[C@H]1C(=O)CC(C)(C)CC1=N2 ZINC000017511604 GI Annotated Anodyne Cc1nn(-c2ccccn2)c2c1[C@@H](c1ccncc1)[C@@H]1C(=O)CC(C)(C)CC1=N2 ZINC000017511606 GI Annotated Anodyne Cc1nn(-c2ccccn2)c2c1[C@H](c1ccncc1)[C@H]1C(=O)CC(C)(C)CC1=N2 ZINC000017511608 GI Annotated Anodyne Cc1nn(-c2ccccn2)c2c1[C@H](c1ccncc1)[C@@H]1C(=O)CC(C)(C)CC1=N2 ZINC000017511610 GI Annotated Anodyne COc1ccc(CCN(C)C(=O)C23C[C@@H]4C[C@@H](CC(Cl)(C4)C2)C3)cc1OC ZINC000017822529 GI Annotated Anodyne COCCn1c(-c2ccc(Br)cc2)cs/c1=N\c1cccnc1 ZINC000017888496 GI Annotated Anodyne COc1ccc([C@H]2CC(=O)C(/C=N/c3ccc(OC)c(OC)c3)=C(O)C2)cc1 ZINC000017950249 GI Annotated Mild COc1c2c(cc3c1-c1c(cc4c(c1OC)OCO4)[C@@H]1O[C@H]3[C@@H](C)[C@@H]1C)OCO2 ZINC000017970202 GI Annotated Anodyne COC(=O)c1ccc(N2Cc3ccccc3/C2=N\C(=O)Nc2ccccc2)cc1 ZINC000017993930 GI Annotated Mild CCC(=O)c1c(O)n(O)c2cc(NC(=O)/C=C/c3ccccc3Cl)ccc12 ZINC000018038033 GI Annotated Anodyne CSc1nc(O)c2c(-c3ccc(F)cc3)c3c(nc2n1)CC(C)(C)CC3=O ZINC000018045058 GI Annotated Anodyne CN(C)c1ccc(/N=N\c2ccccc2C(=O)OCC(=O)NC2CCCC2)cc1 ZINC000018066158 GI Annotated Clean COc1ccc([C@@H]2C=CCN(CC(C)C)CC(=O)N2Cc2cccc(F)c2)cc1 ZINC000018069049 GI Annotated Anodyne CC1(C)CC(=O)[C@@H]2C(=Nc3cc4c(cc3[C@@H]2c2ccc3c(c2)OCO3)OCO4)C1 ZINC000018084955 GI Annotated Anodyne COc1ccc([C@H]2C=CCN(CC(C)C)CC(=O)N2Cc2ccc(F)cc2)cc1 ZINC000018090464 GI Annotated Anodyne COc1ccc([C@H]2C=CCN(CC(C)C)CC(=O)N2Cc2cccc(F)c2)cc1 ZINC000018101164 GI Annotated Anodyne COc1ccc([C@@H]2C=CCN(CC3CC3)CC(=O)N2Cc2ccc(F)cc2)cc1 ZINC000018119293 GI Annotated Anodyne COc1ccc([C@@H]2C=CCN(CC(C)C)CC(=O)N2Cc2ccc(F)cc2)cc1 ZINC000018128133 GI Annotated Anodyne C[C@H]1C[C@@H](C)CN(C(=O)c2ccc(CSc3nc4ccncc4[nH]3)cc2)C1 ZINC000018157714 GI Annotated Anodyne COc1ccc([C@H]2C=CCN(CC3CC3)CC(=O)N2Cc2ccc(F)cc2)cc1 ZINC000018176713 GI Annotated Anodyne N#CCCC1(CCC#N)CCCCCCC(CCC#N)(CCC#N)[C@@H](O)[C@H]1O ZINC000018179053 GI Annotated Mild CC1(C)CC(=O)[C@@H]2C(=Nc3cc4c(cc3[C@H]2c2ccc3c(c2)OCO3)OCO4)C1 ZINC000018182095 GI Annotated Anodyne CC1=NC2=C(C(=O)CCC2)[C@H](c2ccc(O)c([N+](=O)[O-])c2)/C1=C(\O)OC(C)C ZINC000019315034 GI Annotated Mild CC1=NC2=C(C(=O)CCC2)[C@@H](c2ccc(O)c([N+](=O)[O-])c2)/C1=C(\O)OC(C)C ZINC000019315037 GI Annotated Mild N[C@@H](NC1CC1)c1ccc(-c2ccc(-c3ccc([C@@H](N)NC4CC4)cc3)o2)cc1 ZINC000019329482 GI Annotated Anodyne N[C@@H](NC1CC1)c1ccc(-c2ccc(-c3ccc([C@H](N)NC4CC4)cc3)o2)cc1 ZINC000019329485 GI Annotated Anodyne in-vitro N[C@H](NC1CC1)c1ccc(-c2ccc(-c3ccc([C@H](N)NC4CC4)cc3)o2)cc1 ZINC000019329488 GI Annotated Anodyne COc1ccc(CCN[C@@]2(Cc3ccccc3)C[C@H](C)N(C)C[C@@H]2C)cc1OC ZINC000019462401 GI Annotated Anodyne CC1=C[C@@]2(C)C(=CC1=O)[C@H]1C[C@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000194819714 GI Annotated Mild CC1=C[C@@]2(C)C(=CC1=O)[C@H]1C[C@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@@H]1C[C@H]1[C@@]21CCC(=O)O1 ZINC000194819744 GI Annotated Mild CC1=C[C@@]2(C)C(=CC1=O)[C@H]1C[C@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@H]1C[C@H]1[C@@]21CCC(=O)O1 ZINC000194819760 GI Annotated Mild COC(=O)C1=CCCC[C@@H]1C1=C(C)C2=Cc3c(C)cc(C)n3[B-](F)(F)[N+]2=C1C ZINC000194829830 GI Annotated Anodyne COC(=O)C1=CCCC[C@H]1C1=C(C)C2=Cc3c(C)cc(C)n3[B-](F)(F)[N+]2=C1C ZINC000194829846 GI Annotated Anodyne CO[C@H]1C[C@H](O[Si](C)(C)C(C)(C)C)O[C@@H](C)/C1=C/C(=O)N1CCCCC1 ZINC000194842494 GI Annotated Reactive CC(C)(C)[Si](C)(C)O[C@@H]1CCCO[C@@H]1COCC(=O)OCc1ccccc1 ZINC000194999352 GI Annotated Reactive COc1cc([C@@H]2N[C@H](c3nccs3)Cc3ccsc32)cc(OC)c1OC ZINC000019549934 GI Annotated Anodyne Cc1oc2ccc(O)c(CN3CCOCC3)c2c1C(=O)c1ccc(Cl)cc1 ZINC000019594748 GI Annotated Clean CCc1cc(=O)[nH]c(-c2cccc(CN(C)Cc3cccc4cnccc34)c2)n1 ZINC000019742139 GI Annotated Anodyne COc1cc([C@H]2C(C#N)=C(C)N=C3CC(C)(C)CC(O)=C32)ccc1OCCO ZINC000019760556 GI Annotated Reactive CC1=C(C(=O)OC[C@@H]2CCCO2)[C@@H](c2ccncc2)C2=C(O)CC(C)(C)CC2=N1 ZINC000019770315 GI Annotated Anodyne CC1=C(C(=O)OC[C@H]2CCCO2)[C@@H](c2ccncc2)C2=C(O)CC(C)(C)CC2=N1 ZINC000019770316 GI Annotated Anodyne CC1=C(C(=O)OC[C@@H]2CCCO2)[C@H](c2ccncc2)C2=C(O)CC(C)(C)CC2=N1 ZINC000019770317 GI Annotated Anodyne CC1=C(C(=O)OC[C@H]2CCCO2)[C@H](c2ccncc2)C2=C(O)CC(C)(C)CC2=N1 ZINC000019770318 GI Annotated Anodyne O=C1N/C(=C/c2ccc(Br)cc2)C(O)=C1/C=N/Cc1ccccc1 ZINC000019790777 GI Annotated Mild COc1ccc(-c2cs/c(=N\CC3CCNCC3)n2-c2ccccc2)cc1 ZINC000019851177 GI Annotated Anodyne Cc1ccc([C@H]2N[C@H](c3ccc(C)cc3)[C@@H]([N+](=O)[O-])C(C)(C)[C@@H]2[N+](=O)[O-])cc1 ZINC000019856847 GI Annotated Bother COc1cccc([C@H]2c3cc4c(cc3O[C@](C)(N3CCCC3)[C@H]2C)OCO4)c1 ZINC000019898964 GI Annotated Anodyne O=S(=O)(N[C@@H]1[C@H]2CC[C@H]1Cc1c(F)cccc1C2)c1ccc(Cl)s1 ZINC000195089165 GI Annotated Anodyne O=S(=O)(N[C@@H]1[C@H]2CC[C@H]1Cc1cc(F)ccc1C2)c1ccc(Cl)s1 ZINC000195105965 GI Annotated Anodyne C[C@H]1/C(=N/N=C2\NC(=O)CS2)C[C@H](c2ccccc2)N(C)[C@H]1c1ccccc1 ZINC000195188731 GI Annotated Mild C[C@@H]1/C(=N/N=C2\NC(=O)CS2)C[C@H](c2ccccc2)N(C)[C@H]1c1ccccc1 ZINC000195188740 GI Annotated Mild Cc1ccc(B(CCc2ccccc2)OC(=O)c2ncccc2O)cc1Cl ZINC000195218557 GI Annotated Anodyne C[C@@H]1CC[C@@H]2CC(=O)N(Cc3ccc(Cl)cc3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000195252365 GI Annotated Reactive C[C@@H]1CC[C@@H]2CC(=O)N(Cc3ccc(Cl)cc3)[C@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 ZINC000195252375 GI Annotated Reactive COC(=O)[C@H]1[C@@H]2CC[C@H]3CC[C@@H]1N(C/C2=C\c1ccc(-n2cccc2)cc1)C3 ZINC000195280008 GI Annotated Anodyne COC(=O)[C@@H]1[C@@H]2CC[C@H]3CC[C@@H]1N(C/C2=C\c1ccc(-n2cccc2)cc1)C3 ZINC000195280017 GI Annotated Anodyne COC(=O)[C@H]1[C@@H]2CC[C@H]3CC[C@H]1N(C/C2=C\c1ccc(-n2cccc2)cc1)C3 ZINC000195280026 GI Annotated Anodyne COC(=O)[C@@H]1[C@@H]2CC[C@H]3CC[C@H]1N(C/C2=C\c1ccc(-n2cccc2)cc1)C3 ZINC000195280037 GI Annotated Anodyne CC(C)(C)[Si](C)(C)O[C@H]1CCCO[C@@H]1COCC(=O)OCc1ccccc1 ZINC000195285369 GI Annotated Reactive C[C@@H]1CC[C@H]2[C@]3(CC[C@@H]3C[Si](C)(C)C)C(=O)O[C@H]3O[C@]4(C)CC[C@@H]1[C@]23OO4 ZINC000195297125 GI Annotated Reactive C[C@@H]1CC[C@H]2[C@]3(CC[C@@H]3C[Si](C)(C)C)C(=O)O[C@H]3O[C@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000195297134 GI Annotated Reactive C[C@@H]1CC[C@H]2[C@]3(CC[C@@H]3C[Si](C)(C)C)C(=O)O[C@H]3O[C@@]4(C)CC[C@@H]1[C@]23OO4 ZINC000195297148 GI Annotated Reactive C[C@@H]1CC[C@H]2[C@]3(CC[C@@H]3C[Si](C)(C)C)C(=O)O[C@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000195297159 GI Annotated Reactive C[C@@H]1CC[C@@H]2CC(=O)N(CCCc3ccccc3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000195310696 GI Annotated Reactive C[C@@H]1CC[C@@H]2CC(=O)N(CCCc3ccccc3)[C@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 ZINC000195310707 GI Annotated Reactive C[Si](C)(C)CCOCn1ccnc1-c1nccn1COCC[Si](C)(C)C ZINC000195339818 GI Annotated Anodyne Cc1nc(/C=C/[C@@H]2C/C=C/CCC[C@@H](C)C(=O)[C@H](C)[C@@H](O)CC(=O)O2)cs1 ZINC000195341293 GI Annotated Anodyne Cc1nc(/C=C/[C@@H]2C/C=C/CCC[C@H](C)C(=O)[C@H](C)[C@@H](O)CC(=O)O2)cs1 ZINC000195341304 GI Annotated Anodyne COC(=O)N1C2=C(c3ccccc3[C@@H]1CC(=O)O)[C@@H]1O[C@H](C2)c2ccccc21 ZINC000195356237 GI Annotated Anodyne COC(=O)N1C2=C(c3ccccc3[C@H]1CC(=O)O)[C@@H]1O[C@H](C2)c2ccccc21 ZINC000195356241 GI Annotated Anodyne COc1ccc(COC[C@H](C)[C@H](O[Si](C)(C)C)[C@@H](C)[C@H]2OC(=O)[C@H]2C)cc1 ZINC000195367319 GI Annotated Reactive CC(=O)CC[C@@H]1[C@H]2[C@H](O)[C@@H](C(C)C)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@]12C ZINC000195370927 GI Annotated Anodyne CC(=O)CC[C@@H]1[C@H]2[C@H](O)[C@H](C(C)C)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@]12C ZINC000195370935 GI Annotated Anodyne CC(=O)CC[C@@H]1[C@H]2[C@@H](O)[C@@H](C(C)C)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@]12C ZINC000195370943 GI Annotated Anodyne CC(=O)CC[C@@H]1[C@H]2[C@@H](O)[C@H](C(C)C)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@]12C ZINC000195370950 GI Annotated Anodyne CC[C@@H]1/C(=N/N=C2\NC(=O)CS2)C[C@H](c2ccccc2)N[C@H]1c1ccccc1 ZINC000195371137 GI Annotated Mild CC(C)[C@@H](OCc1ccccc1)[C@@H](C)/C=N\OC[C@@H](O)COCc1ccco1 ZINC000195390882 GI Annotated Mild CC(C)[C@@H](OCc1ccccc1)[C@@H](C)/C=N/OC[C@@H](O)COCc1ccco1 ZINC000195390887 GI Annotated Mild CC(C)[C@H](OCc1ccccc1)[C@@H](C)/C=N\OC[C@@H](O)COCc1ccco1 ZINC000195390892 GI Annotated Mild CC(C)[C@H](OCc1ccccc1)[C@@H](C)/C=N/OC[C@@H](O)COCc1ccco1 ZINC000195390898 GI Annotated Mild COc1ccc2nc3c(c([Si](C)(C)C(C)(C)C)c2c1)Cn1c-3cccc1=O ZINC000195391540 GI Annotated Anodyne O=C1[C@H]2[C@H](c3ccccc3)C=C[C@H](c3ccccc3)[C@H]2C(=O)N1c1ccncc1 ZINC000195405641 GI Annotated Anodyne CC[C@H]1C(=O)C[C@H](c2ccccc2)N(C(=O)Cn2ccnc2)[C@H]1c1ccccc1 ZINC000195411105 GI Annotated Anodyne CC[C@@H]1C(=O)C[C@H](c2ccccc2)N(C(=O)Cn2ccnc2)[C@H]1c1ccccc1 ZINC000195411115 GI Annotated Anodyne CC/C=C1/C(=O)[C@]2(C(=O)c3ccccc3)C[C@H]3CC[C@@](CCC)(C2=O)[C@@]13OC ZINC000195418280 GI Annotated Mild CC/C=C1\C(=O)[C@]2(C(=O)c3ccccc3)C[C@H]3CC[C@](CCC)(C2=O)[C@@]13OC ZINC000195418288 GI Annotated Mild CC/C=C1/C(=O)[C@]2(C(=O)c3ccccc3)C[C@H]3CC[C@](CCC)(C2=O)[C@@]13OC ZINC000195418295 GI Annotated Mild COC(=O)[C@]1(/C=C2/c3ccc(F)cc3[C@H](OC)[C@H]2C)[C@@H]2Oc3ccccc3[C@@H]21 ZINC000195426329 GI Annotated Anodyne COC(=O)[C@]1(/C=C2\c3ccc(F)cc3[C@H](OC)[C@H]2C)[C@@H]2Oc3ccccc3[C@@H]21 ZINC000195426336 GI Annotated Anodyne COC(=O)[C@]1(/C=C2/c3ccc(F)cc3[C@@H](OC)[C@H]2C)[C@@H]2Oc3ccccc3[C@@H]21 ZINC000195426341 GI Annotated Anodyne COC(=O)[C@]1(/C=C2\c3ccc(F)cc3[C@@H](OC)[C@H]2C)[C@@H]2Oc3ccccc3[C@@H]21 ZINC000195426347 GI Annotated Anodyne O=C1[C@H]2[C@H](c3ccccc3)C=C[C@H](c3ccccc3)[C@H]2C(=O)N1c1cccnc1 ZINC000195464607 GI Annotated Anodyne C=Cc1ccc(C)[n+](C[Si](C)(C)O[Si](C)(C)C[n+]2cc(C=C)ccc2C)c1 ZINC000195472633 GI Annotated Reactive COc1ccc([C@@H]2[C@@H]3CCC[C@H](C3=O)[C@H](c3ccc(OC)cc3)N2N=O)cc1 ZINC000195477583 GI Annotated Anodyne C=C([C@@]1(O)C[C@H]2[C@H](CCC2(OC)OC)[C@@H]2c3ccccc3O[C@@H]21)[Si](C)(C)C ZINC000195479374 GI Annotated Mild COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CC[C@]13C/C(=N/O)[C@](OC(C)=O)(CC[C@@H]21)C3 ZINC000195489693 GI Annotated Mild CC(=O)O[C@H]1/C=C(/C)[C@H](OC(C)=O)C/C=C(\C)CC[C@@H]2[C@@H](/C=C/C1=O)C2(C)C ZINC000195489914 GI Annotated Mild CC(=O)O[C@H]1/C=C(/C)[C@H](OC(C)=O)C/C=C(/C)CC[C@@H]2[C@@H](/C=C/C1=O)C2(C)C ZINC000195489918 GI Annotated Mild C=CC[C@@H]1C=C[C@@H](O/N=C\[C@H](C)[C@H](OCc2ccccc2)C(C)C)[C@@H](CO)O1 ZINC000195498851 GI Annotated Mild C=CC[C@@H]1C=C[C@@H](O/N=C/[C@H](C)[C@H](OCc2ccccc2)C(C)C)[C@@H](CO)O1 ZINC000195498854 GI Annotated Mild C=CC[C@@H]1C=C[C@@H](O/N=C\[C@H](C)[C@@H](OCc2ccccc2)C(C)C)[C@@H](CO)O1 ZINC000195498856 GI Annotated Mild C=CC[C@@H]1C=C[C@@H](O/N=C/[C@H](C)[C@@H](OCc2ccccc2)C(C)C)[C@@H](CO)O1 ZINC000195498859 GI Annotated Mild COc1cccc(N2C(=O)[C@@H]3[C@@H](C2=O)c2[nH]c4ccccc4c2[C@H]2CCC[C@H]23)c1 ZINC000195514328 GI Annotated Anodyne COc1cccc(N2C(=O)[C@H]3c4[nH]c5ccccc5c4[C@H]4CCC[C@@H]4[C@H]3C2=O)c1 ZINC000195514330 GI Annotated Anodyne O=C1[C@@H]2[C@H]3CSCC[C@@H]3c3c([nH]c4ccccc34)[C@@H]2C(=O)N1c1ccccc1 ZINC000195514764 GI Annotated Anodyne CCCCCCCCCCCC[C@@H]1NC(=N)N[C@@]2(CCCO2)[C@@H]1C(=O)OC ZINC000195514804 GI Annotated Mild CCCCCCCCCCCC[C@H]1NC(=N)N[C@@]2(CCCO2)[C@@H]1C(=O)OC ZINC000195514806 GI Annotated Mild C[Si](C)(C[C@](C#N)(Cn1cncn1)c1ccc(Cl)cc1)c1ccccc1 ZINC000195871956 GI Annotated Mild C[Si](C)(C[C@@](C#N)(Cn1cncn1)c1ccc(Cl)cc1)c1ccccc1 ZINC000195871959 GI Annotated Mild C[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]1C(=O)N/C1=C\C(=O)Sc1ccccc1 ZINC000195883120 GI Annotated Reactive [C-]#[N+][C@]12C(=O)[C@H](C=C(Cl)[C@@]1(C)C=C)C(C)(C)[C@H]1C(=O)N(C)c3cccc2c31 ZINC000195927150 GI Annotated Reactive C/C=C/C=C/C(=O)CC1=C(C)C(=O)[C@@]2(C)OC(=O)[C@]1(C)[C@H]2CC(=O)/C=C/C=C/C ZINC000195949799 GI Annotated Mild C[C@H]1CN=C(c2ccc(-c3ccc(-c4ccc(C5=NC[C@@H](C)N5)cc4)o3)cc2)N1 ZINC000196125350 GI Annotated Anodyne C[C@H]1CN=C(c2ccc(-c3ccc(-c4ccc(C5=NC[C@H](C)N5)cc4)o3)cc2)N1 ZINC000196125358 GI Annotated Anodyne C[C@@H]1CN=C(c2ccc(-c3ccc(-c4ccc(C5=NC[C@@H](C)N5)cc4)o3)cc2)N1 ZINC000196125365 GI Annotated Anodyne CC(C)c1cc2cc(=O)cc3c4cc(=O)cc5cc(C(C)C)c(=O)c(c(c1=O)c23)c54 ZINC000196199515 GI Annotated Bother C[Si](C)(C)O/N=C/c1ccc(NC(=O)NC(=O)c2c(F)cccc2F)cc1 ZINC000197620825 GI Annotated Reactive CC(C)[C@@H]1C[C@@H]2[C@H]3[C@H]4[C@](C)(CC[C@]13C[C@H]2O)[C@@H](Br)CC[C@@]4(C)O ZINC000197878104 GI Annotated Reactive C=C(C)C[C@@H](OC)[C@@H](C#N)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C ZINC000197979259 GI Annotated Reactive Cc1ccc(O[C@H]2[C@H](/C=C\C#Cc3ccc(C(C)(C)C)cc3)OC[C@H]2O)cc1 ZINC000198014668 GI Annotated Mild CC(C)c1cc2c(N3CCCN(C4=NCC(C)(C)S4)CC3)ncnc2s1 ZINC000198339242 GI Annotated Anodyne O=C1CC[C@@H](/C=C/[C@H](O)CCCCCC=C(Br)Br)O1 ZINC000198354524 GI Annotated Anodyne O=C1CC[C@H](/C=C/[C@@H](O)CCCCCC=C(Br)Br)O1 ZINC000198354537 GI Annotated Anodyne O=C1CC[C@@H](/C=C/[C@@H](O)CCCCCC=C(Br)Br)O1 ZINC000198354559 GI Annotated Anodyne O=C1CC[C@H]([C@@H](O)/C=C/CCCCCC=C(Br)Br)O1 ZINC000198355096 GI Annotated Anodyne O=C1CC[C@@H]([C@H](O)/C=C/CCCCCC=C(Br)Br)O1 ZINC000198355108 GI Annotated Anodyne O=C1CC[C@H]([C@H](O)/C=C/CCCCCC=C(Br)Br)O1 ZINC000198355122 GI Annotated Anodyne O=C1CC[C@@H]([C@@H](O)/C=C/CCCCCC=C(Br)Br)O1 ZINC000198355134 GI Annotated Anodyne COC(C)(C)[C@H](O)CC/C(C)=C\COc1c2ccoc2cc2oc(=O)ccc12 ZINC000198439252 GI Annotated Anodyne CCCCCCN1C[C@H](n2cc(C3CC3)nn2)[C@@H](O)C[C@H]1c1ccc(C)cc1 ZINC000198496983 GI Annotated Anodyne C=C(C)[C@@H]1C[C@]2(CC=C(C)C)C(=O)Oc3cc(O)cc(O)c3C(=O)C2=C(C)O1 ZINC000198550465 GI Annotated Mild Nc1ccc(CNC(=O)c2ccc3c(ccn3Cc3ccc(F)cc3F)c2)cc1 ZINC000198564948 GI Annotated Clean O=C1C[C@H](c2ccc(O)c(O)c2)c2c(/C=C/c3ccc(O)cc3)cc(O)cc2O1 ZINC000198596267 GI Annotated Clean CC(=O)N(C)[C@H](C(=O)N/C=C/c1c[nH]c2c(CC=C(C)C)cccc12)C(C)C ZINC000199073018 GI Annotated Anodyne Cc1ccc(CN2C(=O)CSC[C@@]2(C)C(=O)Nc2c(C)cccc2C)cc1 ZINC000199230672 GI Annotated Anodyne Cc1ccc(CN2C(=O)CSC[C@]2(C)C(=O)Nc2c(C)cccc2C)cc1 ZINC000199230690 GI Annotated Anodyne Cc1ccccc1CN1C(=O)CSC[C@@]1(C)C(=O)Nc1c(C)cccc1C ZINC000199230713 GI Annotated Anodyne Cc1ccccc1CN1C(=O)CSC[C@]1(C)C(=O)Nc1c(C)cccc1C ZINC000199230732 GI Annotated Anodyne CC[C@@H](c1nc2ccccc2[nH]1)n1c(=O)c(-c2cccnc2)nc2ccccc21 ZINC000199240482 GI Annotated Anodyne CC[C@H](c1nc2ccccc2[nH]1)n1c(=O)c(-c2cccnc2)nc2ccccc21 ZINC000199240498 GI Annotated Anodyne CC[C@@]1(c2cccc(Cl)c2)C(=O)N(C(=O)OC(C)C)N1C(=O)OC(C)C ZINC000199257518 GI Annotated Anodyne O=C(CC1CCCC1)N1CC[C@H]2[C@H](CCCN2Cc2cc(F)cc(F)c2)C1 ZINC000199407879 GI Annotated Anodyne O=C(c1cccs1)N1CC[C@H]2[C@H](CCCN2Cc2cc(F)cc(F)c2)C1 ZINC000199408047 GI Annotated Anodyne CC/C=C(\C)C[C@H](C)C[C@H](C)/C(O)=C1/C(=O)N[C@@H](Cc2ccc(O)cc2)C1=O ZINC000199422447 GI Annotated Mild CC1CCN(C(=O)c2ccc(-c3nc4ccc(O)c(C=O)c4s3)cc2)CC1 ZINC000199612504 GI Annotated Anodyne COc1cc2c(c(OC)c1OC)C1(CCCCC1)C[C@@H]2NC(=O)c1ccncc1 ZINC000199724308 GI Annotated Anodyne COc1cc2c(c(OC)c1OC)C1(CCCCC1)C[C@H]2NC(=O)c1ccncc1 ZINC000199724326 GI Annotated Anodyne COc1cc2c(cc1OC)[C@H](c1ccccc1)[C@@H](C)[C@@H]2NC(=O)c1ccncc1 ZINC000199724394 GI Annotated Anodyne CC(=O)C1=C(C)N(CC(C)C)C(=S)N[C@H]1c1ccc(Br)cc1 ZINC000199727343 GI Annotated Mild CC(=O)C1=C(C)N(CC(C)C)C(=S)N[C@@H]1c1ccc(Br)cc1 ZINC000199727361 GI Annotated Mild COc1ccc(N2C(=O)c3n[nH]c(C)c3[C@H]2c2cccc(C(F)(F)F)c2)cc1 ZINC000199729422 GI Annotated Anodyne COc1ccc(N2C(=O)c3n[nH]c(C)c3[C@@H]2c2cccc(C(F)(F)F)c2)cc1 ZINC000199729440 GI Annotated Anodyne Cc1[nH]nc2c1[C@@H](c1ccc(Br)cc1)N(Cc1ccccc1)C2=O ZINC000199729465 GI Annotated Anodyne Cc1[nH]nc2c1[C@H](c1ccc(Br)cc1)N(Cc1ccccc1)C2=O ZINC000199729484 GI Annotated Anodyne COCc1[nH]nc2c1[C@@H](c1cccc(C(F)(F)F)c1)N(c1ccccc1)C2=O ZINC000199731306 GI Annotated Anodyne COCc1[nH]nc2c1[C@H](c1cccc(C(F)(F)F)c1)N(c1ccccc1)C2=O ZINC000199731331 GI Annotated Anodyne C=CCCC(=O)N1C[C@H]2CCN(C)[C@H]2C[C@H]1c1ccccc1Br ZINC000199734572 GI Annotated Mild CN1OC[C@@H]2CN3C4(C[C@@H]21)c1ccccc1C3(c1ccccc1)c1ccccc14 ZINC000199736981 GI Annotated Anodyne O=C1CCCC2=C1[C@@]1(O[C@H]3C=CC=CN23)C(=O)N(c2ccccc2)c2ccccc21 ZINC000199741765 GI Annotated Mild CCOC(=O)c1c(CC)c(C(=O)SCC)c(CC)[n+](C)c1-c1ccccc1 ZINC000002022436 GI Annotated Anodyne CCCO/C(O)=C1\C(C)=NC2=C(C(=O)CCC2)[C@@H]1c1cc(OC)ccc1OC ZINC000002063673 GI Annotated Mild O=C(/C=C/c1ccccc1)[C@H]1C(=O)C(=O)N(c2ccccc2)[C@H]1c1ccccc1 ZINC000002411899 GI Annotated Mild O=C(/C=C/c1ccccc1)[C@H]1C(=O)C(=O)N(c2ccccc2)[C@@H]1c1ccccc1 ZINC000002411900 GI Annotated Mild O=C(/C=C/c1ccccc1)[C@@H]1C(=O)C(=O)N(c2ccccc2)[C@@H]1c1ccccc1 ZINC000002411901 GI Annotated Mild CCOc1ccc(S(=O)(=O)Nc2nc3c(C)cccc3s2)c2cccnc12 ZINC000002455785 GI Annotated Anodyne CN1C(=O)c2ccccc2[C@H](C(=O)NCc2cccs2)[C@@H]1c1cccs1 ZINC000002455931 GI Annotated Anodyne CN1C(=O)c2ccccc2[C@@H](C(=O)NCc2cccs2)[C@@H]1c1cccs1 ZINC000002455934 GI Annotated Anodyne CN1C(=O)c2ccccc2[C@H](C(=O)NCc2cccs2)[C@H]1c1cccs1 ZINC000002455936 GI Annotated Anodyne CN1C(=O)c2ccccc2[C@@H](C(=O)NCc2cccs2)[C@H]1c1cccs1 ZINC000002455938 GI Annotated Anodyne O=C1CN(C(=O)c2ccco2)[C@H](c2ccc(F)cc2)c2cc(Cl)ccc2N1 ZINC000002456390 GI Annotated Anodyne O=C1CN(C(=O)c2ccco2)[C@@H](c2ccc(F)cc2)c2cc(Cl)ccc2N1 ZINC000002456392 GI Annotated Anodyne O=C1CN(C(=O)C2CCCCC2)[C@@H](c2ccc(F)cc2)c2cc(F)ccc2N1 ZINC000002456430 GI Annotated Anodyne O=C1CN(C(=O)C2CCCCC2)[C@H](c2ccc(F)cc2)c2cc(F)ccc2N1 ZINC000002456432 GI Annotated Anodyne O=C1CN(C(=O)c2cccs2)[C@H](c2ccc(F)cc2)c2cc(F)ccc2N1 ZINC000002456479 GI Annotated Anodyne O=C1CN(C(=O)c2cccs2)[C@@H](c2ccc(F)cc2)c2cc(F)ccc2N1 ZINC000002456481 GI Annotated Anodyne O=C1CN(C(=O)c2ccccc2F)[C@@H](c2ccccc2)c2cc(F)ccc2N1 ZINC000002456687 GI Annotated Anodyne O=C1CN(C(=O)c2ccccc2F)[C@H](c2ccccc2)c2cc(F)ccc2N1 ZINC000002456690 GI Annotated Anodyne O=C1CN(C(=O)c2c(F)cccc2F)[C@@H](c2ccccc2)c2cc(F)ccc2N1 ZINC000002456705 GI Annotated Anodyne O=C1CN(C(=O)c2c(F)cccc2F)[C@H](c2ccccc2)c2cc(F)ccc2N1 ZINC000002456707 GI Annotated Anodyne O=C(CSc1nc(-c2ccccc2)nc2c1CCCC2)c1ccc(O)c(O)c1 ZINC000002459116 GI Annotated Clean Cc1nc(SCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)c(C#N)c(C)c1C ZINC000002459165 GI Annotated Mild O=c1c2c(nc(SCc3ccccc3F)n1-c1ccc(F)cc1)CCS2 ZINC000002459508 GI Annotated Anodyne CC1(C)[C@@H](C=C(Cl)Cl)[C@H]1C(=O)NCCCOC(=O)Nc1ccccc1 ZINC000002461300 GI Annotated Anodyne CC1(C)[C@@H](C(=O)NCCCOC(=O)Nc2ccccc2)[C@@H]1C=C(Cl)Cl ZINC000002461302 GI Annotated Anodyne CN(Cc1ccccc1)C(=O)[C@H]1c2ccccc2C(=O)N2CCc3ccccc3[C@H]12 ZINC000002466575 GI Annotated Anodyne CN(Cc1ccccc1)C(=O)[C@@H]1c2ccccc2C(=O)N2CCc3ccccc3[C@H]12 ZINC000002466577 GI Annotated Anodyne CN(Cc1ccccc1)C(=O)[C@H]1c2ccccc2C(=O)N2CCc3ccccc3[C@@H]12 ZINC000002466578 GI Annotated Anodyne CN(Cc1ccccc1)C(=O)[C@@H]1c2ccccc2C(=O)N2CCc3ccccc3[C@@H]12 ZINC000002466582 GI Annotated Anodyne Brc1cccc(-c2nnc3sc(CNC4CCCC4)cn23)c1 ZINC000002467030 GI Annotated Anodyne C[C@H]1CCCN(Cc2cn3c(-c4ccc(Br)cc4)nnc3s2)C1 ZINC000002467085 GI Annotated Anodyne C[C@@H]1CCCN(Cc2cn3c(-c4ccc(Br)cc4)nnc3s2)C1 ZINC000002467086 GI Annotated Anodyne COc1ccccc1N1C(=O)N[C@@H]2C[C@@]1(C)Oc1ccc(Br)cc12 ZINC000002468504 GI Annotated Anodyne COc1ccccc1N1C(=O)N[C@@H]2C[C@]1(C)Oc1ccc(Br)cc12 ZINC000002468506 GI Annotated Anodyne COc1ccccc1N1C(=O)N[C@H]2C[C@]1(C)Oc1ccc(Br)cc12 ZINC000002468508 GI Annotated Anodyne CN1C(=O)c2ccccc2[C@H](C(=O)Nc2ccccn2)[C@@H]1c1c[nH]c2ccccc12 ZINC000002469281 GI Annotated Anodyne CN1C(=O)c2ccccc2[C@@H](C(=O)Nc2ccccn2)[C@@H]1c1c[nH]c2ccccc12 ZINC000002469284 GI Annotated Anodyne CN1C(=O)c2ccccc2[C@H](C(=O)Nc2ccccn2)[C@H]1c1c[nH]c2ccccc12 ZINC000002469286 GI Annotated Anodyne CN1C(=O)c2ccccc2[C@@H](C(=O)Nc2ccccn2)[C@H]1c1c[nH]c2ccccc12 ZINC000002469287 GI Annotated Anodyne O=C1C2=C(c3ccccc3CC23CCCCC3)n2nnnc2[C@@H]1Cc1ccccc1 ZINC000002469577 GI Annotated Mild O=C1C2=C(c3ccccc3CC23CCCCC3)n2nnnc2[C@H]1Cc1ccccc1 ZINC000002469579 GI Annotated Mild CC1(C)CC(=O)CC2=C1OC1=C(CC(=O)CC1(C)C)C21C(=O)Nc2ccccc21 ZINC000002477574 GI Annotated Anodyne CCOc1ccc(-c2onc(-c3ccc(F)cc3)c2C(=O)NCCCOC)cc1 ZINC000002478206 GI Annotated Anodyne CCOc1cccc(-c2onc(-c3ccc(F)cc3)c2C(=O)NCCCOC)c1 ZINC000002478310 GI Annotated Anodyne CC(=O)Nc1ccc(N2C(=O)CS[C@@H]2c2ccc(Br)cc2)cc1 ZINC000002478713 GI Annotated Anodyne CC(=O)Nc1ccc(N2C(=O)CS[C@H]2c2ccc(Br)cc2)cc1 ZINC000002478716 GI Annotated Anodyne O=C(NCCO)c1c(-c2ccc(F)cc2)noc1-c1cccc2ccccc12 ZINC000002480281 GI Annotated Anodyne CCOc1ccccc1-c1onc(-c2ccccc2F)c1C(=O)NCCCOC ZINC000002482193 GI Annotated Anodyne CCCCNC(=O)c1c(C(C)(C)C)noc1-c1ccc(OC)c(OC)c1OC ZINC000002483324 GI Annotated Anodyne CN(CCCNC(=O)c1c(C(C)(C)C)noc1-c1ccoc1)c1ccccc1 ZINC000002483396 GI Annotated Anodyne CCCCNC(=O)c1ccc2c(c1)[C@@H](NCCCOC)CC1(CCCCC1)O2 ZINC000002489235 GI Annotated Anodyne CCCCNC(=O)c1ccc2c(c1)[C@H](NCCCOC)CC1(CCCCC1)O2 ZINC000002489236 GI Annotated Anodyne COc1ccc(CN[C@H]2CC3(CCCCC3)Oc3ccc(C(N)=O)cc32)cc1 ZINC000002492518 GI Annotated Anodyne COc1ccc(CN[C@@H]2CC3(CCCCC3)Oc3ccc(C(N)=O)cc32)cc1 ZINC000002492520 GI Annotated Anodyne CC1(C)CC(=O)[C@H]2C(=Nc3cc4c(cc3[C@@H]2c2ccc3c(c2)OCO3)OCO4)C1 ZINC000002492690 GI Annotated Anodyne CC1(C)CC(=O)[C@H]2C(=Nc3cc4c(cc3[C@H]2c2ccc3c(c2)OCO3)OCO4)C1 ZINC000002493468 GI Annotated Anodyne O=C1C2=NCCNC(c3ccccc3)=C2[C@H](c2ccccc2)N1c1ccccc1 ZINC000002494674 GI Annotated Anodyne O=C1C2=NCCNC(c3ccccc3)=C2[C@@H](c2ccccc2)N1c1ccccc1 ZINC000002494676 GI Annotated Anodyne Cc1cc(O)c(C2=NCCS[C@@H](c3ccccc3Br)C2)c(=O)o1 ZINC000002496662 GI Annotated Anodyne C[C@]12C[C@H](NC(=O)N1c1ccccc1F)c1cc(Br)ccc1O2 ZINC000002498601 GI Annotated Anodyne C[C@@]12C[C@H](NC(=O)N1c1ccccc1F)c1cc(Br)ccc1O2 ZINC000002498604 GI Annotated Anodyne C[C@@]12C[C@@H](NC(=O)N1c1ccc(F)cc1)c1cc(Br)ccc1O2 ZINC000002498614 GI Annotated Anodyne C[C@]12C[C@@H](NC(=O)N1c1ccc(F)cc1)c1cc(Br)ccc1O2 ZINC000002498616 GI Annotated Anodyne C[C@@]12C[C@H](NC(=O)N1c1ccc(F)cc1)c1cc(Br)ccc1O2 ZINC000002498618 GI Annotated Anodyne C[C@]12C[C@H](NC(=O)N1c1ccc(F)cc1)c1cc(Br)ccc1O2 ZINC000002498619 GI Annotated Anodyne CC[C@H]1CC[C@H](C)N(c2ccc3nc(O)c(Cc4ccc(F)cc4)nc3n2)C1 ZINC000002499512 GI Annotated Anodyne CC1=C(C(=O)N2CCOCC2)[C@@H](c2ccccc2F)C2=C(O)CC(C)(C)CC2=N1 ZINC000020028832 GI Annotated Anodyne CC1=C(C(=O)N2CCOCC2)[C@H](c2ccccc2F)C2=C(O)CC(C)(C)CC2=N1 ZINC000020028833 GI Annotated Anodyne Cc1ccccc1[C@H]1N[C@H](c2ccccc2C)[C@@H]([N+](=O)[O-])C(C)(C)[C@@H]1[N+](=O)[O-] ZINC000020064420 GI Annotated Bother N#Cc1c(N)nc(Sc2ccccc2N)c(C#N)c1-c1ccc(Cl)cc1 ZINC000020094495 GI Annotated Mild CC(C)c1ccc([C@H]2C(C(=O)c3ccc(Cl)cc3)=C(O)C(=O)N2CCN)cc1 ZINC000020101778 GI Annotated Mild CC(C)c1ccc([C@@H]2C(C(=O)c3ccc(Cl)cc3)=C(O)C(=O)N2CCN)cc1 ZINC000020101781 GI Annotated Mild Brc1cccc(-c2nnc3sc(CNCc4ccco4)cn23)c1 ZINC000020151788 GI Annotated Anodyne CC(C)Cn1c(=O)c2ccccc2n2c(-c3ccc(C(F)(F)F)cc3)nnc12 ZINC000020483996 GI Annotated Anodyne Cc1cccc(C2=N[C@@H](Cc3ccccc3)C(=O)c3c(nc4ccccn34)N2)c1 ZINC000200213191 GI Annotated Anodyne CCOCCOc1ccccc1-c1cn(-c2ccc(C(=O)O)cc2)cc1C#N ZINC000200823937 GI Annotated Mild O=C(CNCCC1(O)CCCCC1)N1CCc2ccccc2[C@H]1C1CCCCC1 ZINC000201381689 GI Annotated Anodyne O=C(CNCCC1(O)CCCCC1)N1CCc2ccccc2[C@@H]1C1CCCCC1 ZINC000201381725 GI Annotated Anodyne O=C(CNCC1(O)CCCCCC1)N1CCc2ccccc2[C@H]1C1CCCCC1 ZINC000201387290 GI Annotated Anodyne O=C(CNCC1(O)CCCCCC1)N1CCc2ccccc2[C@@H]1C1CCCCC1 ZINC000201387318 GI Annotated Anodyne CC[C@@H](C)CNC(=O)CSc1nnc(-c2cccnc2)n1C1CCCCC1 ZINC000201446738 GI Annotated Anodyne CC[C@H](C)CNC(=O)CSc1nnc(-c2cccnc2)n1C1CCCCC1 ZINC000201446770 GI Annotated Anodyne C[C@@H]1[C@@H](O)C[C@@]2(C[C@H](O)c3cc(F)ccc3O2)O[C@H]1c1ccccc1Cl ZINC000201480686 GI Annotated Anodyne CCN(CC)C(=O)Cc1c(-c2ccc(OC(C)C)cc2)nn2c(C)cc(C)nc12 ZINC000201768688 GI Annotated Anodyne O=S(=O)(c1cccc(-c2ccccc2)n1)N1CCC(c2ccccc2)CC1 ZINC000201774695 GI Annotated Anodyne N#Cc1cn(-c2ccc(C(=O)O)c(O)c2)c2cccc(OCc3ccccc3)c12 ZINC000202399132 GI Annotated Mild CC(C)[C@H]1[C@H]2OC(C)(C)O[C@H]2[C@@H]2[C@H]3OCC4=C3[C@@](C)(CC[C@@H]4O)CC[C@@]21C ZINC000202800980 GI Annotated Anodyne O=C(Nc1ccc(F)cc1)OCc1cn(Cc2ccc(C(F)(F)F)cc2)nn1 ZINC000203462582 GI Annotated Anodyne O=C(Nc1ccc(F)cc1)OCc1cn(Cc2ccccc2C(F)(F)F)nn1 ZINC000203462599 GI Annotated Anodyne CC(C)(C)n1nnnc1[C@@H]1CN=C(c2ccccc2)c2cc(Cl)ccc2N1 ZINC000203464055 GI Annotated Anodyne CC(C)(C)n1nnnc1[C@H]1CN=C(c2ccccc2)c2cc(Cl)ccc2N1 ZINC000203464060 GI Annotated Anodyne O=C1[C@@H](C2CCCCC2)[C@@H]2c3ccccc3C=NN2[C@@H]2c3ccccc3C=NN12 ZINC000203465081 GI Annotated Anodyne CC(C)n1nnnc1[C@]1(C)CCCCC(=O)N1Cc1cccc(C(F)(F)F)c1 ZINC000203465530 GI Annotated Anodyne CC(C)n1nnnc1[C@@]1(C)CCCCC(=O)N1Cc1cccc(C(F)(F)F)c1 ZINC000203465536 GI Annotated Anodyne C[C@@H]1OCN(C)[C@H]2C[C@H]3c4[nH]c5cccc(-c6ccccc6)c5c4CCN3C[C@@H]12 ZINC000203467329 GI Annotated Anodyne CN[C@H]1C[C@H]2c3[nH]c4c(-c5cccc(C)c5)cccc4c3CCN2C[C@H]1[C@H](C)O ZINC000203468694 GI Annotated Anodyne O=C(Nc1ccc2c(c1)OCO2)N1CCC(c2nc3ccc(Cl)cc3[nH]2)CC1 ZINC000203475205 GI Annotated Anodyne Cc1ccc(-c2cccc(Cn3nc(-c4cc(F)cc(F)c4)ccc3=O)c2)nn1 ZINC000203897598 GI Annotated Anodyne OCC[C@@H](NCc1ccnc(-c2ccc(C(F)(F)F)cc2)n1)c1ccccc1 ZINC000204406246 GI Annotated Anodyne OCC1(CNCc2ccnc(-c3ccc(C(F)(F)F)cc3)n2)CCCCC1 ZINC000204407189 GI Annotated Anodyne OC[C@H](NCc1nc(-c2ccc(C(F)(F)F)nc2)ccc1F)C1CCCCC1 ZINC000204409157 GI Annotated Anodyne OC[C@H](NCc1ccnc(-c2ccc(C(F)(F)F)cc2)n1)C1CCCCC1 ZINC000204412718 GI Annotated Anodyne Cc1nc(-c2ccccc2)sc1-c1ccc(F)c(CN[C@@H](CO)C(C)C)n1 ZINC000204415873 GI Annotated Anodyne OCC[C@H](NCc1ccnc(-c2ccc(C(F)(F)F)cc2)n1)c1ccccc1 ZINC000204417122 GI Annotated Anodyne O[C@H](CCNCc1ccnc(-c2ccc(C(F)(F)F)cc2)n1)c1ccccc1 ZINC000204420036 GI Annotated Anodyne O[C@@H](CCNCc1ccnc(-c2ccc(C(F)(F)F)cc2)n1)c1ccccc1 ZINC000204420047 GI Annotated Anodyne CC(C)[C@@H](NCc1nc(-c2ccc(C(F)(F)F)nc2)ccc1F)C(C)(C)O ZINC000204422660 GI Annotated Anodyne CC(C)Oc1ccc(-c2nc(-c3ccc(C(=O)O)cc3)cc3[nH]nc(N)c23)cc1 ZINC000204818120 GI Annotated Anodyne N#C[C@H]1CCCC[C@@H]1n1cc(C(N)=O)c(Nc2cc(Cl)cc(Cl)c2)n1 ZINC000204937204 GI Annotated Mild N#C[C@H]1CCCC[C@@H]1n1cc(C(N)=O)c(Nc2cnc3ccc(Cl)cc3c2)n1 ZINC000204937380 GI Annotated Mild COC1CCC2(CC1)Oc1ccc(C#CC3CC3)cc1[C@@]21N=C(N)c2ccccc21 ZINC000204989094 GI Annotated Mild COC1CCC2(CC1)Oc1ccc(C#CC3CC3)cc1[C@]21N=C(N)c2ccccc21 ZINC000204989112 GI Annotated Mild O=C(CCN1C(=O)c2ccccc2Sc2ncccc21)NC1CCCCCC1 ZINC000020512095 GI Annotated Anodyne CCN(Cc1ccccc1)C(=O)[C@H](c1ccccc1)N1Cc2ccccc2C1=O ZINC000020531073 GI Annotated Anodyne CCN(Cc1ccccc1)C(=O)[C@@H](c1ccccc1)N1Cc2ccccc2C1=O ZINC000020531074 GI Annotated Anodyne Cc1ccc(C)c(-n2cc(CNCCc3cnccn3)c(-c3ccccc3)n2)c1 ZINC000020541278 GI Annotated Anodyne CN(C1CCCCC1)S(=O)(=O)c1ccc(-c2cc(C(F)(F)F)no2)s1 ZINC000020580911 GI Annotated Anodyne CC1CCC(NS(=O)(=O)c2ccc(-c3cc(C(F)(F)F)no3)s2)CC1 ZINC000020580974 GI Annotated Anodyne Cc1cc(O)c([C@H](c2ccccc2)N2CCCCC2)c(=O)n1Cc1ccco1 ZINC000020604670 GI Annotated Anodyne aggregator Cc1cc(O)c([C@@H](c2ccccc2)N2CCCCC2)c(=O)n1Cc1ccco1 ZINC000020604673 GI Annotated Anodyne aggregator CCc1nc2ccc(C(=O)NCc3ccc(OC(C)C)cc3)cc2nc1CC ZINC000020616507 GI Annotated Anodyne C[C@H]1C[C@@H](C)CN(C(=O)c2ccc(SCc3ccccn3)c([N+](=O)[O-])c2)C1 ZINC000020663983 GI Annotated Anodyne CC[C@@H](c1ccccc1)c1n[nH]c2c1CN(Cc1nc(C)c(C)nc1C)CC2 ZINC000020866688 GI Annotated Anodyne CC[C@H](c1ccccc1)c1n[nH]c2c1CN(Cc1nc(C)c(C)nc1C)CC2 ZINC000020866692 GI Annotated Anodyne CCC(C)(C)c1nnc(NC(=O)N(C)Cc2c[nH]nc2-c2ccccc2)s1 ZINC000020905648 GI Annotated Anodyne Cc1ccc(-c2nnc(CS(=O)(=O)C([Si](C)(C)C)[Si](C)(C)C)o2)cc1 ZINC000205071499 GI Annotated Anodyne N#Cc1ccccc1CSc1nnc2c(n1)[nH]c1cccc(Br)c12 ZINC000205093441 GI Annotated Mild N#Cc1ccccc1CSc1nnc2c3ccccc3n(C(=O)C3CC3)c2n1 ZINC000205100900 GI Annotated Mild COc1ccc(C(=O)C[C@]2(OC)C(=O)N(C)c3c(Cl)ccc(Cl)c32)cc1 ZINC000205122079 GI Annotated Anodyne COc1ccc(C(=O)C[C@@]2(OC)C(=O)N(C)c3c(Cl)ccc(Cl)c32)cc1 ZINC000205122100 GI Annotated Anodyne COc1ccc(-c2ccc3c(c2)COCC(=O)N3Cc2ccccc2)cc1OC ZINC000205207892 GI Annotated Anodyne Cc1cccc(C)c1NC(=O)N1C[C@H]2ON=C(c3c(F)cccc3Cl)[C@@H]2C1 ZINC000205209089 GI Annotated Anodyne Cc1cccc(C)c1NC(=O)N1C[C@H]2ON=C(c3c(F)cccc3Cl)[C@H]2C1 ZINC000205209104 GI Annotated Anodyne Cc1cccc(C)c1NC(=O)N1C[C@H]2C(c3c(F)cccc3Cl)=NO[C@H]2C1 ZINC000205209127 GI Annotated Anodyne Cc1cccc(C)c1NC(=O)N1C[C@@H]2ON=C(c3c(F)cccc3Cl)[C@H]2C1 ZINC000205209139 GI Annotated Anodyne Cc1ccccc1C1=NO[C@H]2CN(C(=O)c3ccc(Cl)c(Cl)c3)C[C@H]12 ZINC000205210631 GI Annotated Anodyne Cc1ccccc1C1=NO[C@@H]2CN(C(=O)c3ccc(Cl)c(Cl)c3)C[C@H]12 ZINC000205210641 GI Annotated Anodyne Cc1ccccc1C1=NO[C@H]2CN(C(=O)c3ccc(Cl)c(Cl)c3)C[C@@H]12 ZINC000205210653 GI Annotated Anodyne Cc1ccccc1C1=NO[C@@H]2CN(C(=O)c3ccc(Cl)c(Cl)c3)C[C@@H]12 ZINC000205210662 GI Annotated Anodyne COc1ccc(-c2ccc3c(c2)COCC(=O)N3Cc2cccc(OC)c2)cc1 ZINC000205212106 GI Annotated Anodyne COc1cc(NC(=O)C(C)(C)n2cc(-c3ccccc3C)cn2)cc(OC)c1 ZINC000205214467 GI Annotated Anodyne COc1ccc(-c2ccc3c(c2)N(Cc2ccccc2Cl)C(=O)COC3)cn1 ZINC000205218092 GI Annotated Anodyne COc1ccc(-c2ccc3c(c2)N(Cc2cc(F)cc(F)c2)C(=O)COC3)cn1 ZINC000205218655 GI Annotated Anodyne O=C(c1ccc(F)c(Cl)c1)N1C[C@@H]2ON=C(c3c(F)cccc3Cl)[C@H]2C1 ZINC000205220099 GI Annotated Anodyne O=C(c1ccc(F)c(Cl)c1)N1C[C@H]2ON=C(c3c(F)cccc3Cl)[C@H]2C1 ZINC000205220110 GI Annotated Anodyne O=C(c1ccc(F)c(Cl)c1)N1C[C@H]2C(c3c(F)cccc3Cl)=NO[C@H]2C1 ZINC000205220126 GI Annotated Anodyne O=C(c1ccc(F)c(Cl)c1)N1C[C@H]2ON=C(c3c(F)cccc3Cl)[C@@H]2C1 ZINC000205220137 GI Annotated Anodyne O=C(c1cccc(Cl)c1)N1C[C@H]2ON=C(c3c(F)cccc3Cl)[C@@H]2C1 ZINC000205220453 GI Annotated Anodyne O=C(c1cccc(Cl)c1)N1C[C@H]2ON=C(c3c(F)cccc3Cl)[C@H]2C1 ZINC000205220466 GI Annotated Anodyne O=C(c1cccc(Cl)c1)N1C[C@H]2C(c3c(F)cccc3Cl)=NO[C@H]2C1 ZINC000205220477 GI Annotated Anodyne O=C(c1cccc(Cl)c1)N1C[C@@H]2ON=C(c3c(F)cccc3Cl)[C@H]2C1 ZINC000205220492 GI Annotated Anodyne Cc1ccccc1C1=NO[C@H]2CN(C(=O)c3ccc(Cl)cc3Cl)C[C@H]12 ZINC000205220579 GI Annotated Anodyne Cc1ccccc1C1=NO[C@@H]2CN(C(=O)c3ccc(Cl)cc3Cl)C[C@H]12 ZINC000205220600 GI Annotated Anodyne Cc1ccccc1C1=NO[C@H]2CN(C(=O)c3ccc(Cl)cc3Cl)C[C@@H]12 ZINC000205220614 GI Annotated Anodyne Cc1ccccc1C1=NO[C@@H]2CN(C(=O)c3ccc(Cl)cc3Cl)C[C@@H]12 ZINC000205220627 GI Annotated Anodyne COc1cccc(CN2C(=O)COCc3cc(-c4ccccc4OC)ccc32)c1 ZINC000205221062 GI Annotated Anodyne COc1cccc(CN2C(=O)COCc3cc(-c4cccc(O)c4)ccc32)c1 ZINC000205224345 GI Annotated Anodyne CCN(CC)C(=O)c1cccc(-c2ccc3c(c2)N(C(C)C)C(=O)COC3)c1 ZINC000205226299 GI Annotated Anodyne COc1ccccc1NC(=O)C[C@@]1(C)N=C(c2cccc3ccccc23)N(C)O1 ZINC000205228310 GI Annotated Anodyne COc1ccccc1NC(=O)C[C@]1(C)N=C(c2cccc3ccccc23)N(C)O1 ZINC000205228323 GI Annotated Anodyne COc1cccc(CN2C(=O)COCc3ccc(-c4ccccc4OC)cc32)c1 ZINC000205228938 GI Annotated Anodyne O=C1COCc2cc(-c3cccc(CO)c3)ccc2N1Cc1cc(F)cc(F)c1 ZINC000205228959 GI Annotated Anodyne COc1cc(-c2nccc3[nH]nc(-c4cccc(F)c4)c23)cc(OC)c1OC ZINC000205232214 GI Annotated Anodyne CCCN1C(=O)COCc2cc(-c3cccc(C(=O)N(CC)CC)c3)ccc21 ZINC000205232501 GI Annotated Anodyne CSc1ccccc1NC(=O)C(C)(C)n1cc(-c2nc(C)cnc2C)cn1 ZINC000205233359 GI Annotated Anodyne Cc1cc(-c2n[nH]c3c(F)c(NC(=O)N[C@H](C)c4ccccc4)ncc23)ccn1 ZINC000205434082 GI Annotated Anodyne C[C@@H](NC(=O)Nc1cc2n[nH]c([C@]3(C)CC3(F)F)c2cn1)c1ccc(F)cc1 ZINC000205434147 GI Annotated Anodyne C[C@@H](NC(=O)Nc1cc2n[nH]c([C@@]3(C)CC3(F)F)c2cn1)c1ccc(F)cc1 ZINC000205434165 GI Annotated Anodyne C=C1CCC[C@@H]2[C@]1(C)CC[C@H](C)[C@@]2(C)CC/C(C)=C/C(=O)OC[C@H](O)CO ZINC000205527401 GI Annotated Mild O=C1CCC[C@H]2C[C@H](NCc3ccc(Br)cc3)CC[C@]23CCCN13 ZINC000205705752 GI Annotated Anodyne O=C(NCCCc1ccccc1)O[C@@H]1CC[C@@]23CCCN2C(=O)CCC[C@H]3C1 ZINC000205708249 GI Annotated Anodyne C[C@H]1[C@@H](OC(=O)Nc2ccc(C#N)cc2)CC[C@@]23CCCN2C(=O)CCC[C@@H]13 ZINC000205708964 GI Annotated Mild CCC[C@H]1[C@@H](OC(=O)NCc2ccco2)CC[C@@]23CCCN2C(=O)CCC[C@@H]13 ZINC000205710591 GI Annotated Anodyne CCC[C@H]1[C@@H](OC(=O)NCc2cccnc2)CC[C@@]23CCCN2C(=O)CCC[C@@H]13 ZINC000205710646 GI Annotated Anodyne O=C(NCc1ccccc1Cl)O[C@H]1CC[C@@]23CCCN2C(=O)CCC[C@H]3C1 ZINC000205710842 GI Annotated Anodyne O=C(NCc1cccc(Cl)c1)O[C@H]1CC[C@@]23CCCN2C(=O)CCC[C@H]3C1 ZINC000205710897 GI Annotated Anodyne O=C(NCc1ccc(Cl)cc1)O[C@H]1CC[C@@]23CCCN2C(=O)CCC[C@H]3C1 ZINC000205710922 GI Annotated Anodyne Cc1ccc(CNC(=O)O[C@H]2CC[C@@]34CCCN3C(=O)CCC[C@H]4[C@H]2C)cc1 ZINC000205711812 GI Annotated Anodyne CCC[C@H]1[C@@H](NC(=O)c2ccc(OC)cc2)CC[C@@]23CCCN2C(=O)CCC[C@@H]13 ZINC000205712128 GI Annotated Anodyne CCC[C@H]1[C@@H](NC(=O)c2ccc(C)cc2)CC[C@@]23CCCN2C(=O)CCC[C@@H]13 ZINC000205712151 GI Annotated Anodyne CCC[C@H]1[C@@H](NC(=O)c2cccc(C)c2)CC[C@@]23CCCN2C(=O)CCC[C@@H]13 ZINC000205712241 GI Annotated Anodyne CSc1ccc(C(=O)C[C@@]2(O)C(=O)Nc3c(Cl)ccc(Cl)c32)cc1 ZINC000205722908 GI Annotated Anodyne CSc1ccc(C(=O)C[C@]2(O)C(=O)Nc3c(Cl)ccc(Cl)c32)cc1 ZINC000205722923 GI Annotated Anodyne COc1ccc(C(=O)C[C@@]2(OC)C(=O)Nc3c(Cl)ccc(Cl)c32)cc1 ZINC000205724145 GI Annotated Anodyne COc1ccc(C(=O)C[C@]2(OC)C(=O)Nc3c(Cl)ccc(Cl)c32)cc1 ZINC000205724165 GI Annotated Anodyne C[C@H](O[Si](C)(C)C(C)(C)C)[C@H]1C(=O)N/C1=C\C(=O)Sc1ccccc1 ZINC000205829837 GI Annotated Reactive CC[C@@H](Oc1ncc(Cl)cc1Cl)C(=O)NCc1ccc2[nH]ccc2c1 ZINC000205833504 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1ccccc1-n1cncc1C(=O)c1ccccc1 ZINC000205863835 GI Annotated Anodyne COC(=O)c1ccc(C2=C3C(C)=CC(C)=[N+]3[B-](F)(F)n3c(C)cc(C)c32)cc1 ZINC000205877227 GI Annotated Anodyne COc1ccc2c(c1)[C@@H](n1c(C)ccc1C)C(=O)N2Cc1ccc(Cl)nc1 ZINC000206029016 GI Annotated Anodyne COc1ccc2c(c1)[C@H](n1c(C)ccc1C)C(=O)N2Cc1ccc(Cl)nc1 ZINC000206029040 GI Annotated Anodyne COc1c2ccccc2nn1-c1ccc(-c2cn(Cc3ccccc3)nn2)cc1 ZINC000206038832 GI Annotated Anodyne CCCCC(=O)N[C@H]1CC[C@@]23CCCN2C(=O)CCC[C@H]3[C@H]1Cc1ccccc1 ZINC000206039886 GI Annotated Anodyne C=CCCC(=O)N[C@H]1CC[C@@]23CCCN2C(=O)CCC[C@H]3[C@H]1Cc1ccccc1 ZINC000206039946 GI Annotated Mild O=C(N[C@H]1CC[C@@]23CCCN2C(=O)CCC[C@H]3[C@H]1Cc1ccccc1)C1CCC1 ZINC000206039975 GI Annotated Anodyne C[C@H]1[C@@H](NC(=O)Nc2ccc(Cl)cc2)CC[C@@]23CCCN2C(=O)CCC[C@@H]13 ZINC000206045301 GI Annotated Anodyne O=C(Nc1ccc2c(c1)OCCO2)[C@@H](Nc1ccccc1)c1ccccc1F ZINC000206049885 GI Annotated Anodyne O=C(Nc1ccc2c(c1)OCCO2)[C@H](Nc1ccccc1)c1ccccc1F ZINC000206049912 GI Annotated Anodyne NC(=O)c1cccc(-c2ccc3nnc(-c4cccc(OC(F)(F)F)c4)n3c2)c1 ZINC000206056362 GI Annotated Anodyne C[C@@H]1CN=C(c2ccc(Cl)cc2)c2c3ccc(C(F)(F)F)cc3[n+]([O-])n21 ZINC000206060845 GI Annotated Anodyne C[C@H]1CN=C(c2ccc(Cl)cc2)c2c3ccc(C(F)(F)F)cc3[n+]([O-])n21 ZINC000206060872 GI Annotated Anodyne O=c1c(-c2cccs2)cc(-n2c(=O)[nH]c3ccccc32)cn1-c1ccccc1 ZINC000206062673 GI Annotated Anodyne Cc1ccccc1-c1nccc2cc(S(=O)(=O)Nc3nccs3)ccc12 ZINC000206101623 GI Annotated Anodyne COc1ccccc1-c1cccc2cc(S(=O)(=O)Nc3ncns3)ccc12 ZINC000206154517 GI Annotated Anodyne O=S(=O)(Nc1ncns1)c1ccc2c(NCc3ccccc3)cccc2c1 ZINC000206159565 GI Annotated Anodyne CC1(C)OB(c2cn([Si](C)(C)C(C)(C)C)cc2Br)OC1(C)C ZINC000206162739 GI Annotated Mild CC1(C)OB(c2cc(C(F)(F)F)cnc2NCc2ccccc2)OC1(C)C ZINC000206189941 GI Annotated Mild CN(Cc1ccccc1)c1ncc(C(F)(F)F)cc1B1OC(C)(C)C(C)(C)O1 ZINC000206190118 GI Annotated Mild CN(Cc1ccccc1)c1cc(B2OC(C)(C)C(C)(C)O2)cnc1OC(C)(C)C ZINC000206201842 GI Annotated Mild CC(C)(C)Oc1ncc(B2OC(C)(C)C(C)(C)O2)cc1NCc1ccccc1 ZINC000206202053 GI Annotated Mild CC1(C)OB(c2cnc(NCc3ccccc3)c(C(F)(F)F)c2)OC1(C)C ZINC000206202577 GI Annotated Mild Cc1ccc(S(=O)(=O)Nc2nccn3c(-c4cc(C)cc(C)c4)cnc23)cc1 ZINC000206594560 GI Annotated Anodyne COc1ccc(NC2=C[C@H](c3ccco3)N(c3ccc(OC)cc3)C2=O)cc1 ZINC000206954736 GI Annotated Anodyne COc1ccc(NC2=C[C@@H](c3ccco3)N(c3ccc(OC)cc3)C2=O)cc1 ZINC000206954776 GI Annotated Anodyne COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)[C@@H](O)[C@]1(C)CCCN1C3 ZINC000207348205 GI Annotated Bother Cc1cc(C#N)cc(C)c1Oc1cc(Nc2ccc(C#N)cc2)nc2ncnn12 ZINC000207618102 GI Annotated Mild CN(C)CCc1cc(F)ccc1-c1nc(-c2ccc3[nH]c(=O)oc3c2)cs1 ZINC000207637410 GI Annotated Anodyne NCc1cc2ccccc2n1-c1nc2c(c(NCc3ccccc3)n1)CCCC2 ZINC000208058656 GI Annotated Anodyne CC(=O)N1Cc2nc(-n3c(C)cc4ccccc43)nc(NCc3ccccc3)c2C1 ZINC000208135945 GI Annotated Anodyne COc1cccc2c(NCc3ccccc3)nc([C@H]3NCc4ccccc43)nc12 ZINC000208177790 GI Annotated Anodyne COc1cccc2c(NCc3ccccc3)nc([C@@H]3NCc4ccccc43)nc12 ZINC000208177833 GI Annotated Anodyne C[C@H](c1ccc(Cl)cc1)N(C(=O)[C@@H]1CC[C@H](c2ccccn2)NC1=O)C1CC1 ZINC000208619791 GI Annotated Anodyne C[C@H](c1ccc(Cl)cc1)N(C(=O)[C@H]1CC[C@H](c2ccccn2)NC1=O)C1CC1 ZINC000208619870 GI Annotated Anodyne Cc1ccc(NC(=O)N2CCN(Cc3nc4ccc(C)cc4o3)CC2)c(Cl)c1 ZINC000021020964 GI Annotated Anodyne CSc1cccc(-c2ncn(CCCN3CCOCC3)c2-c2ccncc2)c1 ZINC000021289890 GI Annotated Anodyne Cc1c(/N=C/C=C2\N(C)c3ccccc3C2(C)C)c(=O)n(-c2ccccc2)n1C ZINC000021487108 GI Annotated Mild C=C1C(=O)O[C@@]2(C)CC[C@H]1C[C@@H](O)/C(C)=C/C/C=C(\C)CC[C@H]2OC(C)=O ZINC000210427131 GI Annotated Mild CC1(C)c2ccc(O)cc2O[C@@H](c2ccc(O)cc2O)[C@@H]1c1cc(O)cc(O)c1 ZINC000210525584 GI Annotated Anodyne CC[C@@H]1C(=O)C[C@H]2CCN(S(=O)(=O)c3ccc(Cl)cc3)[C@H]3CCC[C@@H]1[C@@H]32 ZINC000211060306 GI Annotated Anodyne COc1ccc(C[C@@H]2C(=O)C[C@H]3CCN(C(=O)C4CCC4)[C@H]4CCC[C@@H]2[C@@H]43)cc1 ZINC000211062821 GI Annotated Anodyne CCc1ncccc1Oc1cc(Sc2ccccn2)cnc1NC(=O)NC ZINC000213030251 GI Annotated Anodyne in-vitro Cc1sc(-n2cccc2CNCCCN(C)c2ccccc2)c(C(=O)O)c1C ZINC000021935450 GI Annotated Anodyne CS(=O)(=O)c1ccc(/C(=C/C2CCCC2)c2ncc(C(F)(F)F)[nH]2)cc1 ZINC000215068574 GI Annotated Anodyne COc1ccccc1-c1cncc2cc(S(=O)(=O)Nc3nccs3)ccc12 ZINC000215507593 GI Annotated Anodyne CC(C)(NC(=O)c1nn(-c2ccc(F)cc2F)c2c1C[C@H]1C[C@@H]21)c1ccccc1 ZINC000215558722 GI Annotated Anodyne OC[C@H]1[C@H]2CC[C@@H](C2)[C@H]1NCc1cccc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000216149241 GI Annotated Anodyne OC[C@H]1[C@H]2CC[C@@H](C2)[C@@H]1NCc1cccc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000216149284 GI Annotated Anodyne Cc1ccccc1C1=N[C@H](Cc2ccccc2)C(=O)c2c(nc3ccccn23)N1 ZINC000216666971 GI Annotated Anodyne COc1ccc(F)c(C(=O)NCC2(c3ccc(F)nc3)CCC(F)(F)CC2)c1 ZINC000217360581 GI Annotated Anodyne O=C(NCC1(c2ccc(F)nc2)CCC(F)(F)CC1)c1cc(F)ccc1F ZINC000217360783 GI Annotated Anodyne O=C(NCC1(c2ccc(F)nc2)CCC(F)(F)CC1)c1cccc(F)c1F ZINC000217361110 GI Annotated Anodyne Cc1ncc([C@@H](CNC(=O)c2cccc(Cl)c2Cl)C2CCOCC2)cn1 ZINC000217373800 GI Annotated Anodyne Cc1ncc([C@H](CNC(=O)c2cccc(Cl)c2Cl)C2CCOCC2)cn1 ZINC000217373871 GI Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](c2ccccc2)C(F)(F)F)n1 ZINC000218478422 GI Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@H](c2ccccc2)C(F)(F)F)n1 ZINC000218478478 GI Annotated Anodyne O=C(Cn1ncc2c(=O)oc3ccccc3c21)Nc1ccc(Cl)c(Cl)c1 ZINC000218929628 GI Annotated Anodyne COC(=O)C1CCC(C(=O)N2CC[C@]3(C)c4ccccc4C[C@@H]2C3(C)C)CC1 ZINC000218967820 GI Annotated Anodyne COC(=O)[C@H]1CCC[C@@H](C(=O)N2CC[C@]3(C)c4ccccc4C[C@@H]2C3(C)C)C1 ZINC000218969725 GI Annotated Anodyne COc1cccc2c(NCc3ccccc3)nc(N3C(=O)Cc4ccccc43)nc12 ZINC000218971224 GI Annotated Anodyne CC(C)CCN1CCC[C@@H]1C(=O)N1CC[C@]2(C)c3cccc(O)c3C[C@@H]1C2(C)C ZINC000218971683 GI Annotated Anodyne CC(C)CCN1CCC[C@H]1C(=O)N1CC[C@]2(C)c3cccc(O)c3C[C@@H]1C2(C)C ZINC000218971713 GI Annotated Anodyne OCc1cc2ccccc2n1-c1nc2c(c(NCc3ccccc3)n1)CCCC2 ZINC000219009481 GI Annotated Anodyne Cc1cc2c(F)cccc2n1-c1nc2c(c(NCc3ccccc3)n1)CNCC2 ZINC000219026368 GI Annotated Anodyne COc1nc2ccccc2n1-c1nc(NCc2ccccc2)c2ncsc2n1 ZINC000219028501 GI Annotated Anodyne COC1CCN(c2nccc(Nc3cc4c(ccn4C4CCCC4)cn3)n2)CC1 ZINC000219082815 GI Annotated Anodyne in-vitro C[C@@H](NC(=O)Nc1cc2n[nH]c([C@@H]3CC3(F)F)c2cn1)c1ccc(F)cc1 ZINC000219751065 GI Annotated Anodyne C[C@@H](NC(=O)Nc1cc2n[nH]c([C@H]3CC3(F)F)c2cn1)c1ccc(F)cc1 ZINC000219751142 GI Annotated Anodyne Cc1cncc(-c2n[nH]c3cc(NC(=O)N[C@H](C)c4ccc(F)cc4)ncc23)c1 ZINC000219759758 GI Annotated Anodyne C[C@@H](NC(=O)Nc1cc2[nH]nc(-c3cncc(F)c3)c2cn1)c1ccc(F)cc1 ZINC000219773582 GI Annotated Anodyne C[C@@H]1O[C@@H](OCCCCCCCCCCCCCCC(=O)O)[C@H](O)C[C@H]1O ZINC000219956091 GI Annotated Anodyne in-vitro Cc1ccc2nc([C@@H](NS(=O)(=O)c3ccc(F)cc3)c3ccccc3)[nH]c2c1 ZINC000022262342 GI Annotated Anodyne Cc1ccc2nc([C@H](NS(=O)(=O)c3ccc(F)cc3)c3ccccc3)[nH]c2c1 ZINC000022262346 GI Annotated Anodyne O=C(CSc1nnc2scc(-c3ccccc3)n12)NC1CCCCCC1 ZINC000022337457 GI Annotated Anodyne COc1ccc(CC(F)(F)F)cc1CN[C@H]1CCCN[C@H]1c1ccccc1 ZINC000022450672 GI Annotated Anodyne CN1CCC(c2cc3c(-c4cccc(NCc5cccnc5)n4)ccnc3[nH]2)CC1 ZINC000220206268 GI Annotated Anodyne CC[C@H]1CC=C(c2ccc3c(c2)[C@@]2(COC(N)=N2)C2(COC2)C(C)(C)O3)CC1 ZINC000220720201 GI Annotated Anodyne CC[C@@H]1CC=C(c2ccc3c(c2)[C@@]2(COC(N)=N2)C2(COC2)C(C)(C)O3)CC1 ZINC000220720275 GI Annotated Anodyne CC[C@H]1CC=C(c2ccc3c(c2)[C@]2(COC(N)=N2)C2(COC2)C(C)(C)O3)CC1 ZINC000220720333 GI Annotated Anodyne CC[C@@H]1CC=C(c2ccc3c(c2)[C@]2(COC(N)=N2)C2(COC2)C(C)(C)O3)CC1 ZINC000220720398 GI Annotated Anodyne CC(C)CCC[C@]1(C)CCc2cc(S(N)(=O)=O)cc(Br)c2O1 ZINC000220722791 GI Annotated Anodyne CC(C)CCC[C@@]1(C)CCc2cc(S(N)(=O)=O)cc(Br)c2O1 ZINC000220722857 GI Annotated Anodyne O=C([C@@H]1CNC[C@@]12CCSc1ccccc12)N1CCC(c2ccccc2)CC1 ZINC000220852535 GI Annotated Anodyne Cc1nn(Cc2c(Cl)cccc2Cl)c2cc(CS(=O)(=O)O)ccc12 ZINC000220966552 GI Annotated Anodyne Cc1cc(Oc2ncccc2C(F)F)ccc1-c1c(C)c(=O)[nH]c(=O)n1C1CC1 ZINC000221000717 GI Annotated Anodyne O=[N+]([O-])c1ccc(CSc2nnc(-c3ccc(Cl)cc3)o2)c([N+](=O)[O-])c1 ZINC000221035729 GI Annotated Anodyne N#C[C@H]1CCCC[C@@H]1n1cc(C(N)=O)c(Nc2cnc3cc(Cl)ccc3c2)n1 ZINC000221170745 GI Annotated Mild C#Cc1ccc(/C=C/c2nc3ccccc3c(=O)n2-c2cccc(C(=O)O)c2)cc1 ZINC000221234642 GI Annotated Mild CC(C)[C@H]1COC(=O)N1c1ccnc(N[C@@H](C)c2ccc(C(C)(C)C)nc2)n1 ZINC000221304434 GI Annotated Anodyne CC(C)Oc1cccc([C@H](C)Nc2nccc(N3C(=O)OC[C@@H]3C(C)C)n2)c1 ZINC000221308034 GI Annotated Anodyne CC(C)[C@H]1COC(=O)N1c1nc(N[C@@H](C)c2ccc(Cl)cc2)ncc1F ZINC000221308503 GI Annotated Anodyne O=C(N/N=C/c1c(F)cccc1F)c1cc(-c2ccc(F)cc2F)ccc1O ZINC000221321552 GI Annotated Reactive CN1c2ccccc2Sc2ccc([C@]3(O)CN(C)[C@H]4CCCC[C@@H]4O3)cc21 ZINC000221466318 GI Annotated Clean CCOc1ccc2cc(-c3nn(C4CCCCCC4)c(N)c3C(N)=O)cnc2c1 ZINC000221711867 GI Annotated Anodyne CCOc1ccc2cc(-c3nn(C4CCCCCC4)c(N)c3C(N)=O)ccc2n1 ZINC000221714906 GI Annotated Anodyne N#C[C@H]1CCCC[C@@H]1n1cc(C(N)=O)c(Nc2ccc(Cl)c(Cl)c2)n1 ZINC000221831076 GI Annotated Mild Cn1nc(-c2ccccc2)c2c(C(F)(F)F)cc(-c3cccc(C(N)=O)c3)nc21 ZINC000221927386 GI Annotated Anodyne CC(C)Oc1ccc(C(=O)C[C@@]2(O)C(=O)Nc3c(Cl)ccc(Cl)c32)cc1 ZINC000221953677 GI Annotated Anodyne CC(C)Oc1ccc(C(=O)C[C@]2(O)C(=O)Nc3c(Cl)ccc(Cl)c32)cc1 ZINC000221953731 GI Annotated Anodyne COc1cc(C)cc(OC)c1Oc1nc(Cl)nc(Nc2ccc(C#N)cc2)n1 ZINC000222053199 GI Annotated Mild CN(C)CCCCCCNC(=O)c1cccc(-c2cc(O)c3ncccc3c2)c1 ZINC000222530788 GI Annotated Anodyne Cc1c(C2CC2)nc2ccc(-n3ccc(OCc4ccc(F)cc4)cc3=O)cn12 ZINC000223400517 GI Annotated Anodyne Cc1c(C2CC2)nc2ccc(-n3ccc(OCc4ccsc4)cc3=O)cn12 ZINC000223419274 GI Annotated Anodyne Cc1c(C2CC2)nc2ccc(-n3ccc(OCc4cccs4)cc3=O)cn12 ZINC000223420644 GI Annotated Anodyne Cn1c(C2CC2)nc2ccc(-n3ccc(OCc4cccs4)cc3=O)cc21 ZINC000223453967 GI Annotated Anodyne Cn1c(C2CC2)nc2ccc(-n3ccc(OCc4ccsc4)cc3=O)cc21 ZINC000223469193 GI Annotated Anodyne CCCc1nc2ccc(-n3ccc(OCc4ccc(F)cc4)cc3=O)cc2n1C ZINC000223507606 GI Annotated Anodyne CC(C)C[C@@H](N)CNc1nc(-c2ccncc2)nc2sc3c(c12)CCCC3 ZINC000223659038 GI Annotated Anodyne CC(C)C[C@@H](N)COc1nc(-c2ccncc2)nc2sc3c(c12)CCCC3 ZINC000223660762 GI Annotated Anodyne Clc1cccc2sc3c(N[C@@H]4CCNC4)nc(-c4ccncc4)nc3c12 ZINC000223661573 GI Annotated Anodyne Cc1csc2c(NC[C@@H](N)Cc3ccccc3)nc(-c3ccncc3)nc12 ZINC000223665028 GI Annotated Anodyne N[C@H](CNc1nc(-c2ccncc2)nc2c(Cl)csc12)Cc1ccccc1 ZINC000223665114 GI Annotated Anodyne N[C@H](CNc1nc(-c2ccncc2Cl)nc2ccsc12)Cc1ccccc1 ZINC000223667537 GI Annotated Anodyne Cc1sc2c(NC[C@@H](N)Cc3ccccc3)nc(-c3ccncc3)nc2c1C ZINC000223667620 GI Annotated Anodyne CCCN1CCN(c2nc(-c3ccncc3)nc3sc4c(c23)CCCC4)CC1 ZINC000223668009 GI Annotated Anodyne CC(C)C[C@H](N)COc1nc(-c2ccncc2)nc2sc3c(c12)CCCC3 ZINC000223668074 GI Annotated Anodyne c1ccc(-c2cc3nc(-c4ccncc4)nc(N4CCCNCC4)c3s2)cc1 ZINC000223669068 GI Annotated Anodyne Clc1cccc2sc3c(N4CCCNCC4)nc(-c4ccncc4)nc3c12 ZINC000223669239 GI Annotated Anodyne C=Cc1csc2c(NC[C@@H](N)Cc3ccccc3)nc(-c3ccncc3)nc12 ZINC000223670367 GI Annotated Anodyne c1cc(-c2nc(N[C@@H]3CCNC3)c3sccc3n2)cc(NC2CCCCC2)n1 ZINC000223672808 GI Annotated Anodyne c1cc(-c2nc(OC[C@@H]3CCCCN3)c3c4c(sc3n2)CCCC4)ccn1 ZINC000223681163 GI Annotated Anodyne c1cc(-c2nc(OC[C@H]3CCCCN3)c3c4c(sc3n2)CCCC4)ccn1 ZINC000223682640 GI Annotated Anodyne CC#Cc1csc2c(NC[C@@H](N)Cc3ccccc3)nc(-c3ccncc3)nc12 ZINC000223684777 GI Annotated Mild CSCC[C@@H](N)CNc1nc(-c2ccncc2)nc2sc3c(c12)CCCC3 ZINC000223685123 GI Annotated Anodyne c1cc(-c2nc(NC[C@H]3CCCCN3)c3c4c(sc3n2)CCCC4)ccn1 ZINC000223689043 GI Annotated Anodyne CCC/C=C1/OC(=O)C2=C1CC[C@@H]1[C@H]2[C@@]23C=CCC[C@@H]2[C@]1(C(=O)CCC)OC3=O ZINC000223917931 GI Annotated Anodyne O=C(Nc1cc[nH]c(=O)c1)c1ccc(C(F)(F)F)cc1O[C@H]1C[C@H]2CC[C@H]1C2 ZINC000224199727 GI Annotated Anodyne NC(=O)Nc1ccc2nc(-c3ccc(C4(N)CCC4)cc3)c(-c3ccccc3)n2c1 ZINC000224256163 GI Annotated Anodyne Nc1cnc(-c2ccc(C3CCC3)c(Oc3ccc(C(=O)O)cn3)c2F)cn1 ZINC000224545695 GI Annotated Anodyne Nc1cnc(-c2ccc(C3CCC3)c(OCc3ccc(C(=O)O)o3)c2F)cn1 ZINC000224547738 GI Annotated Anodyne CNc1nc(C)cc(Oc2c(C3CCC3)ccc(-c3cnc(N)cn3)c2F)n1 ZINC000224547810 GI Annotated Anodyne Cc1cc(Oc2c(C3CCC3)ccc(-c3cnc(N)cn3)c2F)nc(N(C)C)n1 ZINC000224551424 GI Annotated Anodyne Nc1ccnc(Oc2c(C3CCC3)ccc(-c3cnc4c(c3)OCCN4)c2F)n1 ZINC000224556867 GI Annotated Anodyne COC(=O)c1ccc(Oc2c(C3CCC3)ccc(-c3cnc(N)cn3)c2F)nc1 ZINC000224565757 GI Annotated Anodyne Nc1cnc(-c2ccc(C3CCCCC3)c(Oc3nccc(N)n3)c2F)cn1 ZINC000224567253 GI Annotated Anodyne Cc1nc(Oc2c(C3CCC3)ccc(-c3cnc(N)cn3)c2F)cc(N(C)C)n1 ZINC000224575657 GI Annotated Anodyne Nc1cnc(-c2ccc(CC3CCCCC3)c(Oc3nccc(N)n3)c2F)cn1 ZINC000224576848 GI Annotated Anodyne Nc1ccnc(Oc2c(C3CCC3)ccc(-c3cc4cc[nH]c4nn3)c2F)n1 ZINC000224576914 GI Annotated Anodyne CSc1ccnc(Oc2c(C3CCC3)ccc(-c3cnc(N)cn3)c2F)n1 ZINC000224580052 GI Annotated Anodyne CC(C)(C)S(=O)(=O)c1ccccc1-c1ccc(-c2cnc(N)nc2)c(F)c1 ZINC000224701791 GI Annotated Anodyne Nc1cc(Sc2ccccc2-c2ccc(-c3cnc(N)nc3)c(F)c2)ncn1 ZINC000224707094 GI Annotated Anodyne Nc1cnc(-c2ccc(-c3ccccc3Sc3ncccn3)cc2F)cn1 ZINC000224712767 GI Annotated Anodyne Nc1ncc(-c2ccc(-c3ccccc3Sc3cnccn3)cc2F)cn1 ZINC000224718674 GI Annotated Anodyne CC(C)CNS(=O)(=O)c1ccccc1-c1ccc(-c2ccc(N)nc2)c(F)c1 ZINC000224727949 GI Annotated Anodyne Nc1ncc(-c2ccc(-c3ccccc3Sc3ncccn3)cc2F)cn1 ZINC000224730188 GI Annotated Anodyne CCS(=O)(=O)Nc1ccccc1-c1ccc(-c2cnc3[nH]ccc3n2)c(F)c1 ZINC000224733038 GI Annotated Anodyne Nc1cnc(-c2ccc(-c3ccccc3Sc3cnccn3)cc2F)cn1 ZINC000224736726 GI Annotated Anodyne Nc1ncc(-c2ccc(-c3ccccc3Sc3ncncc3N)cc2F)cn1 ZINC000224741356 GI Annotated Anodyne CC(C)(C)S(=O)(=O)c1ccccc1-c1ccc(-c2cnc(N)cn2)c(F)c1 ZINC000224741489 GI Annotated Anodyne Nc1cnc(Sc2ccccc2-c2ccc(-c3cnc(N)cn3)c(F)c2)cn1 ZINC000224746806 GI Annotated Anodyne Cc1nc(N)cc(Oc2ccccc2-c2ccc(-c3cnc(N)cn3)c(F)c2)n1 ZINC000224755219 GI Annotated Anodyne Nc1ncc(-c2ccc(-c3ccccc3Sc3ccnc(N)n3)cc2F)cn1 ZINC000224769849 GI Annotated Anodyne Nc1cnc(-c2ccc(-c3ccccc3Sc3ncncc3N)cc2F)cn1 ZINC000224773699 GI Annotated Anodyne Nc1cnc(Sc2ccccc2-c2ccc(-c3cnc(N)nc3)c(F)c2)cn1 ZINC000224774848 GI Annotated Anodyne Nc1ccnc(Sc2ccccc2-c2ccc(-c3cnc(N)nc3)c(F)c2)n1 ZINC000224775985 GI Annotated Anodyne CC(C)(C)NS(=O)(=O)c1ccccc1-c1ccc(-c2ccc(N)cn2)c(F)c1 ZINC000224787165 GI Annotated Anodyne COc1cnc(Oc2ccccc2-c2ccc(-c3cnc(N)nc3)c(F)c2)nc1 ZINC000224788567 GI Annotated Anodyne Nc1cncc(Sc2ccccc2-c2ccc(-c3cnc(N)nc3)c(F)c2)n1 ZINC000224789148 GI Annotated Anodyne Nc1cnc(-c2ccc(-c3ccccc3Sc3ccncn3)cc2F)cn1 ZINC000224789951 GI Annotated Anodyne Nc1cnc(-c2ccc(-c3ccccc3Sc3nccc(N)n3)cc2F)cn1 ZINC000224790879 GI Annotated Anodyne Nc1cnc(Sc2ccccc2-c2ccc(-c3cnc(N)nc3)c(F)c2)nc1 ZINC000224792048 GI Annotated Anodyne CC(C)(C)NS(=O)(=O)c1ccccc1-c1ccc(-c2ccc(N)nc2)c(F)c1 ZINC000224803234 GI Annotated Anodyne Nc1cnc(-c2ccc(-c3ccccc3Sc3ccnc(N)n3)cc2F)cn1 ZINC000224804680 GI Annotated Anodyne Nc1ncc(-c2ccc(-c3ccccc3Sc3ccncn3)cc2F)cn1 ZINC000224804945 GI Annotated Anodyne Nc1cnc(-c2ccc(-c3ccccc3S(=O)(=O)C3CCCC3)cc2F)cn1 ZINC000224805133 GI Annotated Anodyne Nc1cnc(-c2ccc(-c3ccccc3Sc3cncc(N)n3)cc2F)cn1 ZINC000224807759 GI Annotated Anodyne Cc1nc(N)cc(Oc2ccccc2-c2ccc(-c3cnc(N)nc3)c(F)c2)n1 ZINC000224808861 GI Annotated Anodyne N#Cc1cccc(COc2ccccc2-c2ccc(-c3cnc(N)cn3)c(F)c2)n1 ZINC000224809049 GI Annotated Mild COc1cnc(Oc2ccccc2-c2ccc(-c3cnc(N)cn3)c(F)c2)nc1 ZINC000224815918 GI Annotated Anodyne N#Cc1cccnc1COc1ccccc1-c1ccc(-c2cnc(N)cn2)c(F)c1 ZINC000224816080 GI Annotated Mild Nc1cnc(Sc2ccccc2-c2ccc(-c3cnc(N)cn3)c(F)c2)nc1 ZINC000224824908 GI Annotated Anodyne CCOc1ccccc1C(=O)Nc1ccccc1C(=O)Nc1cccc(C#N)c1 ZINC000224875730 GI Annotated Anodyne O=C(Nc1ccccc1C(=O)Nc1cccc(C(F)(F)F)c1)c1ccno1 ZINC000224880154 GI Annotated Anodyne Cc1ccc2nc(C)n(C3CCN(C(=O)Cc4ccc(F)c(F)c4)CC3)c2c1 ZINC000022668460 GI Annotated Anodyne COc1cc(CN2CCC[C@@H](N3CCc4ccccc4C3)C2)c(Cl)cc1O ZINC000022909979 GI Annotated Anodyne COc1cc(CN2CCC[C@H](N3CCc4ccccc4C3)C2)c(Cl)cc1O ZINC000022909981 GI Annotated Anodyne CCN1CCN([C@@H]2Cn3cccc3Sc3ccc(Br)cc32)CC1 ZINC000022925271 GI Annotated Anodyne CCN1CCN([C@H]2Cn3cccc3Sc3ccc(Br)cc32)CC1 ZINC000022925275 GI Annotated Anodyne COc1ccc([C@@H](N)[C@@H](N)c2c(Cl)cc(OC)cc2Cl)c(Cl)c1 ZINC000022931051 GI Annotated Anodyne CC[C@H](C)[C@@H](CN[C@H](C)CNC)NCCC(c1ccccc1)c1ccccc1 ZINC000022938839 GI Annotated Anodyne CCC[C@@H](CNC)NC[C@H](Cc1ccccc1)NCCCCc1ccccc1 ZINC000022938891 GI Annotated Anodyne CC(C)CN1CCCN(CCn2ccc3ccc(Br)cc32)CC1 ZINC000022939944 GI Annotated Anodyne CC(C)(C)CN1CCCN(CCn2ccc3ccc(Br)cc32)CC1 ZINC000022939947 GI Annotated Anodyne Brc1ccc2ccn(CCN3CCCN(C4CCCC4)CC3)c2c1 ZINC000022939958 GI Annotated Anodyne COc1ccccc1-c1ccnc2cc(S(=O)(=O)Nc3nccs3)ccc12 ZINC000225058424 GI Annotated Anodyne COc1ccccc1-c1nccc2cc(S(=O)(=O)Nc3nccs3)ccc12 ZINC000225117822 GI Annotated Anodyne COc1cccc(Cc2noc(-c3cc(Cl)ccc3OC3CCNCC3)n2)c1 ZINC000225196341 GI Annotated Anodyne O=C(O)c1cccc(-n2c(/C=C/c3ccc(F)cc3)nc3ccccc3c2=O)c1 ZINC000225603211 GI Annotated Anodyne COc1ccc(F)cc1-c1ccnc2[nH]c([C@@H]3CCN(C4CCOCC4)C3)cc12 ZINC000226056193 GI Annotated Anodyne COc1ccc(F)cc1-c1ccnc2[nH]c([C@H]3CCN(C4CCOCC4)C3)cc12 ZINC000226056204 GI Annotated Anodyne COc1ccc(F)cc1-c1ccnc2[nH]c(C3CN(Cc4ccncc4)C3)cc12 ZINC000226073790 GI Annotated Anodyne C1=C(c2cc3c(-c4cncc(NCc5ccccc5)n4)ccnc3[nH]2)CCNC1 ZINC000226078901 GI Annotated Anodyne COc1ccc(F)cc1-c1ccnc2[nH]c(C3CN(CC4CCOCC4)C3)cc12 ZINC000226094608 GI Annotated Anodyne CC(C)(N)c1cn(C2CCN(Cc3sc4ccccc4c3Cl)CC2)nn1 ZINC000023129833 GI Annotated Anodyne Fc1ccc(Nc2ncc(CN3CCC[C@@H](Cn4ccnc4)C3)s2)c(F)c1 ZINC000023340430 GI Annotated Anodyne Fc1ccc(Nc2ncc(CN3CCC[C@H](Cn4ccnc4)C3)s2)c(F)c1 ZINC000023340432 GI Annotated Anodyne Cc1ccc(C[C@H](N)[C@H]2c3[nH]c4ccc(Br)cc4c3CCN2C)cc1 ZINC000023377885 GI Annotated Anodyne C[C@H](c1nccs1)N(C)Cc1ccc(-c2nc(-c3ccoc3)cc(=O)[nH]2)cc1 ZINC000023379920 GI Annotated Anodyne C[C@@H](c1nccs1)N(C)Cc1ccc(-c2nc(-c3ccoc3)cc(=O)[nH]2)cc1 ZINC000023379922 GI Annotated Anodyne CN(C)[C@@H](CNC1CCN(c2cccc(-c3ccco3)c2)CC1)c1ccccn1 ZINC000023399337 GI Annotated Anodyne CN(C)[C@H](CNC1CCN(c2cccc(-c3ccco3)c2)CC1)c1ccccn1 ZINC000023399339 GI Annotated Anodyne C=C1[C@@H](OC(=O)/C=C(\C)CC)C[C@H](C(C)C)[C@@H]2[C@@H]1CC(=O)[C@H]2[C@@H](C)OC(C)=O ZINC000230102107 GI Annotated Mild in-man O=C(O)c1nc2ccccc2c2[nH]c3c(I)cccc3c12 ZINC000230506524 GI Annotated Bother in-vitro Cc1ncc2c(c1-c1noc(-c3ccsc3)n1)CCN(Cc1ccccn1)C2 ZINC000023506532 GI Annotated Anodyne COc1cc(/C=C2\COc3ccc(Br)cc3C2=O)cc(OC)c1 ZINC000023609288 GI Annotated Mild CCSc1ccc(C(=O)N2CCC[C@@H]2c2ccc(C(=O)NC)s2)s1 ZINC000023620173 GI Annotated Anodyne CCSc1ccc(C(=O)N2CCC[C@H]2c2ccc(C(=O)NC)s2)s1 ZINC000023620176 GI Annotated Anodyne O=C(Nc1ccc(Cl)cc1F)c1cc(I)ccc1O ZINC000236574400 GI Annotated Anodyne CC[C@@H](Br)[C@H]1CC=CC[C@H]2O[C@H](C=C=CBr)C[C@@H]2O1 ZINC000238730644 GI Annotated Reactive CC(=O)O[C@H]1C[C@H]2[C@@H]3CC[C@H]4[C@H](OC(C)=O)CCC[C@]4(C)[C@H]3C(=O)C[C@]2(C)C1 ZINC000238730755 GI Annotated Anodyne CC(=O)O[C@H]1CC[C@H]2C(=O)c3occ(C)c3[C@@H](OC(=O)C(C)C)[C@]2(C)[C@H]1C ZINC000238730863 GI Annotated Anodyne C=C(CCCC(C)=O)[C@@H]1[C@H](OC(C)=O)OC=C2[C@H]1CC(=O)O[C@@H]2CC=C(C)C ZINC000238731034 GI Annotated Mild CCC/C=C1\OC(=O)C2=C1CC[C@@H]1[C@H]3C4=C(/C(=C/CCC)OC4=O)[C@H](C[C@@H]3O)[C@H]21 ZINC000238731111 GI Annotated Anodyne C/C=C(/C)C(=O)O[C@@H]1C[C@H](C)[C@H](O)C[C@H]1[C@H](C)C[C@H](C=C(C)C)OC(C)=O ZINC000238731376 GI Annotated Anodyne COC(=O)C[C@@]1(C)CC[C@]2(O1)C(C(=O)OC)=CC[C@@H]1C(C)(C)CCC[C@]12C ZINC000238731500 GI Annotated Anodyne CC/C=C\C[C@@H](/C=C/[C@H]1C=CC(=O)[C@@H]1C/C=C\CCCC(=O)OC)OC(C)=O ZINC000238731659 GI Annotated Mild CC(=O)O/C=C(/C=C/OC(C)=O)[C@](C)(C/C=C(\C)C#CCC(C)C)OC(C)=O ZINC000238732022 GI Annotated Mild COC(=O)C1=CC[C@H]2[C@](C)(CCC=C(C)C)[C@@H](Cl)C[C@@H]3O[C@H](O)[C@H]1[C@@]32C ZINC000238732216 GI Annotated Reactive CC(=O)O[C@H]1C[C@]2(C)C(C)=C(O)C(=O)C[C@@H]2[C@@](C)(CC[C@@H](C)CC(=O)O)[C@@H]1C ZINC000238732232 GI Annotated Mild C/C=C\C1=CC2=CC(=O)[C@@]3(C)OC(=O)[C@@H](C(=O)CCCCCCC)[C@@H]3C2=CO1 ZINC000238732300 GI Annotated Mild CC(=O)Oc1ccc2cc1-c1cc(ccc1OC(C)=O)CC(=O)/C=C/CCC2 ZINC000238732316 GI Annotated Mild COc1cc2c(cc1O)c1c(c3c(C)c(OC)cc(O)c32)CN2CCC[C@@H]2C1 ZINC000238732367 GI Annotated Bother CC(=O)OC/C(C)=C\CC/C(=C/CC/C(C)=C/CCC1=CCOC1=O)C(=O)O ZINC000238732492 GI Annotated Anodyne C=C1CCCC(C)(C)[C@@H]2CC[C@@](C)([C@H]3[C@@H]4CC(=O)O[C@H]3O[C@H]4OC(C)=O)[C@H]12 ZINC000238732517 GI Annotated Mild C[C@@](Br)(CCl)[C@@H]1C[C@H](Cl)[C@](C)(/C=C/Br)O1 ZINC000238733543 GI Annotated Reactive CC(=O)O[C@@H]1O[C@@H]2OC(=O)C[C@H]1[C@@H]2[C@]1(C)CCC2=C(CCCC2(C)C)[C@H]1C ZINC000238733808 GI Annotated Anodyne CC(=O)O[C@H]1C[C@H]2[C@@H]3CC[C@H]4C(=O)CCC[C@]4(C)[C@H]3[C@H](OC(C)=O)C[C@]2(C)C1 ZINC000238733891 GI Annotated Anodyne C=C(C)[C@H]1C[C@]2(C)[C@@H](C)CC(=O)C[C@@H]2[C@H](OC(=O)C=C(C)C)[C@@H]1OC(C)=O ZINC000238733927 GI Annotated Mild CC(C)(C#N)[C@@H]1CC[C@](C)([C@H]2CC[C@](C)(C#N)[C@H]3CC[C@](C)(C#N)[C@@H](O)[C@@H]32)O1 ZINC000238733942 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)CCC=C(COC(=O)/C=C\c4ccccc4)[C@H]3C[C@H]12 ZINC000238734367 GI Annotated Mild CC(C)[C@@H]1CC[C@]2(C)[C@@H](O)CC[C@@]34CO[C@@](/C=C/c5ccccc5)(O[C@H]1[C@H]32)O4 ZINC000238734503 GI Annotated Anodyne CC1=C(C)[C@@H]2CC=C(C=O)[C@H](C=O)[C@@]2(C)[C@H](OC(=O)/C=C/c2ccccc2)C1 ZINC000238734527 GI Annotated Reactive CC[C@@H](C)/C=C(C)/C=C/C1=CC2=C(Cl)C(=O)[C@](C)(OC(C)=O)C(=O)[C@H]2CO1 ZINC000238736153 GI Annotated Mild C[C@H](CC[C@@]1(C)C2=CCCC(C)(C)[C@@H]2CC[C@H]1C)CC(=O)OC[C@H](O)CO ZINC000238736212 GI Annotated Anodyne CC(=O)O[C@@H]1O[C@H]2OC(=O)C[C@@H]1[C@@H]2[C@]1(C)CC[C@@H]2C(C)(C)CCC[C@@]23C[C@@H]13 ZINC000238736475 GI Annotated Anodyne [C-]#[N+]C(=C\C1=C[C@H](O)[C@@H](O)CC1)/C(=C/[C@@H]1CC[C@@H](OC(=O)C=C(C)C)CC1)[N+]#[C-] ZINC000238736918 GI Annotated Reactive CC(=O)O[C@H]1C[C@](C)(Cl)[C@@H](Br)C[C@]12C(C)(C)[C@H]1CC[C@]2(C)O1 ZINC000238736953 GI Annotated Reactive CC(=O)O[C@@H]1O[C@H]2OC(=O)C[C@@H]1[C@@H]2[C@]1(C)CC[C@H]2C(=CCCC2(C)C)[C@H]1C ZINC000238737435 GI Annotated Anodyne COc1cc(C(=O)O[C@H]2CC(C)=CC[C@]3(C)CC[C@](O)(C(C)C)[C@H]23)ccc1O ZINC000238738100 GI Annotated Anodyne COc1cc2c(=O)c(-c3ccc4c(c3)OCO4)coc2c2c1C=CC(C)(C)O2 ZINC000238738144 GI Annotated Anodyne CO[C@@H]1C[C@]2(CC[C@]3(O2)[C@@H](C)C[C@H](OC(C)=O)[C@@H]2C(C)(C)CCC[C@]23C)CO1 ZINC000238738376 GI Annotated Anodyne C[C@]1(C(=O)O)CCC[C@]2(C)[C@@H]3CC[C@](C)(CCOS(=O)(=O)O)C=C3C=C[C@H]12 ZINC000238738554 GI Annotated Anodyne C=C(CC(=O)[C@H](C)CCC[C@@]1(CO)O[C@@H]1CC/C(C)=C\COC(C)=O)C(C)C ZINC000238738623 GI Annotated Mild C=C(C)[C@H]1C[C@]2(C)[C@@H](C)CC(=O)C[C@@H]2[C@H](OC(=O)C/C(C)=C/C)[C@@H]1OC(C)=O ZINC000238738690 GI Annotated Mild CC(C)[C@@H]1C[C@H](O)[C@@]2(C)CCC[C@](C)(O)[C@@H]2[C@@H]1OC(=O)/C=C/c1ccccc1 ZINC000238739035 GI Annotated Anodyne CO[C@H]1C[C@]2(CC[C@]3(O2)[C@@H](C)C[C@H](OC(C)=O)[C@@H]2C(C)(C)CCC[C@]23C)CO1 ZINC000238739190 GI Annotated Anodyne C/C=C(/C)C(=O)O/C=C/Cc1cc(OC)c(OC(=O)CC(C)C)c(OC)c1 ZINC000238739338 GI Annotated Anodyne COc1ccc([C@@H]2CC(=O)c3c(OC)cc(OC)c(/C=C/C(C)(C)O)c3O2)cc1 ZINC000238739745 GI Annotated Anodyne COC(=O)/C=C(\CC[C@@H]1C(=O)C=C[C@@H]2C(C)(C)CCC[C@@]12C)COC(C)=O ZINC000238740140 GI Annotated Mild COC(=O)C[C@@]1(C)CC[C@@]2(O1)C(C)=C[C@H](OC=O)[C@H]1C(C)(C)CCC[C@@]12C ZINC000238740321 GI Annotated Anodyne CC[C@H](C)/C=C(C)/C=C/C1=CC2=CC(=O)[C@]3(C)OC(=O)C(C(C)=O)=C3C2=CO1 ZINC000238740373 GI Annotated Mild CO[C@@]1(CO)C[C@@]23CC[C@@H]4C(C)(C)[C@H](OC(C)=O)CC[C@@]4(C)[C@@H]2CC[C@@H]1C3 ZINC000238740542 GI Annotated Anodyne CC(=O)OCC1=CC[C@@H]2C(C)(C)CCC[C@@]2(C)[C@]12CC[C@](C)(CC(=O)O)O2 ZINC000238740829 GI Annotated Anodyne CC[C@H](Br)[C@H]1CC=CC[C@H]2O[C@H](C=C=CBr)C[C@@H]2O1 ZINC000238740982 GI Annotated Reactive CCC[C@H](C)[C@H](OC(=O)/C=C/c1ccccc1)[C@H](C)[C@H](O)C/C=C/C=C\C(N)=O ZINC000238741295 GI Annotated Anodyne CC(C)[C@@H]1CC[C@@]2(C)CC[C@H](O)[C@H](C=O)[C@@H]2[C@@H]1OC(=O)/C=C/c1ccccc1 ZINC000238741554 GI Annotated Mild C/C=C(/C)C(=O)O[C@@H]1c2c(C)coc2C(=O)[C@H]2[C@@H](OC(C)=O)CC[C@H](C)[C@@]12C ZINC000238741649 GI Annotated Anodyne C=C1C(=O)O[C@H](CCCCCCCCCCCCCOC(C)=O)[C@H]1C(=O)O ZINC000238741864 GI Annotated Mild CC[C@@H](C)C(=O)c1c(O)c(C)c(O)c2c1O[C@@](C)(CCC=C(C)C)[C@H](O)C2 ZINC000238741923 GI Annotated Anodyne CC(C)N[C@@H]1c2cc(C(C)C)c(O)c(O)c2[C@@]23CCCC(C)(C)[C@@H]2[C@@H]1OC3=O ZINC000238742431 GI Annotated Clean CC(C)[C@H]1[C@H](O)[C@H]2C[C@@H]3[C@H]4[C@@](C)(O)CC[C@@H](Br)[C@]4(C)CC[C@]31C2 ZINC000238742433 GI Annotated Reactive COC(=O)C1=CC=C[C@H]2[C@@]1(COC(C)=O)CC[C@@H](C)[C@]2(C)CCc1ccoc1 ZINC000238742489 GI Annotated Anodyne COC1(OC)C(C(C)C)=C(O)C(=O)C2=C1[C@@H]1C[C@@H]3C(C)(C)CCC[C@@]3(C2)O1 ZINC000238742660 GI Annotated Mild CC(=O)CC[C@@H]1[C@H]2[C@H](O)[C@H](C(C)C)[C@H](OC(=O)/C=C\c3ccccc3)C[C@@]12C ZINC000238742667 GI Annotated Anodyne CC(=O)O[C@H]1CC[C@@]2(C)[C@H](CCC3=C[C@]4(C(C)C)CC[C@@]32OO4)[C@]1(C)C(=O)O ZINC000238742683 GI Annotated Reactive CO[C@H]1C[C@@]2(CC[C@]3(O2)[C@@H](C)C[C@H](OC(C)=O)[C@@H]2C(C)(C)CCC[C@]23C)CO1 ZINC000238742852 GI Annotated Anodyne CC(C)[C@H]1[C@H]2C[C@@H]3[C@H]4[C@@](C)(O)CC[C@@H](Br)[C@]4(C)CC[C@@]13C[C@H]2O ZINC000238743144 GI Annotated Reactive CC(C)[C@H]1C[C@@H](O)[C@@H]2C[C@]13CC[C@@]1(C)[C@H](Br)CC[C@](C)(O)[C@@H]1[C@@H]23 ZINC000238743153 GI Annotated Reactive CC(=O)O[C@H]1C(=O)C=C(C)[C@@H](CCC2=CC[C@H](c3ccoc3)OC2=O)C1(C)C ZINC000238743221 GI Annotated Mild CC1=C(C)[C@@H]2CC=C(C=O)[C@H](C=O)[C@@]2(C)[C@H](OC(=O)/C=C\c2ccccc2)C1 ZINC000238743381 GI Annotated Reactive C/C=C(/C)C(=O)O[C@H]1CC[C@]2(C)CC(=O)C(=C(C)C)C[C@H]2[C@@]1(C)OC(C)=O ZINC000238743542 GI Annotated Mild CC1=C2CC[C@H](C)[C@]2(c2c(O)c3c(C)cccc3oc2=O)[C@@](O)(CC(C)C)C1=O ZINC000238743962 GI Annotated Mild CC(C)C1=CC[C@@]2(C)[C@H](O)C[C@@H](O)[C@](C)(OC(=O)/C=C/c3ccccc3)[C@@H]2C1 ZINC000238744755 GI Annotated Anodyne CC/C=C(\C)[C@H](O)[C@@H](C)/C=C(C)/C=C/C=C\C=C\C=C(/C)C(=O)N[C@H](C)CO ZINC000238745222 GI Annotated Anodyne C/C=C(/C)C(=O)O/C=C/Cc1cc(OC)c(OC(=O)[C@@H](C)CC)c(OC)c1 ZINC000238745807 GI Annotated Anodyne COC(=O)C[C@@]1(C)CC[C@@]2(O1)C(C)=CC[C@@H]1[C@]2(C)CCC[C@@]1(C)C(=O)OC ZINC000238745829 GI Annotated Anodyne CC(=O)O[C@@H]1[C@H](C(C)C)[C@@H](OC(=O)C=C(C)C)C/C(C)=C/CC[C@]2(C)O[C@H]12 ZINC000238746125 GI Annotated Anodyne CC1=C2[C@H](OC(=O)/C=C/c3ccccc3)[C@H](C(C)C)CC[C@@]2(C)C(=O)C[C@@H]1O ZINC000238746219 GI Annotated Anodyne COc1c(-c2cc3c(OC)cc(O)cc3oc2=O)ccc2c1CCC(C)(C)O2 ZINC000238746322 GI Annotated Anodyne C/C=C(/C)C(=O)O[C@H]1C/C=C(\C)CC[C@@H](C(C)C)[C@@H](OC(C)=O)[C@@H]2O[C@]12C ZINC000238746369 GI Annotated Anodyne C/C=C/C1=CC2=C[C@@H]3[C@@H](C(=O)CCCCCCC)C(=O)O[C@@]3(C)C(=O)C2=CO1 ZINC000238746404 GI Annotated Mild C=CC(C)(C)c1[nH]c2cc(CC=C(C)C)ccc2c1/C=C1/NC(=O)[C@@H](C)NC1=O ZINC000238746743 GI Annotated Mild C/C=C(/C)C(=O)O[C@H]1C/C(C)=C/CC[C@]2(C)O[C@@H]2[C@H](OC(C)=O)[C@@H]1C(C)C ZINC000238746858 GI Annotated Anodyne CC[C@H]1O[C@@H]2C[C@H](C=C=CBr)O[C@H]2C/C=C\C[C@@H]1Br ZINC000238747000 GI Annotated Reactive C/C=C(/C)OC(=O)[C@H](c1cc(OC)c2c(c1)OCO2)[C@@H](C)C(=O)O/C(C)=C\C ZINC000238747362 GI Annotated Anodyne C/C=C(/C)C(=O)O[C@@H]1CC[C@]2(C)CC(=O)[C@@H](C(C)C)C[C@@H]2[C@]1(C)OC(C)=O ZINC000238747603 GI Annotated Anodyne C=CCOc1c(OC)cc([C@@H](C)Cc2cc(OC)c3c(c2)OCO3)cc1OC ZINC000238748251 GI Annotated Mild C/C=C(/C)C(=O)O[C@@H](C)[C@@H](OC(=O)/C(C)=C\C)c1cc2c(c(OC)c1)COC2 ZINC000238748277 GI Annotated Anodyne C=C1[C@@H](OC(=O)/C=C(\C)CC)C[C@H](C(C)C)[C@@H]2[C@@H]1CC(=O)[C@H]2[C@H](C)OC(C)=O ZINC000238749037 GI Annotated Mild CC(=O)O[C@H]1CC[C@@]2(C)[C@H](CC/C(C)=C/C(=O)O)C(C)=CC[C@@H]2[C@]1(C)CO ZINC000238749049 GI Annotated Anodyne Cn1c(=O)c2cc3ccc4c(c3cc2c2ccc3cc5c(cc3c21)OCO5)OCO4 ZINC000238749320 GI Annotated Bother COc1cc2cc(OC)c3c(c2cc1OC)N(C)Cc1c-3ccc(OC)c1OC ZINC000238749386 GI Annotated Anodyne CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@H]2CC[C@@H](OC(=O)C=C(C)C)[C@H](C)[C@@]12C ZINC000238749425 GI Annotated Anodyne C=C1C[C@H](O)/C=C(\C)CC[C@@H]2/C(=C/C=C/C(C)(C)OC)[C@@H](OC)O[C@H](OC)[C@@H]12 ZINC000238749450 GI Annotated Mild CC(=O)OC[C@]1(C)CCC[C@@H]2C1=CC(=O)[C@H](C)[C@@]2(C)CC[C@@H](C)CC(=O)O ZINC000238749472 GI Annotated Mild CC(=O)O[C@H]1O[C@@H]2OC(=O)C[C@@H]2[C@@H]1[C@]1(C)CC[C@@H]2C(C)(C)CCC[C@@]23C[C@@H]13 ZINC000238749705 GI Annotated Anodyne COc1ccc(C2=C(c3ccc(OC)c(OC)c3)[C@@H]3CCCN3CC2)cc1OC ZINC000238750011 GI Annotated Anodyne CC(=O)O[C@H]1O[C@@H]2OC(=O)[C@@H](C)C3=C2[C@@H]1CC[C@H]3[C@]1(C)CCCC(C)(C)C1 ZINC000238750171 GI Annotated Anodyne C=C(C[C@@H](O)/C(C)=C/CC[C@]1(C)O[C@@H]1CC[C@@]1(C)O[C@@H]1COC(C)=O)C(C)C ZINC000238750177 GI Annotated Mild CC(C)[C@@H]1CC[C@@]2(C)CC[C@H](O)[C@@H](C=O)[C@@H]2[C@@H]1OC(=O)/C=C/c1ccccc1 ZINC000238750410 GI Annotated Mild CN1c2c(ccc3cc4c(cc23)OCO4)-c2ccc3c(c2[C@@H]1CC=O)OCO3 ZINC000238750470 GI Annotated Mild COc1c(O)ccc2c1[C@@H](CC=O)N(C)c1c-2ccc2cc3c(cc12)OCO3 ZINC000238750472 GI Annotated Mild C/C=C(\C)C(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]2(O)[C@@H](Cl)CC[C@H](C)[C@@]12C ZINC000238750503 GI Annotated Reactive C/C(=C\COc1ccc2oc3cc(O)cc(O)c3c(=O)c2c1)C/C=C/C(C)(C)O ZINC000238750635 GI Annotated Bother CCOC(=O)c1cc2c(c3c1c([N+](=O)[O-])cc1ccc(OCC)cc13)OCO2 ZINC000238750688 GI Annotated Bother CC(C)(Cl)[C@H](Br)C[C@H](Br)[C@](C)(Cl)[C@H]1CO1 ZINC000238750828 GI Annotated Reactive CN[C@H](CCSC)c1nccc2c1[nH]c1ccc(O)c(Br)c12 ZINC000238750921 GI Annotated Anodyne CCC[C@@H](CC(=O)O)C1=CC(C)(C)Oc2cc(O)c3c(c21)O[C@@H](C)[C@@H](C)C3=O ZINC000238750978 GI Annotated Anodyne C=C(C)[C@H](O)CC/C(C)=C/COc1cc(O)c2c(=O)c3cc(O)ccc3oc2c1 ZINC000238751251 GI Annotated Mild C/C=C(\C)C(=O)O[C@]1(C)C(=O)C[C@@H]2[C@H]1CC[C@]1(C)[C@H](OC(C)=O)CC=C(C)[C@@H]21 ZINC000238751702 GI Annotated Anodyne C/C=C(/C)C(=O)O[C@H]1C/C=C(\C)CC[C@@H](C(C)C)[C@@H](OC(C)=O)[C@H]2O[C@]12C ZINC000238751779 GI Annotated Anodyne C=C/C(C)=C\C[C@]1(C(=O)O)[C@H]2CC[C@H]3O[C@@]3(C)[C@]2(C)[C@@H](OC(C)=O)C[C@H]1C ZINC000238751812 GI Annotated Anodyne CO[C@@H]1C[C@H](CC[C@@]2(C)[C@H](C)[C@H](O)C[C@@]3(C)C(COC(C)=O)=CCC[C@@H]32)CO1 ZINC000238751869 GI Annotated Anodyne COC(=O)[C@@]1(C)CCC[C@@]2(C)[C@H]1CC[C@]13C=C(C(C)(C)OO)[C@H](C[C@H]21)OO3 ZINC000238751972 GI Annotated Reactive C[C@H](CC[C@@]1(C)C2=CCCC(C)(C)[C@@H]2CC[C@H]1C)CC(=O)OC(CO)CO ZINC000238752007 GI Annotated Anodyne CC(=O)OC[C@]1(C)[C@@H](O)CC[C@@]2(C)[C@H](CC/C(C)=C/C(=O)O)C(C)=CC[C@@H]21 ZINC000238752463 GI Annotated Anodyne CC(C)C1=CC[C@@]2(C)[C@H](O)[C@@H](O)C[C@](C)(OC(=O)/C=C/c3ccccc3)[C@@H]2C1 ZINC000238752762 GI Annotated Anodyne C=C(C)[C@@H]1CC/C(C)=C/C[C@H](OC(=O)/C(C)=C\C)[C@@]2(C)O[C@@H]2[C@@H]1OC(C)=O ZINC000238752857 GI Annotated Mild C/C=C(/C)C(=O)O[C@H]1C/C(C)=C/CC[C@]2(C)O[C@H]2[C@H](OC(C)=O)[C@H]1C(C)C ZINC000238752878 GI Annotated Anodyne C=C1C[C@H](OC(=O)C=C(C)C)[C@@H]2[C@](C)(CC[C@@]2(O)C(C)C)[C@@H]2OC(C)(C)O[C@H]12 ZINC000238752902 GI Annotated Mild CC(=O)O[C@@H]1[C@H]2c3oc(-c4ccccc4)cc(=O)c3-c3ccoc3[C@H]2OC1(C)C ZINC000238753166 GI Annotated Anodyne CC1=C(C(=O)CC(C)C)O[C@@H]([C@@]2(O)Oc3cccc(C)c3C2=O)[C@@H]2[C@@H](C)CC[C@H]12 ZINC000238753524 GI Annotated Mild C=C1CC[C@H]2[C@@](C)(C(=O)OC)CCC[C@@]2(C)[C@@H]1CCC1=C[C@@H](OC)OC1=O ZINC000238753574 GI Annotated Mild C/C=C/C1=CC2=CC(=O)[C@@]3(C)OC(=O)[C@@H](C(=O)CCCCCCC)[C@@H]3C2=CO1 ZINC000238753634 GI Annotated Mild CC1=C[C@H](OC(=O)/C=C/c2ccc(O)cc2)[C@@H]2[C@](C)(CC[C@@]2(O)C(C)C)CC1=O ZINC000238753910 GI Annotated Mild CC(C)[C@@H]1CC[C@]2(C)[C@@H]([C@@H]1OC(=O)/C=C/c1ccccc1)[C@@](C)(O)CC[C@H]2O ZINC000238754144 GI Annotated Anodyne C/C=C(/C)C(=O)O[C@@H]1CC[C@]2(C)CC(=O)C(=C(C)C)C[C@H]2[C@]1(C)OC(C)=O ZINC000238754509 GI Annotated Mild CC(=O)OCC1=CC[C@@](C)(c2cc(Br)c(C)cc2OC(C)=O)[C@H]1C ZINC000238754685 GI Annotated Anodyne CC(=O)CC[C@@H]1[C@H]2[C@H](O)[C@H](C(C)C)[C@H](OC(=O)/C=C/c3ccccc3)C[C@@]12C ZINC000238754799 GI Annotated Anodyne C=C(C)[C@H]1C[C@H](OC(=O)CC(C)C)[C@]2(C1)C(C)=CC(=O)[C@@H](OC(C)=O)[C@@H]2C ZINC000238754932 GI Annotated Mild CC1(C)[C@H](Br)CC[C@@]2(C)O[C@H](CBr)[C@@]3(C)O[C@H]3C[C@H]12 ZINC000238755001 GI Annotated Reactive CC(=O)O[C@H]1C(=O)C=C(C)[C@H](CCC2=CC[C@H](c3ccoc3)OC2=O)C1(C)C ZINC000238755033 GI Annotated Mild C=C1[C@@H](C)C[C@@H](OC(=O)/C=C\c2ccccc2)[C@@]2(C)[C@H]1CC=C(C=O)[C@@H]2C=O ZINC000238755174 GI Annotated Reactive CCC/C=C1\OC(=O)C2=C1CC[C@@H]1[C@H]3C4=C(/C(=C/CCC)OC4=O)[C@H](C[C@H]3O)[C@H]21 ZINC000238755763 GI Annotated Anodyne C/C=C(/C)C(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@H]2CC[C@@H](OC(C)=O)[C@H](C)[C@@]12C ZINC000238756097 GI Annotated Anodyne CC(=O)OC[C@H](C)CCC[C@@H](C)C1=CC[C@]2(C)OC3=C(C[C@H]12)C(=O)[C@@H](O)CC3 ZINC000238756118 GI Annotated Mild COc1ccc(C(=O)O[C@H]2CC(C)=CC[C@@]3(C)CC[C@@](O)(C(C)C)[C@H]23)cc1O ZINC000238756318 GI Annotated Anodyne CCCCC[C@H]1/C=C/[C@H]2[C@H](OC(C)=O)CC(=O)[C@@H]2C/C=C\CCCC(=O)O1 ZINC000238756837 GI Annotated Anodyne CC(=O)Oc1c(CC=C(C)C)c(O)c(C(C)=O)c(OC(C)=O)c1CC=C(C)C ZINC000238756883 GI Annotated Anodyne C=C1[C@H](O)C[C@H]2C(C)(C)[C@@H](Br)CC[C@]2(C)O[C@H]1CBr ZINC000238756962 GI Annotated Reactive CC1=C(C(=O)CC(C)C)O[C@@H]([C@]2(O)Oc3cccc(C)c3C2=O)[C@@H]2[C@@H](C)CC[C@H]12 ZINC000238757107 GI Annotated Mild C=C(C)[C@@H]1CC/C(C)=C/C[C@H](OC(=O)/C(C)=C/C)[C@@]2(C)O[C@@H]2[C@@H]1OC(C)=O ZINC000238757351 GI Annotated Mild CC[C@@H](C)C(=O)O[C@H]1CC[C@]2(C)CC(=O)C(=C(C)C)C[C@H]2[C@]1(C)OC(C)=O ZINC000238757688 GI Annotated Mild C/C=C\C1=CC2=C[C@@H]3[C@@H](C(=O)CCCCCCC)C(=O)O[C@@]3(C)C(=O)C2=CO1 ZINC000238757721 GI Annotated Mild C=C1[C@@H]2CC[C@@H]3[C@@]45CCC[C@](C)(CN6CCO[C@@H]64)[C@H]5CC[C@]3(C2)[C@@H]1OC(C)=O ZINC000238757763 GI Annotated Mild COC(=O)/C=C(\CC[C@@H]1[C@@H](C=O)C=C[C@@H]2C(C)(C)CCC[C@@]12C)COC(C)=O ZINC000238757929 GI Annotated Mild CC(=O)OC[C@H](C)/C=C\C(=O)O[C@@H]1CCC2=CC(=O)C(=C(C)C)C[C@]2(C)[C@H]1C ZINC000238759193 GI Annotated Mild CCCOC(=O)[C@@H]1C(C)=CC[C@@H]2[C@@]1(C)CC[C@H]1C(C)(C)[C@H](O)[C@@H](O)C[C@]21C ZINC000238759409 GI Annotated Anodyne C/C=C/C=C/C(=O)CC1=C(C)C(=O)[C@@]2(C)OC(=O)[C@]1(C)[C@H]2CC(=O)CC/C=C/C ZINC000238759555 GI Annotated Mild C=C1[C@@H]2CC[C@H]3[C@@]45CCC[C@](C)(CN6CCO[C@H]64)[C@H]5CC[C@]3(C2)[C@@H]1OC(C)=O ZINC000238759820 GI Annotated Mild C=C(C)[C@@H]1CC[C@](C)(O)[C@H]2Oc3c(C(=O)OC)c(CCCCC)cc(O)c3[C@H]21 ZINC000238759836 GI Annotated Mild COC(=O)C[C@H](C)CC[C@H]1C(COC(C)=O)=CC[C@H]2C(C)(C)[C@@H](O)CC[C@]12C ZINC000238760005 GI Annotated Anodyne C#C/C=C/C/C(Br)=C1\C[C@H]2O[C@@H](CC)[C@H](Br)C[C@H]2O1 ZINC000238760064 GI Annotated Reactive CC(=O)OC/C=C(/C)CC[C@H]1O[C@]1(CO)CCC[C@@H](C)C(=O)/C=C(\C)C(C)C ZINC000238760261 GI Annotated Mild CC(=O)OC/C(C)=C/CC[C@H](C)C1=CC[C@]2(C)OC3=C(C[C@H]12)C(=O)[C@@H](O)CC3 ZINC000238760594 GI Annotated Mild CC[C@H](C)C[C@@H](/C=C/C[C@H](C)CCC(=O)C1=C(O)C[C@@H](C)OC1=O)C(=O)O ZINC000238760664 GI Annotated Mild COC(=O)CC[C@]12C[C@]13CC[C@]1(C)C(=O)CC[C@@]1(C)[C@@H]3CC[C@H]2C(C)(C)O ZINC000238760946 GI Annotated Anodyne C=C(C)C(=O)O[C@H]1CC=C2C(=O)c3occ(C)c3[C@@H](OC(=O)C(=C)C)[C@]2(C)[C@H]1C ZINC000238761124 GI Annotated Mild COC(=O)C1=CCC[C@@H]2[C@@](C)(CCC3=C[C@@H](OC)OC3=O)[C@H](C)CC[C@@]12C ZINC000238761508 GI Annotated Anodyne COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CC[C@@]13C[C@@H](CC[C@H]12)[C@]1(COC(=O)O1)C3 ZINC000238761643 GI Annotated Anodyne COc1c(OC(C)=O)cc(C)c2cc3ccc(OC(C)=O)c(OC(C)=O)c3cc12 ZINC000238761728 GI Annotated Bother CC1=C[C@H](OC(=O)/C=C/c2ccccc2)[C@@H]2[C@](C)(CC[C@@]2(O)C(C)C)CC1=O ZINC000238762008 GI Annotated Mild C=C(C)[C@H](O)CC/C(C)=C/CC[C@](C)(O)[C@H]1Cc2c(c3ccccc3oc2=O)O1 ZINC000238762711 GI Annotated Mild C=NC(C)(C)[C@@H]1CC[C@](C)([C@H]2CC[C@](C)(N=C)[C@H]3CC[C@](C)(N=C)[C@@H](O)[C@@H]32)O1 ZINC000238762726 GI Annotated Mild C=C1CCCC(C)(C)[C@@H]2CC[C@@](C)([C@H]3[C@@H](OC(C)=O)O[C@@H]4OC(=O)C[C@H]34)[C@H]12 ZINC000238762975 GI Annotated Mild CC(C)[C@@H]1CC[C@@]2(C)CC[C@@H](O)[C@](C)(O)[C@@H]2[C@@H]1OC(=O)/C=C/c1ccccc1 ZINC000238763121 GI Annotated Anodyne CC(=O)OC/C(C)=C\CC/C(=C/CC/C(C)=C/CCC1=CC(=O)OC1)C(=O)O ZINC000238763246 GI Annotated Anodyne C=C1C(=O)CC[C@H]2[C@]1(C)C[C@H](OC(C)=O)[C@@H](C)[C@]2(C)CC[C@@H](C)CC(=O)O ZINC000238763310 GI Annotated Mild C[C@]1([C@H](Br)CO)CC=C2[C@@H](C1)[C@H](O)C[C@@H]1[C@@]3(C)C[C@H]3CC[C@@]21C ZINC000238763441 GI Annotated Reactive C=C(C)[C@H](O)CC/C(C)=C/COc1ccc2oc3cc(O)cc(O)c3c(=O)c2c1 ZINC000238763447 GI Annotated Mild CC(=O)OC/C(=C\C(=O)O)CC[C@@H]1C(C)=CC(=O)[C@@H]2C(C)(C)CCC[C@@]12C ZINC000238763771 GI Annotated Mild COc1ccc([C@@H]2CC(=O)c3c(OC)cc(OC)c(/C=C\C(C)(C)O)c3O2)cc1 ZINC000238763986 GI Annotated Anodyne CC(C)[C@]1(O)CC[C@]2(C)C[C@@H]3O[C@]3(C)C[C@H](OC(=O)/C=C/c3ccccc3)[C@H]21 ZINC000238764350 GI Annotated Anodyne C[C@@H](COC[C@H](CO[Si](C)(C)C)O[Si](C)(C)C)C(=O)O[Si](C)(C)C ZINC000238764399 GI Annotated Reactive COc1ccc2c3c(c4ccc(OC)c(OC)c4c2c1)C[N+]1([O-])CCC[C@H]1[C@H]3O ZINC000238764450 GI Annotated Bother COc1ccc(C(=O)O[C@@H]2C=C(C)CC[C@]3(C)CC[C@@](O)(C(C)C)[C@H]23)cc1O ZINC000238764508 GI Annotated Anodyne COc1cc(C(=O)O[C@H]2CC(C)=CCC3=C(C)[C@@](O)(C(C)C)C[C@@H]32)ccc1O ZINC000238764542 GI Annotated Anodyne C=C(C)[C@H]1C[C@]2(C)[C@@H](C)CC(=O)C[C@@H]2[C@H](OC(=O)C/C(C)=C\C)[C@@H]1OC(C)=O ZINC000238765007 GI Annotated Mild C=C1C[C@H](OC(=O)CC(C)C)[C@@H]2[C@](C)(CC[C@@]2(O)C(C)C)[C@@H]2OC(C)(C)O[C@H]12 ZINC000238765219 GI Annotated Mild C=C(C)[C@@H]1CC[C@](C)(O)[C@H]2Oc3cc(CCCCC)c(C(=O)OC)c(O)c3[C@H]21 ZINC000238765326 GI Annotated Mild COC(=O)C1=CC[C@H]2[C@](C)(CCC=C(C)C)[C@@H](Cl)C[C@H](O)[C@]2(C)[C@H]1C=O ZINC000238765880 GI Annotated Reactive C=C(C)[C@@H]1C[C@@]2(C)C(=CC1=O)CC[C@@H](OC(=O)/C=C\[C@@H](C)COC(C)=O)[C@@H]2C ZINC000238766049 GI Annotated Mild Cc1c(O)ccc2c1CC[C@]1(C)[C@@H]3CC[C@]21O[C@@]1(OC(C)(C)[C@@H](C)[C@H]1O)[C@H]3C ZINC000238766117 GI Annotated Anodyne CCCc1cc(OC)c(Oc2cc(CCCO)cc(OC)c2O)c(OC)c1 ZINC000238766506 GI Annotated Anodyne COC(=O)C[C@H](C)CC[C@@H]1C(COC(C)=O)=CC[C@@H]2[C@](C)(CO)CCC[C@@]12C ZINC000238766596 GI Annotated Anodyne C=C(C)[C@H]1C[C@]2(C)[C@@H](C)CC[C@H](OC(C)=O)[C@H]2C(=O)[C@@H]1OC(=O)/C(C)=C\C ZINC000238766727 GI Annotated Mild CCC/C=C1\OC(=O)C2=C1CC[C@@H]1[C@H]2[C@]23C=CCC[C@@H]2[C@@]1(C(=O)CCC)OC3=O ZINC000238767012 GI Annotated Anodyne CC(C)[C@@H]1CC[C@](C)(O)[C@@H]2CC[C@H](C(=O)COC(=O)/C=C/c3ccccc3)[C@@H]12 ZINC000238767024 GI Annotated Anodyne CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@H]2[C@@H](OC(=O)C=C(C)C)CC[C@H](C)[C@@]12C ZINC000238767190 GI Annotated Anodyne CC(=O)O[C@H]1c2c(C)coc2C/C(C)=C/CC[C@@H](C)[C@@H]2CC[C@](C)(O2)[C@@H]1O ZINC000238767261 GI Annotated Anodyne CC[C@H](C)/C=C(\C=C\C[C@H](C)CCC(=O)C1=C(O)C[C@@H](C)OC1=O)C(=O)O ZINC000238768237 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@@]3(C)CCC=C(COC(=O)/C=C/c4ccccc4)[C@H]3C[C@H]12 ZINC000238768376 GI Annotated Mild COC(=O)/C1=C/CC[C@H](C(=O)OC)[C@H]2C[C@@H](CC/C(C)=C\CC1)C(C)(C)O2 ZINC000238768460 GI Annotated Anodyne C/C=C(/C)C(=O)O[C@H]1CC[C@]2(C)CC(=O)C(=C(C)C)C[C@H]2[C@]1(C)OC(C)=O ZINC000238768493 GI Annotated Mild C=C1C(=O)O[C@@]2(C)CC[C@H]1C[C@H](O)/C(C)=C/C/C=C(\C)CC[C@H]2OC(C)=O ZINC000238768809 GI Annotated Mild C=C1CC(=O)O[C@]2(C)CC[C@@H]1C[C@H](O)/C(C)=C\C/C=C(\C)CC[C@@H]2OC(C)=O ZINC000238769411 GI Annotated Mild C=C1C[C@]23[C@@H](OC(=O)[C@H](C)CC)C[C@]45C6=NC[C@@]4(C)CCC[C@]5(O)[C@H]2C[C@H]1C[C@@H]63 ZINC000238769454 GI Annotated Mild C=C1[C@@H]2CC[C@H]3[C@@]45CCC[C@](C)(CN6CCO[C@@H]64)[C@H]5CC[C@]3(C2)[C@@H]1OC(C)=O ZINC000238769639 GI Annotated Mild CCCC#CC#C[C@@H](O)CCCCCC/C=C/C#CC#CCCC(=O)OCC ZINC000238769835 GI Annotated Mild C=C1[C@@H](O)CC[C@H]2[C@@]1(C)C[C@@H](OC(C)=O)[C@@H](C)[C@]2(C)CC/C(C)=C/C(=O)OC ZINC000238769953 GI Annotated Mild CC(=O)O[C@]1(C)[C@@H](OC(=O)C/C=C(/C)O)CC[C@]2(C)CC(=O)C(=C(C)C)C[C@@H]12 ZINC000238770022 GI Annotated Mild C=C1C(=O)C(O)=C[C@H]2[C@]1(C)C[C@H](OC(C)=O)[C@@H](C)[C@]2(C)CC[C@@H](C)CC(=O)O ZINC000238770033 GI Annotated Mild COC(=O)[C@H]1C[C@]23CN(C)C[C@H](CCC4=C2[C@H]1CC4)[C@]31CC=C(C(C)C)OC1 ZINC000238770036 GI Annotated Anodyne COC(=O)/C=C(/CC[C@@H]1C(C)=CC(=O)[C@@H]2C(C)(C)CCC[C@@]12C)COC(C)=O ZINC000238770532 GI Annotated Mild CC1=CC[C@@]2(C)CC[C@@](O)(C(C)C)[C@@H]2[C@@H](OC(=O)c2ccc3c(c2)OCO3)C1 ZINC000238770638 GI Annotated Anodyne CC[C@H](O)[C@@H](O)C[C@](C)(O)CCC/C(C)=C/C[C@H](O)[C@@H]1[C@@H](C)C=CCC1(C)C ZINC000238770727 GI Annotated Anodyne COc1cc([C@H]2c3c(cc4c(c3OC)OCO4)C[C@@H](C)[C@@H]2C)cc2c1OCO2 ZINC000238770825 GI Annotated Anodyne CC(=O)OC/C(=C\C(=O)O)CC[C@@H]1C(CO)=CC[C@@H]2C(C)(C)CCC[C@@]12C ZINC000238770843 GI Annotated Anodyne C=C(C=O)[C@H]1Oc2ccc([C@@H](C)OC(=O)/C(C)=C/C)cc2[C@@H]1OC(=O)/C(C)=C/C ZINC000238771503 GI Annotated Reactive C=C(C)/C=C\CC(=O)O[C@H](CC=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000238771577 GI Annotated Mild CC(C)C1=C[C@H]2[C@@](C)(OC(=O)/C=C/c3ccccc3)C[C@H](O)[C@@H](O)[C@]2(C)CC1 ZINC000238772024 GI Annotated Anodyne COC(=O)/C=C(\CC[C@@H]1C(C)=CC(=O)[C@@H]2C(C)(C)CCC[C@@]12C)COC(C)=O ZINC000238772519 GI Annotated Mild C=C(C)[C@H]1C[C@]2(C)[C@@H](C)CC(=O)C[C@@H]2[C@H](OC(C)=O)[C@@H]1OC(=O)/C(C)=C\C ZINC000238772560 GI Annotated Mild C=C(C)[C@H]1C[C@]2(C)[C@@H](C)CC[C@H](OC(C)=O)[C@H]2C(=O)[C@@H]1OC(=O)/C(C)=C/C ZINC000238772631 GI Annotated Mild COC(=O)[C@]1(C)CCC[C@]2(C)[C@]1(C)CC[C@@]13CC[C@@H](C[C@@]21C)[C@@](O)(CO)C3 ZINC000238772694 GI Annotated Anodyne COC(=O)[C@H]1CCC[C@@H](C(=O)OC)CC/C=C(/C)CC[C@@H]2C[C@H]1OC2(C)C ZINC000238772902 GI Annotated Anodyne CC(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@H]2[C@@H](OC(=O)C(C)C)CC[C@H](C)[C@@]12C ZINC000238773038 GI Annotated Anodyne COc1cc(/C=C/COC(=O)CC(C)C)cc(OC)c1OC(=O)CC(C)C ZINC000238773105 GI Annotated Anodyne CC[C@H](Br)[C@@H]1CC=CC[C@H]2O[C@H](C=C=CBr)C[C@H]2O1 ZINC000238773171 GI Annotated Reactive CC1(C)OC[C@]2(C[C@]34C[C@H]2CC[C@H]3[C@]2(C)CCCC(C)(C)[C@H]2C(=O)[C@H]4O)O1 ZINC000238773239 GI Annotated Anodyne CC(=O)O[C@@H]1C[C@@H](C)[C@](O)(CCC2=COC(=O)C2)[C@@]2(C)CCCC(C)(C)[C@H]12 ZINC000238773352 GI Annotated Anodyne COc1ccccc1[C@H]1c2ccc3[nH]c(C)c(OC)c(=O)c3c2[C@@H]2CC[C@H]1O2 ZINC000238773744 GI Annotated Anodyne CC1(C)OC[C@@H]([C@@]2(C)CC[C@@]3(O)[C@H]2C(=O)CC[C@H]2C(C)(C)CCC[C@@]23C)O1 ZINC000238774406 GI Annotated Anodyne COc1cc(OC)c([C@@H]2CCCc3cc(OC)c(OC)c(OC)c32)cc1OC ZINC000238774490 GI Annotated Anodyne COC(=O)[C@@]1(C)CC(=O)C=C2[C@@H]1CC[C@@H](C)[C@]2(C)CC[C@@H](C)CCOC(C)=O ZINC000238774493 GI Annotated Mild COc1cc(OC)c([C@H]2CC=Cc3cc(OC)c(OC)c(OC)c32)cc1OC ZINC000238774507 GI Annotated Anodyne CC(=O)O[C@H]1CC[C@H](C)[C@@]2(C)[C@H](OC(=O)C(C)C)c3c(C)coc3C(=O)[C@H]12 ZINC000238774518 GI Annotated Anodyne C/C=C/c1cc(OC)c(O[C@@H](C)Cc2cc(OC)c(O)c(OC)c2)c(OC)c1 ZINC000238774821 GI Annotated Anodyne CO[C@H]1C[C@H](CC[C@@]2(C)[C@H](C)[C@H](O)C[C@@]3(C)C(COC(C)=O)=CCC[C@@H]32)CO1 ZINC000238774942 GI Annotated Anodyne COC(=O)/C=C(/C)CC/C=C(/C)CC/C=C(\CC/C=C(\C)C(=O)O)C(=O)O ZINC000238775052 GI Annotated Anodyne C=N[C@@H]1[C@H]2[C@H](CC[C@@]1(C)O)[C@@](C)(N=C)CC[C@@H]2[C@@]1(C)CC[C@@H](C(C)(C)N=C)O1 ZINC000238775258 GI Annotated Mild CC(C)[C@@H]1CC[C@@]2(C)CCC[C@](O)(CO)[C@@H]2[C@@H]1OC(=O)/C=C/c1ccccc1 ZINC000238775314 GI Annotated Anodyne C=C1[C@@H](C)C[C@H]2O[C@@]2(C)[C@]12C[C@H](Br)[C@@](C)(Cl)C[C@H]2OC(C)=O ZINC000238775417 GI Annotated Reactive Cc1ccc([C@@]2(COC(=O)/C=C/c3ccccc3)CO2)c(OC(=O)C(C)C)c1 ZINC000238775667 GI Annotated Anodyne C#C/C=C\C/C(Br)=C1\C[C@H]2O[C@@H](CC)[C@H](Br)C[C@H]2O1 ZINC000238775668 GI Annotated Reactive COc1cc([C@H]2c3c(cc(OC)c(O)c3OC)C=C(C)[C@H]2C)cc(OC)c1O ZINC000238776505 GI Annotated Anodyne C/C=C(/C)C(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@H]2[C@@H](OC(C)=O)CC[C@H](C)[C@@]12C ZINC000238776671 GI Annotated Anodyne Cc1c(Br)cc2c(c1Br)O[C@@]1(CO)CC[C@]2(C)[C@@H]1C ZINC000238776673 GI Annotated Anodyne CC(=O)O[C@]1(C)[C@H](OC(=O)C/C=C(/C)O)CC[C@]2(C)CC(=O)C(=C(C)C)C[C@@H]12 ZINC000238776677 GI Annotated Mild CC(=O)OC[C@]1(C)C[C@@H](O)C[C@@]2(C)[C@H](CC[C@@H](C)CC(=O)O)C(C)=CC[C@@H]21 ZINC000238776935 GI Annotated Anodyne CC(=O)OC/C(=C\C(=O)O)CC[C@@]1(C)[C@H](C)CC[C@@]2(C)C(C=O)=CCC[C@H]12 ZINC000238776947 GI Annotated Reactive CC(=O)O[C@@H]1C=C(C)C[C@H](OC(=O)CC(C)C)[C@@H]2[C@]1(C)CC[C@@]2(O)C(C)C ZINC000238777023 GI Annotated Anodyne COC(=O)/C(=C\CC/C(C)=C/CC[C@@]1(C)C=Cc2cc(O)cc(C)c2O1)CO ZINC000238777166 GI Annotated Anodyne CC(C)[C@@]12C[C@@H](O)[C@@](C)(O1)[C@H]1CC[C@@H](C)[C@H]1[C@@H]2OC(=O)/C=C/c1ccccc1 ZINC000238777273 GI Annotated Anodyne CC(=O)OC/C=C1/CC[C@@]2(C)[C@@H]3CC(=O)C=C(C)[C@]3(C)CC[C@H]2[C@@H]1OC(C)=O ZINC000238777312 GI Annotated Mild CC(=O)O[C@@H](CNC(=O)/C=C/c1ccccc1)c1ccc(OCC=C(C)C)cc1 ZINC000238777324 GI Annotated Anodyne CC1(C)CCC[C@@]2(C)[C@H]1CC(OC(=O)/C=C\c1ccc(O)cc1)=C(C=O)[C@@H]2C=O ZINC000238777546 GI Annotated Reactive CC1(C)CCC[C@@]2(C)[C@H]1CC(OC(=O)/C=C/c1ccc(O)cc1)=C(C=O)[C@@H]2C=O ZINC000238777555 GI Annotated Reactive C=C(C)[C@H]1C[C@]2(C)[C@@H](C)CC(=O)C[C@@H]2[C@H](OC(=O)/C(C)=C/C)[C@@H]1OC(C)=O ZINC000238777615 GI Annotated Mild CC(=O)OC/C=C(\CO)CC[C@@]1(C)[C@H](C(=O)O)CC[C@@]2(C)C(C)=CCC[C@@H]21 ZINC000238778232 GI Annotated Anodyne COc1cc2c(c3c1OCO3)-c1c(cc(OC)c3c1OCO3)C[C@@H](C)[C@@H](C)C2 ZINC000238778611 GI Annotated Anodyne CC(=O)OC/C(=C\CC/C(C)=C\CO)[C@@H]1CC=C(CCC=C(C)C)C(=O)O1 ZINC000238778722 GI Annotated Anodyne C/C=C/c1cc2c(cn1)C(=O)[C@@]1(C)OC(=O)[C@@H](C(=O)CCCCCCC)[C@@H]1C2 ZINC000238778971 GI Annotated Mild CC(=O)OC/C(=C\CC/C(C=O)=C\C=O)CC/C=C(\C)[C@H](O)CC=C(C)C ZINC000238779193 GI Annotated Reactive CO[C@@H]1C[C@@]2(CC[C@]3(O2)[C@@H](C)C[C@H](OC(C)=O)[C@@H]2C(C)(C)CCC[C@]23C)CO1 ZINC000238779524 GI Annotated Anodyne C/C=C(/C)C(=O)O[C@H]1CC[C@H](C)[C@@]2(C)[C@H](OC(C)=O)c3c(C)coc3C(=O)[C@H]12 ZINC000238779615 GI Annotated Anodyne COC(=O)C[C@]1(C)CC[C@@]2(O1)C(C(=O)OC)=CC[C@H]1C(C)(C)CCC[C@@]12C ZINC000238779755 GI Annotated Anodyne C=C1CC(=O)O[C@]2(C)CC[C@@H]1C[C@H](O)/C(C)=C/C/C=C(\C)CC[C@@H]2OC(C)=O ZINC000238779995 GI Annotated Mild C=C[C@]1(C)C(Cl)=C[C@@H]2C(=O)[C@]1(N=C)c1cccc3c1[C@H](C(=O)N3C)C2(C)C ZINC000238780003 GI Annotated Mild COC(=O)C1=CC[C@H]2[C@](C)(CCC=C(C)C)[C@@H](Cl)C[C@@H]3O[C@@H](O)[C@H]1[C@@]32C ZINC000238780350 GI Annotated Reactive COC(=O)CCCCCCC[C@@H](O)[C@@H](CCCCCCCC(=O)OC)OC ZINC000238780752 GI Annotated Anodyne C=C(C)[C@H](O)CC/C(C)=C/CC[C@]1(C)Oc2oc3ccccc3c(=O)c2C[C@@H]1O ZINC000238780813 GI Annotated Mild C=C1CC(=O)O[C@]2(C)CC[C@@H]1C[C@H](O)/C(C)=C\C/C=C(/C)CC[C@@H]2OC(C)=O ZINC000238780819 GI Annotated Mild C=C1CC(=O)O[C@]2(C)CC[C@@H]1C[C@H](O)/C(C)=C/C/C=C(/C)CC[C@@H]2OC(C)=O ZINC000238780826 GI Annotated Mild COc1cc2c(cc1O)[C@H](CC(C)=O)N(C)c1c-2ccc2cc3c(cc12)OCO3 ZINC000238781389 GI Annotated Anodyne C/C=C(\C)C(=O)O[C@H]1C/C(C)=C/CC[C@]2(C)O[C@H]2[C@H](OC(C)=O)[C@H]1C(C)C ZINC000238781565 GI Annotated Anodyne CC(=O)OCC[C@@H](C)CC[C@@H]1[C@@](C)(O)CC[C@@H]2[C@@](C)(C(=O)O)CCC[C@@]12C ZINC000238781655 GI Annotated Anodyne COc1cc2c(cc1O)-c1ccc3cc4c(cc3c1N(C)[C@H]2CC(C)=O)OCO4 ZINC000238782117 GI Annotated Anodyne CCCCCC[C@H]1C(=O)O[C@@H]1C[C@H](CCCCC)OC(=O)[C@H](NC=O)C(C)C ZINC000238782306 GI Annotated Anodyne C=C1CCCC(C)(C)[C@@H]2C[C@@](C)([C@@H]3[C@@H](OC(C)=O)O[C@@H]4OC(=O)C[C@@H]43)C[C@H]12 ZINC000238782675 GI Annotated Mild C=C1CCC[C@@H]2[C@]1(C)CC[C@H](C)[C@@]2(C)CC/C(C)=C\C(=O)OC(CO)CO ZINC000238782807 GI Annotated Mild C/C=C/c1cc(OC)c(O[C@H](C)Cc2cc(OC)c(O)c(OC)c2)c(OC)c1 ZINC000238782983 GI Annotated Anodyne CC(=O)OC/C=C(\C)CC/C=C(\C)[C@H](C/C=C(\C)COC(C)=O)OC(C)=O ZINC000238782998 GI Annotated Anodyne CC(=O)OC[C@@H]1C[C@@]2(C)[C@@H](OC(=O)C=C(C)C)CCC(C)(C)[C@@]2(C)[C@@]12CO2 ZINC000238783143 GI Annotated Anodyne C=C1CC(=O)O[C@]2(C)CC[C@@H]1C[C@@H](O)/C(C)=C/C/C=C(\C)CC[C@@H]2OC(C)=O ZINC000238783677 GI Annotated Mild CC(=O)O[C@H]1C[C@H]2[C@@H]3CC[C@@H]4C[C@H]5NC[C@H](O5)[C@]4(C)[C@H]3CC[C@]2(C)[C@H]1C(C)C ZINC000238783694 GI Annotated Anodyne C=C1CC/C=C(\C)C[C@@H]2OC(=O)C(=C)[C@H]2C/C=C(\COC(C)=O)CC[C@@H]1OO ZINC000238783763 GI Annotated Reactive CCO[C@H]1OC[C@]23CCC[C@@]1(C(=O)OC)[C@@H]2CC[C@@H]1[C@@H]3Cc2occc2[C@@H]1C ZINC000238785208 GI Annotated Anodyne CC[C@H](Br)[C@@H]1C/C=C/C[C@H]2O[C@H](C=C=CBr)C[C@H]2O1 ZINC000238785327 GI Annotated Reactive C=CC(C)(C)c1cc2c3c(c4c(c2oc1=O)C(C)(C)[C@@H](CO)O4)C=CC(C)(C)O3 ZINC000238785553 GI Annotated Mild CC(C)=CCC[C@]1(C)O[C@H]1Cc1c(O)cc(O)c(C(=O)c2ccccc2)c1O ZINC000238785561 GI Annotated Anodyne C=C1CC(=O)O[C@]2(C)CC[C@@H]1C[C@@H](O)/C(C)=C\C/C=C(\C)CC[C@@H]2OC(C)=O ZINC000238785809 GI Annotated Mild C=C1CC(=O)O[C@]2(C)CC[C@@H]1C[C@@H](O)/C(C)=C\C/C=C(/C)CC[C@@H]2OC(C)=O ZINC000238785811 GI Annotated Mild C=C1CC(=O)O[C@]2(C)CC[C@@H]1C[C@@H](O)/C(C)=C/C/C=C(/C)CC[C@@H]2OC(C)=O ZINC000238785812 GI Annotated Mild CCC/C=C1/OC(=O)C2=C1CC[C@@H]1[C@H]2[C@]23C=CCC[C@@H]2[C@@]1(C(=O)CCC)OC3=O ZINC000238785861 GI Annotated Anodyne C/C=C(/C)C(=O)O[C@@H]1c2c(C)coc2C(=O)[C@@]2(O)[C@@H](Cl)CC[C@H](C)[C@@]12C ZINC000238785976 GI Annotated Reactive COC(=O)[C@@H]1CC[C@@H]2[C@@]3(C)CCCC(C)(C)[C@@H]3CC[C@]23[C@@H](OC(C)=O)OC[C@H]13 ZINC000238786269 GI Annotated Anodyne COc1ccc2c(c1)CCc1c(Cc3ccc(O)c(OC)c3)c(O)cc(O)c1-2 ZINC000238786969 GI Annotated Anodyne COC(=O)CC(C)(C)C(=O)[C@H]1CC[C@H]2C1=CC[C@@H]1c3ccc(N)cc3CC[C@@H]12 ZINC000238787189 GI Annotated Anodyne CC(C)C1=CC[C@@]2(C)[C@H](O)[C@@H](O)C[C@](C)(OC(=O)/C=C\c3ccccc3)[C@@H]2C1 ZINC000238787445 GI Annotated Anodyne CC(C)[C@@H]1CC[C@@]2(C)CC[C@@H](O)[C@](C)(O)[C@@H]2[C@@H]1OC(=O)/C=C\c1ccccc1 ZINC000238787487 GI Annotated Anodyne CC(C)[C@@]12C[C@@H](O)[C@@](C)(O1)[C@H]1CC[C@@H](C)[C@H]1[C@@H]2OC(=O)/C=C\c1ccccc1 ZINC000238787666 GI Annotated Anodyne CC(C)[C@@H]1CC[C@@]2(C)CC[C@H](O)[C@@](C)(O)[C@@H]2[C@@H]1OC(=O)/C=C\c1ccccc1 ZINC000238787735 GI Annotated Anodyne CC(C)=CCC/C(C)=C\CC[C@]1(C)Oc2c(c(O)cc3c2CNC3=O)C[C@@H]1O ZINC000238787811 GI Annotated Anodyne CO[C@]1(C)CCC[C@]2(C)[C@@H](CN(C)C)C[C@@H](C3=CC[C@@H](C(C)(C)O)OC3)C[C@@H]12 ZINC000238788149 GI Annotated Anodyne CC(=O)O[C@]1(C)CCC(=C(C)C)C(=O)[C@@H]2O[C@@]2(C)CC/C=C(\C)[C@@H](O)CC1 ZINC000238789147 GI Annotated Mild CC(C)C1=CC[C@@]2(C)[C@H](O)C[C@@H](O)[C@](C)(OC(=O)/C=C\c3ccccc3)[C@@H]2C1 ZINC000238789158 GI Annotated Anodyne COc1c(O)cc2c3c1COc1cc(O)c(Cc4ccc(O)cc4)c(c1-3)CC2 ZINC000238789206 GI Annotated Anodyne C=C1CCC[C@@H]2[C@]1(C)CC[C@H](C)[C@@]2(C)CC/C(C)=C\C(=O)OC[C@H](O)CO ZINC000238789715 GI Annotated Mild C=C1CC/C=C(\C)CC[C@H](/C(=C\C=C\C(C)(C)O)COC(C)=O)[C@H]1C(=O)OC ZINC000238789730 GI Annotated Mild C=C1CC/C=C(/C)CC[C@H](/C(=C\C=C\C(C)(C)O)COC(C)=O)[C@H]1C(=O)OC ZINC000238789731 GI Annotated Mild CC(=O)O[C@H]1C/C(C)=C\CC[C@H](C)CC(=O)CC2=C[C@H](OC2=O)[C@@H]1C(C)C ZINC000238789850 GI Annotated Anodyne CC(=O)O[C@H]1C/C(C)=C/CC[C@H](C)CC(=O)CC2=C[C@H](OC2=O)[C@@H]1C(C)C ZINC000238789851 GI Annotated Anodyne FC(F)(F)c1ccc2c(N3CCCNCC3)ncc(-c3ccsc3)c2n1 ZINC000024904215 GI Annotated Anodyne Brc1cnn2c(NCc3cncnc3)cc(-c3ccccc3)cc12 ZINC000024930139 GI Annotated Anodyne in-vivo C[C@@H]1[C@@H](NC(=O)[C@@H]2c3ccccc3C(=O)N2Cc2cccs2)CCC[C@H]1C ZINC000245234905 GI Annotated Anodyne C[C@@H]1[C@@H](NC(=O)[C@H]2c3ccccc3C(=O)N2Cc2cccs2)CCC[C@H]1C ZINC000245234906 GI Annotated Anodyne Cc1cccc2cc(CNCc3cccs3)c(N3CCN4CCC[C@H]4C3)nc12 ZINC000248342624 GI Annotated Anodyne O=c1[nH]c2ccc(N3CCC[C@@H]4CCCC[C@@H]43)nc2nc1Cc1ccc(F)cc1 ZINC000002500083 GI Annotated Anodyne CCN(Cc1ccccc1)c1ccc2nc(O)c(Cc3ccc(F)cc3)nc2n1 ZINC000002500160 GI Annotated Anodyne CCCN(CC1CC1)c1ccc2[nH]c(=O)c(CSCc3ccccc3)nc2n1 ZINC000002500168 GI Annotated Anodyne Cc1sc(C(=O)Nc2ccccc2)c2c1C(=O)N[C@@](C)(c1cccs1)N2 ZINC000002501965 GI Annotated Anodyne Cc1sc(C(=O)Nc2ccccc2)c2c1C(=O)N[C@](C)(c1cccs1)N2 ZINC000002501966 GI Annotated Anodyne ClC1=C(Cl)[C@]2(Cl)[C@H]3[C@H]([C@@H]4C[C@H]3[C@H]3O[C@@H]43)[C@@]1(Cl)C2(Cl)Cl ZINC000002510779 GI Annotated Anodyne O=C(N[C@H](C(=O)O)c1cccc(F)c1)OCC1c2ccccc2-c2ccccc21 ZINC000002511447 GI Annotated Anodyne ClC1=C(Cl)[C@]2(Cl)[C@@H]3[C@@H]4C[C@@H]([C@@H]5O[C@@H]54)[C@@H]3[C@@]1(Cl)C2(Cl)Cl ZINC000002572813 GI Annotated Anodyne in-man O=C(Nc1c2n(c(=S)n(-c3ccccc3)c1=O)CCCCC2)c1ccccc1 ZINC000002617579 GI Annotated Anodyne CCCn1nc(/C(O)=N/c2sc3c(c2C#N)CCCC3)c2ccccc2c1=O ZINC000002628362 GI Annotated Mild Cc1nn(-c2cccc(Cl)c2)c(Cl)c1/C=N/NC(=O)c1cccs1 ZINC000002658693 GI Annotated Reactive Cc1[nH]c2ccccc2c1SCCNC(=O)c1ccc(Br)o1 ZINC000002721082 GI Annotated Anodyne Cc1ccc2c(c1)[C@@H](c1ccccc1)N(C(=O)Cc1ccc(F)cc1)CC(=O)N2 ZINC000002723617 GI Annotated Anodyne Cc1ccc2c(c1)[C@H](c1ccccc1)N(C(=O)Cc1ccc(F)cc1)CC(=O)N2 ZINC000002723618 GI Annotated Anodyne Cc1ccc2c(c1)[C@@H](c1ccc(F)cc1)N(C(=O)c1cccc(F)c1)CC(=O)N2 ZINC000002724189 GI Annotated Anodyne Cc1ccc2c(c1)[C@H](c1ccc(F)cc1)N(C(=O)c1cccc(F)c1)CC(=O)N2 ZINC000002724190 GI Annotated Anodyne COc1ccccc1C(=O)N1CC(=O)Nc2ccc(C)cc2[C@H]1c1ccccc1 ZINC000002724199 GI Annotated Anodyne COc1ccccc1C(=O)N1CC(=O)Nc2ccc(C)cc2[C@@H]1c1ccccc1 ZINC000002724200 GI Annotated Anodyne COc1ccc(C(=O)N2CC(=O)Nc3ccc(C)cc3[C@H]2c2ccccc2)cc1 ZINC000002724207 GI Annotated Anodyne COc1ccc(C(=O)N2CC(=O)Nc3ccc(C)cc3[C@@H]2c2ccccc2)cc1 ZINC000002724208 GI Annotated Anodyne Cc1ccccc1C(=O)N1CC(=O)Nc2ccc(F)cc2[C@H]1c1ccc(F)cc1 ZINC000002724721 GI Annotated Anodyne Cc1ccccc1C(=O)N1CC(=O)Nc2ccc(F)cc2[C@@H]1c1ccc(F)cc1 ZINC000002724722 GI Annotated Anodyne COc1ccccc1C(=O)N1CC(=O)Nc2ccc(F)cc2[C@H]1c1ccccc1 ZINC000002724747 GI Annotated Anodyne COc1ccccc1C(=O)N1CC(=O)Nc2ccc(F)cc2[C@@H]1c1ccccc1 ZINC000002724748 GI Annotated Anodyne Cc1cccc(-n2nc3c(c2NC(=O)CC2CCCCC2)C[S@@](=O)C3)c1C ZINC000002724838 GI Annotated Anodyne Cc1ccc(-n2nc3c(c2NC(=O)CCC2CCCCC2)C[S@@](=O)C3)cc1 ZINC000002724897 GI Annotated Anodyne O/C(=N\CCOc1ccccc1)C(O)(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000002848762 GI Annotated Mild CCc1ccc([C@H]2C[C@@H](c3ccc(OC)c(OC)c3OC)n3ncnc3N2)cc1 ZINC000002915273 GI Annotated Anodyne CCc1ccc([C@@H]2C[C@@H](c3ccc(OC)c(OC)c3OC)n3ncnc3N2)cc1 ZINC000002915274 GI Annotated Anodyne CCc1ccc([C@H]2C[C@H](c3ccc(OC)c(OC)c3OC)n3ncnc3N2)cc1 ZINC000002915276 GI Annotated Anodyne CCc1ccc([C@@H]2C[C@H](c3ccc(OC)c(OC)c3OC)n3ncnc3N2)cc1 ZINC000002915278 GI Annotated Anodyne CCc1ccc([C@H]2C[C@@H](c3cc(OC)c(OC)c(OC)c3)n3ncnc3N2)cc1 ZINC000002915478 GI Annotated Anodyne CCc1ccc([C@@H]2C[C@@H](c3cc(OC)c(OC)c(OC)c3)n3ncnc3N2)cc1 ZINC000002915479 GI Annotated Anodyne CCc1ccc([C@H]2C[C@H](c3cc(OC)c(OC)c(OC)c3)n3ncnc3N2)cc1 ZINC000002915481 GI Annotated Anodyne FC(F)Oc1ccc([C@@H]2C[C@@H](c3ccc(Cl)cc3)Nc3nnnn32)cc1 ZINC000002918158 GI Annotated Anodyne FC(F)Oc1ccc([C@H]2C[C@H](c3ccc(Cl)cc3)Nc3nnnn32)cc1 ZINC000002918159 GI Annotated Anodyne FC(F)Oc1ccc([C@@H]2C[C@H](c3ccc(Cl)cc3)Nc3nnnn32)cc1 ZINC000002918161 GI Annotated Anodyne COc1cc([C@@H]2C(C#N)=C(C)N=C3CC(C)(C)CC(O)=C32)ccc1OCCO ZINC000002922932 GI Annotated Reactive CCN(CC)c1nc(C)nc2sc(C(=O)Nc3ccccc3OC)c(C)c12 ZINC000002925912 GI Annotated Anodyne Cc1c(C(=O)NCc2ccco2)sc2ncnc(N(C)c3ccccc3)c12 ZINC000002926873 GI Annotated Anodyne CCCCNC(=O)c1sc2ncnc(N3CCc4ccccc4C3)c2c1C ZINC000002931591 GI Annotated Anodyne CCN(CC)C(=O)c1sc2ncnc(N3CCc4ccccc4C3)c2c1C ZINC000002931648 GI Annotated Anodyne COc1ccc(CC/N=C/C2=C(O)C[C@H](c3ccccc3)CC2=O)cc1OC ZINC000002934062 GI Annotated Mild Oc1ccccc1[C@H]1C=C(c2ccc3c(c2)OCO3)N[C@@H](c2cccc(F)c2)N1 ZINC000002936913 GI Annotated Clean Oc1ccccc1[C@@H]1C=C(c2ccc3c(c2)OCO3)N[C@@H](c2cccc(F)c2)N1 ZINC000002936915 GI Annotated Clean Oc1ccccc1[C@H]1C=C(c2ccc3c(c2)OCO3)N[C@H](c2cccc(F)c2)N1 ZINC000002936917 GI Annotated Clean Oc1ccccc1[C@@H]1C=C(c2ccc3c(c2)OCO3)N[C@H](c2cccc(F)c2)N1 ZINC000002936919 GI Annotated Clean COc1ccc(-n2cc(C(=O)N3C[C@@H](C)C[C@@H](C)C3)c3ccccc3c2=O)cc1 ZINC000002937582 GI Annotated Anodyne COc1ccc(-n2cc(C(=O)N3C[C@H](C)C[C@@H](C)C3)c3ccccc3c2=O)cc1 ZINC000002937584 GI Annotated Anodyne COc1ccc(-n2cc(C(=O)N3C[C@@H](C)C[C@H](C)C3)c3ccccc3c2=O)cc1 ZINC000002937586 GI Annotated Anodyne CCN(CC)CCCNC(=O)c1oc(=O)c2ccccc2c1-c1ccc(C)cc1 ZINC000002939888 GI Annotated Anodyne O=C(Nc1ccc2c(c1)OCO2)c1oc(=O)c2ccccc2c1-c1ccccc1 ZINC000002940008 GI Annotated Anodyne CC(C)(C)CC(C)(C)NC[C@H](O)COc1c(F)cc(Br)cc1F ZINC000002942633 GI Annotated Anodyne CC(C)(C)CC(C)(C)NC[C@@H](O)COc1c(F)cc(Br)cc1F ZINC000002942634 GI Annotated Anodyne O=c1[nH]c2ccccc2c(=O)n1CC1CCC(/C(O)=N/C2CCCCCC2)CC1 ZINC000002952584 GI Annotated Mild CC[C@@H](C(=O)NCc1ccc(C)cc1)N1C(=O)COc2ccc(C(C)(C)C)cc21 ZINC000002953484 GI Annotated Anodyne CC[C@H](C(=O)NCc1ccc(C)cc1)N1C(=O)COc2ccc(C(C)(C)C)cc21 ZINC000002953485 GI Annotated Anodyne O=C(Nc1ccc(F)cc1F)c1sc(=S)n2c1[nH]c(=O)c1sccc12 ZINC000002956541 GI Annotated Anodyne CC1CCC(NC(=O)c2ccc(-n3c(=S)[nH]c4ccccc4c3=O)cc2)CC1 ZINC000002973941 GI Annotated Anodyne CCN(CCCn1c(=S)[nH]c2cc3c(cc2c1=O)OCO3)c1cccc(C)c1 ZINC000002974094 GI Annotated Anodyne O=C(N[C@@H](c1ccccc1)c1c(O)c(C(=O)O)cc2ccccc12)c1cccnc1 ZINC000002980753 GI Annotated Clean O=C(N[C@H](c1ccccc1)c1c(O)c(C(=O)O)cc2ccccc12)c1cccnc1 ZINC000002980754 GI Annotated Clean Cc1cc(OCCN(C)C)c(C)c2c1CC[C@@H]([C@@H](C)C(=O)Nc1ccccn1)C2 ZINC000025206585 GI Annotated Anodyne Cc1cc(OCCN(C)C)c(C)c2c1CC[C@H]([C@H](C)C(=O)Nc1ccccn1)C2 ZINC000025206590 GI Annotated Anodyne Cc1cc(OCCN(C)C)c(C)c2c1CC[C@H]([C@@H](C)C(=O)Nc1ccccn1)C2 ZINC000025206595 GI Annotated Anodyne C[C@@H](NC(=O)C1CCC(C(C)(C)C)CC1)[C@H](c1ccccc1)N1CCOCC1 ZINC000025330253 GI Annotated Anodyne C[C@H](NC(=O)C1CCC(C(C)(C)C)CC1)[C@H](c1ccccc1)N1CCOCC1 ZINC000025330255 GI Annotated Anodyne C[C@@H](NC(=O)C1CCC(C(C)(C)C)CC1)[C@@H](c1ccccc1)N1CCOCC1 ZINC000025330258 GI Annotated Anodyne C[C@H](NC(=O)C1CCC(C(C)(C)C)CC1)[C@@H](c1ccccc1)N1CCOCC1 ZINC000025330260 GI Annotated Anodyne CN(C)c1ccc([C@H]2N[C@H](c3ccc(N(C)C)cc3)[C@H]3CCC[C@H]2C3=O)cc1 ZINC000250351845 GI Annotated Anodyne CCOc1ccc([C@@H]2N(c3ccc(Cl)cc3)C(=O)[C@@H]3CCCN32)cc1OC ZINC000250522437 GI Annotated Anodyne O=C1[C@H]2[C@@H](c3ccccc3)C=C[C@@H](c3ccccc3)[C@H]2C(=O)N1c1nccs1 ZINC000250796303 GI Annotated Anodyne O=C1[C@H]2[C@H](c3ccccc3)C=C[C@@H](c3ccccc3)[C@H]2C(=O)N1c1nccs1 ZINC000250796308 GI Annotated Anodyne CCOc1cc2nc(=S)n(CCCN(CC)CC)c(O)c2cc1OCC ZINC000253497294 GI Annotated Anodyne CC1(C)CC[C@@H]2Nc3ccnn3[C@H](c3ccc(F)c(Br)c3)[C@H]2C1=O ZINC000253634015 GI Annotated Anodyne CC1=C[C@]2(C)C(=CC1=O)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000253638106 GI Annotated Mild CC1=C[C@]2(C)C(=CC1=O)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000253638108 GI Annotated Mild CC1=C[C@]2(C)C(=CC1=O)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@H]1C[C@H]1[C@@]21CCC(=O)O1 ZINC000253638111 GI Annotated Mild CC1=C[C@]2(C)C(=CC1=O)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@@H]1C[C@H]1[C@@]21CCC(=O)O1 ZINC000253638114 GI Annotated Mild CCOCCOC(=O)[C@H](C)c1ccc2c(c1)SC[C@@H]1CCCC[C@H]1C2=O ZINC000253638738 GI Annotated Anodyne C[C@]12C(=CC(=O)C[C@@H]1C#N)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@H]1C[C@H]1[C@@]21CCC(=O)O1 ZINC000253639273 GI Annotated Mild C[C@]12C(=CC(=O)C[C@@H]1C#N)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@@H]1C[C@H]1[C@@]21CCC(=O)O1 ZINC000253639275 GI Annotated Mild C[C@]12C(=CC(=O)C[C@@H]1C#N)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000253639277 GI Annotated Mild C[C@]12C(=CC(=O)C[C@@H]1C#N)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000253639278 GI Annotated Mild Cn1cc([C@@H]2CCN([C@@H]3Cc4cccc5cccc3c45)C[C@H]2O)c2cccnc21 ZINC000253639848 GI Annotated Anodyne Cn1cc([C@@H]2CCN([C@H]3Cc4cccc5cccc3c45)C[C@H]2O)c2cccnc21 ZINC000253639850 GI Annotated Anodyne N[C@@H]1CN(c2nccc(-c3ccsc3)n2)C[C@H]1c1ccc(Cl)cc1Cl ZINC000253659127 GI Annotated Anodyne N[C@@H]1CN(c2ccnc(-c3ccsc3)n2)C[C@H]1c1ccc(Cl)cc1Cl ZINC000253660144 GI Annotated Anodyne COc1ccc([C@@H]2C[C@@]3(N(C)C)CCN[C@H]2[C@@H](c2ccc(OC)cc2)C3)cc1 ZINC000253664909 GI Annotated Anodyne COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)[C@@H](O)[C@H]1CCC[N@@+]1([O-])C3 ZINC000253666475 GI Annotated Bother COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)[C@@H](O)[C@H]1CCC[N@+]1([O-])C3 ZINC000253666481 GI Annotated Bother CCC[N@@+]12CCc3cc4c(cc3[C@@H]1Cc1cc(OC)c(OC)cc1C2)OCO4 ZINC000253666642 GI Annotated Bother CCC[N@@+]12CCc3cc4c(cc3[C@H]1Cc1cc(OC)c(OC)cc1C2)OCO4 ZINC000253666652 GI Annotated Bother CCC[N@+]12CCc3cc4c(cc3[C@H]1Cc1cc(OC)c(OC)cc1C2)OCO4 ZINC000253666655 GI Annotated Bother CCC[N@+]12CCc3cc4c(cc3[C@@H]1Cc1cc(OC)c(OC)cc1C2)OCO4 ZINC000253666663 GI Annotated Bother CC[C@H]1C[C@@]2(C[C@@H](CC)N1)C(=O)N(Cc1ccccc1)C(=O)N2c1ccccc1 ZINC000253666844 GI Annotated Anodyne CC[C@H]1C[C@]2(C[C@@H](CC)N1)C(=O)N(Cc1ccccc1)C(=O)N2c1ccccc1 ZINC000253666848 GI Annotated Anodyne COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[N@@+]1([O-])CCC[C@H]1[C@@H]3O ZINC000253667009 GI Annotated Bother COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[N@+]1([O-])CCC[C@H]1[C@@H]3O ZINC000253667014 GI Annotated Bother C[C@]12C(=CC(=O)[C@@H]3C[C@@H]31)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000253680448 GI Annotated Mild C[C@]12C(=CC(=O)[C@@H]3C[C@@H]31)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000253680454 GI Annotated Mild C[C@]12C(=CC(=O)[C@@H]3C[C@@H]31)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@@H]1C[C@H]1[C@@]21CCC(=O)O1 ZINC000253680457 GI Annotated Mild C[C@]12C(=CC(=O)[C@@H]3C[C@@H]31)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@H]1C[C@H]1[C@@]21CCC(=O)O1 ZINC000253680464 GI Annotated Mild CCOc1cc([N+](=O)[O-])cc(C=Nc2cccc(NC(=O)c3ccco3)c2)c1O ZINC000253683301 GI Annotated Mild Oc1ccc(-c2ccc3c(c2)OCO3)cc1CNC[C@@H]1C[C@H]2C=C[C@H]1C21CC1 ZINC000253683731 GI Annotated Clean Oc1ccc(-c2ccc3c(c2)OCO3)cc1CNC[C@H]1C[C@H]2C=C[C@H]1C21CC1 ZINC000253683740 GI Annotated Clean CCN1CCN(CCOc2ccccc2)[C@H]2CCn3c(c(C)c4ccccc43)[C@H]21 ZINC000253685270 GI Annotated Anodyne COc1ccc([C@H]2C[C@]3(N(C)C)CC(=O)[C@@H]2[C@H](c2ccc(OC)cc2)C3)cc1 ZINC000253686421 GI Annotated Anodyne C=C1C[C@]2(C)C(=CC1=O)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000253689600 GI Annotated Mild C=C1C[C@]2(C)C(=CC1=O)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000253689605 GI Annotated Mild C=C1C[C@]2(C)C(=CC1=O)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@H]1C[C@H]1[C@@]21CCC(=O)O1 ZINC000253689608 GI Annotated Mild C=C1C[C@]2(C)C(=CC1=O)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@@H]1C[C@H]1[C@@]21CCC(=O)O1 ZINC000253689612 GI Annotated Mild O=[S@@]1N=C(NCCCc2ccccc2)C(Nc2cc(Cl)cc(Cl)c2)=N1 ZINC000253703177 GI Annotated Anodyne O=[S@]1N=C(NCCCc2ccccc2)C(Nc2cc(Cl)cc(Cl)c2)=N1 ZINC000253703186 GI Annotated Anodyne C[C@]12C(=CC(=O)C[C@@H]1S)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000253737857 GI Annotated Mild C[C@]12C(=CC(=O)C[C@@H]1S)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@@H]1C[C@H]1[C@@]21CCC(=O)O1 ZINC000253737874 GI Annotated Mild C[C@]12C(=CC(=O)C[C@@H]1S)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@H]1C[C@H]1[C@@]21CCC(=O)O1 ZINC000253737890 GI Annotated Mild C[C@]12C(=CC(=O)C[C@@H]1S)[C@@H]1C[C@@H]1[C@@H]1[C@@H]2CC[C@]2(C)[C@@H]1[C@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000253737901 GI Annotated Mild CCC[N@@+]1(C)CCc2c(c(O)c(OC)c3c2ccc2cc(O)c(OC)cc23)C1 ZINC000253806693 GI Annotated Clean CCC[N@+]1(C)CCc2c(c(O)c(OC)c3c2ccc2cc(O)c(OC)cc23)C1 ZINC000253806697 GI Annotated Clean O=C(Nc1ccccc1-n1cccn1)c1cccc2c1[S@](=O)c1ccccc1-2 ZINC000253809891 GI Annotated Anodyne O=C(Nc1ccccc1-n1cccn1)c1cccc2c1[S@@](=O)c1ccccc1-2 ZINC000253809897 GI Annotated Anodyne CCO[C@@]1(C(F)(F)F)O[C@@H]2O[C@]3(C)CC[C@@H]4[C@H](C)CC[C@H]([C@H]1C)[C@@]24OO3 ZINC000253855531 GI Annotated Reactive CC[N@+]1(C)CC[C@@](O)(/C=C/c2ccccc2)[C@H](C(=O)/C=C/c2ccccc2)C1 ZINC000253867374 GI Annotated Mild CC[N@@+]1(C)CC[C@@](O)(/C=C/c2ccccc2)[C@H](C(=O)/C=C/c2ccccc2)C1 ZINC000253867375 GI Annotated Mild CCOc1ccc(C[C@@H]2CN3C(=NC[C@@H]3C)N2CC[C@@H]2C[C@H]3CC[C@H]2C3)cc1 ZINC000253867381 GI Annotated Anodyne CCOc1ccc(C[C@@H]2CN3C(=NC[C@@H]3C)N2CC[C@H]2C[C@H]3CC[C@H]2C3)cc1 ZINC000253867382 GI Annotated Anodyne CC(=NO)c1ccc(NC2=C(N3CCCCC3)C(=O)c3ccccc3C2=O)cc1 ZINC000253868606 GI Annotated Mild O=C(O)C[C@@H]1CCN([C@H]2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 ZINC000253917021 GI Annotated Anodyne C[C@@]1(C(=O)O)CCN([C@H]2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 ZINC000253918618 GI Annotated Anodyne C[C@]1(C(=O)O)CCN([C@H]2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 ZINC000253918621 GI Annotated Anodyne Cc1cc(C)n(CCC(=O)N=Nc2c(O)[nH]c3ccc(Br)cc23)n1 ZINC000253920483 GI Annotated Clean CC(C)=CCO[C@]1(C)CC[C@H]2C[C@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 ZINC000253930085 GI Annotated Reactive CC(C)=CCO[C@@]1(C)CC[C@H]2C[C@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 ZINC000253930087 GI Annotated Reactive CCOC(=O)[C@H]1CC[C@@H](N(C(=O)c2cc(Cl)c(N)c(Cl)c2)C2CC2)CC1 ZINC000253951945 GI Annotated Anodyne NC(=S)N=Nc1c(O)n(Cc2ccc(Br)cc2)c2ccccc12 ZINC000253966715 GI Annotated Clean CCOC(=O)OC[C@@H]1O[C@H](c2ccccc2)C=C[C@H]1Oc1cccc(N(C)C)c1 ZINC000253977228 GI Annotated Anodyne CC(C)n1c(O)c(N=NC(=O)CNC(=O)CCc2ccccc2)c2ccccc21 ZINC000253977823 GI Annotated Clean CC(=O)CC[C@@H]1[C@@H]2[C@H](O)[C@H](C(C)C)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@]21C ZINC000253979339 GI Annotated Anodyne CC(=O)CC[C@@H]1[C@@H]2[C@H](O)[C@H](C(C)C)[C@H](OC(=O)/C=C/c3ccccc3)C[C@]21C ZINC000253979346 GI Annotated Anodyne O=C(Cn1c(O)c(N=NC(=O)c2ccncc2)c2ccccc21)Nc1ccccc1 ZINC000253979480 GI Annotated Clean Oc1[nH]c2ccc(Br)cc2c1N=N/C(S)=N/C[C@H]1CCCO1 ZINC000253993131 GI Annotated Mild Oc1[nH]c2ccc(Br)cc2c1N=N/C(S)=N/C[C@@H]1CCCO1 ZINC000253993134 GI Annotated Mild C[C@@H]1C(=NO)[C@H](C)[C@@H](c2ccc(N(C)C)cc2)N[C@H]1c1ccc(N(C)C)cc1 ZINC000253995363 GI Annotated Mild CC(=O)S[C@@H]1CC(=O)C=C2CC[C@@H]3[C@@H]4CCC(=O)O[C@]4(C)CC[C@@H]3[C@]21C ZINC000254043393 GI Annotated Mild CC(=O)S[C@@H]1CC(=O)C=C2CC[C@@H]3[C@@H]4CCC(=O)O[C@]4(C)CC[C@H]3[C@@]21C ZINC000254043398 GI Annotated Mild CC(=O)S[C@@H]1CC(=O)C=C2CC[C@H]3[C@H](CC[C@@]4(C)OC(=O)CC[C@@H]34)[C@@]21C ZINC000254043401 GI Annotated Mild CC(=O)S[C@@H]1CC(=O)C=C2CC[C@@H]3[C@@H]4CCC(=O)O[C@]4(C)CC[C@H]3[C@]21C ZINC000254043403 GI Annotated Mild CC[N@+]1(C)CC[C@](O)(/C=C/c2ccccc2)[C@@H](C(=O)/C=C/c2ccccc2)C1 ZINC000254047430 GI Annotated Mild CC[N@+]1(C)CC[C@](O)(/C=C/c2ccccc2)[C@H](C(=O)/C=C/c2ccccc2)C1 ZINC000254047438 GI Annotated Mild CC[N@+]1(C)CC[C@@](O)(/C=C/c2ccccc2)[C@@H](C(=O)/C=C/c2ccccc2)C1 ZINC000254047443 GI Annotated Mild CN(Cc1ccc(C#N)cc1)[C@@H]1CC[C@@H]([C@H](N)Cc2cc(F)ccc2F)CC1 ZINC000254051130 GI Annotated Mild C[N@@+]1(CC(=O)c2ccc(I)cc2)CCCc2ccccc21 ZINC000254071213 GI Annotated Mild C[N@+]1(CC(=O)c2ccc(I)cc2)CCCc2ccccc21 ZINC000254071217 GI Annotated Mild O=C1[C@@H]2c3[nH]c4ccccc4c3[C@@H]3CCSC[C@H]3[C@H]2C(=O)N1c1ccccc1 ZINC000254077168 GI Annotated Anodyne O=C1[C@@H]2c3[nH]c4ccccc4c3[C@@H]3CCSC[C@H]3[C@@H]2C(=O)N1c1ccccc1 ZINC000254077169 GI Annotated Anodyne O=C1[C@@H]2c3[nH]c4ccccc4c3[C@@H]3CCSC[C@@H]3[C@H]2C(=O)N1c1ccccc1 ZINC000254077170 GI Annotated Anodyne Cc1ccc(/C=C2\CN(C)C[C@@H]3C2=NC(=S)N[C@H]3c2ccc(C)cc2)cc1 ZINC000254079375 GI Annotated Anodyne Cc1c(N[C@@H]2CC[C@@H](N)CC2)nc2ccnn2c1Nc1ccc(F)c(Cl)c1 ZINC000254093799 GI Annotated Anodyne C[C@@H]1CC[C@@H]([C@](C)(NC(=O)c2ccsc2)c2cn(C(C)(C)C#N)nn2)CC1 ZINC000254133043 GI Annotated Mild C/C=C(/C)C(=O)O[C@@H]1C[C@H](C)[C@H]2CC(=O)C(C)=C2C[C@H]1C(C)(C)OC(C)=O ZINC000254143497 GI Annotated Mild C/C=C(/C)C(=O)O[C@@H]1C[C@@H](C)[C@H]2CC(=O)C(C)=C2C[C@H]1C(C)(C)OC(C)=O ZINC000254143499 GI Annotated Mild O=C1c2ccccc2NC(=O)[C@@H]2[C@@H]1[C@H](c1ccccc1)C[C@]2(O)c1ccccc1 ZINC000254201662 GI Annotated Anodyne O=C1c2ccccc2NC(=O)[C@@H]2[C@@H]1[C@@H](c1ccccc1)C[C@@]2(O)c1ccccc1 ZINC000254201664 GI Annotated Anodyne COc1ccc(CCN2C(=O)CSC2=Nc2ccc(C)cc2C)cc1OC ZINC000254393881 GI Annotated Mild Oc1c(Br)cc(Br)cc1C=Nc1ccc2c(c1)OCO2 ZINC000254408402 GI Annotated Mild aggregator Cn1cc(C=Nn2cnc3scc(-c4ccccc4)c3c2=O)c2ccccc21 ZINC000254412443 GI Annotated Mild aggregator O=C1N/C(=N\N=Cc2cccs2)S[C@@H]1Cc1cccc(Cl)c1Cl ZINC000254494340 GI Annotated Mild aggregator O=C1N/C(=N\N=Cc2cccs2)S[C@H]1Cc1cccc(Cl)c1Cl ZINC000254494342 GI Annotated Mild aggregator Oc1c(Br)cccc1C=NNc1c(F)c(F)c(F)c(F)c1F ZINC000254512586 GI Annotated Mild aggregator O=C(NN=Cc1c[nH]c2ccccc12)c1cc(-c2ccc3ccccc3c2)n[nH]1 ZINC000254525298 GI Annotated Reactive aggregator O=C(NN=Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1C[C@@H]1c1ccccc1 ZINC000254556170 GI Annotated Reactive aggregator O=C(NN=Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1C[C@@H]1c1ccccc1 ZINC000254683424 GI Annotated Reactive aggregator CC(C)Oc1cccc(-c2n[nH]c(=S)n2N=Cc2cccc([N+](=O)[O-])c2)c1 ZINC000254746028 GI Annotated Mild Cc1ccc(C=N/N=C2/N=C(O)[C@H](CC(=O)Nc3ccc(Cl)cc3)S2)o1 ZINC000254752897 GI Annotated Mild aggregator Cc1ccc(C=N/N=C2/N=C(O)[C@@H](CC(=O)Nc3ccc(Cl)cc3)S2)o1 ZINC000254752901 GI Annotated Mild aggregator COc1ccc(N=Cc2cc3c(cc2O)OC(N)=C(C#N)[C@@H]3c2ccccc2)cc1 ZINC000254756613 GI Annotated Reactive aggregator COc1ccc(N=Cc2cc3c(cc2O)OC(N)=C(C#N)[C@H]3c2ccccc2)cc1 ZINC000254756614 GI Annotated Reactive aggregator Cc1cc(-c2nnc(S)n2N=Cc2c3ccccc3cc3ccccc23)n[nH]1 ZINC000254823354 GI Annotated Mild COc1ccc2c(c1[N+](=O)[O-])CCCC2=NOC(=O)c1ccccc1SC ZINC000254865735 GI Annotated Mild aggregator CN(C)Cc1cc(C(=O)/C=C/c2c(F)cccc2Cl)cc(CN(C)C)c1O ZINC000025978817 GI Annotated Mild C=C1[C@@H](NC)CC[C@]23C[C@]24CC[C@]2(C)[C@@H]([C@H](C)NC)[C@H](O)C[C@@]2(C)[C@@H]4CC[C@H]13 ZINC000255200894 GI Annotated Mild C=C1[C@@H](NC)CC[C@]23C[C@]24CC[C@]2(C)[C@@H]([C@H](C)NC)[C@H](O)C[C@]2(C)[C@H]4CC[C@@H]13 ZINC000255200895 GI Annotated Mild C=C1[C@H](NC)CC[C@]23C[C@]24CC[C@@]2(C)[C@H]([C@@H](C)NC)[C@@H](O)C[C@@]2(C)[C@@H]4CC[C@@H]13 ZINC000255200896 GI Annotated Mild C=C1[C@H](NC)CC[C@]23C[C@]24CC[C@]2(C)[C@@H]([C@H](C)NC)[C@H](O)C[C@]2(C)[C@H]4CC[C@@H]13 ZINC000255200897 GI Annotated Mild C=C1[C@@H](NC)CC[C@]23C[C@]24CC[C@]2(C)[C@@H]([C@@H](C)NC)[C@H](O)C[C@@]2(C)[C@@H]4CC[C@@H]13 ZINC000255200898 GI Annotated Mild C=C1[C@H](NC)CC[C@]23C[C@]24CC[C@]2(C)[C@@H]([C@H](C)NC)[C@H](O)C[C@@]2(C)[C@@H]4CC[C@@H]13 ZINC000255200899 GI Annotated Mild C[C@]12CC[C@H](O)C[C@H]1CCC1=C3C[C@H](O)[C@H](c4ccc(=O)oc4)[C@@]3(C)CC[C@@H]12 ZINC000255212154 GI Annotated Anodyne C[C@]12CCC=C[C@@]1(O)CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)CC[C@]12O ZINC000255220058 GI Annotated Anodyne CN[C@H](C)[C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)[C@@H](O)CC[C@@]45C[C@@]35CC[C@]12C ZINC000255222601 GI Annotated Anodyne CC/C=C(C)/C=C(\C)[C@H](O)[C@H](C)[C@@]12O[C@H]3[C@@H](C)[C@@](CC)(O1)O[C@@](O)([C@@H]2C)[C@@H]3C ZINC000255260385 GI Annotated Anodyne CC(=O)O[C@@H]1C[C@@H]2[C@@]3(C)CCC(=O)C(C)(C)[C@@H]3CC[C@@]2(C)[C@]2(C)[C@@H](O)C=C[C@@H]12 ZINC000255262129 GI Annotated Anodyne O=C1C(=NNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c2ccccc2-c2ccccc21 ZINC000256435899 GI Annotated Mild C=C1[C@H]2CC(=O)[C@@H]([C@@H](C)OC(C)=O)[C@@H]2[C@@H](C(C)C)C[C@H]1OC(=O)/C=C(\C)CC ZINC000257394616 GI Annotated Mild in-man C=C1[C@H]2CC(=O)[C@H]([C@H](C)OC(C)=O)[C@@H]2[C@@H](C(C)C)C[C@H]1OC(=O)/C=C(\C)CC ZINC000257394617 GI Annotated Mild in-man CC1=CC[C@H]([C@@](C)(Cl)CCl)O[C@H]1C(Br)Br ZINC000257420469 GI Annotated Reactive COC(=O)[C@]1(OC(C)=O)C[C@@]23CC[C@@H]4[C@](C)(C=O)CCC[C@]4(C)[C@H]2CC[C@H]1C3 ZINC000257422589 GI Annotated Mild COC(=O)[C@]1(OC(C)=O)C[C@@]23CC[C@@H]4[C@](C)(C=O)CCC[C@]4(C)[C@@H]2CC[C@H]1C3 ZINC000257422590 GI Annotated Mild Cc1cc(O)cc(O)c1C(=O)O[C@@H]1C[C@]2(C)[C@@H]3CC(C)(C)C[C@@H]3C=C(C=O)[C@H]12 ZINC000257491487 GI Annotated Reactive Cc1cc(O)cc(O)c1C(=O)O[C@@H]1C[C@@]2(C)[C@H]1C(C=O)=C[C@@H]1CC(C)(C)C[C@H]12 ZINC000257491488 GI Annotated Reactive C=C1[C@@H](NC)CC[C@@]2(C)[C@H]1CC[C@H]1[C@H]2CC[C@]2(C)[C@H]([C@H](C)NC)[C@H](O)C[C@]12C ZINC000257526271 GI Annotated Mild C=C1[C@@H](NC)CC[C@@]2(C)[C@H]1CC[C@H]1[C@H]2CC[C@]2(C)[C@H]([C@@H](C)NC)[C@H](O)C[C@]12C ZINC000257526272 GI Annotated Mild C=C1[C@@H](NC)CC[C@@]2(C)[C@H]1CC[C@H]1[C@H]2CC[C@]2(C)[C@H]([C@@H](C)NC)[C@@H](O)C[C@]12C ZINC000257526273 GI Annotated Mild C=C1[C@@H](NC)CC[C@@]2(C)[C@H]1CC[C@H]1[C@H]2CC[C@]2(C)[C@H]([C@H](C)NC)[C@@H](O)C[C@]12C ZINC000257526274 GI Annotated Mild Cc1cc(-n2ccc(=O)[nH]c2=O)cc(Cl)c1Sc1ccc(Cl)cc1 ZINC000026015352 GI Annotated Anodyne CCOc1nc(C(Cl)(Cl)Cl)c(Cl)c(OC(=O)COC)c1Cl ZINC000026022181 GI Annotated Anodyne CC(=O)Oc1nc(C(Cl)(Cl)Cl)c(Cl)c(OC(C)=O)c1Cl ZINC000026023266 GI Annotated Anodyne Cc1cccc(S[C@@]2(CC#Cc3ccc(Cl)cc3)SC(=O)NC2=O)n1 ZINC000026028851 GI Annotated Mild Cc1cccc(S[C@]2(CC#Cc3ccc(Cl)cc3)SC(=O)NC2=O)n1 ZINC000026028861 GI Annotated Mild Cc1ccc(OCCOc2ccc(Cl)cc2Br)c([N+](=O)[O-])n1 ZINC000026036771 GI Annotated Bother O=C(O)CCC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=C/[C@@H](O)c3ccc4c(c3)CCC4)[C@H]2C1 ZINC000026147543 GI Annotated Anodyne O=C(O)CCC/C=C1/C[C@@H]2[C@@H](/C=C/[C@@H](O)c3ccc4c(c3)CCC4)[C@H](O)C[C@H]2C1 ZINC000026147551 GI Annotated Anodyne O=C(O)CCC/C=C1\C[C@H]2C[C@@H](O)[C@H](/C=C/[C@@H](O)c3ccc4c(c3)CCC4)[C@@H]2C1 ZINC000026147560 GI Annotated Anodyne O=C(O)CCC/C=C1\C[C@@H]2C[C@@H](O)[C@H](/C=C/[C@@H](O)c3ccc4c(c3)CCC4)[C@@H]2C1 ZINC000026147568 GI Annotated Anodyne O=C1C(Cl)=C(Nc2ccc(Cl)cc2)C(=O)c2[nH]c(-c3ccccn3)nc21 ZINC000026150157 GI Annotated Mild CC#Cc1ccc2[nH]c(C(=O)N3C[C@H]4C[C@@]45C3=CC(=O)c3ccccc35)cc2c1 ZINC000026154786 GI Annotated Mild Cc1cc(NC(=O)[C@@H]2C(=O)N3c4ccccc4Sc4cccc2c43)sn1 ZINC000026157313 GI Annotated Anodyne O=C(Nc1ccc(F)cc1F)[C@@H]1C(=O)N2c3ccccc3Oc3cccc1c32 ZINC000026158000 GI Annotated Anodyne Cc1cc(NC(=O)[C@@H]2C(=O)N3c4ccc(F)cc4Cc4cc(F)cc2c43)ns1 ZINC000026161681 GI Annotated Anodyne CCOc1ccc2[nH]c(C(=O)N3C[C@H]4C[C@@]45C3=CC(=O)c3ccccc35)cc2c1 ZINC000026162390 GI Annotated Mild O=C(Nc1c(F)cccc1F)[C@H]1C(=O)N2c3ccccc3Cc3cccc1c32 ZINC000026162968 GI Annotated Anodyne O=C1Cc2c(OCCNCc3cccc(-c4ccccc4)c3)ccc(F)c2N1 ZINC000026163524 GI Annotated Anodyne O=C(Nc1cc(F)ccc1F)[C@H]1C(=O)N2c3ccc(F)cc3Cc3cccc1c32 ZINC000026163619 GI Annotated Anodyne CCC(=O)c1ccc2[nH]c(C(=O)N3C[C@H]4C[C@@]45C3=CC(=O)c3ccccc35)cc2c1 ZINC000026164055 GI Annotated Mild CN(Cc1ccccc1)C(=O)N1CC(=O)Nc2ccccc2[C@@H]1c1ccccc1 ZINC000026166357 GI Annotated Anodyne CN(Cc1ccccc1)C(=O)N1CC(=O)Nc2ccccc2[C@H]1c1ccccc1 ZINC000026166362 GI Annotated Anodyne O=S(=O)(O)O[C@@H](CCc1ccccc1)COCc1cccc2ccccc12 ZINC000026168291 GI Annotated Anodyne O=S(=O)(O)O[C@H](CCc1ccccc1)COCc1cccc2ccccc12 ZINC000026168294 GI Annotated Anodyne COc1cccc2c1-c1ccc(NS(C)(=O)=O)cc1[C@H](c1ccc(F)cc1)O2 ZINC000026175451 GI Annotated Anodyne COc1cccc2c1-c1ccc(NS(C)(=O)=O)cc1[C@@H](c1ccc(F)cc1)O2 ZINC000026175457 GI Annotated Anodyne O=C(O)c1cccc2c1[nH]c1c3cc(I)ccc3oc21 ZINC000026182796 GI Annotated Bother C=CCN(c1nccc(-c2c(OC)cc(OC)cc2OC)n1)C(C1CC1)C1CC1 ZINC000026183645 GI Annotated Mild COc1cccc2c1-c1ccc(NS(C)(=O)=O)cc1[C@H](c1cccs1)O2 ZINC000026187081 GI Annotated Anodyne COc1cccc2c1-c1ccc(NS(C)(=O)=O)cc1[C@@H](c1cccs1)O2 ZINC000026187086 GI Annotated Anodyne COc1c(Cl)ccc2c1[C@](C#Cc1ccccc1)(C(F)(F)F)NC(=O)N2 ZINC000026247795 GI Annotated Mild CC(C)C(=O)Oc1c2c(c(OC(=O)C(C)C)c3cc(Cl)ccc13)OCCO2 ZINC000026248899 GI Annotated Anodyne C=CCc1c(OC(C)=O)c2cccnc2n(-c2cccc(C(F)(F)F)c2)c1=O ZINC000026253524 GI Annotated Mild CCCCc1c(OCCCN(C)C)c2cccnc2n(-c2ccccc2)c1=O ZINC000026256095 GI Annotated Anodyne CCCCc1c(OC(C)=O)c2cccnc2n(-c2ccc(SC)cc2)c1=O ZINC000026259547 GI Annotated Anodyne O=C(O)C1=CN(CCOCCC2c3ccccc3CCc3ccccc32)CCC1 ZINC000026271757 GI Annotated Anodyne CN(CC[C@@H]1CN(C)C(=S)c2cccnc2O1)Cc1ccc(C(C)(C)C)cc1 ZINC000026279610 GI Annotated Anodyne CN(CC[C@H]1CN(C)C(=S)c2cccnc2O1)Cc1ccc(C(C)(C)C)cc1 ZINC000026279616 GI Annotated Anodyne O=S1N=C(NCCCc2ccccc2)C(Nc2cc(Cl)cc(Cl)c2)=N1 ZINC000026284430 GI Annotated Anodyne O[C@H](c1cc(C(F)(F)F)nc2c(C(F)(F)F)cccc12)[C@@H]1CCCNC1 ZINC000026288408 GI Annotated Anodyne O[C@@H](c1cc(C(F)(F)F)nc2c(C(F)(F)F)cccc12)[C@@H]1CCCNC1 ZINC000026288413 GI Annotated Anodyne O[C@H](c1cc(C(F)(F)F)nc2c(C(F)(F)F)cccc12)[C@H]1CCCNC1 ZINC000026288418 GI Annotated Anodyne O[C@@H](c1cc(C(F)(F)F)nc2c(C(F)(F)F)cccc12)[C@H]1CCCNC1 ZINC000026288422 GI Annotated Anodyne CN(C)CCN1C(=O)c2cccc3nc(-c4ccc5ccccc5c4)cc(c23)C1=O ZINC000026294695 GI Annotated Anodyne CCCCn1c(=O)c2cc([N+](=O)[O-])ccc2c2cnc3cc4c(cc3c21)OCO4 ZINC000026295230 GI Annotated Bother O=C1Nc2ccccc2C(c2ccccc2F)=N[C@H]1NCc1cc2ccccc2[nH]1 ZINC000026377013 GI Annotated Anodyne O=C1Nc2ccccc2C(c2ccccc2F)=N[C@@H]1NCc1cc2ccccc2[nH]1 ZINC000026377014 GI Annotated Anodyne Cc1noc(-c2ncn3c2CN=C(c2ccccc2)c2c(Cl)cccc2-3)n1 ZINC000026380575 GI Annotated Anodyne CCc1nc(-c2ncn3c2CN=C(c2ccccc2Cl)c2ccccc2-3)no1 ZINC000026380633 GI Annotated Anodyne Cc1nc(-c2ncn3c2CN=C(c2ccccc2Cl)c2ccccc2-3)no1 ZINC000026380636 GI Annotated Anodyne Cc1noc(-c2ncn3c2CN=C(c2ccccc2Cl)c2ccccc2-3)n1 ZINC000026380639 GI Annotated Anodyne CCc1noc(-c2ncn3c2CN=C(c2ccccc2)c2c(Cl)cccc2-3)n1 ZINC000026380962 GI Annotated Anodyne CCCc1nc(-c2ncn3c2CN=C(c2ccccc2)c2c(F)cccc2-3)no1 ZINC000026382218 GI Annotated Anodyne CCc1nc(-c2ncn3c2CN=C(c2ccccc2)c2c(Cl)cccc2-3)no1 ZINC000026389168 GI Annotated Anodyne Cc1nc(-c2ncn3c2CN=C(c2ccccc2)c2c(Cl)cccc2-3)no1 ZINC000026389172 GI Annotated Anodyne CCN1CCN(CC)[C@H](c2ccc(OC)cc2F)[C@@H]1c1ccc(OC)cc1F ZINC000026390096 GI Annotated Anodyne CCCc1noc(-c2ncn3c2CN=C(c2ccccc2)c2c(F)cccc2-3)n1 ZINC000026392191 GI Annotated Anodyne O=C(O)C1(c2ccc3c(c2)OC[C@H](Cc2ccc(F)cc2F)[C@H]3O)CCCC1 ZINC000026393001 GI Annotated Anodyne CCCc1c2c(=O)c(OC)ccc-2c2ccc3cc4c(cc3c2n1C)OCO4 ZINC000026398051 GI Annotated Anodyne CC1(C)OC[C@@H](O)[C@H](NCc2ccc3ccc4cccc5ccc2c3c45)CO1 ZINC000026403785 GI Annotated Bother CC(C)(C)c1nn(-c2ccccc2)c2[nH]c(=O)c(CNCc3ccccc3)cc12 ZINC000026440429 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C)[C@@H](/N=C(\N)Nc1ccccc1I)C2 ZINC000026487789 GI Annotated Mild CC1(C)[C@H]2CC[C@]1(C)[C@@H](/N=C(\N)Nc1ccccc1I)C2 ZINC000026487795 GI Annotated Mild CCCC[n+]1cc2cc(OC)c(OC)cc2c2c1-c1cc3c(cc1C2)OCO3 ZINC000026498786 GI Annotated Anodyne Cc1cc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)ccc1N1CC[C@H](N2CCC[C@H]2C)C1 ZINC000261071577 GI Annotated Anodyne Cc1cc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)ccc1N1CC[C@@H](N2CCC[C@@H]2C)C1 ZINC000261071578 GI Annotated Anodyne Cc1cc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)ccc1N1CC[C@H](N2CCC[C@@H]2C)C1 ZINC000261071579 GI Annotated Anodyne Cc1cc(NC(=O)[C@@H]2C[C@H]3CC[C@H]2C3)ccc1N1CC[C@@H](N2CCC[C@H]2C)C1 ZINC000261071580 GI Annotated Anodyne C[C@@H](NC(=O)Nc1ncc2c(-c3ccnc(F)c3)n[nH]c2c1F)c1ccccc1 ZINC000261071587 GI Annotated Anodyne CN1c2ccccc2Sc2ccc([C@]3(O)CN(C)[C@@H]4CCCC[C@H]4O3)cc21 ZINC000261072777 GI Annotated Clean CN1c2ccccc2Sc2ccc([C@]3(O)CN(C)[C@@H]4CCCC[C@@H]4O3)cc21 ZINC000261072781 GI Annotated Clean CCn1c(-c2ccc(Oc3ncccc3C(F)F)cc2C)c(C)c(O)nc1=O ZINC000261074079 GI Annotated Anodyne Cc1cc(NC(=O)NCc2cccs2)ccc1N1CC[C@H](N2CCC[C@H]2C)C1 ZINC000261083177 GI Annotated Anodyne CCc1c(-c2ccc(Oc3ncccc3C(F)F)cc2C)n(C)c(O)nc1=O ZINC000261087789 GI Annotated Anodyne Cc1cc(Oc2ncccc2C(F)(F)F)ccc1-c1c(C)cnc(=O)n1C ZINC000261093743 GI Annotated Anodyne COc1cc2cc([C@@H]3CC[N@@+](C)(Cc4ccccc4)C[C@H]3O)sc2cc1OC ZINC000261099913 GI Annotated Bother COc1cc2cc([C@@H]3CC[N@@+](C)(Cc4ccccc4)C[C@@H]3O)sc2cc1OC ZINC000261099916 GI Annotated Bother COc1cc2cc([C@@H]3CC[N@+](C)(Cc4ccccc4)C[C@H]3O)sc2cc1OC ZINC000261099919 GI Annotated Bother COc1cc2cc([C@@H]3CC[N@+](C)(Cc4ccccc4)C[C@@H]3O)sc2cc1OC ZINC000261099922 GI Annotated Bother Cc1cc(Oc2ncccc2OC(F)(F)F)ccc1-c1c(C)n[nH]c(=O)c1C ZINC000261103162 GI Annotated Anodyne CN(Cc1cccc(C#N)c1)[C@@H]1CC[C@@H]([C@H](N)Cc2cc(F)ccc2F)CC1 ZINC000261110754 GI Annotated Mild COc1ccnc(Oc2ccc(-c3c(C)n[nH]c(=O)c3C)c(C)c2)c1C(F)F ZINC000261112820 GI Annotated Anodyne COC(=O)[C@H]1[C@H]2CC[C@H]3CC[C@H]1N(C/C2=C\c1ccc(-n2cccc2)cc1)C3 ZINC000261120754 GI Annotated Anodyne COC(=O)[C@@H]1[C@H]2CC[C@H]3CC[C@H]1N(C/C2=C\c1ccc(-n2cccc2)cc1)C3 ZINC000261120759 GI Annotated Anodyne C[C@H]1CN(c2ccccc2Sc2ccc(Cl)cc2)[C@H](C)CN1CC(=O)O ZINC000261123476 GI Annotated Anodyne OC[C@@H]1[C@H]2CC[C@@H](C2)[C@H]1NCc1cccc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000261127966 GI Annotated Anodyne OC[C@@H]1[C@H]2CC[C@@H](C2)[C@@H]1NCc1cccc(-c2ccc(C(F)(F)F)cc2)n1 ZINC000261127967 GI Annotated Anodyne CCc1[nH]nc(NC[C@@H]2CC[C@@H](NC(=O)c3cc(Cl)cnc3C)CC2)c1C ZINC000261128475 GI Annotated Anodyne Cc1cc(Oc2ncccc2Br)ccc1-c1c(C)n[nH]c(=O)c1C ZINC000261136206 GI Annotated Anodyne CN1C[C@](O)(c2ccc(-c3nc4ccccc4s3)cc2)O[C@@H]2CCCC[C@H]21 ZINC000261138427 GI Annotated Anodyne CN1C[C@](O)(c2ccc(-c3nc4ccccc4s3)cc2)O[C@H]2CCCC[C@H]21 ZINC000261138428 GI Annotated Anodyne C[C@@H]1CCCN1[C@H]1CCN(c2ccc(NC(=O)NCc3cccs3)cc2)C1 ZINC000261139856 GI Annotated Anodyne C[C@H]1CCCN1[C@H]1CCN(c2ccc(NC(=O)NCc3cccs3)cc2)C1 ZINC000261139858 GI Annotated Anodyne C[C@@H](NC(=O)Nc1cc2[nH]nc(-c3cn[nH]c3)c2cn1)c1ccc(F)c(Cl)c1 ZINC000261145023 GI Annotated Anodyne CCO[C@@H]1CC[C@@](C)(N2CCC(n3c(=O)oc4cc(F)c(C)cc43)CC2)CC1 ZINC000261147781 GI Annotated Anodyne Cc1cc(N2CC[C@H](N3CCC[C@@H]3C)C2)ccc1NC(=O)[C@H]1C[C@H]2CC[C@H]1C2 ZINC000261152122 GI Annotated Anodyne Cc1cc(N2CC[C@H](N3CCC[C@@H]3C)C2)ccc1NC(=O)[C@@H]1C[C@H]2CC[C@H]1C2 ZINC000261152123 GI Annotated Anodyne CCCO[C@@H]1CC[C@@](C)(N2CCC(N3C(=O)Cc4ccc(C)cc43)CC2)CC1 ZINC000261160404 GI Annotated Anodyne C[C@H]1CCCN1[C@H]1CCN(c2ccc(NC(=O)C3CC3)c(C(F)(F)F)c2)C1 ZINC000261160633 GI Annotated Anodyne C[C@@H]1CCCN1[C@H]1CCN(c2ccc(NC(=O)C3CC3)c(C(F)(F)F)c2)C1 ZINC000261160636 GI Annotated Anodyne CCCc1cc(NC[C@@H]2CC[C@@H](NC(=O)c3cc(Cl)cnc3C)CC2)n[nH]1 ZINC000261175822 GI Annotated Anodyne CCO[C@@H]1CC[C@@](C)(N2CCC(n3c(=O)oc4c(F)cc(C)cc43)CC2)CC1 ZINC000261186752 GI Annotated Anodyne COc1cc(/C=C2\Oc3cccc(OC)c3C2=O)c(OC)cc1Br ZINC000261187252 GI Annotated Mild O=[N+]([O-])c1cc(C=NN2CCN(Cc3ccccc3Cl)CC2)ccc1Cl ZINC000263590416 GI Annotated Mild O=C(Nc1ccc(Br)cc1)O[C@@H]1C[C@H]2C[C@H]1[C@H]1CCCCN1C2 ZINC000263590852 GI Annotated Anodyne O=C(Nc1ccc(Br)cc1)O[C@H]1C[C@H]2C[C@H]1[C@H]1CCCCN1C2 ZINC000263590853 GI Annotated Anodyne COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CC[C@]13CC(=NO)[C@](OC(C)=O)(CC[C@@H]21)C3 ZINC000263591707 GI Annotated Mild COC(=O)[C@]1(C)CCC[C@@]2(C)[C@H]3CC[C@]4(OC(C)=O)C[C@@]3(CC[C@@H]21)CC4=NO ZINC000263591708 GI Annotated Mild COC(=O)[C@]1(C)CCC[C@@]2(C)[C@H]3CC[C@]4(OC(C)=O)C[C@@]3(CC[C@H]21)CC4=NO ZINC000263591709 GI Annotated Mild COC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@]4(OC(C)=O)C[C@@]3(CC[C@H]21)CC4=NO ZINC000263591710 GI Annotated Mild O=C(c1cc(COc2ccc(F)cc2F)on1)N1C[C@H]2C[C@H]3C[C@H]1C[C@H](C3)C2 ZINC000263591720 GI Annotated Anodyne CC(=O)c1ccc(OCc2cc(C(=O)N3C[C@H]4C[C@H]5C[C@H]3C[C@H](C5)C4)no2)cc1 ZINC000263591747 GI Annotated Anodyne CC(=O)c1cccc(OCc2cc(C(=O)N3C[C@H]4C[C@H]5C[C@H]3C[C@H](C5)C4)no2)c1 ZINC000263591749 GI Annotated Anodyne Fc1ccccc1-c1csc(=Nc2cccnc2)n1CCCn1ccnc1 ZINC000263592195 GI Annotated Anodyne CC[C@H](N=c1cc(-c2ccc(OC)c(OC)c2)oc2ccc(C)cc12)C(=O)O ZINC000263592206 GI Annotated Anodyne CC[C@@H](N=c1cc(-c2ccc(OC)c(OC)c2)oc2ccc(C)cc12)C(=O)O ZINC000263592207 GI Annotated Anodyne COCCN=c1scc(-c2ccccc2)n1N/C=C1\C=Nc2ccccc21 ZINC000263592235 GI Annotated Anodyne COc1cccc(N2C(=O)[C@@H]3c4[nH]c5ccccc5c4[C@@H]4CCC[C@H]4[C@@H]3C2=O)c1 ZINC000263604108 GI Annotated Anodyne O=C(O)[C@H]1[C@](Br)(c2ccccc2)[C@]1(Br)c1ccccc1 ZINC000263604572 GI Annotated Anodyne c1ccc2c(c1)N[C@H]([C@@H]1O[C@@H]3CCCN3[C@@H]1[C@@H]1Nc3ccccc3S1)S2 ZINC000263607831 GI Annotated Anodyne c1ccc2c(c1)N[C@H]([C@@H]1[C@H]([C@H]3Nc4ccccc4S3)O[C@@H]3CCCN13)S2 ZINC000263607832 GI Annotated Anodyne c1ccc2c(c1)N[C@H]([C@@H]1O[C@@H]3CCCN3[C@H]1[C@H]1Nc3ccccc3S1)S2 ZINC000263607833 GI Annotated Anodyne c1ccc2c(c1)N[C@H]([C@@H]1O[C@@H]3CCCN3[C@H]1[C@@H]1Nc3ccccc3S1)S2 ZINC000263607834 GI Annotated Anodyne Fc1ccc([C@@H]2NCCO[C@@]23COC[C@H](c2ccccc2C(F)(F)F)C3)cc1 ZINC000026501239 GI Annotated Anodyne Fc1ccc([C@@H]2NCCO[C@]23COC[C@H](c2ccccc2C(F)(F)F)C3)cc1 ZINC000026501242 GI Annotated Anodyne Fc1ccc([C@@H]2NCCO[C@@]23COC[C@H](c2cccc(C(F)(F)F)c2)C3)cc1 ZINC000026503568 GI Annotated Anodyne Fc1ccc([C@@H]2NCCO[C@]23COC[C@H](c2cccc(C(F)(F)F)c2)C3)cc1 ZINC000026503570 GI Annotated Anodyne C[C@H](c1ccccc1)N1C(=O)C2(CCCC2)c2c1nc(-c1ccccc1)[nH]c2=O ZINC000026503622 GI Annotated Anodyne Cn1c(Cc2nn(C)c(=O)c3ccccc23)ccc1SCc1ccccc1 ZINC000026567596 GI Annotated Anodyne C[C@@H]1OC2(CCN(C)CC2)C/C1=N\NC(=O)c1ccc(C2CCCCC2)cc1 ZINC000026568749 GI Annotated Reactive C[C@H]1OC2(CCN(C)CC2)C/C1=N\NC(=O)c1ccc(C2CCCCC2)cc1 ZINC000026568752 GI Annotated Reactive COc1cc2nc(Nc3c(C)cccc3Cl)c3cnc(C=O)n3c2cc1OC ZINC000026571065 GI Annotated Anodyne O=C(O)CCCc1ccc(NC(=O)/C=C/c2c(F)c(F)c(F)c(F)c2F)cc1 ZINC000026571633 GI Annotated Anodyne CC[C@@H](C)n1c(=O)n(C)c(=O)c2cn(CC3=Cc4cccc5cccc3c45)cc21 ZINC000026575578 GI Annotated Anodyne CC[C@H](C)n1c(=O)n(C)c(=O)c2cn(CC3=Cc4cccc5cccc3c45)cc21 ZINC000026575579 GI Annotated Anodyne Cc1ccc(-c2nn(-c3cccc(C(F)(F)F)c3)cc2CC(=O)N(C)C)cc1 ZINC000026578291 GI Annotated Anodyne CCCn1cc2c3c(cccc31)C[C@@H](N(C)CCC(=O)NC1CCCCC1)C2 ZINC000026579674 GI Annotated Clean O=C(N/C(C(=O)N1CCCCC1)=C(/Cl)c1ccccc1)c1ccc(F)cc1 ZINC000026644204 GI Annotated Anodyne CC(C)S(=O)(=O)n1c(CCc2ccccn2)nc2cc(Cl)c(Cl)cc21 ZINC000026648218 GI Annotated Anodyne Cc1ccc2c(c1CC[C@@H](Br)C(C)(C)O)C(=O)C(=O)C(C(C)C)=C2 ZINC000026652470 GI Annotated Reactive Cc1ccc2c(c1CC[C@H](Br)C(C)(C)O)C(=O)C(=O)C(C(C)C)=C2 ZINC000026652474 GI Annotated Reactive O=C(N/C(C(=O)N1CCCCC1)=C(/Cl)c1ccc(F)cc1)c1ccccc1 ZINC000026652664 GI Annotated Anodyne Cc1cc2c(n1-c1ccccc1)CCc1cc(C(=O)c3ccccc3)c(=O)[nH]c1-2 ZINC000026668870 GI Annotated Clean CCCC(=O)c1cnc2c(OCCO)cccc2c1Nc1ccc(O)cc1C ZINC000026669003 GI Annotated Anodyne COC(=O)c1sc(C(C)(C)C)cc1NC(=O)Nc1nnc(C2CC2)s1 ZINC000026670378 GI Annotated Anodyne O=c1c2c(ncn2Cc2ccc(Cl)cc2)c2cccnc2n1-c1ccccc1 ZINC000026721963 GI Annotated Anodyne CC(C)c1nc2c(Nc3ccc(Cl)cc3)nc(N3CCC(=O)CC3)nc2[nH]1 ZINC000026725222 GI Annotated Anodyne O=c1[nH]c2cc(C(F)(F)F)c(-n3cccc3)cc2n(C2CCCCC2)c1=O ZINC000026726137 GI Annotated Anodyne O=c1c2c(ncn2C/C=C/c2ccccc2)c2cccnc2n1-c1ccccc1 ZINC000026726210 GI Annotated Anodyne Cc1ccc(C)c(Cn2cnc3c4cccnc4n(-c4ccccc4)c(=O)c32)c1 ZINC000026727082 GI Annotated Anodyne CO[C@@H](C)C(=O)N(c1ccccc1)[C@@H]1CCN(CCc2cccs2)C[C@@H]1C ZINC000026728597 GI Annotated Anodyne CO[C@H](C)C(=O)N(c1ccccc1)[C@@H]1CCN(CCc2cccs2)C[C@@H]1C ZINC000026728602 GI Annotated Anodyne CO[C@@H](C)C(=O)N(c1ccccc1)[C@H]1CCN(CCc2cccs2)C[C@@H]1C ZINC000026728606 GI Annotated Anodyne CO[C@H](C)C(=O)N(c1ccccc1)[C@H]1CCN(CCc2cccs2)C[C@@H]1C ZINC000026728611 GI Annotated Anodyne O=C1CCCN1C1=CC(CF)(CF)Oc2ccc(C(F)(F)C(F)(F)F)cc21 ZINC000026729121 GI Annotated Mild O=c1c2c(ncn2Cc2ccccc2Cl)c2cccnc2n1-c1ccccc1 ZINC000026732613 GI Annotated Anodyne O=C(O)CCC[C@@]1(Cc2ccncc2)C(=O)N(c2ccccc2)c2ccccc21 ZINC000026735031 GI Annotated Anodyne O=C(O)CCC[C@]1(Cc2ccncc2)C(=O)N(c2ccccc2)c2ccccc21 ZINC000026735035 GI Annotated Anodyne COC(=O)CC[C@@]1(Cc2ccncc2)C(=O)N(c2ccccc2)c2ccccc21 ZINC000026740488 GI Annotated Anodyne COC(=O)CC[C@]1(Cc2ccncc2)C(=O)N(c2ccccc2)c2ccccc21 ZINC000026740493 GI Annotated Anodyne Cc1nn(-c2cccc(Cl)c2)c2c1c(N1CCOCC1)nc1ccccc12 ZINC000026746156 GI Annotated Anodyne CCN(CC)[P@@](N)(=O)O[C@@H](C[C@@H]1NC(C)(C)C[C@@H](C)O1)c1ccccc1 ZINC000026823618 GI Annotated Anodyne CCN(CC)[P@](N)(=O)O[C@@H](C[C@@H]1NC(C)(C)C[C@@H](C)O1)c1ccccc1 ZINC000026823623 GI Annotated Anodyne CCN(CC)[P@](N)(=O)O[C@H](C[C@@H]1NC(C)(C)C[C@@H](C)O1)c1ccccc1 ZINC000026823628 GI Annotated Anodyne COc1cc(-n2c(-c3ccc4ccccc4c3)coc2=O)cc(OC)c1OC ZINC000026831924 GI Annotated Anodyne CCOC(=O)Cn1c2ccccc2[n+]2nc3c(cc12)-c1cccc2cccc-3c12 ZINC000026832654 GI Annotated Anodyne COS(=O)(=O)Nc1ccc2c(Nc3ccc(N)cc3)c3ccccc3nc2c1 ZINC000026841392 GI Annotated Clean Cc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2cc(N)ccc12 ZINC000026847003 GI Annotated Clean COc1cc(-c2c3c(nc4cc5c(cc24)CCC5)COC3=O)cc(OC)c1OC ZINC000026847571 GI Annotated Anodyne Cc1cccc2c(Nc3ccc(NS(C)(=O)=O)cc3)c3ccc(N)cc3nc12 ZINC000026848505 GI Annotated Clean O[C@@](Cn1ccnc1)(c1ccc(-c2cccnc2)cc1)c1ccc(F)cc1F ZINC000026941351 GI Annotated Anodyne O[C@](Cn1ccnc1)(c1ccc(-c2cccnc2)cc1)c1ccc(F)cc1F ZINC000026941358 GI Annotated Anodyne CCO/N=C/c1ccc(OCCC2CCN(c3ccc(Cl)nn3)CC2)cc1 ZINC000026943563 GI Annotated Mild CCO/N=C(\C)c1ccc(OCCC2CCN(c3ccc(C)nn3)CC2)cc1 ZINC000026955117 GI Annotated Mild CCCOC1=Nc2c(cnn2-c2ccccc2)C2=N[C@H](C)[C@@H](c3ccccc3)N12 ZINC000026963501 GI Annotated Anodyne CCCOC1=Nc2c(cnn2-c2ccccc2)C2=N[C@@H](C)[C@H](c3ccccc3)N12 ZINC000026971835 GI Annotated Anodyne O=[N+]([O-])c1cc(I)c2oc(C3=CN4CCC3CC4)cc2c1 ZINC000026974560 GI Annotated Bother COc1ccc2c(ccn2CCCCOC(=O)Cc2ccc([N+](C)(C)C)cc2)c1 ZINC000026993642 GI Annotated Bother C[N+](C)(C)c1ccc(C(=O)OCCCCn2ccc3cc([N+](=O)[O-])ccc32)cc1 ZINC000026995643 GI Annotated Bother COc1ccc2c(ccn2CCCCOC(=O)c2cccc([N+](C)(C)C)c2)c1 ZINC000026995792 GI Annotated Bother C[n+]1cccc(C(=O)OCCCCCCCn2ccc3cc([N+](=O)[O-])ccc32)c1 ZINC000027079796 GI Annotated Bother COc1ccc2[nH]c3c(c(=O)c2c1)C(=O)C[C@H](c1ccc(C(F)(F)F)cc1)C3 ZINC000027085759 GI Annotated Anodyne COc1ccc2[nH]c3c(c(=O)c2c1)C(=O)C[C@@H](c1ccc(C(F)(F)F)cc1)C3 ZINC000027085766 GI Annotated Anodyne O=C(O)c1cn2c3c(c(Cl)c(F)cc3c1=O)S[C@H](c1ccccc1F)C2 ZINC000027094312 GI Annotated Anodyne O=C(O)c1cn2c3c(c(Cl)c(F)cc3c1=O)S[C@@H](c1ccccc1F)C2 ZINC000027094320 GI Annotated Anodyne CCN(CC)CCCn1[nH]c2c3cc(OC)ccc3nc3c([N+](=O)[O-])ccc1c32 ZINC000027096468 GI Annotated Bother O=C(O)c1cn2c3c(c(Cl)c(F)cc3c1=O)S[C@H](c1cccc(F)c1)C2 ZINC000027098789 GI Annotated Anodyne O=C(O)c1cn2c3c(c(Cl)c(F)cc3c1=O)S[C@@H](c1cccc(F)c1)C2 ZINC000027098796 GI Annotated Anodyne O=C(O)c1cn2c3c(c(Cl)c(F)cc3c1=O)S[C@H](c1ccc(F)cc1)C2 ZINC000027099232 GI Annotated Anodyne O=C(O)c1cn2c3c(c(Cl)c(F)cc3c1=O)S[C@@H](c1ccc(F)cc1)C2 ZINC000027099235 GI Annotated Anodyne COC(=O)c1cccc(Cc2cc(Cl)cc(Cc3ccccc3O)c2O)c1O ZINC000027100357 GI Annotated Anodyne COc1cc2cc3c4c(cccc4c2c(OC)c1O)C(=O)N3CCCCN(C)C ZINC000027104294 GI Annotated Bother O=C1C(Cl)=C(Nc2ccc(Cl)cc2)C(=O)c2[nH]c(C(F)(F)F)nc21 ZINC000027104649 GI Annotated Mild CSc1ccc2[nH]c3c([N+](=O)[O-])ccc4c3c(nn4CCCN(C)C)c2c1 ZINC000027104657 GI Annotated Bother COc1cc(-c2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)ccc1[S@@](C)=O ZINC000027107052 GI Annotated Anodyne COc1cc(-c2nc(-c3ccc4c(c3)CCC(=O)N4)cs2)ccc1[S@](C)=O ZINC000027107055 GI Annotated Anodyne Cc1ccc(CS[C@@H]2NC(=O)n3cnc(Cc4ccc(C)cc4)c3N2)cc1 ZINC000027108101 GI Annotated Anodyne Cc1ccc(CS[C@H]2NC(=O)n3cnc(Cc4ccc(C)cc4)c3N2)cc1 ZINC000027108104 GI Annotated Anodyne CCOc1ccc2[nH]c3c([N+](=O)[O-])ccc4c3c(nn4CCN(CC)CC)c2c1 ZINC000027108987 GI Annotated Bother O=C(O)c1ccc2c(c1)[C@H]1c3cccc[n+]3[C@@H]2CC1(c1ccoc1)c1ccoc1 ZINC000027110234 GI Annotated Anodyne O=C(O)c1ccc2c(c1)[C@@H]1c3cccc[n+]3[C@H]2CC1(c1ccoc1)c1ccoc1 ZINC000027110236 GI Annotated Anodyne COc1c(-c2cccc(C(F)(F)F)c2)oc2c(CC(=O)O)cccc2c1=O ZINC000027185269 GI Annotated Anodyne COc1cccc2c1cc1n2C(=O)[C@@H](SSCc2ccccc2)N(C)C1=O ZINC000027187509 GI Annotated Reactive O=C(O)[C@H]1C2c3ccccc3C(c3ccccc32)[C@@H]1C(=O)NCC1CCCCC1 ZINC000027189437 GI Annotated Anodyne O=C(O)[C@H]1C2c3ccccc3C(c3ccccc32)[C@H]1C(=O)NCC1CCCCC1 ZINC000027189442 GI Annotated Anodyne O=C(O)[C@@H]1C2c3ccccc3C(c3ccccc32)[C@H]1C(=O)NCC1CCCCC1 ZINC000027189447 GI Annotated Anodyne C[C@H]1C(=O)N(C(=O)NCc2ccccc2)[C@@H]1Oc1ccc(C(=O)C(C)(C)C)cc1 ZINC000027194557 GI Annotated Anodyne C[C@@H]1C(=O)N(C(=O)NCc2ccccc2)[C@@H]1Oc1ccc(C(=O)C(C)(C)C)cc1 ZINC000027195276 GI Annotated Anodyne COc1ccc2c(Cc3c(Cl)cncc3Cl)nnc(-n3ccnc3)c2c1 ZINC000027199339 GI Annotated Anodyne CCCCn1c2c(c3cc(OC)c(OC)cc3c1=O)Cc1cc3c(cc1-2)OCO3 ZINC000027206777 GI Annotated Anodyne O=C1c2cc(CCCCOC(=O)C(F)(F)F)ccc2OCc2ccsc21 ZINC000027209851 GI Annotated Anodyne C[S@@](=O)c1ccc(/C=C2\C=C(CCN3CCOCC3)c3ccccc32)cc1 ZINC000027213256 GI Annotated Anodyne C[S@](=O)c1ccc(/C=C2\C=C(CCN3CCOCC3)c3ccccc32)cc1 ZINC000027213260 GI Annotated Anodyne COc1ccc(/C=C2\C=C(CCN3CCOCC3)c3ccccc32)cc1OC ZINC000027213602 GI Annotated Anodyne Cc1cc2c(cc1C(=O)c1ccccc1)[n+]([O-])c1cc(Cl)c(Cl)cc1[n+]2[O-] ZINC000027214313 GI Annotated Bother O=S(=O)(OC(F)(F)F)c1cccc(-c2ccoc2C2=CN3CCC2CC3)c1 ZINC000027214549 GI Annotated Mild CCN1CCN(CCOc2ccccc2)[C@@H]2CCn3c(c(C)c4ccccc43)[C@@H]21 ZINC000027305245 GI Annotated Anodyne NCCCN(CCCCC1CC1)CCCCN(CCCN)CCCCC1CC1 ZINC000027307848 GI Annotated Anodyne CN1C(=O)CCc2ccc(Sc3ncc([C@@]4(C)COC(C)(C)O4)s3)cc21 ZINC000027308536 GI Annotated Clean CN1C(=O)COc2ccc(Sc3cc([C@@]4(C)COC(C)(C)O4)cs3)cc21 ZINC000027309058 GI Annotated Anodyne CN1C(=O)COc2ccc(Sc3cc([C@]4(C)COC(C)(C)O4)cs3)cc21 ZINC000027309063 GI Annotated Anodyne CCN1CCN(CC)[C@H]2c3c(C)c4cc(Br)ccc4n3CC[C@@H]21 ZINC000027316745 GI Annotated Anodyne C[C@H](Cc1c[nH]cn1)/N=C(\c1ccccc1)c1ccc(Br)cc1O ZINC000027406245 GI Annotated Mild CCCCC(=O)SC[C@H](CO[P@](=O)(O)OC)SC(=O)CCCC ZINC000027412341 GI Annotated Anodyne CC(=O)c1ccc(CCCCCOc2c(C)cc(-c3nnn(C)n3)cc2C)o1 ZINC000027413619 GI Annotated Anodyne CCC[C@H](C)[C@@H]1C[C@@]23C=C[C@]1(OC)[C@@H]1Oc4cccc5c4[C@@]12CCN(C)[C@@H]3C5 ZINC000027418045 GI Annotated Anodyne CCC[C@H](C)[C@H]1C[C@@]23C=C[C@]1(OC)[C@@H]1Oc4cccc5c4[C@@]12CCN(C)[C@@H]3C5 ZINC000027418049 GI Annotated Anodyne C=C1CCC[C@]2(C)C[C@H]3OC(=O)[C@@H](CN(C)[C@@H](C)[C@H](O)c4ccccc4)[C@H]3C[C@@H]12 ZINC000027430560 GI Annotated Mild C=C1CCC[C@]2(C)C[C@H]3OC(=O)[C@@H](CN(C)[C@H](C)[C@H](O)c4ccccc4)[C@H]3C[C@@H]12 ZINC000027430565 GI Annotated Mild C[C@]1(O)CC(=O)O[C@H](CSc2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)C1 ZINC000027432101 GI Annotated Anodyne COc1cccc(-c2ccc3c(c2)C[C@@H]2OC(=O)[C@@](C)(CCCCC(=N)N)[C@@H]32)c1 ZINC000027432203 GI Annotated Anodyne COc1cccc(-c2ccc3c(c2)C[C@@H]2OC(=O)[C@](C)(CCCCC(=N)N)[C@@H]32)c1 ZINC000027432208 GI Annotated Anodyne CC(C)NC(=N)c1ccc(/C=C/c2cn3cc(C(=N)NC(C)C)ccc3n2)cc1 ZINC000027433655 GI Annotated Anodyne COc1cccc(-c2ccc3c(c2)C[C@@H]2OC(=O)[C@H](CCCCC(=N)N)[C@@H]32)c1 ZINC000027437702 GI Annotated Anodyne COc1cccc(-c2ccc3c(c2)C[C@@H]2OC(=O)[C@@H](CCCCC(=N)N)[C@@H]32)c1 ZINC000027437707 GI Annotated Anodyne O=C(O)C1=Cc2ccccc2C(=NNc2cc(C(F)(F)F)ccc2Cl)C1=O ZINC000271773625 GI Annotated Mild C[C@@]1(O)CC(=O)O[C@H](CSc2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)C1 ZINC000027517461 GI Annotated Anodyne COc1ccc(-c2scc3[nH]c([S@@](=O)Cc4cc(OC)ccn4)nc23)cc1 ZINC000027520068 GI Annotated Anodyne COc1ccc(-c2scc3[nH]c([S@](=O)Cc4cc(OC)ccn4)nc23)cc1 ZINC000027520070 GI Annotated Anodyne O=C1CC[C@]2(c3c[nH]c4ccccc34)O[C@H](COc3ccc(Cl)cc3)CN12 ZINC000027521088 GI Annotated Anodyne O=C1CC[C@]2(c3ccc(Cl)cc3)O[C@H](CNc3ccc(Cl)cc3)CN12 ZINC000027521917 GI Annotated Anodyne O=[N+]([O-])c1ccc(NN=c2c3ccccc3oc3ccccc23)c([N+](=O)[O-])c1 ZINC000027522078 GI Annotated Bother Cc1cc(CCCCCOc2c(Cl)cc(C3=NCCO3)cc2[N+](=O)[O-])on1 ZINC000027522415 GI Annotated Bother O=C1CC[C@]2(c3ccc(Cl)cc3)O[C@@H](CNc3ccc(Cl)cc3)CN12 ZINC000027522664 GI Annotated Anodyne COC(=O)c1ccc2c(c1)sc1c(=O)n(CCCN(C)C)c3ccccc3c12 ZINC000027522749 GI Annotated Bother O=[N+]([O-])c1ccc(N/N=C(\c2ccccc2)c2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC000027522768 GI Annotated Mild O=C1CC[C@]2(c3ccc(Cl)cc3)O[C@H](COc3ccc(Cl)cc3)CN12 ZINC000027523051 GI Annotated Anodyne C[C@@H]1CC[C@@](Oc2ccc(CC(=O)Nc3ccc4c(c3)CCC4)cc2)(C(=O)O)C1 ZINC000027524631 GI Annotated Anodyne C[C@H]1CC[C@@](Oc2ccc(CC(=O)Nc3ccc4c(c3)CCC4)cc2)(C(=O)O)C1 ZINC000027524632 GI Annotated Anodyne C[C@@H]1CC[C@](Oc2ccc(CC(=O)Nc3ccc4c(c3)CCC4)cc2)(C(=O)O)C1 ZINC000027524633 GI Annotated Anodyne C[C@H]1CC[C@](Oc2ccc(CC(=O)Nc3ccc4c(c3)CCC4)cc2)(C(=O)O)C1 ZINC000027524634 GI Annotated Anodyne Cc1cc(CCC#CCOc2c(Cl)cc(C3=NCCO3)cc2Cl)on1 ZINC000027524798 GI Annotated Mild C[C@@H]1CCC[C@@]1(Oc1ccc(CC(=O)Nc2ccc3c(c2)CCC3)cc1)C(=O)O ZINC000027525323 GI Annotated Anodyne C[C@H]1CCC[C@@]1(Oc1ccc(CC(=O)Nc2ccc3c(c2)CCC3)cc1)C(=O)O ZINC000027525325 GI Annotated Anodyne C[C@@H]1CCC[C@]1(Oc1ccc(CC(=O)Nc2ccc3c(c2)CCC3)cc1)C(=O)O ZINC000027525327 GI Annotated Anodyne C[C@H]1CCC[C@]1(Oc1ccc(CC(=O)Nc2ccc3c(c2)CCC3)cc1)C(=O)O ZINC000027525329 GI Annotated Anodyne C=CCOc1ccc2nc3c([N+](=O)[O-])ccc4c3c([nH]n4CCCN(C)C)c2c1 ZINC000027548647 GI Annotated Mild CCCCC(O)(CCCC)c1n[nH]c(-c2cccc(C(F)(F)F)c2)nc1=O ZINC000027553131 GI Annotated Anodyne CC1(C)OC(c2ccccc2)(c2ccccc2)c2c1nnc(-c1ccccc1)[n+]2[O-] ZINC000027555222 GI Annotated Anodyne CCOCCOC(=O)[C@@H](C)c1ccc2c(c1)SC[C@H]1CCCC[C@H]1C2=O ZINC000027556055 GI Annotated Anodyne CCOCCOC(=O)[C@H](C)c1ccc2c(c1)SC[C@H]1CCCC[C@H]1C2=O ZINC000027556057 GI Annotated Anodyne CCOCCOC(=O)[C@@H](C)c1ccc2c(c1)SC[C@H]1CCCC[C@@H]1C2=O ZINC000027556059 GI Annotated Anodyne CCOCCOC(=O)[C@H](C)c1ccc2c(c1)SC[C@H]1CCCC[C@@H]1C2=O ZINC000027556061 GI Annotated Anodyne C[C@@H](NC(=O)Cc1ccc(C(=O)O)cc1)c1ccccc1N1CCCC[C@H]1C ZINC000027563335 GI Annotated Anodyne C[C@H]1CCCCN1c1ccccc1[C@@H](C)NC(=O)Cc1ccc(C(=O)O)cc1 ZINC000027563338 GI Annotated Anodyne C[C@]12C=CC(=O)C=C1CC[C@H]1[C@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)C[C@H]3O[C@]132 ZINC000027625015 GI Annotated Anodyne C[C@]12C=CC(=O)C=C1CC[C@H]1[C@@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)C[C@H]3O[C@]132 ZINC000027625022 GI Annotated Anodyne C/C1=C\CC[C@@]2(C)O[C@@H]2[C@H](O)[C@@H]2CC[C@@H](C)[C@](C)(CC1)[C@H]2COC(=O)N(C)C ZINC000027625424 GI Annotated Anodyne O=C1CS[C@H](c2c(F)cccc2Cl)N1c1cccc(Br)n1 ZINC000027625668 GI Annotated Anodyne O=C1CS[C@@H](c2c(F)cccc2Cl)N1c1ccc(Br)cn1 ZINC000027626016 GI Annotated Anodyne O=C1CS[C@H](c2c(F)cccc2Cl)N1c1ccc(Br)cn1 ZINC000027626022 GI Annotated Anodyne C[C@]12CC[C@H](O)C=C1CC[C@H]1[C@@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)CC[C@]12O ZINC000027631154 GI Annotated Anodyne C[C@]12CC[C@H](O)C=C1CC[C@@H]1[C@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)CC[C@]12O ZINC000027631159 GI Annotated Anodyne C[C@]12CC[C@H](O)C=C1CC[C@H]1[C@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)CC[C@]12O ZINC000027631165 GI Annotated Anodyne CC1=C[C@@]2(C)C(=CC1=O)[C@H]1C[C@H]1[C@@H]1[C@@H]2CC[C@@]2(C)[C@H]1[C@@H]1C[C@@H]1[C@@]21CCC(=O)O1 ZINC000027632262 GI Annotated Mild C[C@]12C=CC(=O)C[C@H]1CC[C@@H]1[C@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)C[C@H]3O[C@@]312 ZINC000027632666 GI Annotated Anodyne C[C@]12C=CC(=O)C[C@H]1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)C[C@H]3O[C@@]312 ZINC000027632672 GI Annotated Anodyne C[C@]12C=CC(=O)C[C@H]1CC[C@H]1[C@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)C[C@H]3O[C@]132 ZINC000027632679 GI Annotated Anodyne C[C@]12C=CC(=O)C[C@H]1CC[C@H]1[C@@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)C[C@H]3O[C@]132 ZINC000027632684 GI Annotated Anodyne COc1ccc2[nH]cc(-c3csc(/N=C(\N)NCc4ccccc4)n3)c2c1 ZINC000027634063 GI Annotated Mild CO/N=C(/C(=O)OC)c1ccccc1/C=C/C#Cc1ccccc1C(F)(F)F ZINC000027635783 GI Annotated Mild O=C(C[C@H]1C=NN2c3cc(Cl)ccc3[N+]([O-])=N[C@H]12)Oc1ccccc1Cl ZINC000027635829 GI Annotated Anodyne O=C(C[C@H]1C=NN2c3cc(Cl)ccc3[N+]([O-])=N[C@@H]12)Oc1ccccc1Cl ZINC000027635834 GI Annotated Anodyne O=C(C[C@@H]1C=NN2c3cc(Cl)ccc3[N+]([O-])=N[C@H]12)Oc1ccccc1Cl ZINC000027635839 GI Annotated Anodyne O=C(C[C@@H]1C=NN2c3cc(Cl)ccc3[N+]([O-])=N[C@@H]12)Oc1ccccc1Cl ZINC000027635845 GI Annotated Anodyne COc1ccc(/N=C2/C(Nc3ccc(OC)cc3)=CC(=O)c3ncccc32)cc1 ZINC000027638733 GI Annotated Mild O=C1Nc2c(ncn2Cc2ccccc2)[C@@H](C#CC2CC2)N1Cc1ccccc1 ZINC000027650900 GI Annotated Mild O=C1Nc2c(ncn2Cc2ccccc2)[C@H](C#CC2CC2)N1Cc1ccccc1 ZINC000027650904 GI Annotated Mild CSc1nc(Nc2ccc(I)cc2)c2cccnc2n1 ZINC000027654699 GI Annotated Anodyne NCCCSC[C@@H](COc1ccc(-c2ccccc2)cc1)SCCCN ZINC000027655940 GI Annotated Anodyne NCCCSC[C@H](COc1ccc(-c2ccccc2)cc1)SCCCN ZINC000027655942 GI Annotated Anodyne CC(C)(C)c1cc(I)c2c(c1)CN[C@]1(O2)C2C[C@@H]3C1[C@@H]3C2 ZINC000027656444 GI Annotated Anodyne CC(C)(C)c1cc(I)c2c(c1)CN[C@@]1(O2)C2C[C@@H]3C1[C@@H]3C2 ZINC000027656446 GI Annotated Anodyne CSc1nc(Nc2cccc(I)c2)c2cccnc2n1 ZINC000027656513 GI Annotated Anodyne CC(C)Cn1cc2c3c(cccc31)[C@H]1C[C@@H](C(=O)NC3CCCC3)CN(C)[C@@H]1C2 ZINC000027657829 GI Annotated Clean C=Cc1nc2sc(-c3ccc(S(C)(=O)=O)cc3)c(-c3ccccc3)n2n1 ZINC000027707250 GI Annotated Anodyne CN(C)CCNc1ccccc1-c1ccccc1NC(=O)Cc1ccc(N)cc1 ZINC000027714330 GI Annotated Clean CCCCNC(=O)Oc1ccc2c(c1Br)c1c(n2C)/C(=N\C)CC1 ZINC000027716083 GI Annotated Mild CCCn1c2c(c3c(Br)c(OC(=O)NC)ccc31)CC/C2=N/CC ZINC000027720566 GI Annotated Mild CCCn1cc2c3c(cccc31)[C@H]1C[C@@H](C(=O)NC3CCCCC3)CN(C)[C@@H]1C2 ZINC000027722647 GI Annotated Clean CC(C)(C/C=C1\C[C@H]2C[C@@H](O)[C@H](C#C[C@H](O)C3CCCCC3)[C@H]2C1)CC(=O)O ZINC000027726971 GI Annotated Mild CC(C)n1cc2c3c(cccc31)[C@H]1C[C@@H](C(=O)NC3CCCC3)CN(C)[C@@H]1C2 ZINC000027731501 GI Annotated Anodyne C=CCn1cc2c3c(cccc31)[C@H]1C[C@@H](C(=O)NC3CCCCC3)CN(C)[C@@H]1C2 ZINC000027745895 GI Annotated Mild CCn1cc2c3c(cccc31)[C@H]1C[C@@H](C(=O)NC3CCCCC3)CN(C)[C@@H]1C2 ZINC000027745902 GI Annotated Clean CC(C)c1ccc2c3c(c(=O)oc2c1)CN(CCN1CC2CCC(CC2)C1)CC3 ZINC000027746331 GI Annotated Anodyne O=S1(=O)N=C(O)c2sc3ccccc3c2N1Cc1ccc(Cl)cc1 ZINC000027754755 GI Annotated Anodyne COC(=O)c1[nH]cc(-c2ccc(Cl)cc2)c1N1CCN(c2ccccc2)CC1 ZINC000027848368 GI Annotated Anodyne Cc1nc2ccccn2c(=O)c1CCN1CCc2oc3c(Cl)cccc3c2C1 ZINC000027862211 GI Annotated Anodyne CCN1CC[C@@H]2[C@H](C1)c1ccc(C)cc1[C@H]2c1ccc(COC(=O)NC)cc1 ZINC000027863386 GI Annotated Anodyne Cc1nc2ccc(Cl)cn2c(=O)c1CCN1CCc2oc3ccccc3c2C1 ZINC000027865233 GI Annotated Anodyne Nc1nc(-c2nn(Cc3ccccc3F)c3ncccc23)ncc1C1=CCCC1 ZINC000027871321 GI Annotated Anodyne Nc1nc(-c2nn(Cc3ccccc3F)c3ncccc23)ncc1C1CCCC1 ZINC000027873766 GI Annotated Anodyne C[N+](C)(C)CCO[P@](=O)(O)OCCCCC=C1C2CC3CC(C2)CC1C3 ZINC000027874113 GI Annotated Bother CCCCCc1cnc(-c2nn(Cc3ccccc3F)c3ncccc23)nc1N ZINC000027876473 GI Annotated Anodyne CCCCc1cnc(-c2nn(Cc3ccccc3F)c3ncccc23)nc1N ZINC000027876488 GI Annotated Anodyne CC(=O)OC/C=C1\CC[C@@H](O)[C@](C)(CCC[C@H](C)C(=O)CC=C(C)C)OC1 ZINC000027880627 GI Annotated Anodyne CC(=O)OC/C=C1\CC[C@@H](O)[C@](C)(CCC[C@@H](C)C(=O)CC=C(C)C)OC1 ZINC000027880634 GI Annotated Anodyne CC(=O)OC/C=C1\CCC(=O)[C@](C)(CCC[C@H](C)C(=O)CC=C(C)C)OC1 ZINC000027889925 GI Annotated Anodyne CC(=O)OC/C=C1\CCC(=O)[C@](C)(CCC[C@@H](C)C(=O)CC=C(C)C)OC1 ZINC000027889931 GI Annotated Anodyne CC(=O)O[C@@H]1CC/C(=C\C=O)CO[C@@]1(C)CCC[C@H](C)C(=O)CC=C(C)C ZINC000027890129 GI Annotated Reactive CC(=O)O[C@@H]1CC/C(=C\C=O)CO[C@@]1(C)CCC[C@@H](C)C(=O)CC=C(C)C ZINC000027890134 GI Annotated Reactive CC(=O)O[C@@H]1CC/C(=C\CO)CO[C@@]1(C)CCC[C@H](C)C(=O)CC=C(C)C ZINC000027893521 GI Annotated Anodyne CC(=O)O[C@@H]1CC/C(=C\CO)CO[C@@]1(C)CCC[C@@H](C)C(=O)CC=C(C)C ZINC000027893525 GI Annotated Anodyne CC[C@H](c1ccc(O)cc1)[C@@H](CCCCN1CCNCC1)c1ccc(O)cc1 ZINC000027894818 GI Annotated Anodyne N[C@@H]1Cc2c3n(c4ccc(O)cc24)C(=O)C[C@@]2(Cc4ccccc4)CCC[C@@H]1[C@@H]32 ZINC000027896366 GI Annotated Anodyne Cc1ccc(Oc2nc(N)n3ncc(-c4ccc(Cl)c(Cl)c4)c3n2)cn1 ZINC000027902074 GI Annotated Anodyne CCC(=O)N(c1ccccc1)C1(COC)CCN(CCc2ccsc2)CC1 ZINC000027978404 GI Annotated Anodyne CCOP(=O)(Cc1cc(/N=C/c2cc(O)ccc2O)ccc1O)OCC ZINC000027992223 GI Annotated Mild CCc1cc2c(s1)Nc1ccc(F)cc1N/C2=N\CCCN1CCOCC1 ZINC000027995540 GI Annotated Mild CCOC(=O)N1CCN(C2=Nc3cc(F)ccc3Nc3sc(C)cc32)CC1 ZINC000027997144 GI Annotated Anodyne O=[N+]([O-])c1ccc2oc(N[C@H](Cc3ccc(O)cc3)c3ccccn3)nc2c1 ZINC000028001799 GI Annotated Bother O=[N+]([O-])c1ccc2oc(N[C@@H](Cc3ccc(O)cc3)c3ccccn3)nc2c1 ZINC000028001804 GI Annotated Bother C[C@@]1(c2ccccc2)Cc2c3c(c(Cl)c(Cl)c2C1=O)O[C@H](C(=O)O)C3 ZINC000028002612 GI Annotated Anodyne C[C@]1(c2ccccc2)Cc2c3c(c(Cl)c(Cl)c2C1=O)O[C@H](C(=O)O)C3 ZINC000028002615 GI Annotated Anodyne CNCCCCOc1ccc(OC)cc1[C@@H]1Sc2ccccc2N1C(C)=O ZINC000028006031 GI Annotated Anodyne CNCCCCOc1ccc(OC)cc1[C@H]1Sc2ccccc2N1C(C)=O ZINC000028006034 GI Annotated Anodyne Cc1cc(NS(C)(=O)=O)ccc1Nc1c2ccccc2nc2c(N)cccc12 ZINC000028006387 GI Annotated Clean COc1cccc([C@@H]2Sc3ccccc3N2C(C)=O)c1OCCCN(C)C ZINC000028015194 GI Annotated Anodyne COc1cccc([C@H]2Sc3ccccc3N2C(C)=O)c1OCCCN(C)C ZINC000028015199 GI Annotated Anodyne CCOC(=O)Nc1ccc2cc3ccc4c(c3nc2c1)COCN4C(=O)OCC ZINC000028017288 GI Annotated Bother CC(C)c1ccc2oc(N[C@@H](Cc3ccc(F)cc3)C3=CN(C)NO3)nc2c1 ZINC000028020348 GI Annotated Anodyne CC(C)c1ccc2oc(N[C@H](Cc3ccc(F)cc3)C3=CN(C)NO3)nc2c1 ZINC000028020351 GI Annotated Anodyne N=C(NCc1ccccc1)Nc1nnc(-c2ccccc2C(F)(F)F)s1 ZINC000028086181 GI Annotated Anodyne Cc1ccc(C(=O)N(C)c2ccc(CCc3ccc(O)c(O)c3)cc2)c(O)c1 ZINC000028087582 GI Annotated Clean COc1c(Cl)c2c3c(c1OC)N(c1ccc(F)cc1)C[C@H]3CN(C)CC2 ZINC000028087636 GI Annotated Clean COc1c(Cl)c2c3c(c1OC)N(c1ccc(F)cc1)C[C@@H]3CN(C)CC2 ZINC000028087642 GI Annotated Clean O=C1OCc2c1cc1c(Cl)cc3c(c1c2-c1ccc2c(c1)OCO2)OCO3 ZINC000028104178 GI Annotated Anodyne Cc1conc1COc1nn2c(-c3ccccc3)nnc2c2c1C1CCC2CC1 ZINC000028116564 GI Annotated Anodyne COC(=O)C1=C(C)CC2=C(C(=O)OC2)[C@@H]1c1ccc(Cl)c(C(F)(F)F)c1 ZINC000028116946 GI Annotated Anodyne in-vitro COC(=O)C1=C(C)CC2=C(C(=O)OC2)[C@H]1c1ccc(Cl)c(C(F)(F)F)c1 ZINC000028116954 GI Annotated Anodyne in-vitro CN1CC=C(c2cn(S(=O)(=O)c3ccccc3Cl)c3ccccc23)CC1 ZINC000028120732 GI Annotated Anodyne O=C1[C@H]2[C@@H]3C=C[C@@H](C3)[C@H]2C(=O)N1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000028124819 GI Annotated Anodyne O=C1[C@H]2[C@H]3C=C[C@H](C3)[C@H]2C(=O)N1c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000028124826 GI Annotated Anodyne CC1(C)Nc2c(ccc(C(=O)c3ccccc3)c2O)O[C@@H]1NC1CCCCC1 ZINC000028124870 GI Annotated Anodyne CC1(C)Nc2c(ccc(C(=O)c3ccccc3)c2O)O[C@H]1NC1CCCCC1 ZINC000028124876 GI Annotated Anodyne CN1CC=C(c2cn(S(=O)(=O)c3cccc(Cl)c3)c3ccccc23)CC1 ZINC000028130446 GI Annotated Anodyne Nc1nc(-c2ccc(Br)o2)c2c(n1)-c1cc(N3CCCC3)ccc1C2 ZINC000028136619 GI Annotated Anodyne CCN(CC)[C@@H](C)c1ccc(O[C@@H]2Cc3cc(OC)c(OC)cc3C2=O)cc1 ZINC000028137111 GI Annotated Anodyne CCN(CC)[C@H](C)c1ccc(O[C@@H]2Cc3cc(OC)c(OC)cc3C2=O)cc1 ZINC000028137115 GI Annotated Anodyne CCN(CC)[C@@H](C)c1ccc(O[C@H]2Cc3cc(OC)c(OC)cc3C2=O)cc1 ZINC000028137121 GI Annotated Anodyne CCN(CC)[C@H](C)c1ccc(O[C@H]2Cc3cc(OC)c(OC)cc3C2=O)cc1 ZINC000028137127 GI Annotated Anodyne CC1=C(OCCCCCCCCCCN2CCN(C)CC2)[C@H](C)SC1=O ZINC000028137963 GI Annotated Mild CC1=C(OCCCCCCCCCCN2CCN(C)CC2)[C@@H](C)SC1=O ZINC000028137969 GI Annotated Mild COc1ccc([C@@H](c2ccc(O)cc2O)c2ccc(C(C)C)cc(=O)c2O)cc1 ZINC000028220873 GI Annotated Anodyne COc1ccc([C@H](c2ccc(O)cc2O)c2ccc(C(C)C)cc(=O)c2O)cc1 ZINC000028220877 GI Annotated Anodyne COc1ccc([C@H](c2cc(O)ccc2O)c2ccc(C(C)C)cc(=O)c2O)cc1 ZINC000028221691 GI Annotated Anodyne COc1ccc([C@@H](c2cc(O)ccc2O)c2ccc(C(C)C)cc(=O)c2O)cc1 ZINC000028221695 GI Annotated Anodyne CCN1CCCC[C@@H]1c1ccc(-c2cc(S(=O)(=O)CC)ccc2OC)[nH]1 ZINC000028236436 GI Annotated Anodyne CCN1CCCC[C@H]1c1ccc(-c2cc(S(=O)(=O)CC)ccc2OC)[nH]1 ZINC000028236442 GI Annotated Anodyne CCS(=O)(=O)c1ccc(OC)c(-c2ccc([C@@H](C)N3CCCCCC3)[nH]2)c1 ZINC000028242725 GI Annotated Anodyne CCS(=O)(=O)c1ccc(OC)c(-c2ccc([C@H](C)N3CCCCCC3)[nH]2)c1 ZINC000028242730 GI Annotated Anodyne CCN1CCCCC[C@@H]1c1ccc(-c2cc(S(=O)(=O)CC)ccc2OC)[nH]1 ZINC000028242738 GI Annotated Anodyne CCN1CCCCC[C@H]1c1ccc(-c2cc(S(=O)(=O)CC)ccc2OC)[nH]1 ZINC000028242743 GI Annotated Anodyne CCOC(=O)N1CCN([C@@H](c2ccc(C(C)C)cc2)c2cc(C)ns2)CC1 ZINC000028246409 GI Annotated Anodyne CCOC(=O)N1CCN([C@H](c2ccc(C(C)C)cc2)c2cc(C)ns2)CC1 ZINC000028246416 GI Annotated Anodyne Cc1cc([C@H](c2ccc(OCc3ccccc3)cc2)N2CCN(C)CC2)sn1 ZINC000028248922 GI Annotated Anodyne Cc1cc([C@@H](c2ccc(OCc3ccccc3)cc2)N2CCN(C)CC2)sn1 ZINC000028248928 GI Annotated Anodyne C1CCC(NCCN(CCNC2CCCCC2)CCNC2CCCCC2)CC1 ZINC000028250236 GI Annotated Anodyne Cc1cc(Br)ccc1C(=O)N(C)[C@H]1CCCC[C@@]12CCCN2C ZINC000028253541 GI Annotated Anodyne CC1(C)Oc2nc3ccc(Br)cc3c(O)c2C[C@@H]1Br ZINC000028253985 GI Annotated Reactive CC1(C)Oc2nc3ccc(Br)cc3c(O)c2C[C@H]1Br ZINC000028253991 GI Annotated Reactive CC(C)N(CC[C@]1(c2ccccc2Cl)C(=O)NCN2CCCC[C@H]21)C(C)C ZINC000028265008 GI Annotated Anodyne CC(C)N(CC[C@@]1(c2ccccc2Cl)C(=O)NCN2CCCC[C@H]21)C(C)C ZINC000028265013 GI Annotated Anodyne CC(C)N(CC[C@]1(c2ccccc2Cl)C(=O)NCN2CCCC[C@@H]21)C(C)C ZINC000028265016 GI Annotated Anodyne CC(C)N(CC[C@@]1(c2ccccc2Cl)C(=O)NCN2CCCC[C@@H]21)C(C)C ZINC000028265021 GI Annotated Anodyne CC[C@@H](c1ccc(Cl)c(Cl)c1)n1c(C(=O)OC)c(C(=O)O)[nH]c1=S ZINC000028338732 GI Annotated Anodyne CC[C@H](c1ccc(Cl)c(Cl)c1)n1c(C(=O)OC)c(C(=O)O)[nH]c1=S ZINC000028338739 GI Annotated Anodyne CCN(CC)[C@@H](C)c1cccc(O[C@@H]2Cc3cc(OC)c(OC)cc3C2=O)c1 ZINC000028340131 GI Annotated Anodyne CCN(CC)[C@H](C)c1cccc(O[C@@H]2Cc3cc(OC)c(OC)cc3C2=O)c1 ZINC000028340138 GI Annotated Anodyne CCN(CC)[C@@H](C)c1cccc(O[C@H]2Cc3cc(OC)c(OC)cc3C2=O)c1 ZINC000028340143 GI Annotated Anodyne CCN(CC)[C@H](C)c1cccc(O[C@H]2Cc3cc(OC)c(OC)cc3C2=O)c1 ZINC000028340150 GI Annotated Anodyne COc1cc2c(cc1OC)C(=O)[C@H](Oc1ccc([C@@H](C)N3CCCC3)cc1)C2 ZINC000028344334 GI Annotated Anodyne COc1cc2c(cc1OC)C(=O)[C@@H](Oc1ccc([C@@H](C)N3CCCC3)cc1)C2 ZINC000028344340 GI Annotated Anodyne COc1cc2c(cc1OC)C(=O)[C@H](Oc1ccc([C@H](C)N3CCCC3)cc1)C2 ZINC000028344346 GI Annotated Anodyne COc1cc2c(cc1OC)C(=O)[C@@H](Oc1ccc([C@H](C)N3CCCC3)cc1)C2 ZINC000028344353 GI Annotated Anodyne COc1cc2c(cc1OC)C(=O)[C@H](Oc1ccc([C@@H](C)N3CCCCC3)cc1)C2 ZINC000028344365 GI Annotated Anodyne COc1cc2c(cc1OC)C(=O)[C@@H](Oc1ccc([C@@H](C)N3CCCCC3)cc1)C2 ZINC000028344372 GI Annotated Anodyne COc1cc2c(cc1OC)C(=O)[C@H](Oc1ccc([C@H](C)N3CCCCC3)cc1)C2 ZINC000028344380 GI Annotated Anodyne COc1cc2c(cc1OC)C(=O)[C@@H](Oc1ccc([C@H](C)N3CCCCC3)cc1)C2 ZINC000028344388 GI Annotated Anodyne COc1ccc(Sc2c(C#N)[nH]c3cc(S(C)(=O)=O)ccc23)c(Cl)c1 ZINC000028347847 GI Annotated Mild O=S(=O)(N[C@H]1[C@H]2CC[C@@H]1Cc1ccc(F)cc1C2)c1ccc(Cl)s1 ZINC000028348005 GI Annotated Anodyne O=S(=O)(N[C@@H]1[C@H]2CC[C@@H]1Cc1cc(F)ccc1C2)c1ccc(Cl)s1 ZINC000028348012 GI Annotated Anodyne O=S(=O)(N[C@H]1[C@H]2CC[C@@H]1Cc1cccc(F)c1C2)c1ccc(Cl)s1 ZINC000028353012 GI Annotated Anodyne O=S(=O)(N[C@@H]1[C@H]2CC[C@@H]1Cc1c(F)cccc1C2)c1ccc(Cl)s1 ZINC000028353019 GI Annotated Anodyne C[C@@H]1CN(c2nsnc2Cl)CCN1c1nc2cc(C(C)(C)C)ccc2[nH]1 ZINC000028357317 GI Annotated Anodyne C[C@H]1CN(CC(=O)O)[C@H](C)CN1c1ccccc1Sc1ccc(Cl)cc1 ZINC000028362676 GI Annotated Anodyne C[C@H]1CN(c2ccccc2Sc2ccc(Cl)cc2)[C@@H](C)CN1CC(=O)O ZINC000028362683 GI Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(/C=C\c2ccccn2)c1 ZINC000028365843 GI Annotated Anodyne CSc1nn(-c2c(Cl)cc(C(F)(F)F)cc2Cl)c(N)c1C(=O)O ZINC000028379967 GI Annotated Anodyne COc1ccc([C@@H]2CC=CCN([C@@H](CN3CCCC3)c3ccccc3)C2=O)cc1 ZINC000028383868 GI Annotated Anodyne COc1ccc([C@H]2CC=CCN([C@@H](CN3CCCC3)c3ccccc3)C2=O)cc1 ZINC000028383873 GI Annotated Anodyne COc1ccc([C@@H]2CC=CCN([C@H](CN3CCCC3)c3ccccc3)C2=O)cc1 ZINC000028383878 GI Annotated Anodyne COc1ccc([C@H]2CC=CCN([C@H](CN3CCCC3)c3ccccc3)C2=O)cc1 ZINC000028383883 GI Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(/C=C/c2ccoc2)c1 ZINC000028389626 GI Annotated Anodyne COC1=C(CC(C)(C)COC(=O)c2ccccc2)C(=O)c2ccccc2C1=O ZINC000028391432 GI Annotated Mild Fc1cc(-c2conc2-c2ccccc2)cc(-n2nnc(-c3ccccn3)n2)c1 ZINC000028396668 GI Annotated Anodyne O=C1C=C(CCCOC(=O)c2ccc3ccccc3c2O)C(=O)c2ccccc21 ZINC000028398119 GI Annotated Mild CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(/C=C/c2cccnc2)c1 ZINC000028456453 GI Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(/C=C/c2cccn2C)c1 ZINC000028456791 GI Annotated Anodyne COc1cc2c(cc1OC)S[C@H](C(=O)CCc1cc[n+](CC3CCC3)cc1)C2 ZINC000028456842 GI Annotated Anodyne COc1cc2c(cc1OC)S[C@@H](C(=O)CCc1cc[n+](CC3CCC3)cc1)C2 ZINC000028456845 GI Annotated Anodyne COc1ccccc1C(=O)OCC(C)(C)CC1=C(O)C(=O)c2ccccc2C1=O ZINC000028457525 GI Annotated Mild O=S(=O)(/N=C(\O)c1ccc(Cl)cc1Cl)c1ccc(F)c(Cl)c1 ZINC000028457598 GI Annotated Mild CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(/C=C\c2ccncc2)c1 ZINC000028458478 GI Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(/C=C\c2ccco2)c1 ZINC000028458481 GI Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(/C=C/c2ccccn2)c1 ZINC000028459086 GI Annotated Anodyne CN1C(=O)Cc2cc3onc(CCC4CCN(Cc5ccccc5)CC4)c3cc21 ZINC000028461148 GI Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(/C=C/c2nccs2)c1 ZINC000028461818 GI Annotated Anodyne CO[C@@H](Cc1scnc1C(=O)Nc1nccs1)c1cccc(Cl)c1 ZINC000028462038 GI Annotated Anodyne CO[C@H](Cc1scnc1C(=O)Nc1nccs1)c1cccc(Cl)c1 ZINC000028462041 GI Annotated Anodyne CO[C@@H](Cc1scnc1C(=O)Nc1nccs1)c1ccccc1Cl ZINC000028462043 GI Annotated Anodyne CO[C@H](Cc1scnc1C(=O)Nc1nccs1)c1ccccc1Cl ZINC000028462046 GI Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(/C=C/c2ccco2)c1 ZINC000028462054 GI Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(/C=C\c2cccnc2)c1 ZINC000028463184 GI Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(/C=C/c2ccncc2)c1 ZINC000028463188 GI Annotated Anodyne CSc1ccc(S(=O)(=O)/N=C(\O)c2ccc(Cl)cc2Cl)cc1 ZINC000028463466 GI Annotated Mild CCn1cc(C(=O)N2CCC(c3cccc(CN)c3)CC2)c2cccc(C)c21 ZINC000028465771 GI Annotated Anodyne Cc1ncc([N+](=O)[O-])n1CCO[C@@H](c1cccs1)c1cccc(F)c1F ZINC000028466225 GI Annotated Bother Cc1ncc([N+](=O)[O-])n1CCO[C@H](c1cccs1)c1cccc(F)c1F ZINC000028466231 GI Annotated Bother COC(=O)c1ccc2c(c1)sc1c(=O)[nH]c3ccc(C(=N)NC(C)C)cc3c12 ZINC000028470042 GI Annotated Bother CC(C)(C)c1ccc(C(C)(C)C)c(C(=O)C[C@@H](SCC(=O)O)C(=O)O)c1 ZINC000028471304 GI Annotated Anodyne CC(C)(C)c1ccc(C(C)(C)C)c(C(=O)C[C@H](SCC(=O)O)C(=O)O)c1 ZINC000028471308 GI Annotated Anodyne COC(=O)c1ccc2[nH]c(=O)c3sc4cc(C(=N)NC(C)C)ccc4c3c2c1 ZINC000028471536 GI Annotated Bother O=C(O)[C@@H]1COc2cc3nc(-c4cccs4)c(-c4cccs4)nc3cc2O1 ZINC000028474118 GI Annotated Anodyne O=C(O)[C@H]1COc2cc3nc(-c4cccs4)c(-c4cccs4)nc3cc2O1 ZINC000028474121 GI Annotated Anodyne O=C1C(Nc2ccc(C(F)(F)F)cc2)=C(Cl)C(=O)c2sc(CO)cc21 ZINC000028478315 GI Annotated Mild COC(=O)c1cc2c(s1)C(=O)C(Cl)=C(Nc1ccc(Cl)cc1)C2=O ZINC000028520462 GI Annotated Mild O=C(O)/C(=C/c1ncc(-c2ccccc2Cl)s1)NC(=O)c1ccccc1 ZINC000028520643 GI Annotated Anodyne COc1ccc(/C=C/C(=O)Nc2cc(N)c3ccccc3c2CCCl)nc1 ZINC000028521421 GI Annotated Reactive COc1cc(N[C@@H](C)CCCN2C(=O)[C@H](C(C)C)NC2(C)C)c2ncccc2c1 ZINC000028522079 GI Annotated Anodyne COc1cc(N[C@H](C)CCCN2C(=O)[C@H](C(C)C)NC2(C)C)c2ncccc2c1 ZINC000028522082 GI Annotated Anodyne CC[n+]1cc2cc(OC)c(OC)cc2c2ccc3cc(OC)c(OC)cc3c21 ZINC000028522808 GI Annotated Bother O=C(O)/C(=C/c1ccc(Oc2ccccc2F)cc1)NC(=O)c1ccccc1 ZINC000028522850 GI Annotated Anodyne CCOc1cc2ccc3c4cc(OC)c(OC)cc4c[n+](C)c3c2cc1OC ZINC000028522852 GI Annotated Bother CCCOc1nc2cc(OCCC3CCN(c4ccc(C)nn4)CC3)ccc2o1 ZINC000028522936 GI Annotated Anodyne CSc1nc2cc(OCCC3CCN(c4ccc(C)nn4)CC3)ccc2o1 ZINC000028523789 GI Annotated Anodyne O=S(=O)(c1ccc(Cl)s1)n1cc([C@@H]2CCCNC2)c2ccccc21 ZINC000028524773 GI Annotated Anodyne O=S(=O)(c1ccc(Cl)s1)n1cc([C@H]2CCCNC2)c2ccccc21 ZINC000028524774 GI Annotated Anodyne Cc1ccc(NC(=O)Nc2ccc(N3C(=O)[C@@H]4CC=CC[C@H]4C3=O)cc2)cc1C ZINC000028524830 GI Annotated Anodyne CCCn1c(S)nnc1-c1ccc(S(=O)(=O)c2ccc(Cl)cc2)cc1 ZINC000028524836 GI Annotated Anodyne O=C1Cc2c(c3cc(C(F)(F)F)ccc3[nH]c2=O)-c2cc(Cl)ccc2O1 ZINC000028526703 GI Annotated Anodyne CCCCN(CCCC)Cc1cccc(/C(C)=N\NC(=O)c2ccncc2)c1O ZINC000028528018 GI Annotated Reactive CCc1nc(C(F)(F)F)ccc1C(=O)Nc1c(C)cccc1C(=O)NC(C)C ZINC000028528814 GI Annotated Anodyne COC(=O)c1nc(-c2csc([C@@H](NC(=O)CC=C(C)C)C(C)C)n2)oc1C ZINC000028529558 GI Annotated Anodyne Cc1oc(-c2csc([C@@H](NC(=O)CC3=CCCC3)C(C)C)n2)nc1C(=O)O ZINC000028530478 GI Annotated Anodyne Fc1cccc(Oc2ncccc2-c2n[nH]c(Nc3ccc4c(c3)OCO4)n2)c1 ZINC000028564452 GI Annotated Anodyne CC(C)=CCC/C(C)=C/[C@H]1OC(=O)C[C@]12C[C@H](OC(=O)C1CCC1)C=CC2=O ZINC000028566796 GI Annotated Mild N#Cc1c(N)nc(Sc2ccc(O)cc2)c(C#N)c1-c1ccc(O)c(Cl)c1 ZINC000028566810 GI Annotated Mild CC(=O)c1ccc(-c2c(C#N)c(N)nc(Sc3ccc(O)cc3)c2C#N)cc1 ZINC000028566812 GI Annotated Mild COC(=O)c1c(OC)c2ccccc2c2oc3c(c12)C(=O)c1ccccc1C3=O ZINC000028569311 GI Annotated Clean N#Cc1cc(F)ccc1-c1cc(-c2cnc3nc(C(F)(F)F)ccn23)ccn1 ZINC000028569707 GI Annotated Mild CC(=O)Oc1c(/C=N/N=C(\N)c2ccncc2)cc(C(C)(C)C)cc1C(C)(C)C ZINC000028569928 GI Annotated Mild O=c1[nH]c(Nc2ccc3c(c2)CCC3)nc(O)c1CCCCc1ccccc1 ZINC000028570620 GI Annotated Anodyne O=c1[nH]c(Nc2ccc3c(c2)CCC3)nc(O)c1CCCCOc1ccccc1 ZINC000028570718 GI Annotated Anodyne CCO[C@H]1[C@@H](c2ccccc2)O[C@@H]2CO[C@@H](c3ccccc3)O[C@H]2[C@@H]1OCC ZINC000028570747 GI Annotated Anodyne CC(C)c1ccc(Nc2nnc(-c3c(NCc4ccncc4)ncn3C)o2)cc1 ZINC000028571298 GI Annotated Anodyne CCO[C@H]1[C@H](c2ccccc2)O[C@@H]2CO[C@@H](c3ccccc3)O[C@H]2[C@@H]1OCC ZINC000028571714 GI Annotated Anodyne CC(C)(O)c1ccn2c(-c3ccc(F)c(-c4ncc(F)cc4F)c3)cnc2n1 ZINC000028571826 GI Annotated Anodyne CC(C)(C)[C@H](O)C(=O)N1CC(c2cc(F)ccc2F)=C[C@H]1c1cccc(O)c1 ZINC000028572285 GI Annotated Anodyne Oc1noc(C2CCNCC2)c1[C@@H](Br)c1ccc2ccccc2c1 ZINC000028636778 GI Annotated Reactive Oc1noc(C2CCNCC2)c1[C@H](Br)c1ccc2ccccc2c1 ZINC000028636781 GI Annotated Reactive OC[C@H]1C[C@@H](Cn2cnc3c(-c4ccc(Cl)cc4)ncnc32)c2ccccc21 ZINC000028637046 GI Annotated Anodyne O=C1O[C@@H](O)C(c2cccc3c2Sc2ccccc2S3)=C1Br ZINC000028639981 GI Annotated Anodyne O=C1O[C@H](O)C(c2cccc3c2Sc2ccccc2S3)=C1Br ZINC000028639983 GI Annotated Anodyne CCCNc1nc(-c2ccccc2)nc2c1nnn2Cc1ccccc1Cl ZINC000028644942 GI Annotated Anodyne CC(=O)Oc1ccc2oc(C(=O)c3cc4cc(OC(C)=O)ccc4o3)cc2c1 ZINC000028647216 GI Annotated Anodyne in-vivo Cc1cc(C(F)(F)F)nc(N2C(=O)CS[C@@H]2c2c(F)cccc2Cl)n1 ZINC000028647318 GI Annotated Anodyne Cc1cc(C(F)(F)F)nc(N2C(=O)CS[C@H]2c2c(F)cccc2Cl)n1 ZINC000028647321 GI Annotated Anodyne CC1(C)[C@@H](CC(=O)O)[C@@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)cc1 ZINC000028648239 GI Annotated Anodyne CC1(C)[C@@H](c2ccc(OCCc3ccc4c(n3)NCCC4)cc2)[C@H]1CC(=O)O ZINC000028648242 GI Annotated Anodyne CC1(C)[C@@H](CC(=O)O)[C@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)cc1 ZINC000028648245 GI Annotated Anodyne CC1(C)[C@H](CC(=O)O)[C@H]1c1ccc(OCCc2ccc3c(n2)NCCC3)cc1 ZINC000028648248 GI Annotated Anodyne CCOC(=O)C1=CN(C(=O)Oc2ccccc2)C=C[C@@H]1c1ccc(OC)cc1 ZINC000028649392 GI Annotated Anodyne CCOC(=O)C1=CN(C(=O)Oc2ccccc2)C=C[C@H]1c1ccc(OC)cc1 ZINC000028649396 GI Annotated Anodyne O=C(C1=C(O)C(=O)N(Cc2ccccc2)C1)c1ccc(Cc2ccc(F)cc2)o1 ZINC000028649654 GI Annotated Mild CC(C)=CCn1c(C(=O)c2cccc3ccccc23)c(C(C)C)c(=O)[nH]c1=O ZINC000028652524 GI Annotated Anodyne COCCN(CCOC)[C@@H]1CCCC[C@H]1OCCc1ccc2ccccc2c1 ZINC000028653656 GI Annotated Anodyne O=C(NC1CC1)/C(=C\Nc1ccc(Cl)cc1)C(=O)c1ccccc1Cl ZINC000028701967 GI Annotated Mild CCn1c2ccccc2c2cc(S(=O)(=O)Nc3cccnc3OC)ccc21 ZINC000028702589 GI Annotated Anodyne CN(C#N)c1nc(Cl)c(-c2c(F)cc(F)cc2F)c(NCC(F)(F)F)n1 ZINC000028703514 GI Annotated Anodyne Cc1ccc(S(=O)(=O)N2CC[C@@H](Br)C[C@@H]2c2ccccc2)cc1 ZINC000028704310 GI Annotated Reactive COc1ccc2c(CNCCCCCCO)cc3cc4c(cc3c2c1)OCO4 ZINC000028706181 GI Annotated Bother Cc1cccc(C)c1NC(=O)CNCCCC(=O)Nc1cccc(Cl)c1C ZINC000028706766 GI Annotated Anodyne COC(=O)c1ccc(-c2ccc(Cl)cc2Nc2snc(O)c2C#N)o1 ZINC000028707486 GI Annotated Mild CCN(CC)C(=O)c1c(NC(=O)c2cccs2)sc2c1CCSC2 ZINC000028707908 GI Annotated Anodyne O=C(c1cccc2[nH]ccc12)N1CCc2c(cnn2-c2ccccc2Cl)C1 ZINC000028708545 GI Annotated Anodyne O=C(c1ccc2cc[nH]c2c1)N1CCc2c(cnn2-c2ccccc2Cl)C1 ZINC000028708546 GI Annotated Anodyne CCSc1ccc(OCc2nnc3sc(-c4ccccc4N)nn23)cc1 ZINC000028709011 GI Annotated Anodyne CCSc1ccc(OCc2nnc3sc(-c4ccccc4O)nn23)cc1 ZINC000028709015 GI Annotated Anodyne C=CCN1C(=O)/C(=C/c2ccc(-c3ccc(C(=O)OC)cc3)o2)SC1=S ZINC000028710833 GI Annotated Mild C=CCN1C(=O)/C(=C/c2ccc(-c3ccc4c(c3)C(=O)OC4)o2)SC1=S ZINC000028710834 GI Annotated Mild C=CCN1C(=O)/C(=C/c2ccc(-c3ccc(CCC(=O)O)cc3)o2)SC1=S ZINC000028710836 GI Annotated Mild C[N+](C)(C)CCO[P@](=O)(O)OCCCCCC1C2CC3CC(C2)CC1C3 ZINC000028712517 GI Annotated Bother COc1c2ccoc2cc2oc(-c3ccccc3)c(CN3CCOCC3)c(=O)c12 ZINC000028712694 GI Annotated Anodyne Clc1ccc(-c2nnc3n2ccc2nnc(-c4ccc(Cl)cc4)n23)cc1 ZINC000028712771 GI Annotated Anodyne COc1ccc(Cl)c(-c2nnc3sc(-c4ccnc(Cl)c4)nn23)c1 ZINC000028712874 GI Annotated Anodyne COc1ccc2[nH]c(C)c(Cc3nn4c(-c5ccoc5C)nnc4s3)c2c1 ZINC000028712889 GI Annotated Anodyne C[C@@H](CN(C)C)Oc1cc2oc3c(c2cc1Cl)C(=O)c1ccccc1C3=O ZINC000028713987 GI Annotated Clean C[C@H](CN(C)C)Oc1cc2oc3c(c2cc1Cl)C(=O)c1ccccc1C3=O ZINC000028713988 GI Annotated Clean C[C@@H](COc1cc2oc3c(c2cc1Cl)C(=O)c1ccccc1C3=O)N(C)C ZINC000028713989 GI Annotated Clean C[C@H](COc1cc2oc3c(c2cc1Cl)C(=O)c1ccccc1C3=O)N(C)C ZINC000028713990 GI Annotated Clean CCOC(=O)/C(=C\Nc1ccc(Br)cc1)c1ccc(OC)cc1 ZINC000028714127 GI Annotated Anodyne O=C(c1ccc2c(c1)oc(=O)n2CCc1ccncc1)c1ccccc1Cl ZINC000028755781 GI Annotated Anodyne CC[C@@H]1NC(=O)[C@@](CCN(C(C)C)C(C)C)(c2ccccc2)[C@@H]2CCCCN21 ZINC000028756167 GI Annotated Anodyne CC[C@H]1NC(=O)[C@@](CCN(C(C)C)C(C)C)(c2ccccc2)[C@@H]2CCCCN12 ZINC000028756168 GI Annotated Anodyne CC[C@@H]1NC(=O)[C@](CCN(C(C)C)C(C)C)(c2ccccc2)[C@@H]2CCCCN21 ZINC000028756170 GI Annotated Anodyne CC[C@H]1NC(=O)[C@](CCN(C(C)C)C(C)C)(c2ccccc2)[C@@H]2CCCCN12 ZINC000028756172 GI Annotated Anodyne C[C@@H](O)CN(C)c1nc2cc(-c3ccc(Cl)cc3)nnc2c2ccccc12 ZINC000028759011 GI Annotated Bother C[C@H](O)CN(C)c1nc2cc(-c3ccc(Cl)cc3)nnc2c2ccccc12 ZINC000028759012 GI Annotated Bother C[C@@H](Nc1ccc(Cl)cc1C(=O)c1ccc(Br)cc1)C(=O)O ZINC000028761777 GI Annotated Clean C[C@H](Nc1ccc(Cl)cc1C(=O)c1ccc(Br)cc1)C(=O)O ZINC000028761779 GI Annotated Clean Cc1ccc(C(=O)Nc2cc(CN3CCCC3)c(O)c(CN3CCCC3)c2)s1 ZINC000028764799 GI Annotated Clean COc1ccc(Cc2c(C(F)(F)F)nn(Cc3cccc(OC)c3)c2O)cc1 ZINC000028766436 GI Annotated Anodyne COc1cccc(Cn2nc(C(F)(F)F)c(Cc3ccc(F)cc3)c2O)c1 ZINC000028766838 GI Annotated Anodyne COCc1cc(CCCOc2c(C)cc(-c3noc(C4CC4)n3)cc2C)on1 ZINC000028768200 GI Annotated Anodyne CC(C)Oc1c(/C(O)=N/c2nn[nH]n2)n(-c2ccccc2)c2ccc(Cl)cc12 ZINC000028768523 GI Annotated Mild COc1ccc(NCCCCCCC(C)=O)c2c1C(=O)c1ccccc1C2=O ZINC000028770035 GI Annotated Clean O[C@@H](c1nc2cc(Cl)c(Cl)cc2n1Cc1ccccn1)C(F)(F)F ZINC000028817563 GI Annotated Anodyne O[C@H](c1nc2cc(Cl)c(Cl)cc2n1Cc1ccccn1)C(F)(F)F ZINC000028817565 GI Annotated Anodyne C[N+](C)([O-])CCN1C(=O)c2cccc3c2c(cc2c4ccccc4sc32)C1=O ZINC000028818005 GI Annotated Bother CN1CCC[C@@H]1CCNc1nc2cc(/N=C(\N)c3cccs3)ccc2s1 ZINC000028818919 GI Annotated Mild N/C(=N\c1ccc2nc(NCCc3ccccn3)sc2c1)c1cccs1 ZINC000028818922 GI Annotated Mild N#Cc1cnc(Nc2ccc(CCO)cc2)nc1-c1ccc(Br)cc1 ZINC000028819633 GI Annotated Mild NC(=O)CCCCC[n+]1c(-c2ccccc2)c2cc(N)ccc2c2ccc(N)cc21 ZINC000028821294 GI Annotated Bother Cc1nc(NCc2cccc(Cl)c2Cl)nc(-n2ccnc2C)c1[N+](=O)[O-] ZINC000028821424 GI Annotated Bother CN1CCC[C@@H](CN2c3ccccc3Sc3cc(N4CCOCC4)ccc32)C1 ZINC000028821645 GI Annotated Anodyne CN1CCC[C@H](CN2c3ccccc3Sc3cc(N4CCOCC4)ccc32)C1 ZINC000028821646 GI Annotated Anodyne N#Cc1ccc(NC(=O)c2ccc(SC3CCCCC3)nc2)c(C(=O)O)c1 ZINC000028821797 GI Annotated Mild C[C@H]1C=C2OCOC2=C(CCn2nccc2C(=O)Nc2ccc(Cl)cc2)C1 ZINC000028822036 GI Annotated Anodyne C[C@@H]1C=C2OCOC2=C(CCn2nccc2C(=O)Nc2ccc(Cl)cc2)C1 ZINC000028822037 GI Annotated Anodyne O=C(Nc1ccc(C(F)(F)F)c(Cl)c1)c1ccnn1CCc1ccncc1 ZINC000028822057 GI Annotated Anodyne O=S1(=O)N=C(Nc2ccccc2-c2ccccc2)Nc2c(O)cc(Cl)cc21 ZINC000028822703 GI Annotated Anodyne CC(C)C(=O)N1CCC(c2ccccc2)(c2nccn2Cc2ccccc2)CC1 ZINC000028822919 GI Annotated Anodyne O=C(O)[C@@H]1C/C(=C2/CCCN(c3ccccc3)C2=O)c2ccc(Cl)cc2N1 ZINC000028823018 GI Annotated Clean O=C(O)[C@H]1C/C(=C2/CCCN(c3ccccc3)C2=O)c2ccc(Cl)cc2N1 ZINC000028823019 GI Annotated Clean CCC[C@@H](C)N(c1cc(Cl)ccc1CO)S(=O)(=O)c1ccc(F)cc1 ZINC000028823164 GI Annotated Anodyne CCC[C@H](C)N(c1cc(Cl)ccc1CO)S(=O)(=O)c1ccc(F)cc1 ZINC000028823165 GI Annotated Anodyne CCC[C@@H](C)N(c1cc(Cl)ccc1CO)S(=O)(=O)c1ccc(C#N)cc1 ZINC000028823172 GI Annotated Mild CCC[C@H](C)N(c1cc(Cl)ccc1CO)S(=O)(=O)c1ccc(C#N)cc1 ZINC000028823173 GI Annotated Mild CCCCN(c1cc(Cl)ccc1CO)S(=O)(=O)c1ccc(Cl)cc1 ZINC000028823205 GI Annotated Anodyne CC(C)CCn1c(CN2C(=O)[C@@H](CC(=O)O)c3ccccc32)nc2ccccc21 ZINC000028824408 GI Annotated Anodyne COc1cc(=O)n(Cc2nc3ccccc3n2CCCCF)c2ccccc12 ZINC000028824449 GI Annotated Anodyne CN(CCCCOCC(=O)O)c1cc(-c2ccccc2)c(-c2ccccc2)nn1 ZINC000028825570 GI Annotated Anodyne CN(CCCCOCC(=O)O)c1ncc(-c2ccccc2)c(-c2ccccc2)n1 ZINC000028825573 GI Annotated Anodyne CCCOc1ccc(-c2scc(-c3ccccc3)c2CC(=O)N=C(N)N)cc1 ZINC000028826081 GI Annotated Mild CCCOc1ccc(-c2csc(-c3ccccc3)c2CC(=O)N=C(N)N)cc1 ZINC000028826082 GI Annotated Mild CN(C)c1ccc(/C=C/C(=O)c2ccc(I)s2)cc1 ZINC000028826775 GI Annotated Mild CN(C)c1ccc(/C=C/C(=O)c2ccc(I)cc2)s1 ZINC000028826781 GI Annotated Mild CN(C)c1ccc(/C=C/C(=O)c2ccc(I)s2)s1 ZINC000028826782 GI Annotated Mild COc1cc(N)ccc1S(=O)(=O)Oc1c2ccccc2cc2sccc12 ZINC000028826867 GI Annotated Anodyne Cc1cc(NC(=O)CCl)sc1-c1nnc2sc(-c3ccccc3)nn12 ZINC000028826954 GI Annotated Reactive CC(C)=CCn1c(C)c(C(C)(C)C)s/c1=N\S(=O)(=O)c1ccccc1 ZINC000028862031 GI Annotated Anodyne CCN(CC)C(=O)c1cn2c(C)c(C)nc2c2c1CC[C@H](c1ccccc1)O2 ZINC000028867102 GI Annotated Anodyne CCN(CC)C(=O)c1cn2c(C)c(C)nc2c2c1CC[C@@H](c1ccccc1)O2 ZINC000028867105 GI Annotated Anodyne Cc1nc2c3c(c(C(=O)N4CCCC4)cn2c1C)CC[C@@H](c1ccccc1)O3 ZINC000028867170 GI Annotated Anodyne Cc1nc2c3c(c(C(=O)N4CCCC4)cn2c1C)CC[C@H](c1ccccc1)O3 ZINC000028867178 GI Annotated Anodyne Cc1nc2c3c(c(C(=O)NC4CCC4)cn2c1C)CC[C@H](c1ccccc1)O3 ZINC000028867204 GI Annotated Anodyne Cc1nc2c3c(c(C(=O)NC4CCC4)cn2c1C)CC[C@@H](c1ccccc1)O3 ZINC000028867208 GI Annotated Anodyne CN1C(=O)c2c(n3cccc3c3[nH]c4ccc(OCc5ccccc5)cc4c23)C1=O ZINC000028870926 GI Annotated Bother CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@@H]1Nc1cccc(Br)c1 ZINC000028870977 GI Annotated Mild CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@H]1Nc1cccc(Br)c1 ZINC000028870979 GI Annotated Mild COc1cc(OC)c(C2CCN(C)CC2)c(O)c1C(=O)/C=C/c1ccccc1F ZINC000028871174 GI Annotated Mild COc1cc(OC)c(C2CCN(C)CC2)c(O)c1C(=O)/C=C/c1ccccc1C ZINC000028871180 GI Annotated Mild COc1ccc(Cn2c(Cl)nc3c(-c4ccc(Cl)o4)ncnc32)cc1 ZINC000028877919 GI Annotated Anodyne COC(=O)CNC(=O)/C=C/C(C)(C)C/C=C(\C)CC/C=C(\C)Br ZINC000028878259 GI Annotated Anodyne Nc1n[nH]c2nc(-c3cc(Br)ccc3O)cc(-c3ccccc3)c12 ZINC000028882955 GI Annotated Anodyne Cc1c(Cl)ccc2c1N(C)C(=O)C2(c1ccc(O)cc1)c1ccc(O)cc1 ZINC000028883915 GI Annotated Anodyne O=C1Nc2c(Br)cccc2C1(c1ccc(O)cc1)c1ccc(O)cc1 ZINC000028884174 GI Annotated Anodyne O=C1Nc2c(C(F)(F)F)cccc2C1(c1ccc(O)cc1)c1ccc(O)cc1 ZINC000028884198 GI Annotated Anodyne O=C1Nc2c(-c3ccncc3)cccc2C1(c1ccc(O)cc1)c1ccc(O)cc1 ZINC000028884285 GI Annotated Anodyne N#Cc1ccc(NC(=O)c2nsc(-c3ccccc3)c2Cl)c(C(=O)O)c1 ZINC000028887089 GI Annotated Mild Cc1ccc(C(=O)NC2=NC(=O)/C(=C/c3ccc(-c4nccs4)o3)S2)cc1 ZINC000028888609 GI Annotated Clean N#Cc1cc(F)ccc1/C=C/c1ccc(S(=O)(=O)c2ccccc2F)cn1 ZINC000028889323 GI Annotated Mild COc1cc(F)ccc1/C=C/c1ccc(S(=O)(=O)c2ccccc2F)cn1 ZINC000028889338 GI Annotated Anodyne Nc1n[nH]cc1-c1c(-c2ccc(F)cc2)nn2c(NC3CCCC3)cccc12 ZINC000028890500 GI Annotated Anodyne Nc1nc(-c2c(-c3ccc(F)cc3)nn3c(NC4CCCC4)cccc23)c[nH]1 ZINC000028890508 GI Annotated Anodyne COc1cc(SC)ccc1[C@@H]1CC(c2c(O)cc(C)oc2=O)=NCCS1 ZINC000028899055 GI Annotated Anodyne COc1cc(SC)ccc1[C@H]1CC(c2c(O)cc(C)oc2=O)=NCCS1 ZINC000028899062 GI Annotated Anodyne N[C@@H]1CN(c2nccc(-c3ccsc3)n2)C[C@@H]1c1ccc(Cl)cc1Cl ZINC000028899529 GI Annotated Anodyne N[C@@H]1CN(c2ccnc(-c3ccsc3)n2)C[C@@H]1c1ccc(Cl)cc1Cl ZINC000028899533 GI Annotated Anodyne Cc1ccc(-c2ncc(C(=O)N[C@H](CO)C(C)C)nc2-c2ccc(C)cc2)cc1 ZINC000028900300 GI Annotated Anodyne Cc1ccc(-c2ncc(C(=O)N[C@@H](CO)C(C)C)nc2-c2ccc(C)cc2)cc1 ZINC000028900304 GI Annotated Anodyne Brc1ccc(NCc2ccc3cc2OCC#C/C=C\C#CCO3)cc1 ZINC000028901238 GI Annotated Mild C[N+]1(CCC(=O)Nc2ccc3c(c2)C(=O)c2cccc4ccnc-3c24)CCCC1 ZINC000028902610 GI Annotated Bother COc1ccc(-n2c(SC)nc3sc4c(c3c2=O)CCCC4)c(OC)c1 ZINC000028948906 GI Annotated Anodyne CCCc1sc2nc(SCC#N)n(-c3ccc(OC)cc3)c(=O)c2c1C ZINC000028948934 GI Annotated Mild COc1ccc(-n2c(SCC#N)nc3c(c2=O)[C@H]2CCCCC[C@H]2S3)cc1 ZINC000028948939 GI Annotated Mild COc1ccc(-n2c(SCC#N)nc3c(c2=O)[C@H]2CCCCC[C@@H]2S3)cc1 ZINC000028948941 GI Annotated Mild COc1ccc(-n2c(SCC#N)nc3c(c2=O)[C@@H]2CCCCC[C@H]2S3)cc1 ZINC000028948943 GI Annotated Mild COc1ccc(-n2c(SCC#N)nc3c(c2=O)[C@@H]2CCCCC[C@@H]2S3)cc1 ZINC000028948944 GI Annotated Mild COc1ccc(-n2c(SCC#N)nc3sc4c(c3c2=O)C[C@H](C)CC4)cc1 ZINC000028948950 GI Annotated Mild COc1ccc(-n2c(SCC#N)nc3sc4c(c3c2=O)C[C@@H](C)CC4)cc1 ZINC000028948952 GI Annotated Mild C#CCSc1nc2sc(CCC)c(C)c2c(=O)n1-c1ccc(OC)cc1 ZINC000028949104 GI Annotated Mild COc1nnnc2c1sc1nc(N(C)Cc3ccccc3)c3c(c12)CCCC3 ZINC000028949403 GI Annotated Anodyne COc1ccc(N2C(=O)c3c(C)c(OC)cc(O)c3[C@@H]2c2ccc(C)o2)cc1 ZINC000028950867 GI Annotated Clean COc1ccc(N2C(=O)c3c(C)c(OC)cc(O)c3[C@H]2c2ccc(C)o2)cc1 ZINC000028950869 GI Annotated Clean CCOc1cc2ncnc(C#Cc3nccn3-c3ccccc3)c2cc1OCC ZINC000028951235 GI Annotated Mild CC(C)CCn1c(Cn2c(=O)n(C(C)C)c3ccccc32)nc2cc(N)ccc21 ZINC000028952207 GI Annotated Anodyne C=CCNC(=O)C1(N(C(=O)c2cccnc2)[C@H](C)c2ccccc2)CCCCC1 ZINC000028953301 GI Annotated Mild C=CCNC(=O)C1(N(C(=O)c2cccnc2)[C@@H](C)c2ccccc2)CCCCC1 ZINC000028953303 GI Annotated Mild CC(=O)C1=NN(c2cc(F)ccc2F)C[C@@]1(CCCN(C)C)c1ccccc1 ZINC000028953458 GI Annotated Anodyne CC(=O)C1=NN(c2cc(F)ccc2F)C[C@]1(CCCN(C)C)c1ccccc1 ZINC000028953459 GI Annotated Anodyne CC(=O)C1=NN(c2cc(C)ccc2F)C[C@@]1(CCCN(C)C)c1ccccc1 ZINC000028953547 GI Annotated Anodyne COc1cc2c(cc1OC1CCOCC1)Cc1c-2n[nH]c1-c1ccc(C#N)cc1 ZINC000028954534 GI Annotated Mild O=c1[nH]c(C2=C[C@H](N3CC=C(c4ccc(F)cc4)CC3)CC2)nc2ccccc12 ZINC000028954697 GI Annotated Anodyne O=c1[nH]c(C2=C[C@@H](N3CC=C(c4ccc(F)cc4)CC3)CC2)nc2ccccc12 ZINC000028954700 GI Annotated Anodyne COc1cc2c(cc1OC)-c1cc(OC)c(OC)cc1[C@@H]1CN3CCC[C@H]3C=C21 ZINC000028955278 GI Annotated Anodyne COc1cc2c(cc1OC)-c1cc(OC)c(OC)cc1[C@H]1CN3CCC[C@H]3C=C21 ZINC000028955281 GI Annotated Anodyne CN(CCOc1ccc(-c2ccccc2)cc1C(=O)c1cccs1)CC(=O)O ZINC000028958277 GI Annotated Anodyne CN(CCOc1ccc(-c2ccccc2)cc1Cc1cccs1)CC(=O)O ZINC000028958312 GI Annotated Anodyne Brc1cnn2c(NCc3cccnc3)cc(-c3ccccc3)nc12 ZINC000028958699 GI Annotated Anodyne in-vivo Brc1cnn2c(NCc3cccnc3)cc(-c3cccs3)nc12 ZINC000028959038 GI Annotated Anodyne Brc1cnn2c(NCOc3cccnc3)cc(-c3ccccc3)nc12 ZINC000028959130 GI Annotated Anodyne CCCC(=O)O[C@H]1CCCC[C@H]1Cc1ccc(OCCNC(=O)OCC)cc1 ZINC000028959454 GI Annotated Anodyne CCCC(=O)O[C@@H]1CCCC[C@@H]1Cc1ccc(OCCNC(=O)OCC)cc1 ZINC000028959474 GI Annotated Anodyne CCCC(=O)O[C@H]1CCCC[C@@H]1Cc1ccc(OCCNC(=O)OCC)cc1 ZINC000028959478 GI Annotated Anodyne CCCC(=O)O[C@@H]1CCCC[C@H]1Cc1ccc(OCCNC(=O)OCC)cc1 ZINC000028959481 GI Annotated Anodyne C=C1CC/C=C(\C)CC[C@H](/C(=C/C=C/C(C)(C)O)COC(C)=O)[C@H]1C(=O)OC ZINC000028965629 GI Annotated Mild COc1ccc2c(c1OC)[C@H](CC(C)=O)N(C)c1c-2ccc2cc(O)c(O)cc12 ZINC000028969961 GI Annotated Clean in-vitro biogenic CC[C@H]1CC2(C[C@@H](CC)N1)C(=O)N(Cc1ccccc1)C(=O)N2c1ccccc1 ZINC000028971279 GI Annotated Anodyne COc1cc([C@@H]2c3c(cc(OC)c(OC)c3O)C[C@@H](C)[C@H]2C)cc2c1OCO2 ZINC000028972253 GI Annotated Anodyne C=CC(C)(C)c1[nH]c2c(CC=C(C)C)cccc2c1/C=C1\NC(=O)[C@H](C)NC1=O ZINC000028972514 GI Annotated Mild C=CC(C)(C)c1[nH]c2ccc(CC=C(C)C)cc2c1/C=C1\NC(=O)[C@H](C)NC1=O ZINC000028972538 GI Annotated Mild CCCN(Cc1ccc(S(=O)(=O)NCc2ccccc2C)cc1)CC1CC1 ZINC000028972850 GI Annotated Anodyne CC/C(=N\OCC1CC1)c1cc(Cl)ccc1NS(=O)(=O)C(F)(F)F ZINC000028976942 GI Annotated Mild C/C(=N\OC1CCCC1)c1cc(Cl)ccc1NS(=O)(=O)C(F)(F)F ZINC000028976976 GI Annotated Mild Cc1cc2[nH]c([C@@H](O)CCCC(=O)O)c(CCc3ccccc3)c2cc1C(=O)O ZINC000029037380 GI Annotated Anodyne Cc1cc2[nH]c([C@H](O)CCCC(=O)O)c(CCc3ccccc3)c2cc1C(=O)O ZINC000029037382 GI Annotated Anodyne O=C(N[C@H]1CCCN2c3cc(F)ccc3Oc3ccccc3[C@H]12)C(F)(F)F ZINC000029037485 GI Annotated Anodyne CN(C)c1nc(NC2CCCCCC2)nc(NC23CC4CC(CC(C4)C2)C3)n1 ZINC000029038987 GI Annotated Anodyne C[C@@H](CNC(=O)c1ccc(OC(F)(F)F)cc1)c1c[nH]c2ccc(O)cc12 ZINC000029040679 GI Annotated Anodyne C[C@H](CNC(=O)c1ccc(OC(F)(F)F)cc1)c1c[nH]c2ccc(O)cc12 ZINC000029040681 GI Annotated Anodyne CS(=O)(=O)/N=C(\O)CCCc1c(-c2ccc(F)cc2)[nH]c2ccc(C#N)cc12 ZINC000029041400 GI Annotated Mild Cc1cc(=O)[nH]c2ccc3c4c(C(=O)OC(C)(C)C)cccc4oc(=O)c3c12 ZINC000029043566 GI Annotated Bother C[C@@](C#N)(COc1ccccc1Cl)NC(=O)c1ccc(OC(F)(F)F)cc1 ZINC000029044732 GI Annotated Mild C[C@](C#N)(COc1ccccc1Cl)NC(=O)c1ccc(OC(F)(F)F)cc1 ZINC000029044735 GI Annotated Mild C[C@@](C#N)(COc1ccccc1Cl)NC(=O)c1cccc(OC(F)(F)F)c1 ZINC000029045949 GI Annotated Mild C[C@](C#N)(COc1ccccc1Cl)NC(=O)c1cccc(OC(F)(F)F)c1 ZINC000029045952 GI Annotated Mild O=C(O)[C@@H]1CSc2c(C3CC3)c(Cc3cccc4ccccc34)cc(=O)n21 ZINC000029047277 GI Annotated Anodyne c1ccc(Cc2c[nH]c3ncnc(N4CC5(CCNCC5)c5ccccc54)c23)cc1 ZINC000029047366 GI Annotated Anodyne Cc1ccc(SC2=C(Cl)C(=O)c3nc(-c4ccccn4)[nH]c3C2=O)cc1 ZINC000029047447 GI Annotated Mild CCOc1ccc(NC2=C(Cl)C(=O)c3nc(-c4ccccc4)[nH]c3C2=O)cc1 ZINC000029048761 GI Annotated Mild CCC(C)(CC)Sc1nc2cc(Cl)c(N3CCN(CCO)CC3)cc2[nH]1 ZINC000029049879 GI Annotated Anodyne O=C(c1cc2c(cn1)OC(c1ccccc1)(c1ccccc1)O2)N1CCCCC1 ZINC000029054877 GI Annotated Anodyne O=c1[nH]c(N/N=C\c2ccccc2)nc2nc3c(c(-c4ccccc4)c12)CCCC3 ZINC000029059456 GI Annotated Mild O=C1N/C(=N/c2nsc3ccccc23)S/C1=C\c1ccccc1[N+](=O)[O-] ZINC000029060059 GI Annotated Mild O=C1N/C(=N\c2nc3ccccc3s2)S/C1=C\c1ccc([N+](=O)[O-])cc1 ZINC000029060472 GI Annotated Mild O=C1N/C(=N\c2nc3ccccc3s2)S/C1=C\c1ccccc1[N+](=O)[O-] ZINC000029060620 GI Annotated Mild COc1ccc(N2C(=O)O/C(=C3/C(=O)N(c4ccccc4)N=C3C)C=C2C)cc1 ZINC000029060884 GI Annotated Clean CC(=O)Oc1ccc2c(C)cc(=O)oc2c1Cc1c(C)n(C)c2ccccc12 ZINC000029061798 GI Annotated Anodyne CCOc1ccc2nc(C)cc(Nc3ccc(C4=NNC(=O)CC4)c(O)c3)c2c1 ZINC000029064160 GI Annotated Clean Oc1cc2c(cc1Cl)CCN(C(=S)NCCc1ccc(Cl)cc1)C2 ZINC000029123082 GI Annotated Anodyne Oc1ccc2c(c1Cl)CN(C(=S)NCCc1ccc(Cl)cc1)CC2 ZINC000029123105 GI Annotated Anodyne Oc1ccc2c(c1Cl)CCN(C(=S)NCCc1ccc(Cl)cc1)C2 ZINC000029123166 GI Annotated Anodyne Oc1cc2c(cc1Cl)CN(C(=S)NCCc1ccc(Cl)cc1)CC2 ZINC000029123167 GI Annotated Anodyne COc1ccc(NC(=O)Cc2cs/c(=N\c3ccc(C)cc3C)n2C)cc1 ZINC000029124642 GI Annotated Anodyne CCc1ccc(NC(=O)Cc2cs/c(=N/c3ccc(CC#N)cc3)n2C)cc1 ZINC000029124886 GI Annotated Mild CCc1ccc(NC(=O)Cc2cs/c(=N/c3ccc(C(C)=O)cc3)n2C)cc1 ZINC000029124890 GI Annotated Anodyne CCc1ccc(NC(=O)Cc2cs/c(=N\c3ccc(OC)cc3C)n2C)cc1 ZINC000029125066 GI Annotated Anodyne Cn1c(CC(=O)Nc2ccc(Cl)cc2)cs/c1=N\c1cccc(F)c1 ZINC000029125233 GI Annotated Anodyne COc1cccc(CNc2ncnn2-c2cccc(Cl)c2Cl)c1OC ZINC000029126211 GI Annotated Anodyne Clc1cccc(-n2cnnc2NCc2cccnc2N2CCCC2)c1Cl ZINC000029126408 GI Annotated Anodyne FC(F)(F)c1ccc(-c2nc(Cc3ccccc3)nc3c2CCNCC3)cc1 ZINC000029126543 GI Annotated Anodyne Clc1cccc(-n2ncnc2NCc2cccnc2N2CCCC2)c1Cl ZINC000029126716 GI Annotated Anodyne O=C(Nc1ccc(-c2ccccc2)cc1)C1=C(O)[C@H](CCc2ccccc2)NC1=O ZINC000029127001 GI Annotated Anodyne O[C@@H]1COc2cccc(Nc3cc(-c4ccc(C(F)(F)F)cc4)ncn3)c2C1 ZINC000029127263 GI Annotated Anodyne O[C@H]1COc2cccc(Nc3cc(-c4ccc(C(F)(F)F)cc4)ncn3)c2C1 ZINC000029127264 GI Annotated Anodyne CN1C(=O)/C(=C/c2c[nH]c3ccccc23)C(=O)N(c2cccc3ccccc23)C1=O ZINC000029127486 GI Annotated Clean Cc1cc2[nH]c(C(=O)NCC3CC3)c(CCc3ccccc3)c2cc1C(=O)O ZINC000029127603 GI Annotated Anodyne O=C1CCCN1CCc1ccc(C2=CC[C@@H]3CN(Cc4ccccc4)C[C@H]23)cc1 ZINC000029127945 GI Annotated Anodyne O=C1CCCN1CCc1ccc(C2=CC[C@H]3CN(Cc4ccccc4)C[C@H]23)cc1 ZINC000029127946 GI Annotated Anodyne c1ccc(Sc2ncnc3ncn([C@@H]4CNc5ccccc5CO4)c23)cc1 ZINC000029128060 GI Annotated Anodyne c1ccc(Sc2ncnc3ncn([C@H]4CNc5ccccc5CO4)c23)cc1 ZINC000029128061 GI Annotated Anodyne CO[C@@H]1CN(CC2Cc3ccccc3C2)CC[C@H]1n1c(C)nc2cc(C)ccc21 ZINC000029128966 GI Annotated Anodyne CC(C)c1cc(NCc2cccs2)nc(-c2ccc(S(C)(=O)=O)cc2)n1 ZINC000029131735 GI Annotated Anodyne CC(C)(C)c1ccc(CCNC(=S)N2CCCc3cc(O)c(O)cc3C2)cc1 ZINC000029132678 GI Annotated Clean O=C1c2ccccc2[C@@H]2[C@H](C(=O)O)[C@H](C(=O)O)[C@@H]2c2ccc(-c3ccccc3)cc21 ZINC000029206404 GI Annotated Anodyne O=S(=O)(c1ccccc1)c1c(O)nnc(-c2ccccc2)c1-c1ccccc1 ZINC000029210321 GI Annotated Anodyne O=C(CCCn1c2c(c3ccccc31)C(=O)CN1CCCC[C@@H]21)NC1CCCC1 ZINC000029222427 GI Annotated Anodyne O=C(CCCn1c2c(c3ccccc31)C(=O)CN1CCCC[C@H]21)NC1CCCC1 ZINC000029222432 GI Annotated Anodyne CCOP(=O)(Cc1ccc(-c2nc3cccc(F)c3c(=O)[nH]2)cc1)OCC ZINC000029222698 GI Annotated Anodyne COc1ccc(-c2csc3c2-n2cccc2/C3=N/OCCCN(C)C)cc1 ZINC000029235246 GI Annotated Mild CC1(C)CC(=O)[C@@H]2[C@H](C1)Nc1ccnn1[C@H]2c1ccc(F)c(Br)c1 ZINC000029246194 GI Annotated Anodyne CC1(C)CC(=O)[C@@H]2[C@@H](C1)Nc1ccnn1[C@H]2c1ccc(F)c(Br)c1 ZINC000029246201 GI Annotated Anodyne CC1(C)CC(=O)[C@@H]2[C@H](C1)Nc1ccnn1[C@@H]2c1ccc(F)c(Br)c1 ZINC000029246208 GI Annotated Anodyne CC1(C)CC(=O)[C@H]2[C@@H](c3ccc(F)c(Br)c3)n3nccc3N[C@@H]2C1 ZINC000029246214 GI Annotated Anodyne CCOC(=O)[C@@H](C)Oc1ccc(N(C)c2ncc3cc(Cl)ccc3n2)cc1 ZINC000029253255 GI Annotated Anodyne CCOC(=O)[C@H](C)Oc1ccc(N(C)c2ncc3cc(Cl)ccc3n2)cc1 ZINC000029253260 GI Annotated Anodyne CCOC(=O)[C@@H](C)Oc1ccc(N(C)c2cnc3cc(Cl)ccc3n2)cc1 ZINC000029254513 GI Annotated Anodyne CCOC(=O)[C@H](C)Oc1ccc(N(C)c2cnc3cc(Cl)ccc3n2)cc1 ZINC000029254517 GI Annotated Anodyne O=C1Nc2cc(C(F)(F)F)ccc2[C@@]1(O)c1cc(-c2ccccc2)ccc1O ZINC000029306838 GI Annotated Anodyne O=C1Nc2cc(C(F)(F)F)ccc2[C@]1(O)c1cc(-c2ccccc2)ccc1O ZINC000029306842 GI Annotated Anodyne O=C1c2c(F)c(F)c(F)c(F)c2C(=O)N1Cc1c(Cl)cccc1Cl ZINC000029308782 GI Annotated Anodyne CC1(C)CC[C@@H]2Nc3ccnn3[C@@H](c3ccc(F)c(Br)c3)[C@@H]2C1=O ZINC000029309752 GI Annotated Anodyne CC1(C)CC[C@H]2Nc3ccnn3[C@@H](c3ccc(F)c(Br)c3)[C@@H]2C1=O ZINC000029309758 GI Annotated Anodyne CC1(C)CC[C@@H]2Nc3ccnn3[C@H](c3ccc(F)c(Br)c3)[C@@H]2C1=O ZINC000029309764 GI Annotated Anodyne CC1(C)CC[C@H]2Nc3ccnn3[C@H](c3ccc(F)c(Br)c3)[C@@H]2C1=O ZINC000029309769 GI Annotated Anodyne CCN(CC)CCn1nc2c3c(OC)ccc(OC)c3sc3c(N)ccc1c32 ZINC000029323182 GI Annotated Bother CCN(CC)CCn1nc2c3ccccc3sc3c(NCCN)ccc1c32 ZINC000029330980 GI Annotated Bother Cc1c(C(=O)CN2CCCC2)c(C)n(C)c1C(=O)c1ccc(Cl)cc1Cl ZINC000029339707 GI Annotated Anodyne CN(C)CCN1C(=O)c2ccc(Cl)c3cc4c(Cl)cccc4c(c23)C1=O ZINC000029343732 GI Annotated Bother CCOC(=O)CCc1ccc(Oc2ccc(O)c(CN)c2)c(Cl)c1Cl ZINC000029344969 GI Annotated Clean CC[C@@H](C)CNCCCNCCCCCCCNCCCNC[C@H](C)CC ZINC000029389001 GI Annotated Anodyne C[C@@H](NC(=O)[C@@H](C#N)C(C)(C)C)[C@@H](Oc1ccccc1C#N)c1ccccc1 ZINC000029390122 GI Annotated Mild C[C@@H](NC(=O)[C@H](C#N)C(C)(C)C)[C@@H](Oc1ccccc1C#N)c1ccccc1 ZINC000029390125 GI Annotated Mild Nn1c2ccc(F)cc2c2c3c(c4c5cc(F)ccc5sc4c21)C(=O)NC3=O ZINC000029390721 GI Annotated Bother CCOC(=O)Nc1cc2c(c(N)n1)N=C(c1ccccc1)[C@H](c1ccccc1)O2 ZINC000029391050 GI Annotated Anodyne CCOC(=O)Nc1cc2c(c(N)n1)N=C(c1ccccc1)[C@@H](c1ccccc1)O2 ZINC000029391053 GI Annotated Anodyne CC(C)[C@@H](C#N)C(=O)N[C@H](C)[C@@H](Oc1cc(F)ccc1C#N)c1ccccc1 ZINC000029391719 GI Annotated Mild CC(C)[C@H](C#N)C(=O)N[C@H](C)[C@@H](Oc1cc(F)ccc1C#N)c1ccccc1 ZINC000029391722 GI Annotated Mild CC[C@@H](C#N)C(=O)N[C@H](C)[C@@H](Oc1cc(Cl)ccc1C#N)c1ccccc1 ZINC000029391964 GI Annotated Mild CC[C@H](C#N)C(=O)N[C@H](C)[C@@H](Oc1cc(Cl)ccc1C#N)c1ccccc1 ZINC000029391967 GI Annotated Mild CCSc1ccc2c3c(c4ccccc4cc13)C(=O)N(CCN(C)C)C2=O ZINC000029393548 GI Annotated Bother COc1cc(C2=C(c3ccc(SC)cc3)C[C@@H]3CCCN3C2=O)ccc1O ZINC000029399106 GI Annotated Anodyne COc1cc(C2=C(c3ccc(SC)cc3)C[C@H]3CCCN3C2=O)ccc1O ZINC000029399109 GI Annotated Anodyne Cc1csc(-c2cc(-c3ccncc3)c3n(c2=O)CCCc2ccncc2-3)n1 ZINC000029399112 GI Annotated Anodyne CN(C)c1cccc(OCCCCCCN2CCN(c3ccncc3)C2=O)c1 ZINC000029402277 GI Annotated Anodyne COc1ccc(C2=C(c3ccc(SC)cc3)C[C@@H]3CCCN3C2=O)cc1O ZINC000029407040 GI Annotated Anodyne COc1ccc(C2=C(c3ccc(SC)cc3)C[C@H]3CCCN3C2=O)cc1O ZINC000029407043 GI Annotated Anodyne N#C[C@H](Cc1cc(Br)c(O)c(Br)c1)c1ccccn1 ZINC000029409313 GI Annotated Mild N#C[C@@H](Cc1cc(Br)c(O)c(Br)c1)c1ccccn1 ZINC000029409315 GI Annotated Mild Cc1cc(NC(=O)C(=O)c2cn(Cc3ccsc3)c3ccccc23)sn1 ZINC000029409647 GI Annotated Anodyne C=CCNC(=S)Nc1ccc(-c2n[nH]c(=S)n2CCc2ccccc2)cc1 ZINC000029409819 GI Annotated Mild CC(C)NCCOc1ccc2cc3ccc(OCCNC(C)C)cc3nc2c1 ZINC000029412748 GI Annotated Bother CCCCc1ccc(Cn2cnc3c(N(C)C)nc(C(F)(F)F)nc32)cc1 ZINC000029414464 GI Annotated Anodyne C[C@H]1COc2c(-c3ccc4cnccc4c3)c(F)cc3c(=O)c(C(=O)O)cn1c23 ZINC000029415209 GI Annotated Anodyne N=c1sc(-c2cnccn2)nn1-c1c(Cl)cc(C(F)(F)F)cc1Cl ZINC000029464134 GI Annotated Anodyne N=c1sc(-c2cccnn2)nn1-c1c(Cl)cc(C(F)(F)F)cc1Cl ZINC000029464439 GI Annotated Anodyne N=c1sc(-c2ccncn2)nn1-c1c(Cl)cc(C(F)(F)F)cc1Cl ZINC000029464622 GI Annotated Anodyne C[C@@H](c1ccccc1)[C@H](O)/C=C/[C@@H]1[C@@H]2CC[C@@H](O2)[C@@H]1C/C=C\C/C=C/C(=O)O ZINC000029465718 GI Annotated Anodyne C[C@@H](c1ccccc1)[C@H](O)/C=C/[C@@H]1[C@H]2CC[C@H](O2)[C@@H]1C/C=C\C/C=C/C(=O)O ZINC000029465721 GI Annotated Anodyne CC[C@]1(CCCc2ccccc2)CN(c2c(OC)cc(OC)cc2OC)C1=O ZINC000029468419 GI Annotated Anodyne CN(C)c1nc(C(F)(F)F)nc2c1ncn2Cc1ccc(Cl)cc1Cl ZINC000029468575 GI Annotated Anodyne Cc1cc(NC(=N)N)cc(C)c1-c1ccc(-c2c(C)cc(NC(=N)N)cc2C)o1 ZINC000029468587 GI Annotated Anodyne CCCN1CCN(/C(=N\c2ccccc2Cl)c2ccc(C(=O)OC)cc2)CC1 ZINC000029471508 GI Annotated Mild CN(C)c1nc(C(F)(F)F)nc2c1ncn2Cc1ccc(Cl)c(Cl)c1 ZINC000029476793 GI Annotated Anodyne CCCCOc1ccc(Cn2cnc3c(N(C)C)nc(C(F)(F)F)nc32)cc1 ZINC000029479229 GI Annotated Anodyne O=c1c2cc(F)ccc2nc(/C=C/c2ccccn2)n1-c1c(F)cccc1F ZINC000029483564 GI Annotated Anodyne COc1cc2nc(/C=C/c3ccccn3)n(-c3ccccc3C)c(=O)c2cc1OC ZINC000029483758 GI Annotated Anodyne CS/C(=N\c1cccc([C@@H]2CN3CCSC3=N2)c1)Nc1ccccc1C#N ZINC000029485784 GI Annotated Mild CS/C(=N\c1cccc([C@H]2CN3CCSC3=N2)c1)Nc1ccccc1C#N ZINC000029485787 GI Annotated Mild C[C@]12CC[C@]3(OCc4cccc(Br)c4)C[C@@H]1CCC[C@@]2(CO)O3 ZINC000029487175 GI Annotated Anodyne C[C@]12CC[C@]3(OCc4cccc(Br)c4)C[C@H]1CCC[C@@]2(CO)O3 ZINC000029487177 GI Annotated Anodyne Fc1ccc(-n2c3c(c4cc(F)ccc42)CN(CCc2cnccn2)CC3)cc1 ZINC000029488462 GI Annotated Anodyne CS/C(=N\c1cccc([C@@H]2CN3CCSC3=N2)c1)Nc1ccc(C#N)cc1 ZINC000029547306 GI Annotated Mild CS/C(=N\c1cccc([C@H]2CN3CCSC3=N2)c1)Nc1ccc(C#N)cc1 ZINC000029547315 GI Annotated Mild CS/C(=N\c1cccc([C@@H]2CN3CCSC3=N2)c1)Nc1cccc(C#N)c1 ZINC000029547695 GI Annotated Mild CS/C(=N\c1cccc([C@H]2CN3CCSC3=N2)c1)Nc1cccc(C#N)c1 ZINC000029547700 GI Annotated Mild CN(C)CCC[C@@H](O)[C@@]12CCC[C@@H]3C[C@@](OCc4ccccc4)(CC[C@@]31C)O2 ZINC000029547988 GI Annotated Anodyne CN(C)[C@@H]1Cc2ccccc2C[C@H]1N(C)C(=O)c1ccc(Cl)c(Cl)c1 ZINC000029548276 GI Annotated Anodyne COc1cc2c(cc1OCCCOCc1ccccc1)N=C[C@@H]1CCCN1C2=O ZINC000029565285 GI Annotated Anodyne CCc1c(C)nc(O)c(NC(=O)CCCC(=O)O)c1Cc1cc(C)cc(C)c1 ZINC000029565493 GI Annotated Anodyne COC(=O)[C@H](COC(C)(C)C)NC/C=C/c1cccc(Oc2ccccc2)c1 ZINC000029569872 GI Annotated Anodyne O=[P@](O)(Nc1ccccc1)OCc1ccc(I)cc1 ZINC000299804394 GI Annotated Anodyne CO[C@H](C)C(=O)N(c1ccccc1)[C@@H]1CCN(CCc2cccs2)C[C@H]1C ZINC000299804857 GI Annotated Anodyne CC[C@H]1C[C@@]2(C[C@@H](CC)N1Cc1ccccc1)C(=O)NC(=O)N2c1ccccc1 ZINC000299806138 GI Annotated Anodyne CC[C@H]1C[C@]2(C[C@@H](CC)N1Cc1ccccc1)C(=O)NC(=O)N2c1ccccc1 ZINC000299806139 GI Annotated Anodyne O=C1CS[C@H](c2c(Cl)cccc2Cl)N1[C@@H]1CC[C@H]1Br ZINC000299806851 GI Annotated Reactive C[C@H](NC(=O)Cc1ccc(C(=O)O)cc1)c1ccccc1N1CCCC[C@H]1C ZINC000299807300 GI Annotated Anodyne CCN1CCN(CC)[C@H]2c3c(C)c4cc(Br)ccc4n3CC[C@H]21 ZINC000299809310 GI Annotated Anodyne CCN1CCN(CC)[C@@H]2CCn3c(c(C)c4cc(Br)ccc43)[C@H]21 ZINC000299809312 GI Annotated Anodyne CCN(CC)[P@](N)(=O)O[C@H](C[C@H]1NC(C)(C)C[C@H](C)O1)c1ccccc1 ZINC000299809823 GI Annotated Anodyne CCN(CC)[P@](N)(=O)O[C@H](C[C@H]1NC(C)(C)C[C@@H](C)O1)c1ccccc1 ZINC000299809824 GI Annotated Anodyne COc1ccc([C@H]2C[C@]3(N(C)C)C[C@H](O)[C@@H]2[C@H](c2ccc(OC)cc2)C3)cc1 ZINC000299810474 GI Annotated Anodyne COc1ccc([C@H]2C[C@]3(N(C)C)C[C@@H](O)[C@@H]2[C@H](c2ccc(OC)cc2)C3)cc1 ZINC000299810475 GI Annotated Anodyne COc1cc(-c2nc(CN3CC[C@H]4CCCC[C@H]4C3)co2)cc(OC)c1OC ZINC000299810891 GI Annotated Anodyne COc1cc(-c2nc(CN3CC[C@@H]4CCCC[C@H]4C3)co2)cc(OC)c1OC ZINC000299810892 GI Annotated Anodyne N#Cc1c(N[C@@H]2CC[C@@H](N)CC2)cc(Nc2ccccc2Cl)n2nccc12 ZINC000299811012 GI Annotated Mild Cc1ccc([C@H]2N[C@H](c3ccc(C)cc3)[C@H]3CCC[C@H]2C3=NNC(N)=S)cc1 ZINC000299812435 GI Annotated Mild COC(=O)C[C@@H]1c2ccccc2[C@@H](Cc2ccc(OC)cc2)[C@H](C)N1C(=O)OC ZINC000299812690 GI Annotated Anodyne CCCCCCN1C[C@H](n2cc(C3CC3)nn2)[C@H](O)C[C@H]1c1ccc(C)cc1 ZINC000299812881 GI Annotated Anodyne O=S(=O)(Cc1ccccc1)N=Nc1c(O)[nH]c2ccc(Br)cc12 ZINC000299813057 GI Annotated Clean CC(C)n1c(O)c(N=NC(=O)Cn2ccc(C(F)(F)F)n2)c2ccccc21 ZINC000299813192 GI Annotated Clean CCOC(=O)OC[C@@H]1O[C@H](c2cc(C)cc(C)c2)C=C[C@H]1OC(=O)OCC ZINC000299813228 GI Annotated Anodyne Cc1ccc(O[C@@H]2[C@@H](O)CO[C@H]2/C=C/C#Cc2ccc(C(C)(C)C)cc2)cc1 ZINC000299813292 GI Annotated Mild CC/C=C1/C(=O)[C@@]2(C(=O)c3ccccc3)C[C@H]3CC[C@@](CCC)(C2=O)[C@@]13OC ZINC000299813869 GI Annotated Mild COC(=O)[C@]1(/C=C2/c3ccc(F)cc3[C@H](OC)[C@@H]2C)[C@@H]2Oc3ccccc3[C@@H]21 ZINC000299813872 GI Annotated Anodyne COC(=O)[C@@]1(/C=C2/c3ccc(F)cc3[C@H](OC)[C@@H]2C)[C@@H]2c3ccccc3O[C@H]21 ZINC000299813873 GI Annotated Anodyne COC(=O)[C@]1(/C=C2\c3ccc(F)cc3[C@H](OC)[C@@H]2C)[C@@H]2Oc3ccccc3[C@@H]21 ZINC000299813874 GI Annotated Anodyne COC(=O)[C@@]1(/C=C2\c3ccc(F)cc3[C@H](OC)[C@@H]2C)[C@@H]2c3ccccc3O[C@H]21 ZINC000299813875 GI Annotated Anodyne C=CC[C@@H]1C=C[C@H](ON=C[C@H](C)[C@H](OCc2ccccc2)C(C)C)[C@H](CO)O1 ZINC000299813980 GI Annotated Mild C=CC[C@@H]1C=C[C@H](ON=C[C@H](C)[C@H](OCc2ccccc2)C(C)C)[C@@H](CO)O1 ZINC000299813981 GI Annotated Mild C=CC[C@@H]1C=C[C@H](ON=C[C@H](C)[C@@H](OCc2ccccc2)C(C)C)[C@H](CO)O1 ZINC000299813982 GI Annotated Mild C=CC[C@@H]1C=C[C@H](ON=C[C@H](C)[C@@H](OCc2ccccc2)C(C)C)[C@@H](CO)O1 ZINC000299813983 GI Annotated Mild CC(C)[C@H](OCc1ccccc1)[C@H](C)C=NOC[C@@H](O)COCc1ccco1 ZINC000299814132 GI Annotated Mild CC(C)[C@H](OCc1ccccc1)[C@@H](C)C=NOC[C@H](O)COCc1ccco1 ZINC000299814134 GI Annotated Mild CC(C)[C@H](OCc1ccccc1)[C@H](C)C=NOC[C@H](O)COCc1ccco1 ZINC000299814135 GI Annotated Mild CC(C)[C@H](OCc1ccccc1)[C@@H](C)C=NOC[C@@H](O)COCc1ccco1 ZINC000299814137 GI Annotated Mild C[C@@H]1CC[C@@H](C(=O)N(c2cc(C#CC(C)(C)C)sc2C(=O)O)N(C)C)CC1 ZINC000299815469 GI Annotated Reactive C=CCCCCCCCCCO[C@@H]1C=C[C@@H](OC(C)=O)[C@H](COC(C)=O)O1 ZINC000299815650 GI Annotated Mild C=CCCCCCCCCCO[C@@H]1C=C[C@@H](OC(C)=O)[C@@H](COC(C)=O)O1 ZINC000299815651 GI Annotated Mild C[C@@H]1CC[C@H]2[C@]3(CC[C@@H]3C[Si](C)(C)C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 ZINC000299818384 GI Annotated Reactive C[C@@H]1CC[C@H]2[C@]3(CC[C@H]3C[Si](C)(C)C)C(=O)O[C@@H]3O[C@@]4(C)CC[C@@H]1[C@]32OO4 ZINC000299818386 GI Annotated Reactive O=S(=O)(c1ccc(-c2cnc(C3CC3)s2)cc1)N1CCc2ccccc21 ZINC000299819045 GI Annotated Anodyne C#CCOC(=O)c1cc(C(=O)c2ccc(Br)cc2)n2c(C)cccc12 ZINC000299820594 GI Annotated Mild Cc1ccc(Cn2nc3c4ccccc4n(Cc4ccncc4)cc-3c2=O)c(C)c1 ZINC000299821415 GI Annotated Anodyne Cc1nc(Nc2ccc(C(C)C)cc2)nc(S[C@@H](C(N)=O)c2ccccc2)n1 ZINC000299821477 GI Annotated Anodyne Cc1nc(Nc2ccc(C(C)C)cc2)nc(S[C@H](C(N)=O)c2ccccc2)n1 ZINC000299821478 GI Annotated Anodyne COc1cc(Br)cc2cc(-c3ccc(OC(C)=O)cc3)c(=O)oc12 ZINC000299821623 GI Annotated Anodyne COc1ccc(OC)c(-c2cc3cc(Br)cc(OC)c3oc2=O)c1 ZINC000299821863 GI Annotated Anodyne N#Cc1ccccc1CSc1nnc2c(n1)[nH]c1cc(Br)ccc12 ZINC000299821979 GI Annotated Mild Cc1ccc(Cn2nc3c4ccccc4n(Cc4ccccn4)cc-3c2=O)c(C)c1 ZINC000299822149 GI Annotated Anodyne Cc1cc(C)c(Oc2cc(Nc3ccc([N+](=O)[O-])cc3)nc3ncnn23)c(C)c1 ZINC000299822609 GI Annotated Bother COc1cc(NC(=O)[C@@H](C)n2ncc3c(=O)oc4ccccc4c32)ccc1Cl ZINC000299823645 GI Annotated Anodyne COc1cc(NC(=O)[C@H](C)n2ncc3c(=O)oc4ccccc4c32)ccc1Cl ZINC000299823648 GI Annotated Anodyne Cc1ccc(Cn2nc3c4ccccc4n(Cc4cccnc4)cc-3c2=O)c(C)c1 ZINC000299823761 GI Annotated Anodyne Cc1cc(F)ccc1-c1nc(-c2ccc3c(c2)[nH]c(=O)n3CCN(C)C)cs1 ZINC000299824037 GI Annotated Anodyne N#Cc1ccc(-c2ccc(-c3nccn3-c3ccc(N4CCNCC4)cc3)o2)cc1 ZINC000299824147 GI Annotated Mild Oc1ccccc1/C=N/c1nnc(SCc2nnc(-c3ccccc3)o2)s1 ZINC000299824748 GI Annotated Mild O=S(=O)(c1ccc(-c2cnc(C3CC3)o2)cc1F)N1CCc2ccccc21 ZINC000299824804 GI Annotated Anodyne Cc1ccc(-c2c(F)cc3c(=O)c(C(=O)O)cn(C4CC4)c3c2[N+](=O)[O-])cc1 ZINC000299824845 GI Annotated Bother CCS(=O)(=O)N(Cc1cncc(-c2cccc(Cl)c2Cl)c1)C1CC1 ZINC000299825444 GI Annotated Anodyne O=C1c2ccccc2C(=O)c2cc3oc(SCCN4CCCCC4)nc3cc21 ZINC000299825445 GI Annotated Clean Cc1ccc(-c2cn3nc(-c4ccccc4)c(CN4CCN(C)CC4)c3n2C)cc1 ZINC000299826178 GI Annotated Anodyne Cc1nnc(-c2ccc(Nc3nc4n(n3)CCC[C@@H]4c3ccc(F)cc3)cc2)o1 ZINC000299826362 GI Annotated Anodyne Cc1nnc(-c2ccc(Nc3nc4n(n3)CCC[C@H]4c3ccc(F)cc3)cc2)o1 ZINC000299826366 GI Annotated Anodyne COCCCOc1cccc([C@@H]2NC(=S)Nc3c2oc2c(F)cccc32)c1 ZINC000299826627 GI Annotated Anodyne COCCCOc1cccc([C@H]2NC(=S)Nc3c2oc2c(F)cccc32)c1 ZINC000299826633 GI Annotated Anodyne COCc1cc2c3cccnc3cc(CCc3nc(-c4ccccc4)cn3C)n2n1 ZINC000299826914 GI Annotated Anodyne O=c1ccc2cc(OCc3cn(-c4ccc(Cl)c(Cl)c4)nn3)ccc2o1 ZINC000299826949 GI Annotated Anodyne O=C1CCCC2=C1[C@@H](n1nnc3ccccc31)c1cc(Br)ccc1O2 ZINC000299827379 GI Annotated Mild O=C1CCCC2=C1[C@H](n1nnc3ccccc31)c1cc(Br)ccc1O2 ZINC000299827381 GI Annotated Mild Cc1cc(C=O)cc(C)c1Oc1nc(Cl)nc(Nc2ccc(C#N)cc2)n1 ZINC000299827935 GI Annotated Mild O=C1c2ccccc2C(=O)c2cc3oc(Cc4ccc(F)cc4F)nc3cc21 ZINC000299828483 GI Annotated Clean CCCCNC(=S)N[C@@H]1C(=O)N(c2ccc(C)cc2)[C@@H]1/C=C/c1ccccc1 ZINC000299828537 GI Annotated Anodyne COc1ccc(-c2cc3cc(Br)cc(OC)c3oc2=O)cc1OC ZINC000299828706 GI Annotated Anodyne O=[N+]([O-])c1cccc2c(NCc3ccc(F)cc3)nc(N3CCCCC3)nc12 ZINC000299828834 GI Annotated Bother COc1cc(Br)cc2cc(-c3cccc(OC(C)=O)c3)c(=O)oc12 ZINC000299829496 GI Annotated Anodyne C#CCCOC(=O)c1cc(C(=O)c2ccc(Br)cc2)n2ccccc12 ZINC000299830087 GI Annotated Mild CC1CCC(NC(=O)c2cc3cccnc3n(CCCCCCF)c2=O)CC1 ZINC000299830360 GI Annotated Anodyne C[C@@H](c1ccc2c(c1)CCN(C(=O)c1cc3cc(Cl)ncc3n1C)C2)N(C)C ZINC000299831146 GI Annotated Anodyne C[C@H](c1ccc2c(c1)CCN(C(=O)c1cc3cc(Cl)ncc3n1C)C2)N(C)C ZINC000299831160 GI Annotated Anodyne O=c1cc(CO)oc([C@@H](c2ccc(Cl)cc2)c2c[nH]c3ccccc23)c1O ZINC000299831998 GI Annotated Anodyne O=c1cc(CO)oc([C@H](c2ccc(Cl)cc2)c2c[nH]c3ccccc23)c1O ZINC000299832000 GI Annotated Anodyne O=C(CNCCc1ccccc1O)N1CCc2ccccc2[C@H]1C1CCCCC1 ZINC000299832702 GI Annotated Anodyne O=C(CNCCc1ccccc1O)N1CCc2ccccc2[C@@H]1C1CCCCC1 ZINC000299832703 GI Annotated Anodyne CNc1nc(NCc2ccc(OC(F)(F)F)cc2)cc(-c2ccccn2)n1 ZINC000299832985 GI Annotated Anodyne COc1cccc2c1c(C(=O)/C=C(\O)C(=O)O)cn2Cc1cc(C)cc(C)c1 ZINC000299833253 GI Annotated Mild Oc1nc(Cc2nnc(Nc3ccccc3)s2)nc2sc3c(c12)CCCC3 ZINC000299833753 GI Annotated Anodyne O=Cc1c(-c2ccc([N+](=O)[O-])cc2)nc2sc(Cc3ccc(Cl)cc3)nn12 ZINC000299833786 GI Annotated Bother O=C1OCC2=C1[C@@H](c1ccc(F)cc1)c1c(c3cccnc3c3ncccc13)N2 ZINC000299833852 GI Annotated Bother O=C1OCC2=C1[C@H](c1ccc(F)cc1)c1c(c3cccnc3c3ncccc13)N2 ZINC000299833853 GI Annotated Bother CC1(C)OC[C@H]([C@]2(C)C=C3CC[C@H]4[C@@](C)(C[C@H](O)C[C@@]4(C)CO)[C@@H]3CC2)O1 ZINC000299834056 GI Annotated Anodyne O=C(O)c1sc(-c2ccccc2)cc1N1C(=O)CCC[C@H]1C1CCOCC1 ZINC000299834617 GI Annotated Anodyne O=C(O)c1sc(-c2ccccc2)cc1N1C(=O)CCC[C@@H]1C1CCOCC1 ZINC000299834619 GI Annotated Anodyne CC(C)N(c1nc2cc(O)c3c(c2s1)C(=O)c1cccc(O)c1C3=O)C(C)C ZINC000299834942 GI Annotated Clean Cc1ccc(O)c([C@H]2C3=C(COC3=O)Nc3c2c2cccnc2c2ncccc32)c1 ZINC000299835278 GI Annotated Bother Cc1ccc(O)c([C@@H]2C3=C(COC3=O)Nc3c2c2cccnc2c2ncccc32)c1 ZINC000299835280 GI Annotated Bother C[C@H]1c2ccc(CN(C)C)cc2CCN1C(=O)c1cc2cc(Cl)ncc2n1C ZINC000299835329 GI Annotated Anodyne C[C@@H]1c2ccc(CN(C)C)cc2CCN1C(=O)c1cc2cc(Cl)ncc2n1C ZINC000299835331 GI Annotated Anodyne CC(C)(NC(=O)c1nn(CCC2CCOCC2)c2c1C[C@H]1C[C@@H]21)c1ccccc1 ZINC000299835626 GI Annotated Anodyne Cc1ccc2c(Oc3ccccc3OCCn3ccc(O)nc3=O)cccc2c1 ZINC000299835793 GI Annotated Anodyne CC(C)NC(=O)CCC[C@@H]1CC(=O)c2cc(Cl)cc(Br)c2O1 ZINC000299836575 GI Annotated Anodyne CC(C)NC(=O)CCC[C@H]1CC(=O)c2cc(Cl)cc(Br)c2O1 ZINC000299836577 GI Annotated Anodyne O=C(Cn1nc(-c2ccccc2)c2ccccc2c1=O)Nc1ccccc1Cl ZINC000299837026 GI Annotated Anodyne N#Cc1ccccc1CSc1nnc2c(n1)[nH]c1c(Br)cccc12 ZINC000299837056 GI Annotated Mild COc1ccc([C@H]2C3=C(COC3=O)Nc3c2c2cccnc2c2ncccc32)cc1 ZINC000299837800 GI Annotated Bother COc1ccc([C@@H]2C3=C(COC3=O)Nc3c2c2cccnc2c2ncccc32)cc1 ZINC000299837801 GI Annotated Bother O=C(Nc1cc(-c2ccc(Br)cc2)[nH]n1)c1ccc(Cl)nc1 ZINC000299837969 GI Annotated Anodyne N#Cc1ccccc1CSc1nnc2c(n1)[nH]c1ccc(Br)cc12 ZINC000299837973 GI Annotated Mild COC(=O)[C@]1(Cc2ccccc2C(F)(F)F)CC(=O)O[C@@]1(C)c1ccccc1 ZINC000299838723 GI Annotated Anodyne COC(=O)[C@]1(Cc2ccccc2C(F)(F)F)CC(=O)O[C@]1(C)c1ccccc1 ZINC000299838724 GI Annotated Anodyne COC(=O)[C@@]1(Cc2ccccc2C(F)(F)F)CC(=O)O[C@@]1(C)c1ccccc1 ZINC000299838726 GI Annotated Anodyne COC(=O)[C@@]1(Cc2ccccc2C(F)(F)F)CC(=O)O[C@]1(C)c1ccccc1 ZINC000299838727 GI Annotated Anodyne COc1cc(CNCCc2ccncc2)ccc1OCc1ccc(Cl)nc1 ZINC000299838851 GI Annotated Anodyne COc1cc2c3c(c4ccc(O)cc4c2cc1OC)CN1CCCC[C@@H]1[C@@H]3O ZINC000299838879 GI Annotated Bother COC(=O)c1c(O)cc(O)c(Cl)c1CCC(=O)Nc1ccc(C(C)C)cc1 ZINC000299839081 GI Annotated Anodyne CC(C)c1ccc2c(c1)CC[C@@H]1[C@]2(C)CCC[C@@]1(C)C[N+](C)(CCO)CCO ZINC000299839501 GI Annotated Bother Cc1noc(CCC[C@H]2CC(=O)c3cc(Cl)cc(Br)c3O2)n1 ZINC000299840314 GI Annotated Anodyne Cc1noc(CCC[C@@H]2CC(=O)c3cc(Cl)cc(Br)c3O2)n1 ZINC000299840315 GI Annotated Anodyne Cc1cccc([C@@H]2C3=C(COC3=O)Nc3c2c2cccnc2c2ncccc32)c1O ZINC000299840465 GI Annotated Bother Cc1cccc([C@H]2C3=C(COC3=O)Nc3c2c2cccnc2c2ncccc32)c1O ZINC000299840466 GI Annotated Bother Cc1ccc(CCCC(=O)c2cc(C)c(COC[C@@](C)(N)CO)cc2C)cc1 ZINC000299840726 GI Annotated Anodyne COc1cc2c3c(c4ccc(O)cc4c2cc1OC)CN1CCCC[C@@H]1C3=O ZINC000299841119 GI Annotated Bother CC(C)(NC(=O)c1nn(Cc2ccc(F)cc2)c2c1C[C@H]1C[C@@H]21)c1ccccc1 ZINC000299841314 GI Annotated Anodyne CC(=O)O[C@@H]1/C=C(\C)[C@H](OC(C)=O)C/C=C(/C)CC[C@H]2[C@H](/C=C/C1=O)C2(C)C ZINC000299844320 GI Annotated Mild CC(=O)O[C@@H]1/C=C(\C)[C@H](OC(C)=O)C/C=C(/C)CC[C@@H]2[C@@H](/C=C/C1=O)C2(C)C ZINC000299844321 GI Annotated Mild CC(=O)O[C@@H]1/C=C(\C)[C@H](OC(C)=O)C/C=C(/C)CC[C@@H]2[C@H](/C=C/C1=O)C2(C)C ZINC000299844322 GI Annotated Mild COC(=O)c1cc2c3ccccc3[nH]c2c2cn(-c3ccc(F)cc3Cl)c[n+]12 ZINC000299844517 GI Annotated Bother CN1CCN(c2cc(/C=C/c3cc4ccccc4[nH]3)[n+](C)c3ccccc23)CC1 ZINC000299844533 GI Annotated Anodyne COC(=O)c1cc2c3ccccc3[nH]c2c2cn(-c3ccc(Cl)cc3)c[n+]12 ZINC000299844686 GI Annotated Bother C[n+]1c(/C=C/c2cc([N+](=O)[O-])ccc2O)cc(N2CCCCC2)c2ccccc21 ZINC000299844728 GI Annotated Bother CN1c2c(ccc(Cl)c2Cl)N(CCOc2ccc(Cl)cc2)[C@H]1NC#N ZINC000299846725 GI Annotated Anodyne CCOC(=O)c1cc(N=C/C(C#N)=C(/O)OCC)c2ccc(OC)c(OC)c2c1 ZINC000299846766 GI Annotated Reactive CCOC(=O)c1cc(N=C/C(C#N)=C(\O)OCC)c2ccc(OC)c(OC)c2c1 ZINC000299846767 GI Annotated Reactive CC1(C)C[C@@H]2[C@@H]1CC[C@]1(CBr)CC[C@@H]3[C@H](CC(=O)O)C(=O)O[C@@]32C1 ZINC000299848046 GI Annotated Reactive CC1(C)C[C@@H]2[C@@H]1CC[C@]1(CBr)CC[C@H]3[C@H](CC(=O)O)C(=O)O[C@@]32C1 ZINC000299848051 GI Annotated Reactive Cc1cc(N2CC[C@H](N3CCC[C@H]3C)C2)ccc1NC(=O)[C@H]1C[C@H]2CC[C@H]1C2 ZINC000299848080 GI Annotated Anodyne Cc1cc(N2CC[C@H](N3CCC[C@H]3C)C2)ccc1NC(=O)[C@@H]1C[C@H]2CC[C@H]1C2 ZINC000299848082 GI Annotated Anodyne NC(=O)c1ccc(N=Nc2c(-c3ccccc3)[nH]n(-c3ccccc3)c2=O)cc1 ZINC000299849228 GI Annotated Clean O=C(On1c(-c2cccc(F)c2)nc2ccccc2c1=O)c1cccc(Cl)c1 ZINC000299852911 GI Annotated Mild COc1cc2c(cc1OC)[C@H](CCc1ccc(C(F)(F)F)cc1)NC[C@H]2O ZINC000299853632 GI Annotated Anodyne O=C1C[C@H](Sc2ccccc2C(F)(F)F)N1C(=O)NCc1ccccc1 ZINC000299855223 GI Annotated Anodyne O=C1C[C@@H](Sc2ccccc2C(F)(F)F)N1C(=O)NCc1ccccc1 ZINC000299855224 GI Annotated Anodyne COc1ccc2c(c1)O/C(=C\c1ccc(OCCCN(C)C)cc1Cl)C2=O ZINC000299855465 GI Annotated Mild COc1ccc2c(c1)CC(=O)N2[C@@H](C(=O)Nc1c(C)cccc1C)C(C)(C)C ZINC000299855983 GI Annotated Anodyne COc1ccc2c(c1)CC(=O)N2[C@H](C(=O)Nc1c(C)cccc1C)C(C)(C)C ZINC000299855984 GI Annotated Anodyne O=C1Nc2ccc(Cl)cc2[C@]12CCNc1c2cnn1Cc1ccc(Cl)cc1 ZINC000299856372 GI Annotated Anodyne O=C1Nc2ccc(Cl)cc2[C@@]12CCNc1c2cnn1Cc1ccc(Cl)cc1 ZINC000299856373 GI Annotated Anodyne O=C1Cc2cc(Cc3ccc(-c4ccc(F)cc4F)cc3)ccc2C(=O)N1O ZINC000299856603 GI Annotated Anodyne COc1ccc2nc3cc(Cl)ccc3c(N/C(C)=N/CCCN(C)C)c2n1 ZINC000299857287 GI Annotated Mild CCN(CC)CCCn1c2cc(=O)c3cc(OC)ccc3c-2nc2ccccc21 ZINC000299858078 GI Annotated Bother C#CCSc1nc(Nc2ccc([N+](=O)[O-])cc2)c(C#N)c(-c2ccccc2)n1 ZINC000299858396 GI Annotated Mild Cc1cc(-c2cnn3c2C(=O)N(c2ccc(C(F)(F)F)cc2)C[C@@H]3C)ccn1 ZINC000299858439 GI Annotated Anodyne Cc1ccc(C2=Nc3nc4ccccn4c3C(=O)[C@H](Cc3ccccc3)N2)c(C)c1 ZINC000299858919 GI Annotated Anodyne CC(C)(C)[Si](O[C@H]1C[C@H]2CC(=O)C[C@H]2C1)(c1ccccc1)c1ccccc1 ZINC000299859097 GI Annotated Reactive O=C(/C=C(\O)C(=O)O)/C=C/c1cn(Cc2ccc(F)cc2)cc1-c1ccccc1 ZINC000299859888 GI Annotated Mild CN(CCCn1c(=O)sc2ccc(Br)cc21)Cc1ccccc1 ZINC000299860400 GI Annotated Anodyne O=S(=O)(CC[C@@](F)(Cl)C(F)(F)Cl)c1nc2ccccc2s1 ZINC000299861447 GI Annotated Anodyne O=S(=O)(CC[C@](F)(Cl)C(F)(F)Cl)c1nc2ccccc2s1 ZINC000299861449 GI Annotated Anodyne CN(CCCn1c(=O)sc2cc(Br)ccc21)Cc1ccccc1 ZINC000299861530 GI Annotated Anodyne O=c1cc(CO)oc([C@H]2C=C(c3ccc(Cl)cc3)Oc3ccccc32)c1O ZINC000299862846 GI Annotated Anodyne O=c1cc(CO)oc([C@@H]2C=C(c3ccc(Cl)cc3)Oc3ccccc32)c1O ZINC000299862847 GI Annotated Anodyne COc1ccc2ccc(=O)oc2c1C1=NN[C@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000299862907 GI Annotated Anodyne COc1ccc2ccc(=O)oc2c1C1=NN[C@@H](c2ccc(C(F)(F)F)cc2)C1 ZINC000299862909 GI Annotated Anodyne CC1=NN(c2ccccc2)C(=O)[C@@H]1/N=N/c1cc2nc3ccccc3nc2cc1N ZINC000299863192 GI Annotated Clean CC1=NN(c2ccccc2)C(=O)[C@H]1/N=N/c1cc2nc3ccccc3nc2cc1N ZINC000299863193 GI Annotated Clean CC(C)(C)OC(=O)NCc1ccc2[nH]cc(/C=C/C(=O)c3ccncc3)c2c1 ZINC000299863726 GI Annotated Mild O=C1C[C@H](Sc2ccc(C(F)(F)F)cc2)N1C(=O)NCc1ccccc1 ZINC000299864057 GI Annotated Anodyne O=C1C[C@@H](Sc2ccc(C(F)(F)F)cc2)N1C(=O)NCc1ccccc1 ZINC000299864058 GI Annotated Anodyne O=C1NCCC12CCN(c1c(Cl)cncc1-c1ccc3cnccc3c1)CC2 ZINC000299864121 GI Annotated Anodyne CCOc1ncc(CN2CCC(N(C)Cc3c(F)cccc3Cl)CC2)s1 ZINC000299864939 GI Annotated Anodyne O=C(/C=C1/C(=O)N(Cc2ccc(Cl)cc2)c2ccccc21)Nc1ccncc1 ZINC000299865227 GI Annotated Anodyne CSc1nccc(N2CCC(N(C)Cc3c(F)cccc3Cl)CC2)n1 ZINC000299865484 GI Annotated Anodyne Fc1ccc(O[C@@H]2C[C@@H](NCc3cccc4cn[nH]c34)C2)cc1C(F)(F)F ZINC000299865756 GI Annotated Anodyne COc1ccc(-c2ccc(Cc3ccc4c(c3)CC(=O)N(O)C4=O)cc2)cc1F ZINC000299865803 GI Annotated Anodyne O=[N+]([O-])c1cc(-c2nc(-c3ccc(Oc4ccc(F)cc4)cc3)no2)cnc1O ZINC000299866110 GI Annotated Bother CCOc1ncc(CN2CCC(N(C)Cc3ccccc3Cl)CC2)s1 ZINC000299866248 GI Annotated Anodyne COc1cc([C@H]2CC(c3c(O)cc(C)c(Cl)c3C)=NN2)cc(OC)c1OC ZINC000299866505 GI Annotated Clean COc1cc([C@@H]2CC(c3c(O)cc(C)c(Cl)c3C)=NN2)cc(OC)c1OC ZINC000299866506 GI Annotated Clean O=c1sc2cc(Br)ccc2n1CCCN1Cc2ccccc2C1 ZINC000299866633 GI Annotated Anodyne CN(C)CCCn1c(/C=C/c2ccc(F)cc2)nc2cc(Cl)ccc2c1=O ZINC000299867161 GI Annotated Anodyne CCCNc1nc(C)c(-c2nc3ccccc3s2)c(N[C@H]2CC[C@@H](CO)C2)n1 ZINC000299867557 GI Annotated Anodyne CCOC(=O)N1CCN(C2(c3ccc(F)cc3)C3CC4CC(C3)CC2C4)CC1 ZINC000299867782 GI Annotated Anodyne O=C(/C=C/c1ccccc1)N1Cc2ccccc2[C@@H](OCc2ccccc2)[C@@H]1CO ZINC000299868153 GI Annotated Anodyne CCOc1ncc(CN2CCC(N(C)Cc3cccc(Cl)c3)CC2)s1 ZINC000299868269 GI Annotated Anodyne CCCCCCSC(=S)N1CCN(C(=S)NCc2ccccc2)CC1 ZINC000299868508 GI Annotated Anodyne CCn1c(NC(C)C)nc2c(C3CCN(c4ccccn4)CC3)csc2c1=O ZINC000299868551 GI Annotated Anodyne C=CCc1ccc(OCc2cn(-c3ccc(Br)cc3)nn2)c(O)c1 ZINC000299868621 GI Annotated Mild O=c1cc(CO)oc([C@H]2C=C(c3ccccc3)Oc3ccc(Cl)cc32)c1O ZINC000299869203 GI Annotated Anodyne O=c1cc(CO)oc([C@@H]2C=C(c3ccccc3)Oc3ccc(Cl)cc32)c1O ZINC000299869204 GI Annotated Anodyne O=C1C[C@@]2(CNc3ccc(Cl)cc32)c2cnn(Cc3ccc(Cl)cc3)c2N1 ZINC000299870622 GI Annotated Anodyne O=C1C[C@]2(CNc3ccc(Cl)cc32)c2cnn(Cc3ccc(Cl)cc3)c2N1 ZINC000299870623 GI Annotated Anodyne C=C1C(=O)OC[C@H]1CCOC(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000299871102 GI Annotated Mild C=C1C(=O)OC[C@@H]1CCOC(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000299871103 GI Annotated Mild CS(=O)(=O)n1c(/C=C/c2cc(Cl)cc(Cl)c2)nc2cc(F)ccc21 ZINC000299871104 GI Annotated Anodyne CC(C)(C)C1CCC(OC(=O)[C@@H]2CC=CC[C@@H]2C(=O)OC[C@H]2CCCO2)CC1 ZINC000299872804 GI Annotated Anodyne CC1(C)C[C@@H]2[C@@H]1CC[C@@]1(CBr)CC[C@@H]3[C@H](CC(=O)O)C(=O)O[C@]32C1 ZINC000299873042 GI Annotated Anodyne CC1(C)C[C@@H]2[C@@H]1CC[C@@]1(CBr)CC[C@@H]3[C@@H](CC(=O)O)C(=O)O[C@@]23C1 ZINC000299873043 GI Annotated Anodyne CC1(C)C[C@@H]2[C@@H]1CC[C@@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@]32C1 ZINC000299873044 GI Annotated Anodyne CC1(C)C[C@@H]2[C@@H]1CC[C@@]1(CBr)CC[C@H]3[C@H](CC(=O)O)C(=O)O[C@]32C1 ZINC000299873045 GI Annotated Anodyne CC[C@H](C)NC(=O)c1cnc(N2C[C@H](C)C[C@@H](C)C2)nc1-c1ccc(C#N)cc1 ZINC000299873716 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccc(Cl)cc2F)[C@@H]1C(=O)NC[C@@H](O)CC ZINC000299875149 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccc(Cl)cc2F)[C@H]1C(=O)NC[C@@H](O)CC ZINC000299875150 GI Annotated Anodyne C[C@H](NC(=O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccoc1)c1ccc(F)cc1 ZINC000299877274 GI Annotated Anodyne C[C@H](NC(=O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccoc1)c1ccc(F)cc1 ZINC000299877275 GI Annotated Anodyne CC[C@H](C)Nc1ncc(C(=O)N2C[C@H](C)C[C@@H](C)C2)c(-c2ccc(C#N)cc2)n1 ZINC000299877828 GI Annotated Anodyne CC[C@H](C)Nc1nc(Oc2ccc(OC)cc2)nc(N2C[C@H](C)C[C@@H](C)C2)n1 ZINC000299881371 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccc(F)cc2Cl)[C@@H]1C(=O)NC[C@@H](O)CC ZINC000299881476 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccc(F)cc2Cl)[C@H]1C(=O)NC[C@@H](O)CC ZINC000299881477 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccsc2)[C@@H]1C(=O)N[C@H](CO)[C@@H](C)CC ZINC000299881648 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccsc2)[C@@H]1C(=O)N[C@H](CO)[C@H](C)CC ZINC000299881649 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccsc2)[C@@H]1C(=O)N[C@@H](CO)[C@H](C)CC ZINC000299881650 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccsc2)[C@@H]1C(=O)N[C@H]1CCCC[C@@H]1O ZINC000299881867 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccsc2)[C@@H]1C(=O)N[C@H]1CCCC[C@H]1O ZINC000299881868 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccsc2)[C@@H]1C(=O)N[C@@H]1CCCC[C@H]1O ZINC000299881869 GI Annotated Anodyne CC[C@H](C)NC(=O)c1cnc(N2C[C@H](C)C[C@@H](C)C2)nc1-c1ccccc1F ZINC000299882265 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2c(F)cccc2Cl)[C@H]1C(=O)NC[C@@H](O)CC ZINC000299882589 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2c(F)cccc2Cl)[C@@H]1C(=O)NC[C@@H](O)CC ZINC000299882590 GI Annotated Anodyne CC[C@H](C)NC(=O)c1cnc(N2C[C@H](C)C[C@@H](C)C2)nc1-c1cccc(C)c1 ZINC000299882918 GI Annotated Anodyne CC[C@H](C)c1nc2nc(N3CCN(c4cccc(C)c4)[C@@H](C)C3)ccc2nc1O ZINC000299883360 GI Annotated Anodyne CC[C@@H](C)c1nc2nc(N3CCN(c4cccc(C)c4)[C@@H](C)C3)ccc2nc1O ZINC000299883361 GI Annotated Anodyne C=C1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN(C)[C@H](C)[C@H](O)c4ccccc4)[C@H]3C[C@@H]12 ZINC000299883563 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccoc2)[C@@H]1C(=O)NC[C@@H](O)c1ccccc1 ZINC000299884691 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccoc2)[C@H]1C(=O)NC[C@@H](O)c1ccccc1 ZINC000299884692 GI Annotated Anodyne CC[C@H]1CCCCN1c1nc(N[C@H](C)CC#N)nc(Oc2ccc(OC)cc2)n1 ZINC000299885002 GI Annotated Mild CC[C@@H]1CCCCN1c1nc(N[C@H](C)CC#N)nc(Oc2ccc(OC)cc2)n1 ZINC000299885003 GI Annotated Mild CC[C@H](C)NC(=O)c1cnc(N2C[C@H](C)C[C@@H](C)C2)nc1-c1ccc(F)cc1 ZINC000299886102 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccoc2)[C@H]1C(=O)N[C@@H](CO)Cc1ccccc1 ZINC000299887888 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccoc2)[C@@H]1C(=O)N[C@@H](CO)Cc1ccccc1 ZINC000299887889 GI Annotated Anodyne C=C1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN(C)C[C@@](C)(O)c4ccccc4)[C@H]3C[C@H]12 ZINC000299888177 GI Annotated Anodyne Cc1ccc(/N=C(\O)Cn2c(C)nc3sc4c(c3c2=O)CCCC4)cc1F ZINC000003018135 GI Annotated Mild CCc1ccccc1/N=C(\O)c1ccc(F)c(S(=O)(=O)N(CC)CC)c1 ZINC000003023449 GI Annotated Mild CCOC(=O)CN(Cc1sccc1C)C(=O)Nc1ccc(OCC)cc1 ZINC000003028762 GI Annotated Anodyne Cc1cc(N2CCC3(CC2)OCCO3)n2nc(C)c(-c3ccc(Cl)cc3)c2n1 ZINC000003029585 GI Annotated Anodyne O=C1[C@H](c2ccncc2)N(CCC2=CCCCC2)C(=O)CN1C1CCCCC1 ZINC000003037710 GI Annotated Anodyne O=C1[C@@H](c2ccncc2)N(CCC2=CCCCC2)C(=O)CN1C1CCCCC1 ZINC000003037712 GI Annotated Anodyne CC[C@@H]1Oc2ccc(Cl)cc2N(C/C(O)=N/Cc2cccc(OC)c2)C1=O ZINC000003060443 GI Annotated Anodyne CC[C@H]1Oc2ccc(Cl)cc2N(C/C(O)=N/Cc2cccc(OC)c2)C1=O ZINC000003060444 GI Annotated Anodyne CCN1C(=O)c2ccccc2Sc2ccc(C(=O)NCCCOC(C)C)cc21 ZINC000003061161 GI Annotated Anodyne O=C(Cn1c2c(c(-c3ccccc3Cl)cc1=O)CCC2)NCc1cccs1 ZINC000003063727 GI Annotated Anodyne FC(F)(F)c1cccc(NC2=NC[C@H](CI)S2)c1 ZINC000003160363 GI Annotated Reactive Cc1ccc(-n2c(C)cc(/C(O)=N/S(=O)(=O)c3ccc(C)cc3)c2C)cc1 ZINC000003186081 GI Annotated Mild COc1ccc(/C=N/n2cnn(Cc3ccccc3Cl)c2=S)cc1OC ZINC000003197385 GI Annotated Mild COc1cc2c(cc1-c1coc3c4c(ccc3c1=O)OC(C)(C)CC4)OCO2 ZINC000003197600 GI Annotated Anodyne CC1(C)C=Cc2c(ccc3c(=O)c4c(oc23)COc2cc3c(cc2-4)OCO3)O1 ZINC000003203078 GI Annotated Anodyne in-vitro biogenic CC1=C(C)SC(=C(C#N)c2nnc(N3CCOCC3)n2-c2ccccc2)S1 ZINC000003211209 GI Annotated Reactive CCOC(=O)[C@@H]1CCCN([C@@H](c2ccccn2)c2c(C)[nH]c3ccccc23)C1 ZINC000003235288 GI Annotated Anodyne O=C(N/N=C/c1cn(-c2cccs2)nc1-c1ccccc1)c1ccccc1O ZINC000003236964 GI Annotated Reactive COc1ccc(C(C)=O)cc1CO/N=C/c1ccc(OC(F)F)c(OC)c1 ZINC000003319800 GI Annotated Mild O=C(N/N=C/c1sc(N2CCCCC2)nc1-c1cccs1)c1cccnc1 ZINC000003335214 GI Annotated Reactive Nn1c(Cc2cccc3ccccc23)nnc1SCCOc1ccc(F)cc1 ZINC000003340936 GI Annotated Anodyne COc1ccc(C)cc1N(C(=O)c1ccc(C#N)cc1)C1=NC(C)(C)CS1 ZINC000003342491 GI Annotated Mild S/C(=N\CCc1ccccc1)Nc1ccccc1I ZINC000003345009 GI Annotated Mild O=C(CC12C[C@@H]3C[C@@H](CC(Br)(C3)C1)C2)OCCN1CCCCC1 ZINC000003428925 GI Annotated Anodyne C[C@H]1Cc2ccccc2N1C(=O)[C@@H](C)Oc1ccc(NC(=O)c2ccco2)cc1 ZINC000003446305 GI Annotated Anodyne C[C@@H](Oc1ccc(NC(=O)c2ccco2)cc1)C(=O)N1c2ccccc2C[C@H]1C ZINC000003446308 GI Annotated Anodyne C[C@H](Oc1ccc(NC(=O)c2ccco2)cc1)C(=O)N1c2ccccc2C[C@@H]1C ZINC000003446311 GI Annotated Anodyne C[C@H](Oc1ccc(NC(=O)c2ccco2)cc1)C(=O)N1c2ccccc2C[C@H]1C ZINC000003446315 GI Annotated Anodyne Cc1ccc(C)c(-c2nnc(OCC(=O)Nc3cc(C)on3)c3ccccc23)c1 ZINC000003491758 GI Annotated Anodyne CCN(c1ccc(-c2csc(-c3ccnc(Cl)c3)n2)cc1)S(C)(=O)=O ZINC000030447370 GI Annotated Anodyne COc1ccc(CO[C@@H]2C[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@@H]2F)cc1 ZINC000301055196 GI Annotated Reactive COc1ccc(CO[C@@H]2C[C@H](CO)[C@@H](O[Si](C)(C)C(C)(C)C)[C@H]2F)cc1 ZINC000301055197 GI Annotated Reactive COc1ccc(CO[C@@H]2C[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@@H]2F)cc1 ZINC000301055198 GI Annotated Reactive COc1ccc(CO[C@@H]2C[C@H](CO)[C@H](O[Si](C)(C)C(C)(C)C)[C@H]2F)cc1 ZINC000301055199 GI Annotated Reactive COc1cc(C)cc2ccc(-c3ccc4c(c3O)[C@@H](C)N[C@H](C)[C@@H]4O)c(O)c12 ZINC000030727987 GI Annotated Clean in-vitro biogenic COc1c(C/C=C(\C)CO)cc(C(=O)O)cc1C/C=C(\C)[C@H](O)CC=C(C)C ZINC000031167219 GI Annotated Anodyne CN[C@@H](C)[C@H]1[C@H](O)C[C@@]2(C)[C@@H]3CC[C@H]4C(C)(C)C(=O)C=C[C@@]45C[C@@]35CC[C@]12C ZINC000031516542 GI Annotated Anodyne C=C1[C@@H](N(C)C)CC[C@]23C[C@]24CC[C@]2(C)[C@@H](C(C)=O)[C@H](O)C[C@@]2(C)[C@@H]4CC[C@@H]13 ZINC000031539394 GI Annotated Mild CCN(CC)C(=O)[C@H]1C2=C(C[C@H](c3ccccc3)[C@@H]1C(=O)O)CC(C)(C)CC2=O ZINC000031597093 GI Annotated Mild in-man CCN(CC)C(=O)[C@H]1C2=C(C[C@H](c3ccccc3)[C@H]1C(=O)O)CC(C)(C)CC2=O ZINC000031597101 GI Annotated Mild CC[N+]1(C)CC[C@@](O)(/C=C/c2ccccc2)[C@@H](C(=O)/C=C/c2ccccc2)C1 ZINC000031817314 GI Annotated Mild C#CCN1C(=O)CN2C(Cl)(Cl)[C@@]2(c2ccccc2)c2cc(Cl)ccc21 ZINC000031851219 GI Annotated Mild C#CCN1C(=O)CN2C(Cl)(Cl)[C@]2(c2ccccc2)c2cc(Cl)ccc21 ZINC000031851222 GI Annotated Mild c1ccc2c(c1)N[C@@H]([C@H]1O[C@H]3CCCN3[C@@H]1[C@@H]1Nc3ccccc3S1)S2 ZINC000031852382 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C)/C(=C(\Br)I)C(=O)C2 ZINC000031853934 GI Annotated Mild CC[C@@H]1[C@@H](c2cccc(OC)c2O)c2cc3c(cc2O[C@H]1N1CCCC1)OCO3 ZINC000031860826 GI Annotated Anodyne COc1cccc([C@H]2c3cc4c(cc3O[C@H](N3CCCCC3)[C@@H]2C)OCO4)c1O ZINC000031861159 GI Annotated Anodyne COc1cccc([C@@H]2c3cc4c(cc3O[C@H](N3CCCCC3)[C@@H]2C)OCO4)c1O ZINC000031861161 GI Annotated Anodyne COc1cccc([C@H]2c3cc4c(cc3O[C@H](N3CCCCC3)[C@H]2C)OCO4)c1O ZINC000031861163 GI Annotated Anodyne COc1cccc([C@@H]2c3cc4c(cc3O[C@H](N3CCCCC3)[C@H]2C)OCO4)c1O ZINC000031861165 GI Annotated Anodyne CC1(C)C=C(/C=N/Nc2ccc(Br)cc2)C(C#N)=C(O)C1(C#N)C#N ZINC000031861960 GI Annotated Reactive C=CCCCCCCCCCO[C@@H]1C=C[C@H](OC(C)=O)[C@H](COC(C)=O)O1 ZINC000031871052 GI Annotated Mild C=CCCCCCCCCCO[C@@H]1C=C[C@H](OC(C)=O)[C@@H](COC(C)=O)O1 ZINC000031871053 GI Annotated Mild Cc1ccc(S(=O)(=O)N/C(=C\C=C\c2ccccc2)C(=O)C(C)(C)C)cc1 ZINC000031871560 GI Annotated Mild COc1cc([C@@H]2[C@@H]3C=CC=C4CC=CC(=C43)[C@@H]3CCC(=O)N32)cc(OC)c1OC ZINC000031897472 GI Annotated Anodyne COc1cc([C@H]2[C@@H]3C=CC=C4CC=CC(=C43)[C@@H]3CCC(=O)N32)cc(OC)c1OC ZINC000031897476 GI Annotated Anodyne COc1cc([C@@H]2[C@H]3C=CC=C4CC=CC(=C43)[C@@H]3CCC(=O)N32)cc(OC)c1OC ZINC000031897480 GI Annotated Anodyne COc1cc([C@H]2[C@H]3C=CC=C4CC=CC(=C43)[C@@H]3CCC(=O)N32)cc(OC)c1OC ZINC000031897485 GI Annotated Anodyne COC(=O)C1=C[C@H]2C(=O)c3ccccc3[C@]1(c1ccccc1)N2C1CCCCC1 ZINC000031898906 GI Annotated Anodyne Cc1ccc(/C=C2\CN(C)CC3=C2OC(N)=C(C#N)[C@@H]3c2ccc(C)cc2)cc1 ZINC000031904889 GI Annotated Reactive O=C(O)c1cc(Br)cc2[nH]c([C@H]3Cc4ccccc4S3)nc12 ZINC000319470029 GI Annotated Anodyne O=C(O)c1cc(Br)cc2[nH]c([C@@H]3Cc4ccccc4S3)nc12 ZINC000319470031 GI Annotated Anodyne COC(=O)[C@]1(OC(C)=O)C[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C=O)[C@@H]2CC[C@@H]1C3 ZINC000032022330 GI Annotated Mild CC(=O)OC[C@]1(C)C(=O)CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2CC[C@@H]2C=C[C@H](O)[C@]21C ZINC000032296245 GI Annotated Anodyne COC(=O)/C=C(\C)C[C@@H](OC(C)=O)[C@]1(C)[C@H]2CC(=O)C=C(C)[C@]2(C)CC[C@H]1C ZINC000032296814 GI Annotated Mild Cc1ccc2c(nc3s/c(=C/c4ccc(-c5ccccc5F)o4)c(=O)n32)c1C ZINC000033301922 GI Annotated Anodyne Cc1cc(Cl)ccc1-c1ccc(/C=C2\SC(=S)N(CC(=O)O)C2=O)o1 ZINC000033313215 GI Annotated Clean CC1(C)[C@H]2CC[C@]1(C)/C(=C(\Br)I)C(=O)C2 ZINC000033493158 GI Annotated Mild Cc1ccc(/C=C2\CN(C)C[C@H]3C2=NC(=S)N[C@@H]3c2ccc(C)cc2)cc1 ZINC000033493341 GI Annotated Anodyne CCOc1ccccc1NC(=S)N1CCN(c2ccc(OC)cc2)[C@@H](C)C1 ZINC000033613062 GI Annotated Clean CCOc1ccccc1NC(=S)N1CCN(c2ccc(OC)cc2)[C@H](C)C1 ZINC000033613063 GI Annotated Clean N=C1S/C(=C\c2c[nH]nc2-c2ccc(Cl)cc2)C(=O)N1c1nccs1 ZINC000033716571 GI Annotated Anodyne CC1=C2[C@@H](OC(=O)/C=C/c3ccccc3)[C@H](C(C)C)CC[C@]2(C)[C@@H](O)CC1=O ZINC000033818135 GI Annotated Mild biogenic CC(=O)O[C@@]1(C)C(=O)C[C@H]2C(C)(C)CCC[C@]2(C)[C@@]1(O)CCc1ccoc1 ZINC000033831305 GI Annotated Anodyne in-vitro biogenic CC[C@@H](C)/C=C(C)/C=C/C=C/C(=O)c1c(O)c(-c2ccc(O)cc2)cn(O)c1=O ZINC000033833942 GI Annotated Mild in-vitro biogenic CN(CC(=O)c1ccccc1)C1CN(C2c3ccccc3CCc3ccccc32)C1 ZINC000033858151 GI Annotated Anodyne Cc1ccc(/C=C2\CN(C)CC3=C2OC(N)=C(C#N)[C@H]3c2ccc(C)cc2)cc1 ZINC000033917366 GI Annotated Reactive CCC[C@H]1S/C(=N/N=C\c2ccc(OC)cc2)N(Cc2ccccc2)C1=O ZINC000033928530 GI Annotated Mild CCC[C@H]1S/C(=N\N=C/c2ccc(OC)cc2)N(Cc2ccccc2)C1=O ZINC000033928531 GI Annotated Mild C[C@@H](Nc1c(-c2c(F)cc(F)cc2F)c(Cl)nc2ncnn12)C(F)(F)F ZINC000033987636 GI Annotated Anodyne C[C@H](Nc1c(-c2c(F)cc(F)cc2F)c(Cl)nc2ncnn12)C(F)(F)F ZINC000033987637 GI Annotated Anodyne O=C(Nc1ccccc1-c1nc(Br)cs1)OCC1CCNCC1 ZINC000033987647 GI Annotated Anodyne O=C1OC2(CCN(C(=O)Nc3cc(-c4ccccc4)no3)CC2)c2ccccc21 ZINC000034023069 GI Annotated Anodyne O=C1OC2(CCC(C(=O)Nc3cnc(-c4ccccc4)cn3)CC2)c2ccccc21 ZINC000034023580 GI Annotated Anodyne COc1cc2cc(OC)c3c4ccc(OC)c(OC)c4c[n+](C)c3c2cc1OC ZINC000034035306 GI Annotated Bother N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@H](O)c2ccc(C#N)cc2)c1 ZINC000034035547 GI Annotated Reactive N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@@H](O)c2ccc(C#N)cc2)c1 ZINC000034035548 GI Annotated Reactive CS(=O)(=O)c1ccc(-c2cc(C(F)(F)F)nc(NC3CCCCC3)n2)cc1 ZINC000034035599 GI Annotated Anodyne COc1ccc(OC)c(Nc2cc(C(F)(F)F)nc(-c3ccccn3)n2)c1 ZINC000034056358 GI Annotated Anodyne NC(=O)c1c(SCc2ccc(Cl)cc2)nsc1Nc1ccncc1 ZINC000034066280 GI Annotated Anodyne NC(=O)c1c(SCc2ccccc2Cl)nsc1Nc1ccncc1 ZINC000034066281 GI Annotated Anodyne O=C1N=C(NCc2ccc(Cl)cc2)N/C1=C\c1c(Cl)cccc1Cl ZINC000034072982 GI Annotated Anodyne CC(=O)Nc1ccc(-c2nc3n(c2-c2ccc(NC(C)=O)cc2)CCS3)cc1 ZINC000034079717 GI Annotated Anodyne CC(=O)Oc1ccc(-c2nc3n(c2-c2ccc(OC(C)=O)cc2)CCS3)cc1 ZINC000034079729 GI Annotated Anodyne CC[C@@H]1NC(=O)[C@@](CCN(C(C)C)C(C)C)(c2ccccc2)[C@H]2CCCCN12 ZINC000034079783 GI Annotated Anodyne CC[C@@H]1NC(=O)[C@](CCN(C(C)C)C(C)C)(c2ccccc2)[C@H]2CCCCN12 ZINC000034079785 GI Annotated Anodyne CCc1c(C)[nH]c(=O)c(N(C)C)c1C(=O)c1cccc(/C=C\c2nccs2)c1 ZINC000034080937 GI Annotated Anodyne CO[C@H](C)C(=O)N(c1ccccc1)[C@H]1CCN(CCc2cccs2)C[C@H]1C ZINC000034114409 GI Annotated Anodyne COc1cc([C@@H]2CC(=O)Oc3cc(C)c(Cl)c(C)c32)cc(OC)c1OC ZINC000034114879 GI Annotated Anodyne CCOC(=O)C1=C[C@@H](CC)N(S(=O)(=O)c2ccc(C)cc2)[C@H]1c1ccccc1 ZINC000034131393 GI Annotated Anodyne CCOC(=O)C1=CC[C@@H](c2ccccc2)N(S(=O)(=O)c2ccc(C)cc2)[C@H]1C ZINC000034131473 GI Annotated Anodyne COCOc1ccc(Br)cc1C(=O)/C=C/c1ccc2c(c1)OCO2 ZINC000034148530 GI Annotated Mild CC(C)[C@@H](OCc1ccccc1)[C@H](C)/C=N/OC[C@@H](O)COCc1ccco1 ZINC000034149120 GI Annotated Mild C=C[C@H]1CC[C@H]2[C@@H]3CCC(=O)[C@@](CCC(=O)OC)(COC(C)=O)[C@H]3CC[C@@]21C ZINC000034166825 GI Annotated Mild CC1=C(Br)C[C@]2([C@@H](O)C1)C(C)(C)C(Br)=C[C@H]1O[C@]12C ZINC000034194997 GI Annotated Anodyne CN(C)c1ccc(-c2nnc3c4ccccc4c(N4CCCC4)nn23)c(Cl)c1 ZINC000034216070 GI Annotated Anodyne COc1cccc(SC[C@@H](C)CN[C@@H]2COc3ccccc3SC2)c1O ZINC000034230054 GI Annotated Anodyne CC(=O)CC[C@@H]1[C@@H]2[C@H](O)[C@H](C(C)C)[C@H](OC(=O)/C=C/c3ccccc3)C[C@@]21C ZINC000034238690 GI Annotated Anodyne CC(=O)CC[C@@H]1[C@@H]2[C@H](O)[C@@H](C(C)C)[C@H](OC(=O)/C=C/c3ccccc3)C[C@@]21C ZINC000034238691 GI Annotated Anodyne CC(=O)CC[C@@H]1[C@@H]2[C@H](O)[C@H](C(C)C)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@@]21C ZINC000034238692 GI Annotated Anodyne CC(=O)CC[C@@H]1[C@@H]2[C@H](O)[C@@H](C(C)C)[C@@H](OC(=O)/C=C/c3ccccc3)C[C@@]21C ZINC000034238693 GI Annotated Anodyne C=C1CCCC(C)(C)[C@@H]2CC[C@@](C)(C3=COC[C@@H]3[C@H](OC(C)=O)C(=O)OC)[C@H]12 ZINC000034239642 GI Annotated Mild Cc1onc(/C=C/C#N)c1-c1ccc(C(O)(C(F)(F)F)C(F)(F)F)cc1 ZINC000034290542 GI Annotated Reactive CC1=C(C(=O)N2CCCCC2)[C@H](c2ccc(Cl)c(Cl)c2)n2nccc2N1 ZINC000034292838 GI Annotated Anodyne CC1=C(C(=O)N2CCCCC2)[C@@H](c2ccc(Cl)c(Cl)c2)n2nccc2N1 ZINC000034292840 GI Annotated Anodyne Cc1nn(C)c(C(=O)N[C@@H](C)c2ccc(C(C)(C)C)cc2)c1Br ZINC000034302345 GI Annotated Anodyne Cc1nn(C)c(C(=O)N[C@H](C)c2ccc(C(C)(C)C)cc2)c1Br ZINC000034302346 GI Annotated Anodyne C=C1CCCC(C)(C)[C@@H]2CC[C@@](C)([C@@H]3[C@@H](OC(C)=O)O[C@@H]4OC(=O)C[C@@H]43)[C@H]12 ZINC000034302782 GI Annotated Mild CC(C)N1CCC(Sc2ncc(C(=O)c3ccc(Cl)cc3)n2C)CC1 ZINC000034339227 GI Annotated Anodyne CC1(C)[C@H]2CC[C@]1(C)[C@H](/N=C(\N)Nc1ccccc1I)C2 ZINC000034362827 GI Annotated Mild CC1(C)[C@@H]2CC[C@@]1(C)[C@H](/N=C(\N)Nc1ccccc1I)C2 ZINC000034362828 GI Annotated Mild CCCCC[C@H]1/C=C/[C@H]2[C@H](OC(C)=O)C[C@H](O)[C@@H]2C/C=C\CCCC(=O)O1 ZINC000034370097 GI Annotated Anodyne CN(C(=O)COc1onc(C(F)(F)F)c1-c1ccccc1)c1ccccc1 ZINC000034384949 GI Annotated Anodyne C[C@]1([C@@H](Br)CO)CC=C2[C@@H](C1)[C@H](O)C[C@@H]1[C@@]3(C)C[C@H]3CC[C@@]21C ZINC000034405784 GI Annotated Reactive CCOC(=O)N(C(=O)NC(=O)c1c(F)cccc1F)c1ccc(Cl)cc1 ZINC000034430709 GI Annotated Anodyne CC(=O)O[C@H](C/C(C)=C/C(=O)O)[C@]1(C)[C@H]2CC(=O)C=C(C)[C@]2(C)CC[C@H]1C ZINC000034506673 GI Annotated Mild CCN(CC)CC#Cc1ccc2c(c1)C(=O)c1cc(C#CCN(CC)CC)ccc1-2 ZINC000034517325 GI Annotated Mild COc1ccc([C@@H]2CC3(N(C)C)CC(=O)C2[C@H](c2ccc(OC)cc2)C3)cc1 ZINC000034554740 GI Annotated Anodyne CC(C)(C)n1ncc(SCc2nnc(-c3cccc(F)c3)o2)c(Cl)c1=O ZINC000034562207 GI Annotated Anodyne Oc1c(-c2nnc(Cc3ccc(F)cc3)o2)nc(-c2ccccn2)c2cccnc12 ZINC000034575924 GI Annotated Anodyne CCc1ccccc1[C@@H]1CCc2c(C(=O)N(C)C)cc3c(nc(C)n3C)c2O1 ZINC000034602346 GI Annotated Anodyne Cc1cc(F)ccc1[C@@H]1CCc2c(C(=O)N(C)C)cc3c(nc(C)n3C)c2O1 ZINC000034602348 GI Annotated Anodyne Cc1ccccc1[C@@H]1CCc2c(C(=O)N3CCCC3)cc3c(nc(C)n3C)c2O1 ZINC000034602349 GI Annotated Anodyne Cc1ccccc1[C@@H]1CCc2c(C(=O)NC3CC3)cc3c(nc(C)n3C)c2O1 ZINC000034602437 GI Annotated Anodyne Cc1nc2c3c(c(C(=O)N(C)C)cc2n1C)CC[C@@H](c1ccccc1Cl)O3 ZINC000034603792 GI Annotated Anodyne CC(C)(C)n1ncc(SCc2nnc(-c3ccc(F)cc3)o2)c(Cl)c1=O ZINC000034608821 GI Annotated Anodyne N=C(N)c1ccc(/C=C2/CCCCC/C(=C\c3ccc(C(=N)N)cc3)C2=O)cc1 ZINC000034633574 GI Annotated Mild C[C@H]1CN(CCCCOc2ccn(-c3ccc(Cl)c(Cl)c3)n2)C[C@@H](C)O1 ZINC000034641735 GI Annotated Anodyne COc1cc2c(cc1C(C)C)CC[C@H]1C3=C(CC[C@]21C)C(=O)OC(C)(C)[C@H]3O ZINC000034654151 GI Annotated Anodyne Brc1ccc(CO/N=C2/c3ccccc3OC[C@H]2n2ccnc2)cc1 ZINC000034656179 GI Annotated Mild Brc1ccc(CO/N=C2/c3ccccc3OC[C@@H]2n2ccnc2)cc1 ZINC000034656181 GI Annotated Mild O=C1Cc2nncn2-c2ccc(Cl)cc2N1c1ccccc1C(F)(F)F ZINC000034778512 GI Annotated Anodyne Cc1nc2ccccc2c(Nc2ccc(N3CCN(C)C(C)(C)C3)cc2)c1CO ZINC000034801107 GI Annotated Anodyne N#CC(=C(/N)Sc1ccccc1F)/C(C#N)=C(\N)Sc1ccccc1F ZINC000034802604 GI Annotated Reactive COC(=O)c1c(N)nnc2c(C)c(C)c(O)c(Sc3ccc(C)c(C)c3)c12 ZINC000034816850 GI Annotated Anodyne Cc1cc(C)cc(C(=O)c2c(C(C)C)c(=O)[nH]c(=O)n2CC2CCCCC2)c1 ZINC000034819357 GI Annotated Anodyne Cc1cc(C)cc(Sc2c(C(C)C)c(=O)[nH]c(=O)n2Cc2ccccc2)c1 ZINC000034819359 GI Annotated Anodyne Cc1c(Cc2c(F)cccc2F)nc(Sc2ccc(F)cc2F)[nH]c1=O ZINC000034820510 GI Annotated Anodyne CCCC[C@@]12C[C@]1(C(=O)NCc1ccccc1)C(=O)Nc1ccc(Cl)cc12 ZINC000034821560 GI Annotated Anodyne CCCC[C@]12C[C@@]1(C(=O)NCc1ccccc1)C(=O)Nc1ccc(Cl)cc12 ZINC000034821562 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCN(C(=O)c2cc3cc4ccc(C)cc4nc3s2)C1 ZINC000034858269 GI Annotated Anodyne CCOC(=O)[C@H]1CCCN(C(=O)c2cc3cc4ccc(C)cc4nc3s2)C1 ZINC000034858270 GI Annotated Anodyne O=C(Nc1ccncn1)c1oc2cnccc2c1Nc1ccc2c(O)cccc2c1 ZINC000034891276 GI Annotated Anodyne COc1ncc(-c2ccc(F)c(C)c2)c(N2CCC(c3[nH]cnc3C)CC2)n1 ZINC000034892409 GI Annotated Anodyne N=C1N[C@@](c2ccccc2)(C2CCCCC2)C(=O)N1Cc1cc(F)cc(F)c1 ZINC000034948614 GI Annotated Anodyne CC1CCC(Nc2ccc3c(=O)n(-c4cccc(Cl)c4)c(=O)n(C)c3c2)CC1 ZINC000034950286 GI Annotated Anodyne COc1ccc([C@H]2/C=C/CN(CC(C)C)CC(=O)N2Cc2cccc(F)c2)cc1 ZINC000034960809 GI Annotated Anodyne COc1cc([C@H]2CC(=O)Oc3cc(C)c(Cl)c(C)c32)cc(OC)c1OC ZINC000034960897 GI Annotated Anodyne COc1ccc([C@H]2/C=C/CN(CC(C)C)CC(=O)N2Cc2ccc(F)cc2)cc1 ZINC000034961610 GI Annotated Anodyne COc1ccc([C@H]2/C=C/CN(CC3CC3)CC(=O)N2Cc2ccc(F)cc2)cc1 ZINC000034961622 GI Annotated Anodyne NC(=O)c1ccc(-n2c3c(c4ccccc42)C(=O)CCC3)c(Br)c1 ZINC000034984913 GI Annotated Anodyne COC(=O)C[C@@H](c1cccnc1)[C@@H](C(=O)N(C(C)C)C(C)C)c1ccccc1 ZINC000034986385 GI Annotated Anodyne COC(=O)C[C@@H](c1cccnc1)[C@H](C(=O)N(C(C)C)C(C)C)c1ccccc1 ZINC000034986386 GI Annotated Anodyne COC(=O)C[C@H](c1cccnc1)[C@@H](C(=O)N(C(C)C)C(C)C)c1ccccc1 ZINC000034986387 GI Annotated Anodyne COC(=O)C[C@H](c1cccnc1)[C@H](C(=O)N(C(C)C)C(C)C)c1ccccc1 ZINC000034986388 GI Annotated Anodyne CNCC[C@H](c1ccccc1)n1c(=O)n(-c2ccccc2F)c2cccc(F)c21 ZINC000034986675 GI Annotated Anodyne CC(C)(C)c1cnnn1-c1ccc(NC(=O)c2ccc(Br)o2)cc1 ZINC000003582148 GI Annotated Anodyne O=C1CS[C@@H](c2c(F)cccc2Cl)N1c1cccc(Br)n1 ZINC000003587180 GI Annotated Anodyne CCOP(=O)(OCC)[C@](C)(CC)NC(=O)C(C(F)(F)F)C(F)(F)F ZINC000003589144 GI Annotated Anodyne Cc1cc(CCCCCCCOc2c(C)cc(-c3nnn(C)n3)cc2C)on1 ZINC000003590241 GI Annotated Anodyne CC(=O)NCc1ccc(-c2cnc(Nc3ccc4c(C#N)cn(C)c4c3)o2)cc1 ZINC000003595504 GI Annotated Mild Cc1cc(CCCCCOc2c(Cl)cc(-c3nnnn3C)cc2Cl)on1 ZINC000003600031 GI Annotated Anodyne Cc1cccc(C)c1NC(=O)[C@@H](c1ccccc1)N1CC(=O)Nc2ccccc21 ZINC000003625535 GI Annotated Anodyne Cc1cccc(C)c1NC(=O)[C@H](c1ccccc1)N1CC(=O)Nc2ccccc21 ZINC000003625537 GI Annotated Anodyne COC1=C(C(C)C)C(=O)C2=C(C1=O)[C@@]1(C)CCCC(C)(C)C1=C[C@H]2OC(C)=O ZINC000003633423 GI Annotated Mild in-vitro COC1=C(C(C)C)C(=O)C2=C(C1=O)[C@]1(C)CCCC(C)(C)C1=C[C@H]2OC(C)=O ZINC000003633424 GI Annotated Mild CCOc1nsc2cc(OCCC3CCN(c4ccc(C)nn4)CC3)ccc12 ZINC000003633458 GI Annotated Anodyne CCCOc1noc2cc(OCCC3CCN(c4ccc(C)nn4)CC3)ccc12 ZINC000003633462 GI Annotated Anodyne CCOc1nc2cc(OCCC3CCN(c4ccc(C)nn4)CC3)ccc2o1 ZINC000003633487 GI Annotated Anodyne CCOc1nc2ccc(OCCC3CCN(c4ccc(C)nn4)CC3)cc2s1 ZINC000003633497 GI Annotated Anodyne CCOc1nc2ccc(OCCC3CCN(c4ccc(C)nn4)CC3)cc2o1 ZINC000003633644 GI Annotated Anodyne Cc1cccc2sc(NC(=O)CCCN3C(=S)NC(C)(C)C[C@@H]3C)nc12 ZINC000003654885 GI Annotated Anodyne Cc1cccc2sc(NC(=O)CCCN3C(=S)NC(C)(C)C[C@H]3C)nc12 ZINC000003654886 GI Annotated Anodyne Cc1ccc2c(c1)[C@@H](c1ccc(F)cc1)N(C(=O)c1cccs1)CC(=O)N2 ZINC000003660385 GI Annotated Anodyne Cc1ccc2c(c1)[C@H](c1ccc(F)cc1)N(C(=O)c1cccs1)CC(=O)N2 ZINC000003660386 GI Annotated Anodyne CN(C)CCCN(CCCN(C)C)Cc1ccc(-c2cccc(Cl)c2)o1 ZINC000003681052 GI Annotated Anodyne CC1(C)[C@H](C=C(Cl)Cl)[C@@H]1C(=O)NCCCOC(=O)Nc1ccccc1 ZINC000003683374 GI Annotated Anodyne CO[C@H]1C[C@H](O)C[C@@H](CSc2nc(-c3ccccc3)c(-c3ccccc3)[nH]2)O1 ZINC000003782469 GI Annotated Anodyne O=[S@](Cc1cc(Oc2ccc(F)cc2F)ccn1)c1nc2cscc2[nH]1 ZINC000003796081 GI Annotated Anodyne C=CCCCCC[C@@H](Cl)[C@@H](CC#CC#C[C@H](C=C)OC(C)=O)OC(C)=O ZINC000003797231 GI Annotated Reactive CN(CCn1c(=N)sc2cc(OC(F)(F)F)ccc21)Cc1ccccc1 ZINC000003805347 GI Annotated Anodyne CN(CCc1ccccc1)CCn1c(=N)sc2cc(OC(F)(F)F)ccc21 ZINC000003805348 GI Annotated Anodyne CC(=O)N(C)c1ccc(Sc2ncc([C@@]3(C)COC(C)(C)O3)s2)cc1 ZINC000003808232 GI Annotated Clean CCc1ccccc1NC(=O)Oc1ccc2c(c1)[C@]1(C)CCN(C)O[C@@H]1N2C ZINC000003814007 GI Annotated Anodyne in-man N=C(N)c1cccc(-c2cccc([C@H](CCCNc3ccncc3)C(=O)O)c2)c1 ZINC000003815585 GI Annotated Anodyne CCN(C(C)=O)c1ccc(OC)c2nc(NC(=O)c3ccc(F)cc3)sc12 ZINC000003816736 GI Annotated Anodyne Cc1c(-c2ccccc2)c(N2CC[C@H](N(C)C)C2)n2c(nc3ccccc32)c1C#N ZINC000003817182 GI Annotated Mild O=C(C[C@@H]1CN2CCC1CC2)Nc1cc2ccc(Br)cc2s1 ZINC000003818273 GI Annotated Anodyne Brc1cnc2c(NCc3cncnc3)cc(-c3ccccc3)cn12 ZINC000003820146 GI Annotated Anodyne in-vivo CCC[C@@H](C)[C@H](OC(=O)/C=C/c1ccccc1)[C@H](C)[C@H](O)C/C=C/C=C\C(N)=O ZINC000003824862 GI Annotated Anodyne in-vitro CC(C)=CCC[C@]1(C)Oc2cc(C=O)c(C=O)c3c2[C@H]2[C@@H](O3)[C@@](C)(O)CC[C@H]21 ZINC000003826627 GI Annotated Anodyne Cc1cc(OCCN(C)C)c(C)c2c1CC[C@@H]([C@H](C)C(=O)Nc1ccccn1)C2 ZINC000003841691 GI Annotated Anodyne COC(=O)OC[C@H]1[C@H]2CC[C@@H](C)[C@]1(C)CC/C(C)=C/CC[C@@]1(C)O[C@@H]1[C@@H]2O ZINC000003929026 GI Annotated Anodyne CC(C)(Nc1nc(NO)nc(Nc2ccc3ncsc3c2)n1)c1ccccc1 ZINC000003943029 GI Annotated Anodyne CC[C@@H]1COc2c(ccc3[nH]c(=O)cc(C(F)(F)F)c23)N1CC(F)(F)F ZINC000003945835 GI Annotated Anodyne COc1cc(C(=O)O[C@@H]2CC(C)=CC[C@@]3(C)CC[C@](O)(C(C)C)[C@H]23)ccc1O ZINC000003947417 GI Annotated Anodyne CC[C@@H]1CC[C@H](C)N(c2ccc3nc(O)c(Cc4ccc(F)cc4)nc3n2)C1 ZINC000003955314 GI Annotated Anodyne CC[C@@H]1CC[C@@H](C)N(c2ccc3nc(O)c(Cc4ccc(F)cc4)nc3n2)C1 ZINC000003955315 GI Annotated Anodyne CC[C@H]1CC[C@@H](C)N(c2ccc3nc(O)c(Cc4ccc(F)cc4)nc3n2)C1 ZINC000003955316 GI Annotated Anodyne CN1c2ccccc2C(c2ccccc2)=NC[C@H]1CCNC(=O)c1cccs1 ZINC000003955493 GI Annotated Anodyne Cn1cccc1C(=O)N1CCC2(CC1)CN(C(c1ccccc1)c1ccccc1)C2 ZINC000003955723 GI Annotated Anodyne N#Cc1ccc(CN2CCCC3(CCN(C(=O)c4cccc(F)c4)CC3)C2)cc1 ZINC000003956093 GI Annotated Mild O=C(c1cnccn1)N1CCC[C@@]2(CCN(c3cccc(-c4ccccc4)c3)C2)C1 ZINC000003956123 GI Annotated Anodyne Cc1ncc([C@@H](CCCCCCc2ccc3c(n2)NCCC3)CC(=O)O)cn1 ZINC000003962988 GI Annotated Anodyne COc1cc([C@@H]2CN=C(c3ccc4c(c3)cc(C)n4C)O2)cc(OC)c1OC ZINC000003963436 GI Annotated Anodyne CC[C@H](C)CNCCCNCCCCCCCNCCCNC[C@@H](C)CC ZINC000003964065 GI Annotated Anodyne COCOc1ccc(Br)cc1C(=O)/C=C\c1ccc2c(c1)OCO2 ZINC000003965584 GI Annotated Mild CC[C@@H](C)/C=C(\C)C1=Cc2cc3c(c(O)c2[C@H](OC)O1)C(=O)C(=O)C(OC)=C3 ZINC000003973955 GI Annotated Mild in-vitro N#Cc1cccc(NC(=O)NCCC[C@@H]2C[C@H](Cc3ccccc3)CCN2)c1 ZINC000003976511 GI Annotated Mild COc1c2c(cc3occ(-c4ccc5c(c4)OCO5)c(=O)c13)OC(C)(C)C=C2 ZINC000003978645 GI Annotated Anodyne in-vitro Cc1c(NC2CCC(N)CC2)nc2ccnn2c1Nc1ccc(F)c(Cl)c1 ZINC000003987090 GI Annotated Anodyne COc1ccc([C@H](C)Cn2ccnc2NC#N)cc1OC1Cc2ccccc2C1 ZINC000003992390 GI Annotated Anodyne C[C@]12CC[C@@H]3[C@H]4CC[C@](O)(C(F)(F)F)C[C@H]4CC[C@H]3[C@@H]1CC[C@@H]2C(=O)CO ZINC000003994212 GI Annotated Anodyne CC(C)(C)C1CCC(OC(=O)[C@@H]2CC=CC[C@@H]2C(=O)OC[C@@H]2CCCO2)CC1 ZINC000003995402 GI Annotated Anodyne CC(C)(C)C1CCC(OC(=O)[C@@H]2CC=CC[C@H]2C(=O)OC[C@@H]2CCCO2)CC1 ZINC000003995404 GI Annotated Anodyne Brc1ccc(CO/N=C2\c3ccccc3OC[C@H]2n2ccnc2)cc1 ZINC000035001195 GI Annotated Mild Brc1ccc(CO/N=C2\c3ccccc3OC[C@@H]2n2ccnc2)cc1 ZINC000035001197 GI Annotated Mild Cc1ccc(-n2c(C)nnc2SCC(=O)N(C)c2ccccc2Cl)cc1 ZINC000035001740 GI Annotated Anodyne Cc1ccc(NC(=O)CSc2nnc(C)n2-c2ccc(F)cc2)c(Cl)c1 ZINC000035002792 GI Annotated Anodyne Cc1ccc(-n2c(C)nnc2SCC(=O)Nc2ccc(C#N)cc2Cl)cc1 ZINC000035002821 GI Annotated Mild CCCO[C@]1(c2ccccc2)c2ccccc2C(=O)N1CCCC(OC)OC ZINC000035064413 GI Annotated Anodyne CCCO[C@@]1(c2ccccc2)c2ccccc2C(=O)N1CCCC(OC)OC ZINC000035064416 GI Annotated Anodyne COC(=O)/C1=C\CC[C@]2(C)O[C@H]2CC/C(C(=O)OC)=C\C=C(/C(C)C)CC1 ZINC000035066409 GI Annotated Anodyne COc1cc2c(c(O)c1OC)-c1c(cc(O)c(OC)c1OC)C[C@H](C)[C@H](C)C2 ZINC000035086282 GI Annotated Anodyne CCN1CCc2ccc3c(C(=O)O)c(O)c(Cc4ccc(Cl)cc4)nc3c2C1 ZINC000035087124 GI Annotated Anodyne CCN(CC)CCSc1nc(N)c(C#N)c(-c2ccccc2Cl)c1C#N ZINC000035087233 GI Annotated Mild C[C@H](Nc1c(-c2ccc(F)cc2F)c(Cl)nc2ncnn12)C(F)(F)F ZINC000035090941 GI Annotated Anodyne C[C@H](Nc1c(-c2c(F)ccc(F)c2F)c(Cl)nc2ncnn12)C(F)(F)F ZINC000035090942 GI Annotated Anodyne O=c1oc(-c2ccc(C(F)(F)F)cc2F)nn1Cc1cc(Cl)ccc1O ZINC000035242377 GI Annotated Clean O=c1oc(-c2ccc(F)c(C(F)(F)F)c2)nn1Cc1cc(Cl)ccc1O ZINC000035242379 GI Annotated Clean COP(=O)(OC)[C@@H](OC(=O)COc1ccc(Cl)cc1C)c1ccco1 ZINC000035259300 GI Annotated Anodyne COP(=O)(OC)[C@H](OC(=O)COc1ccc(Cl)cc1C)c1ccco1 ZINC000035259301 GI Annotated Anodyne COP(=O)(OC)[C@@H](OC(=O)COc1ccc(Cl)c(C)c1)c1ccco1 ZINC000035259302 GI Annotated Anodyne COP(=O)(OC)[C@H](OC(=O)COc1ccc(Cl)c(C)c1)c1ccco1 ZINC000035259303 GI Annotated Anodyne COP(=O)(OC)[C@@H](OC(=O)COc1cc(C)ccc1Cl)c1ccco1 ZINC000035259304 GI Annotated Anodyne COP(=O)(OC)[C@H](OC(=O)COc1cc(C)ccc1Cl)c1ccco1 ZINC000035259305 GI Annotated Anodyne C=CCN1C[C@H]2C[C@@]2(c2ccc(NS(=O)(=O)c3ccc(C(C)C)cc3)cc2)C1 ZINC000035308960 GI Annotated Mild CCN1C[C@H]2C[C@@]2(c2ccc(NS(=O)(=O)c3ccc(C(C)C)cc3)cc2)C1 ZINC000035308965 GI Annotated Anodyne CC1(C)CN(Cc2ccccc2)C(=O)[C@@H]1Oc1ccc(C#N)c(C(F)(F)F)c1 ZINC000035322715 GI Annotated Mild CC1(C)CN(Cc2ccccc2)C(=O)[C@H]1Oc1ccc(C#N)c(C(F)(F)F)c1 ZINC000035322718 GI Annotated Mild CO/N=C(/C(=O)OC)c1ccccc1CSc1cc(=O)c2ccccc2s1 ZINC000035328891 GI Annotated Mild CC(=N)[C@@H](C#N)C(=O)CSc1nn(-c2ccc(Cl)cc2)c(=S)s1 ZINC000035485643 GI Annotated Mild O=C1c2ccc(NCCO)c3cccc(c23)CN1c1cccc(Br)c1 ZINC000035794393 GI Annotated Anodyne NC1=N[C@@](c2ccccc2)(c2cccc(Cc3ccc(F)cc3)c2)C2=NCCCN12 ZINC000035794560 GI Annotated Anodyne NC1=N[C@](c2ccccc2)(c2cccc(Cc3ccc(F)cc3)c2)C2=NCCCN12 ZINC000035794563 GI Annotated Anodyne O=S(=O)(Nc1nccs1)c1cc(-c2nc3ccccc3s2)cs1 ZINC000035826161 GI Annotated Anodyne Nc1nccc(-c2ccc(C(=O)NCCc3ccc(Cl)cc3Cl)s2)n1 ZINC000035826490 GI Annotated Anodyne C/C(=C\CCc1ccoc1)C/C=C/[C@@](C)(O)CC[C@@H](O)[C@]1(C)CCC(=O)O1 ZINC000035846987 GI Annotated Anodyne CC[C@H](C)/C=C(C)/C=C/C1=CC2=CC3=C(C(C)=O)C(=O)O[C@@]3(C)C(=O)C2=CO1 ZINC000035847114 GI Annotated Mild in-vitro COC(=O)CCc1nc2c(C(C)=O)c(O)c3ccc4c(C)cccc4c3c2o1 ZINC000035859208 GI Annotated Bother O=C1O[C@@H](CCc2ccccc2)C(=O)[C@@H]1SCc1cccc(C(F)(F)F)c1 ZINC000035859797 GI Annotated Anodyne CNc1nccc(N(C(=O)NCc2ccccc2Cl)c2ccc(OC)cc2)n1 ZINC000035878665 GI Annotated Anodyne NS(=O)(=O)c1cc(-c2nc3cccc(-c4ccc(F)cc4)c3s2)cs1 ZINC000035901007 GI Annotated Anodyne COC(=O)c1ccc(Sc2nc(N)c(C#N)c(-c3cccs3)c2C#N)cc1 ZINC000035907433 GI Annotated Mild CN1C(=O)[C@@H](CN2CCCCC2)C[C@H]1c1cnc(-c2ccccc2Cl)s1 ZINC000035932079 GI Annotated Anodyne CN1C(=O)[C@@H](CN2CCCCC2)C[C@@H]1c1cnc(-c2ccccc2Cl)s1 ZINC000035932081 GI Annotated Anodyne CN1C(=O)[C@H](CN2CCCCC2)C[C@H]1c1cnc(-c2ccccc2Cl)s1 ZINC000035932083 GI Annotated Anodyne CN1C(=O)[C@H](CN2CCCCC2)C[C@@H]1c1cnc(-c2ccccc2Cl)s1 ZINC000035932085 GI Annotated Anodyne C/C(=C\[C@H](O)C/C(C)=C/CCc1ccoc1)CC[C@@H](O)[C@]1(C)CCC(=O)O1 ZINC000035950661 GI Annotated Anodyne C/C(=C\[C@@H](O)C/C(C)=C/CCc1ccoc1)CC[C@@H](O)[C@]1(C)CCC(=O)O1 ZINC000035950662 GI Annotated Anodyne CCn1c(-c2ccc(NS(=O)(=O)C(C)C)cc2)c(C#N)c2ccc(OC)cc21 ZINC000035951072 GI Annotated Mild C/C=C(/C)C(=O)O[C@@H]1c2c(C)coc2[C@H](O)[C@@H]2CC[C@H](OC(C)=O)[C@H](C)[C@@]12C ZINC000035967817 GI Annotated Anodyne CCCN(CCC)c1nc2c(c(-c3c(C)cc(C)cc3C)cn2C)c(=O)n1C ZINC000035983224 GI Annotated Anodyne O=C(Nc1ccc(Oc2ccccc2)nc1)c1nnc(Nc2ccccc2F)o1 ZINC000035983442 GI Annotated Anodyne N#Cc1cccc(NC(=O)NCCC[C@H]2C[C@H](Cc3ccccc3)CCN2)c1 ZINC000036093275 GI Annotated Mild CC(C)c1ccccc1Sc1c(O)cc(-c2ccc(C(N)=O)cc2)oc1=O ZINC000036124552 GI Annotated Anodyne C[C@@H]1CN(c2ccccc2Sc2ccc(Cl)cc2)[C@H](C)CN1CC(=O)O ZINC000036143350 GI Annotated Anodyne O=C(N[C@@H]1Cc2ccc(F)cc2[C@H]1O)c1cc2sc(Cl)c(Cl)c2[nH]1 ZINC000036177550 GI Annotated Anodyne O=C(c1cc2cc(OC(F)(F)F)ccc2o1)N1CCC[C@H]1CN1CCCC1 ZINC000036188009 GI Annotated Anodyne Clc1ccc2nc(CN3CCN(c4ccc(Cl)c(Cl)c4)CC3)cn2n1 ZINC000036215313 GI Annotated Anodyne Cn1cc([C@@H]2CCN([C@@H]3Cc4cccc5cccc3c45)C[C@@H]2O)c2cccnc21 ZINC000036221542 GI Annotated Anodyne Cn1cc([C@H]2CCN([C@@H]3Cc4cccc5cccc3c45)C[C@@H]2O)c2cccnc21 ZINC000036221544 GI Annotated Anodyne O=S(=O)(Nc1nc2cc(Cl)ccc2o1)c1ccc(OC(F)(F)F)cc1 ZINC000036241889 GI Annotated Anodyne COC[C@H](CNC(=O)C1CCC1)c1c(-c2ccccc2)n(C)c2ccccc12 ZINC000036242974 GI Annotated Anodyne COC[C@@H](CNC(=O)C1CCC1)c1c(-c2ccccc2)n(C)c2ccccc12 ZINC000036242977 GI Annotated Anodyne CCNC(=O)c1ccc(C(C#N)=C2C[C@@H]3CC[C@H](C2)N3Cc2ccoc2)cc1 ZINC000036286790 GI Annotated Reactive COc1cc2c(cc1OC)C(=O)C(C1CC[N+](C)(Cc3ccccc3)CC1)=C2 ZINC000036286906 GI Annotated Mild O=C1CCCN1CCc1ccc(C2=CC[C@H]3CN(Cc4ccccc4)C[C@@H]23)cc1 ZINC000036289111 GI Annotated Anodyne O=C1CCCN1CCc1ccc(C2=CC[C@@H]3CN(Cc4ccccc4)C[C@@H]23)cc1 ZINC000036289112 GI Annotated Anodyne N[C@H]1CN(c2nccc(-c3ccsc3)n2)C[C@H]1c1ccc(Cl)cc1Cl ZINC000036310955 GI Annotated Anodyne N[C@H]1CN(c2ccnc(-c3ccsc3)n2)C[C@H]1c1ccc(Cl)cc1Cl ZINC000036310957 GI Annotated Anodyne NC(=O)c1c(SCc2ccc(Cl)cc2)nsc1Nc1cccnc1 ZINC000036348959 GI Annotated Anodyne NC(=O)c1c(SCc2ccc(Cl)cc2)nsc1Nc1ccccn1 ZINC000036349012 GI Annotated Anodyne Cc1cc(C(=O)N(C)Cc2cccnc2)cc(OCc2cccc(Cl)c2)n1 ZINC000036352029 GI Annotated Anodyne CC(C)[C@@H]1CC[C@]2(C)CC[C@H](O)[C@@](C)(O)[C@@H]2[C@@H]1OC(=O)/C=C/c1ccccc1 ZINC000036374574 GI Annotated Anodyne CC(C)[C@H]1CC[C@]2(C)CC[C@H](O)[C@@](C)(O)[C@@H]2[C@@H]1OC(=O)/C=C/c1ccccc1 ZINC000036374576 GI Annotated Anodyne CC(C)[C@@H]1CC[C@@]2(C)CC[C@H](O)[C@@](C)(O)[C@@H]2[C@@H]1OC(=O)/C=C/c1ccccc1 ZINC000036374578 GI Annotated Anodyne CC(C)[C@H]1CC[C@@]2(C)CC[C@H](O)[C@@](C)(O)[C@@H]2[C@@H]1OC(=O)/C=C/c1ccccc1 ZINC000036374581 GI Annotated Anodyne CC1(C)C[C@@H]2[C@@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@@]32C1 ZINC000036378446 GI Annotated Reactive in-vitro CC1(C)C[C@H]2[C@@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@]23C1 ZINC000036378448 GI Annotated Reactive in-vitro CC1(C)C[C@@H]2[C@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@@]32C1 ZINC000036378449 GI Annotated Reactive in-vitro CC1(C)C[C@H]2[C@H]1CC[C@]1(CBr)CC[C@H]3[C@@H](CC(=O)O)C(=O)O[C@@]32C1 ZINC000036378450 GI Annotated Reactive in-vitro CCCCC[C@]12Cc3cc(OC)c(OC)cc3[C@H](O1)c1c(cc(C)oc1=O)O2 ZINC000036379187 GI Annotated Anodyne Cn1nnnc1Sc1ncnc2scc(-c3ccccc3C(F)(F)F)c12 ZINC000036380177 GI Annotated Anodyne Cn1nnnc1Sc1ncnc2scc(-c3cccc(C(F)(F)F)c3)c12 ZINC000036380178 GI Annotated Anodyne Cn1nnnc1Sc1ncnc2scc(-c3ccc(C(F)(F)F)cc3)c12 ZINC000036380179 GI Annotated Anodyne Cn1nnnc1Sc1ncnc2scc(-c3ccc4ccccc4c3)c12 ZINC000036380205 GI Annotated Anodyne Cn1nnnc1Sc1ncnc2scc(-c3cccc4ccccc34)c12 ZINC000036380209 GI Annotated Anodyne CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2ccc(Cl)cc2Cl)C1 ZINC000036380569 GI Annotated Anodyne CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2c(Cl)cccc2Cl)C1 ZINC000036380741 GI Annotated Anodyne CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2ccc(Cl)c(Cl)c2)C1 ZINC000036380746 GI Annotated Anodyne CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2cccc(Cl)c2Cl)C1 ZINC000036380831 GI Annotated Anodyne CC(=O)N[C@@H](c1ccco1)c1cc(Cl)c2ccc(N3CCCCC3)nc2c1O ZINC000036380893 GI Annotated Clean CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2cc(Cl)cc(Cl)c2)C1 ZINC000036380992 GI Annotated Anodyne CCCN1CNc2c(c(=O)[nH]c(=S)n2CCc2cc(Cl)ccc2Cl)C1 ZINC000036380994 GI Annotated Anodyne COC(=O)N1C2=C(c3ccccc3[C@@H]1CC(=O)O)[C@H]1O[C@@H](C2)c2ccccc21 ZINC000036381607 GI Annotated Anodyne COC(=O)[C@@]1(/C=C2\c3ccc(F)cc3[C@@H](OC)[C@@H]2C)[C@@H]2Oc3ccccc3[C@@H]21 ZINC000036381671 GI Annotated Anodyne CC/C=C1\C(=O)[C@]2(C(=O)c3ccccc3)C[C@H]3CC[C@@](CCC)(C2=O)[C@@]13OC ZINC000036381772 GI Annotated Mild COc1cc([C@H](CC2=CCCCC2)NC(=O)C(F)(F)F)cc(OC)c1OC ZINC000036381914 GI Annotated Anodyne C#CCN1C(=O)[C@]2(O[C@H](COc3ccccc3)CC3=C2CCC3)c2ccccc21 ZINC000036381940 GI Annotated Mild C=C(C)CCN1C(=O)N[C@@H](c2cccc(C(F)(F)F)c2)C(C(=O)OC)=C1C ZINC000036382000 GI Annotated Mild O=C(Nc1ccc(Cl)cc1Cl)[C@@H]1CC=C[C@@H]2CCN(C3CC3)C(=O)[C@@H]21 ZINC000036383110 GI Annotated Anodyne CCc1cc(Cn2nc(-c3ccccc3)cc2C(=O)NCc2cccs2)on1 ZINC000036384196 GI Annotated Anodyne COC(=O)C1=C(c2ccc3ccccc3c2)C[C@@H]2CC[C@H]1N2C(=O)NC(C)C ZINC000036384229 GI Annotated Anodyne CCCNC(=O)N1[C@H]2CC[C@@H]1C(C(=O)OC)=C(c1ccc3ccccc3c1)C2 ZINC000036384250 GI Annotated Anodyne COC(=O)C1=C(c2ccc3ccccc3c2)C[C@@H]2CC[C@H]1N2C(=O)N1CCCC1 ZINC000036384265 GI Annotated Anodyne COC(=O)C1=C(c2ccc3ccccc3c2)C[C@@H]2CC[C@H]1N2C(=O)NCC1CC1 ZINC000036384285 GI Annotated Anodyne Cc1ccc(O[C@H]2[C@H](/C=C/C#Cc3ccc(C(C)(C)C)cc3)OC[C@H]2O)cc1 ZINC000036384626 GI Annotated Mild CC[C@]1(c2ccccc2)C(=O)N(C(=O)OC(C)(C)C)N1C(=O)OC(C)(C)C ZINC000036386413 GI Annotated Anodyne CC[C@@]1(c2ccccc2)C(=O)N(C(=O)OC(C)(C)C)N1C(=O)OC(C)(C)C ZINC000036386414 GI Annotated Anodyne COC(=O)C[C@@H]1c2ccccc2[C@@H](Cc2ccc(OC)cc2)[C@@H](C)N1C(=O)OC ZINC000036387496 GI Annotated Anodyne COC(=O)[C@]1(C)CCC[C@@]2(C)[C@H]3CC[C@]4(OC(C)=O)C[C@@]3(CC[C@H]21)C/C4=N\O ZINC000036387872 GI Annotated Mild COC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@]4(OC(C)=O)C[C@@]3(CC[C@H]21)C/C4=N\O ZINC000036387873 GI Annotated Mild COC(=O)[C@]1(C)CCC[C@]2(C)[C@@H]1CC[C@]13C/C(=N\O)[C@](OC(C)=O)(CC[C@@H]21)C3 ZINC000036387875 GI Annotated Mild CCOC(=O)c1cccc(C2=CC(=O)C[C@H](c3ccc(OC)c(OC)c3)C2)c1 ZINC000036388316 GI Annotated Mild COc1cccc(-c2ncc3ccccc3c2COC(=O)CCCC(=O)O)c1 ZINC000036388752 GI Annotated Anodyne COc1ccc(C2c3c(c(C)c(C)oc3=O)Oc3c(C)c(C)oc(=O)c32)cc1 ZINC000036389243 GI Annotated Anodyne CC[C@@H](CO)Oc1cc(NC(=O)c2ccc(C)cc2)c2ncn(C(C)C)c2c1 ZINC000036389254 GI Annotated Anodyne CC[C@H](CO)Oc1cc(NC(=O)c2ccc(C)cc2)c2ncn(C(C)C)c2c1 ZINC000036389255 GI Annotated Anodyne CC[C@@H](CO)Oc1cc(NC(=O)c2ccc(F)cc2)c2ncn(C(C)C)c2c1 ZINC000036389256 GI Annotated Anodyne CC[C@H](CO)Oc1cc(NC(=O)c2ccc(F)cc2)c2ncn(C(C)C)c2c1 ZINC000036389257 GI Annotated Anodyne S=C(/N=c1/[nH]c2ccc(Cl)cc2s1)N/N=C/c1ccccc1Cl ZINC000036434740 GI Annotated Mild CCO[C@]1(C)c2ccoc2C[C@H]2[C@H]1CC[C@@]1(O)[C@@](C)(C(=O)OC)CCC[C@]21C ZINC000036442855 GI Annotated Anodyne COC(=O)CCC/C=C(\c1cccc(C#N)c1)c1cc(C)c2oc(=O)n(C)c2c1 ZINC000036476092 GI Annotated Mild COC(=O)CCC/C=C(/c1cccc(C#N)c1)c1cc(C)c2oc(=O)n(C)c2c1 ZINC000036476093 GI Annotated Mild COC(=O)CCC/C=C(/c1ccc(C#N)cc1)c1cc(C)c2oc(=O)n(C)c2c1 ZINC000036476095 GI Annotated Mild CONC(=N)c1ccc(-c2ccc(-c3ccc(C(=N)NOC)cc3)c(F)c2)cc1 ZINC000036476184 GI Annotated Anodyne Cc1ccc([C@@]2(O)[C@H](c3ccccc3)C[C@H]3C(=O)c4ccccc4NC(=O)[C@@H]32)cc1 ZINC000036519505 GI Annotated Anodyne COc1cc2c(cc1OC)Nc1ncnc(N[C@H](C)c3ccccc3)c1NC2 ZINC000036758617 GI Annotated Anodyne Nc1cc2c(ccc(=O)n2-c2c(F)cccc2F)c(-c2ccc(F)cc2F)n1 ZINC000036988459 GI Annotated Anodyne N[C@@H](Cc1cccc2ccccc12)C(=O)Nc1cncc(/C=C\c2ccncc2)c1 ZINC000037867096 GI Annotated Anodyne COc1ccc([C@@H]2/C=C/CN(CC3CC3)CC(=O)N2Cc2ccc(F)cc2)cc1 ZINC000037867891 GI Annotated Anodyne CCC[C@@H](C)[C@H](OC(=O)/C=C/c1ccccc1)[C@H](C)[C@H](O)C/C=C/C=C/C(N)=O ZINC000377391282 GI Annotated Anodyne COc1ccc(-c2ccc3c(c2)n2ncc(-c4ccsc4)c2[nH][n+]3=O)cc1 ZINC000377836323 GI Annotated Anodyne O=C(c1ccccc1)c1c(C(F)F)[n+](=O)c2cc(Cl)c(Cl)cc2n1O ZINC000377839272 GI Annotated Anodyne COc1ccc2cc3n(cc-2c1=NCC(C)C)CCc1cc2c(cc1-3)OCO2 ZINC000377840036 GI Annotated Anodyne CN1/C(=C/C=C2\C=C([N+](=O)[O-])C=CC2=O)C=C(N2CCCCC2)c2ccccc21 ZINC000377853443 GI Annotated Mild CN1/C(=C/C=C2/C=C([N+](=O)[O-])C=CC2=O)C=C(N2CCCCC2)c2ccccc21 ZINC000377853444 GI Annotated Mild CCS(=O)(=O)Nc1ccc(N=c2c3ccccc3n(C)c3ccccc23)cc1 ZINC000377853474 GI Annotated Bother C/C1=C/CC[C@@]2(C)O[C@@H]2[C@H](O)[C@@H]2CC[C@@H](C)[C@](C)(CC1)[C@H]2COC(=O)N(C)C ZINC000038140210 GI Annotated Anodyne COC(=O)OC[C@H]1[C@H]2CC[C@@H](C)[C@]1(C)CC/C(C)=C\CC[C@@]1(C)O[C@@H]1[C@@H]2O ZINC000038140215 GI Annotated Anodyne COC(=O)C[C@H]1c2ccccc2[C@@H](Cc2ccc(OC)cc2)[C@@H](C)N1C(=O)OC ZINC000038140896 GI Annotated Anodyne O=S(=O)(N[C@H]1[C@H]2CC[C@@H]1Cc1cc(F)ccc1C2)c1ccc(Cl)s1 ZINC000038140959 GI Annotated Anodyne O=S(=O)(N[C@@H]1[C@H]2CC[C@@H]1Cc1ccc(F)cc1C2)c1ccc(Cl)s1 ZINC000038140960 GI Annotated Anodyne O=S(=O)(N[C@H]1[C@H]2CC[C@@H]1Cc1c(F)cccc1C2)c1ccc(Cl)s1 ZINC000038140962 GI Annotated Anodyne O=S(=O)(N[C@@H]1[C@H]2CC[C@@H]1Cc1cccc(F)c1C2)c1ccc(Cl)s1 ZINC000038140963 GI Annotated Anodyne N=C(N)c1ccc(/C=C2/CCCCC/C(=C/c3ccc(C(=N)N)cc3)C2=O)cc1 ZINC000038141176 GI Annotated Mild CC(=O)N[C@H](c1ccco1)c1cc(Cl)c2ccc(N3CCCCC3)nc2c1O ZINC000038142070 GI Annotated Clean COc1cc([C@@H](CC2=CCCCC2)NC(=O)C(F)(F)F)cc(OC)c1OC ZINC000038142321 GI Annotated Anodyne C=C(C)CCN1C(=O)N[C@H](c2cccc(C(F)(F)F)c2)C(C(=O)OC)=C1C ZINC000038142373 GI Annotated Mild N#CCCn1c(Cn2c(=O)n(-c3ccccc3)c3ccccc32)nc2ccccc21 ZINC000038142812 GI Annotated Mild C=C(C)n1c(=O)n(Cc2nc3ccccc3n2CCCCC#N)c2ccccc21 ZINC000038142814 GI Annotated Mild CCCCCCCCN1[C@@H](CC(=O)OCC)c2cc(F)ccc2S1(=O)=O ZINC000038143029 GI Annotated Mild N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@H](O)c2cccc(F)c2)c1 ZINC000038145349 GI Annotated Reactive N#C/C(=C(/N)Sc1ccccc1N)c1cccc([C@@H](O)c2cccc(F)c2)c1 ZINC000038145350 GI Annotated Reactive N#C/C(=C(/N)Sc1ccccc1O)c1cccc([C@H](O)c2ccc(C#N)cc2)c1 ZINC000038145363 GI Annotated Reactive N#C/C(=C(/N)Sc1ccccc1O)c1cccc([C@@H](O)c2ccc(C#N)cc2)c1 ZINC000038145364 GI Annotated Reactive C[C@@](O)(c1ccccc1)c1cccc(/C(C#N)=C(\N)Sc2ccccc2N)c1 ZINC000038145373 GI Annotated Reactive C[C@](O)(c1ccccc1)c1cccc(/C(C#N)=C(\N)Sc2ccccc2N)c1 ZINC000038145374 GI Annotated Reactive CC(C)CN1CCC2(CC1)Oc1ccccc1[C@@H]1CC(c3ccncc3)=NN12 ZINC000038147843 GI Annotated Anodyne CC(C)CN1CCC2(CC1)Oc1ccccc1[C@H]1CC(c3ccncc3)=NN12 ZINC000038147844 GI Annotated Anodyne CC(C)=CCO[C@]1(C)CC[C@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 ZINC000038148267 GI Annotated Reactive CC(C)=CCO[C@@]1(C)CC[C@H]2C[C@@H]1OO[C@@]2(C)CS(=O)(=O)c1ccccc1 ZINC000038148268 GI Annotated Reactive O=C(N/C(C(=O)N1CCCCC1)=C(\Cl)c1ccccc1)c1ccc(F)cc1 ZINC000038148939 GI Annotated Anodyne CN(C)Cc1ccc2c(c1)CC[C@H](N(C)C(=O)c1ccc(-c3ccccc3)cn1)C2 ZINC000038149878 GI Annotated Anodyne CN(C)Cc1ccc2c(c1)CC[C@H](N(C)C(=O)c1ccc(-c3ccccn3)cc1)C2 ZINC000038149879 GI Annotated Anodyne CCc1c(C)[nH]c2c1/C(=N/NC(=O)Nc1cccc([C@@H]3CCCN3)c1)CCC2 ZINC000038149910 GI Annotated Reactive CCc1c(C)[nH]c2c1/C(=N/NC(=O)Nc1cccc([C@H]3CCCN3)c1)CCC2 ZINC000038149912 GI Annotated Reactive CCCCNc1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1cc(OC)cc(OC)c1 ZINC000038153944 GI Annotated Reactive CCCCNc1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1cc(OC)cc(OC)c1 ZINC000038153945 GI Annotated Reactive Cc1ccc2c(c1C)CN(C(=O)N(C)CCCN(C)C)C[C@@H]2c1ccccc1 ZINC000038156040 GI Annotated Anodyne Cc1ccc2c(c1C)CN(C(=O)N(C)CCCN(C)C)C[C@H]2c1ccccc1 ZINC000038156041 GI Annotated Anodyne CO[C@H]1O[C@]2(C)CC[C@H]3CCC[C@@H](CCOCc4ccc(F)cc4)[C@]13OO2 ZINC000038158727 GI Annotated Reactive CO[C@H]1O[C@@]2(C)OO[C@@]13[C@H](CCOCc1ccccc1)CCC[C@@H]3C[C@@H]2C ZINC000038158735 GI Annotated Reactive Clc1ccc(CO/N=C2\c3ccccc3OC[C@H]2n2cncn2)cc1Cl ZINC000038171242 GI Annotated Mild Clc1ccc(CO/N=C2\c3ccccc3OC[C@@H]2n2cncn2)cc1Cl ZINC000038171243 GI Annotated Mild CN(C)c1ccc(/C=C/C(O)=C2\C(=O)N(C)[C@]3(C)C[C@H]2c2ccccc2O3)cc1 ZINC000038179733 GI Annotated Clean COc1ccc(/C=C/C(O)=C2\C(=O)N(C)[C@]3(C)C[C@H]2c2ccccc2O3)cc1 ZINC000038179735 GI Annotated Anodyne COc1ccccc1NC(=O)C1=C(C)N=C2CCCC(=O)[C@@H]2[C@@H]1c1ccc(C)o1 ZINC000038197830 GI Annotated Anodyne COc1ccccc1NC(=O)C1=C(C)N=C2CCCC(=O)[C@@H]2[C@H]1c1ccc(C)o1 ZINC000038197831 GI Annotated Anodyne COc1cc([C@H]2C3=C(N=C(C)[C@H]2C#N)c2ccccc2C3=O)cc(OC)c1OC ZINC000038199264 GI Annotated Mild COc1cc([C@@H]2C3=C(N=C(C)[C@@H]2C#N)c2ccccc2C3=O)cc(OC)c1OC ZINC000038199265 GI Annotated Mild Cc1c(C#N)c(-c2ccc(C#N)cc2)c(C)n1Cc1cnc(Cl)c(CO)c1 ZINC000038215152 GI Annotated Mild CC/C=C/C=C1\C(=O)C(Br)=C[C@@]1(O)CCCCCCCC(=O)OC ZINC000038231678 GI Annotated Mild C=C1[C@@H](C)C[C@@H](OC(=O)/C=C/c2ccccc2)[C@@]2(C)[C@H]1CC=C(C=O)[C@@H]2C=O ZINC000038238656 GI Annotated Reactive CC1=C([C@@H](C)c2cccc(Oc3ccccc3)c2)O[C@@H]2/C(=N/O)CCN2C1=O ZINC000038267675 GI Annotated Mild CC1=C([C@@H](C)c2cccc(Oc3ccccc3)c2)O[C@H]2/C(=N/O)CCN2C1=O ZINC000038267676 GI Annotated Mild CC1=C([C@H](C)c2cccc(Oc3ccccc3)c2)O[C@@H]2/C(=N/O)CCN2C1=O ZINC000038267677 GI Annotated Mild CC1=C([C@H](C)c2cccc(Oc3ccccc3)c2)O[C@H]2/C(=N/O)CCN2C1=O ZINC000038267678 GI Annotated Mild COC(=O)[C@]1(C)CCC[C@]2(C)c3cc4occc4c(C)c3C[C@@H](OC(C)=O)[C@H]21 ZINC000038279413 GI Annotated Anodyne C=C/C=C\[C@H](C)[C@H](O)[C@@H](C)[C@H](O)[C@@H](C)C/C(C)=C\[C@H](C)[C@H]1OC(=O)C=C[C@@H]1C ZINC000038289377 GI Annotated Anodyne COc1ccc([C@@H]2CC3(N(C)C)C[C@@H](O)C2[C@H](c2ccc(OC)cc2)C3)cc1 ZINC000038308023 GI Annotated Anodyne COc1ccc([C@@H]2CC3(N(C)C)C[C@H](O)C2[C@H](c2ccc(OC)cc2)C3)cc1 ZINC000038308024 GI Annotated Anodyne C[C@H]1CN(C(=O)c2cn3c4c(cccc24)OC[C@H]3C2CCCCC2)C[C@@H](C)N1C ZINC000038308443 GI Annotated Anodyne CC(C)[C@H](NS(=O)(=O)c1ccc(Cl)s1)c1ccnn1-c1ccccc1 ZINC000038308454 GI Annotated Anodyne CC(C)[C@@H](NS(=O)(=O)c1ccc(Cl)s1)c1ccnn1-c1ccccc1 ZINC000038308455 GI Annotated Anodyne CC[C@H]1O[C@H]2C[C@H](C=C=CBr)O[C@H]2C/C=C\C[C@@H]1Br ZINC000038346152 GI Annotated Reactive COc1ccc(/C=C/C(=O)N2C[C@H](CCl)c3c2cc(O)c2ncccc32)cc1 ZINC000038394657 GI Annotated Reactive COc1ccc(/C=C/C(=O)N2C[C@@H](CCl)c3c2cc(O)c2ncccc32)cc1 ZINC000038394658 GI Annotated Reactive CN(C)CCCCN(Cc1nc2ccccc2[nH]1)[C@@H]1CCCc2cccnc21 ZINC000038411528 GI Annotated Anodyne CN(C)CCCCN(Cc1nc2ccccc2[nH]1)[C@H]1CCCc2cccnc21 ZINC000038411530 GI Annotated Anodyne Brc1cnc2nc(-c3cccnc3NCc3ccccc3)[nH]c2c1 ZINC000038424635 GI Annotated Anodyne CCOc1cc2c(cc1OCC)C(c1cc3ccccc3s1)=NNC(=O)C2 ZINC000038446170 GI Annotated Anodyne O=[N+]([O-])c1cccc(C2=NC(c3ccc(F)cc3)(c3ccc(F)cc3)CN2)c1 ZINC000038465058 GI Annotated Bother COc1ccccc1-n1cc(-c2ccccn2)cc(-c2ccccc2C#N)c1=O ZINC000038465067 GI Annotated Mild C[C@@H](CN[C@@H]1COc2ccccc2SC1)CSc1cccc2c1OCC2 ZINC000038465675 GI Annotated Anodyne CCOc1cc2c3cc(OC)c(OC)cc3cn(C)c2c2cc(OC)c(=O)cc12 ZINC000038626486 GI Annotated Bother C=C[C@@]1(C)CC[C@@H]2[C@](C)(C[C@H](O)[C@@H]3C(C)(C)[C@H](Br)CC(=O)[C@]32C)O1 ZINC000038796934 GI Annotated Reactive Fc1ccccc1-c1cc(NCc2ccncc2)n2ncc(Br)c2n1 ZINC000038837816 GI Annotated Anodyne CC[C@H]1O[C@H]2CC=CC[C@H](C=C=CBr)O[C@H]2C[C@@H]1Br ZINC000038841895 GI Annotated Reactive O=C(c1cc2ccn(Cc3ccc(F)cc3)c2cn1)N(O)Cc1ccccc1 ZINC000038896065 GI Annotated Anodyne C/C1=C\CC(C)(C)/C=C/C[C@@]2(C)Oc3cc(O)c(=O)cc(C)c3C[C@@H]2C[C@H]1O ZINC000039060944 GI Annotated Anodyne COCCSc1c(C)on(C(=O)N(c2ccc(Cl)cc2)C(C)C)c1=O ZINC000039098238 GI Annotated Anodyne COc1cc2c(ccc3c4c(c(O)c(OC)c32)CN(CC(C)C)CC4)cc1O ZINC000039140964 GI Annotated Clean in-vivo COc1cc(C)cc2c(-c3ccc4c(c3O)[C@@H](C)N[C@H](C)[C@@H]4O)ccc(O)c12 ZINC000039161704 GI Annotated Clean COC(=O)[C@@]1(OC(C)=O)C[C@@]23CC[C@H]4[C@@](C)(CCC[C@@]4(C)C=O)[C@@H]2CC[C@@H]1C3 ZINC000039162231 GI Annotated Mild CC(=O)Nc1cc(-n2c(-c3ccccc3)cc3c2CCCC3)cc(C(=O)O)c1O ZINC000039194361 GI Annotated Clean O=C(O)c1cc(-n2c(-c3ccc([N+](=O)[O-])cc3)cc3c2CCCC3)ccc1O ZINC000039194373 GI Annotated Clean Cc1nc([C@@H]2CCCNC2)cc(N(C)Cc2csc(-c3cccs3)n2)n1 ZINC000039364395 GI Annotated Anodyne Cc1nc([C@H]2CCCNC2)cc(N(C)Cc2csc(-c3cccs3)n2)n1 ZINC000039364396 GI Annotated Anodyne O=C(O)c1cccc(/C=C2\C[C@@H]3[C@H](C[C@H](O)[C@@H]3/C=C/[C@H](O)C3CCCCC3)O2)c1 ZINC000039432551 GI Annotated Anodyne COc1cc(Cl)cc(CN2CC[C@]3(CCCN(CC4CC4)C3)C2)c1OC ZINC000039515547 GI Annotated Anodyne COc1cc(Cl)cc(CN2CC[C@@]3(CCCN(CC4CC4)C3)C2)c1OC ZINC000039515548 GI Annotated Anodyne CC(C)[C@@H]1CC[C@]2(C)[C@@H]([C@@H]1OC(=O)/C=C/c1ccccc1)[C@](C)(O)CC[C@H]2O ZINC000039560255 GI Annotated Anodyne COc1cc(/C=C(/C#N)c2nc(-c3ccc4c(c3)OCO4)cs2)ccc1O ZINC000039933149 GI Annotated Reactive CC1(C)[C@H](C=C(Cl)Cl)[C@H]1C(=O)NCCCOC(=O)Nc1ccccc1 ZINC000004012587 GI Annotated Anodyne Cc1c(Br)c(NC(=O)C(F)(F)F)nn1Cc1ccc(Cl)cc1 ZINC000004018775 GI Annotated Anodyne O=c1[nH]c2ccc(N3CCC[C@H]4CCCC[C@@H]43)nc2nc1Cc1ccc(F)cc1 ZINC000004048880 GI Annotated Anodyne O=C(NCCc1ccc(F)cc1)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccccc1 ZINC000004049559 GI Annotated Anodyne O=C(NCCc1ccc(F)cc1)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000004049560 GI Annotated Anodyne N#CCCNC(=O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccc(-c2ccccc2)cc1 ZINC000004049593 GI Annotated Mild N#CCCNC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccc(-c2ccccc2)cc1 ZINC000004049594 GI Annotated Mild N#CCCNC(=O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccc(-c2ccccc2)cc1 ZINC000004049595 GI Annotated Mild N#CCCNC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccc(-c2ccccc2)cc1 ZINC000004049596 GI Annotated Mild COCCCNC(=O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccc(C(C)C)cc1 ZINC000004049645 GI Annotated Anodyne COCCCNC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccc(C(C)C)cc1 ZINC000004049646 GI Annotated Anodyne COCCCNC(=O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccc(C(C)C)cc1 ZINC000004049647 GI Annotated Anodyne COCCCNC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccc(C(C)C)cc1 ZINC000004049648 GI Annotated Anodyne O=C(NCCc1ccc(F)cc1)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccsc1 ZINC000004049934 GI Annotated Anodyne O=C(NCCc1ccc(F)cc1)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000004049936 GI Annotated Anodyne COCCCNC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1cccc2ccccc12 ZINC000004050047 GI Annotated Anodyne COCCCNC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1cccc2ccccc12 ZINC000004050048 GI Annotated Anodyne COCCCNC(=O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1cccc2ccccc12 ZINC000004050049 GI Annotated Anodyne COCCCNC(=O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1cccc2ccccc12 ZINC000004050050 GI Annotated Anodyne C[C@H](NC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccoc1)c1ccc(F)cc1 ZINC000004051507 GI Annotated Anodyne C[C@@H](NC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccoc1)c1ccc(F)cc1 ZINC000004051509 GI Annotated Anodyne C[C@@H](NC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccoc1)c1ccc(F)cc1 ZINC000004051512 GI Annotated Anodyne O=C(NCCOc1ccccc1)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccsc1 ZINC000004051677 GI Annotated Anodyne O=C(NCCOc1ccccc1)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000004051681 GI Annotated Anodyne O=C(NCCOc1ccccc1)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccsc1 ZINC000004051682 GI Annotated Anodyne O=C(NCCOc1ccccc1)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000004051686 GI Annotated Anodyne CC(C)c1ccc([C@H]2ON=C(c3ccccc3)[C@H]2C(=O)NCC(C)(C)CO)cc1 ZINC000004051949 GI Annotated Anodyne CC(C)c1ccc([C@@H]2ON=C(c3ccccc3)[C@H]2C(=O)NCC(C)(C)CO)cc1 ZINC000004051950 GI Annotated Anodyne O=C(NCCc1ccccc1F)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccccc1 ZINC000004053278 GI Annotated Anodyne O=C(NCCc1ccccc1F)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000004053280 GI Annotated Anodyne COc1ccccc1CNC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000004053451 GI Annotated Anodyne COc1ccccc1CNC(=O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccccc1 ZINC000004053454 GI Annotated Anodyne O=C(NCCc1ccccc1F)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccsc1 ZINC000004053764 GI Annotated Anodyne O=C(NCCc1ccccc1F)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000004053765 GI Annotated Anodyne COc1ccccc1CNC(=O)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000004053955 GI Annotated Anodyne COc1ccccc1CNC(=O)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccsc1 ZINC000004053957 GI Annotated Anodyne CCCCNC(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccccc1OC ZINC000004055530 GI Annotated Anodyne CCCCNC(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccccc1OC ZINC000004055531 GI Annotated Anodyne CCCCNC(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1ccccc1OC ZINC000004055532 GI Annotated Anodyne CCCCNC(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1ccccc1OC ZINC000004055533 GI Annotated Anodyne CC1=C(C(=O)OC(C)C)[C@H](c2ccc(OCc3ccccc3)cc2)NC(=O)N1C ZINC000004070113 GI Annotated Anodyne CC1=C(C(=O)OC(C)C)[C@@H](c2ccc(OCc3ccccc3)cc2)NC(=O)N1C ZINC000004070114 GI Annotated Anodyne N#CC1=C(N)Oc2[nH]nc(-c3ccc(-c4ccccc4)cc3)c2[C@@H]1c1ccccn1 ZINC000004075041 GI Annotated Reactive CC(C)c1ccc([C@H]2ON=C(c3ccc(N(C)C)cc3)[C@H]2C(=O)N(C)C)cc1 ZINC000004076856 GI Annotated Anodyne CC(C)c1ccc([C@@H]2ON=C(c3ccc(N(C)C)cc3)[C@H]2C(=O)N(C)C)cc1 ZINC000004076870 GI Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2ccc(N(C)C)cc2)=NO[C@@H]1c1cccc2ccccc12 ZINC000004079747 GI Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2ccc(N(C)C)cc2)=NO[C@H]1c1cccc2ccccc12 ZINC000004079750 GI Annotated Anodyne CN(C)C(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccc(F)cc1Cl ZINC000004081782 GI Annotated Anodyne CN(C)C(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1ccc(F)cc1Cl ZINC000004081785 GI Annotated Anodyne CN(C)C(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccc(Cl)cc1F ZINC000004081807 GI Annotated Anodyne CN(C)C(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1ccc(Cl)cc1F ZINC000004081810 GI Annotated Anodyne CC(=O)O/C=C(/C=C/OC(C)=O)[C@H](C/C=C(C)/C=C/C=C(C)C)OC(C)=O ZINC000004098294 GI Annotated Anodyne in-vitro CC(=O)O/C=C(/C=C/OC(C)=O)[C@@H](C/C=C(C)/C=C/C=C(C)C)OC(C)=O ZINC000004098295 GI Annotated Anodyne in-vitro C=C1[C@@H](NC)CC[C@]23C[C@]24CC[C@]2(C)[C@@H]([C@H](C)NC)[C@H](O)C[C@@]2(C)[C@@H]4CC[C@@H]13 ZINC000004098867 GI Annotated Mild CC/C=C(\C)[C@H](O)[C@H](C)/C=C(C)/C=C/C=C\C=C\C=C(/C)C(=O)N[C@@H](C)CO ZINC000004102366 GI Annotated Anodyne in-vitro Cc1cccc(-n2nc3c(c2NC(=O)CC2CCCCC2)C[S@](=O)C3)c1C ZINC000004105597 GI Annotated Anodyne Cc1ccc(-n2nc3c(c2NC(=O)CCC2CCCCC2)C[S@](=O)C3)cc1 ZINC000004105778 GI Annotated Anodyne CN(C)CCCn1c(SCc2ccc(Cl)cc2)nnc1-c1ccncc1 ZINC000004130383 GI Annotated Anodyne CCOc1cc([C@@H]2C3=C(CCCC3=O)N=C3CCCC(=O)[C@H]32)cc(Cl)c1O ZINC000004146863 GI Annotated Mild CC1(C)CC(=O)c2c(n[nH]c2CCCCc2[nH]nc3c2C(=O)CC(C)(C)C3)C1 ZINC000004147084 GI Annotated Anodyne CCCCNC(=O)[C@H]1C(c2ccccc2OCC)=NO[C@H]1c1ccccc1OC ZINC000004153241 GI Annotated Anodyne CCCCNC(=O)[C@@H]1C(c2ccccc2OCC)=NO[C@H]1c1ccccc1OC ZINC000004153242 GI Annotated Anodyne CCCCNC(=O)[C@H]1C(c2ccccc2OCC)=NO[C@@H]1c1ccccc1OC ZINC000004153243 GI Annotated Anodyne CCCCNC(=O)[C@@H]1C(c2ccccc2OCC)=NO[C@@H]1c1ccccc1OC ZINC000004153245 GI Annotated Anodyne CCOc1ccccc1C1=NOC[C@]1(C)C(=O)NCc1ccc(C(C)(C)C)cc1 ZINC000004153794 GI Annotated Anodyne Cc1cc(NC(=O)CN2C(=O)C[C@@H](c3ccccc3)Sc3ccccc32)no1 ZINC000004162772 GI Annotated Anodyne Cc1cc(NC(=O)CN2C(=O)C[C@H](c3ccccc3)Sc3ccccc32)no1 ZINC000004162773 GI Annotated Anodyne CCOC1=N[C@H]2Nc3ccc(Cl)cc3N(C)[C@@H]2[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000004163985 GI Annotated Bother CCOC1=N[C@H]2Nc3ccc(Cl)cc3N(C)[C@H]2[C@@H]1c1ccc([N+](=O)[O-])cc1 ZINC000004163987 GI Annotated Bother Cc1ccc(SCc2n[nH]c3c2[C@@H](c2ccc(C)o2)C(C#N)=C(N)O3)cc1 ZINC000004168395 GI Annotated Reactive Cc1ccc(SCc2n[nH]c3c2[C@H](c2ccc(C)o2)C(C#N)=C(N)O3)cc1 ZINC000004168397 GI Annotated Reactive Cn1cc(/C(O)=N/Cc2ccccc2Cl)c2c3ccccc3n(C)c2c1=O ZINC000004192709 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@H](c2ccc(C(C)C)cc2)[C@@H]1C(=O)N(C)C ZINC000004204557 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@@H](c2ccc(C(C)C)cc2)[C@@H]1C(=O)N(C)C ZINC000004204558 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@H](c2cccc3ccccc23)[C@@H]1C(=O)N(C)C ZINC000004204997 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@@H](c2cccc3ccccc23)[C@@H]1C(=O)N(C)C ZINC000004205000 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@H](c2ccc(F)cc2Cl)[C@@H]1C(=O)N(C)C ZINC000004205007 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@@H](c2ccc(F)cc2Cl)[C@@H]1C(=O)N(C)C ZINC000004205008 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@H](c2ccc(Cl)cc2F)[C@@H]1C(=O)N(C)C ZINC000004205032 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@@H](c2ccc(Cl)cc2F)[C@@H]1C(=O)N(C)C ZINC000004205035 GI Annotated Anodyne CCCCNC(=O)[C@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1ccccc1OC ZINC000004207479 GI Annotated Anodyne CCCCNC(=O)[C@@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1ccccc1OC ZINC000004207480 GI Annotated Anodyne CCCCNC(=O)[C@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1ccccc1OC ZINC000004207481 GI Annotated Anodyne CCCCNC(=O)[C@@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1ccccc1OC ZINC000004207482 GI Annotated Anodyne CN(C)C(=O)[C@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1ccc(F)cc1Cl ZINC000004211862 GI Annotated Anodyne CN(C)C(=O)[C@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1ccc(F)cc1Cl ZINC000004211863 GI Annotated Anodyne CN(C)C(=O)[C@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1ccc(Cl)cc1F ZINC000004211881 GI Annotated Anodyne CN(C)C(=O)[C@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1ccc(Cl)cc1F ZINC000004211882 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccc(-c3ccccc3)cc2)[C@@H]1C(=O)NCCO ZINC000004212797 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccc(-c3ccccc3)cc2)[C@@H]1C(=O)NCCO ZINC000004212799 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccc(-c3ccccc3)cc2)[C@H]1C(=O)NCCO ZINC000004212802 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccc(-c3ccccc3)cc2)[C@H]1C(=O)NCCO ZINC000004212805 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccsc2)[C@@H]1C(=O)NCCCN1CCCC1 ZINC000004212925 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccsc2)[C@@H]1C(=O)NCCCN1CCCC1 ZINC000004212929 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccsc2)[C@H]1C(=O)NCCCN1CCCC1 ZINC000004212935 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccsc2)[C@H]1C(=O)NCCCN1CCCC1 ZINC000004212940 GI Annotated Anodyne CCN(CC)C(=O)[C@H]1C2=C(C[C@@H](c3ccccc3)[C@H]1C(=O)O)CC(C)(C)CC2=O ZINC000004213241 GI Annotated Mild in-man CCCCCCC1=NO[C@H](c2ccc(F)cc2Cl)[C@@H]1C(=O)NC[C@H](O)CC ZINC000004213354 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccc(F)cc2Cl)[C@@H]1C(=O)NC[C@H](O)CC ZINC000004213355 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccc(F)cc2Cl)[C@H]1C(=O)NC[C@H](O)CC ZINC000004213358 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccc(F)cc2Cl)[C@H]1C(=O)NC[C@H](O)CC ZINC000004213361 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccc(Cl)cc2F)[C@@H]1C(=O)NC[C@H](O)CC ZINC000004213405 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccc(Cl)cc2F)[C@@H]1C(=O)NC[C@H](O)CC ZINC000004213407 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccc(Cl)cc2F)[C@H]1C(=O)NC[C@H](O)CC ZINC000004213410 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccc(Cl)cc2F)[C@H]1C(=O)NC[C@H](O)CC ZINC000004213411 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccsc2)[C@@H]1C(=O)NCCN(CC)CC ZINC000004213528 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccsc2)[C@@H]1C(=O)NCCN(CC)CC ZINC000004213530 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccsc2)[C@H]1C(=O)NCCN(CC)CC ZINC000004213532 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccsc2)[C@H]1C(=O)NCCN(CC)CC ZINC000004213533 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccccc2OCC)[C@@H]1C(=O)NCCCOC ZINC000004213995 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccccc2OCC)[C@@H]1C(=O)NCCCOC ZINC000004213997 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccccc2OCC)[C@H]1C(=O)NCCCOC ZINC000004213998 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccccc2OCC)[C@H]1C(=O)NCCCOC ZINC000004213999 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2cccc(OCC)c2)[C@@H]1C(=O)NCCCOC ZINC000004214604 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2cccc(OCC)c2)[C@@H]1C(=O)NCCCOC ZINC000004214605 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2cccc(OCC)c2)[C@H]1C(=O)NCCCOC ZINC000004214606 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2cccc(OCC)c2)[C@H]1C(=O)NCCCOC ZINC000004214608 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccsc2)[C@@H]1C(=O)N[C@@H]1CCCC[C@@H]1O ZINC000004214642 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccsc2)[C@@H]1C(=O)N[C@@H]1CCCC[C@@H]1O ZINC000004214643 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccsc2)[C@H]1C(=O)N[C@@H]1CCCC[C@@H]1O ZINC000004214646 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccsc2)[C@H]1C(=O)N[C@@H]1CCCC[C@@H]1O ZINC000004214648 GI Annotated Anodyne CC(=O)O[C@]1(C(C)=O)CC[C@H]2[C@@H]3C=C(Cl)C4=CC(=O)CC[C@@H]4[C@H]3CC[C@@]21C ZINC000004214785 GI Annotated Anodyne in-man CCCCCCC1=NOC[C@@]1(C)C(=O)NCc1ccccc1Br ZINC000004214795 GI Annotated Anodyne CCCCCCC1=NOC[C@]1(C)C(=O)NCc1ccccc1Br ZINC000004214797 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccsc2)[C@@H]1C(=O)N[C@@H](CO)[C@@H](C)CC ZINC000004215779 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccsc2)[C@@H]1C(=O)N[C@@H](CO)[C@@H](C)CC ZINC000004215780 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccsc2)[C@H]1C(=O)N[C@@H](CO)[C@@H](C)CC ZINC000004215781 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccsc2)[C@H]1C(=O)N[C@@H](CO)[C@@H](C)CC ZINC000004215782 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccoc2)[C@@H]1C(=O)N[C@H](CO)Cc1ccccc1 ZINC000004215878 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccoc2)[C@@H]1C(=O)N[C@H](CO)Cc1ccccc1 ZINC000004215881 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccoc2)[C@H]1C(=O)N[C@H](CO)Cc1ccccc1 ZINC000004215885 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccoc2)[C@H]1C(=O)N[C@H](CO)Cc1ccccc1 ZINC000004215891 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccc(F)cc2Cl)[C@@H]1C(=O)N1CCOCC1 ZINC000004216486 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccc(F)cc2Cl)[C@@H]1C(=O)N1CCOCC1 ZINC000004216487 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccc(F)cc2Cl)[C@H]1C(=O)N1CCOCC1 ZINC000004216491 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccc(F)cc2Cl)[C@H]1C(=O)N1CCOCC1 ZINC000004216492 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccc(Cl)cc2F)[C@@H]1C(=O)N1CCOCC1 ZINC000004216529 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccc(Cl)cc2F)[C@@H]1C(=O)N1CCOCC1 ZINC000004216530 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccc(Cl)cc2F)[C@H]1C(=O)N1CCOCC1 ZINC000004216531 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccc(Cl)cc2F)[C@H]1C(=O)N1CCOCC1 ZINC000004216534 GI Annotated Anodyne c1cnc2ccc([C@@H](c3nnnn3C3CCCCC3)N3CCCCC3)cc2c1 ZINC000004230590 GI Annotated Anodyne c1cnc2ccc([C@H](c3nnnn3C3CCCCC3)N3CCCCC3)cc2c1 ZINC000004230591 GI Annotated Anodyne CCC(C)(C)n1nnnc1[C@@H](c1ccc2ncccc2c1)N1CCC[C@H](C)C1 ZINC000004230630 GI Annotated Anodyne CCC(C)(C)n1nnnc1[C@H](c1ccc2ncccc2c1)N1CCC[C@H](C)C1 ZINC000004230631 GI Annotated Anodyne O=c1c(-c2cccc(Cl)c2)nc2cncnc2n1Cc1ccccc1Cl ZINC000004238204 GI Annotated Anodyne O=c1c(-c2ccc(Cl)cc2)nc2cncnc2n1Cc1ccccc1Cl ZINC000004238442 GI Annotated Anodyne O=c1c(-c2cc(F)cc(F)c2)nc2cnc(Oc3ccccc3)nc2n1C1CC1 ZINC000004238481 GI Annotated Anodyne Cc1nc2cnc(Oc3cccc(Cl)c3)nc2n(Cc2ccc(F)cc2)c1=O ZINC000004238623 GI Annotated Anodyne O=c1c(CCc2ccccc2)nc2cnc(Oc3ccccc3)nc2n1C1CC1 ZINC000004238681 GI Annotated Anodyne aggregator Cn1c(=O)c(-c2ccc(Cl)cc2)nc2cnc(Oc3cccc(Cl)c3)nc21 ZINC000004238984 GI Annotated Anodyne CN(C)C(=O)c1ccc(-c2nc(N(C)Cc3ccco3)c3ccccc3n2)cc1 ZINC000004268393 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccoc2)[C@@H]1C(=O)NC[C@H](O)c1ccccc1 ZINC000004295395 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccoc2)[C@@H]1C(=O)NC[C@H](O)c1ccccc1 ZINC000004295397 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccoc2)[C@H]1C(=O)NC[C@H](O)c1ccccc1 ZINC000004295402 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2ccoc2)[C@H]1C(=O)NC[C@H](O)c1ccccc1 ZINC000004295405 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]1C(=O)N(C)C ZINC000004295650 GI Annotated Bother CCCCCCC1=NO[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]1C(=O)N(C)C ZINC000004295652 GI Annotated Bother CCCCCCC1=NO[C@H](c2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1C(=O)N(C)C ZINC000004295657 GI Annotated Bother CCCCCCC1=NO[C@@H](c2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1C(=O)N(C)C ZINC000004295658 GI Annotated Bother CN(C)C(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1c(F)cccc1Cl ZINC000004296618 GI Annotated Anodyne CN(C)C(=O)[C@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1c(F)cccc1Cl ZINC000004296619 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@H](c2c(F)cccc2Cl)[C@@H]1C(=O)N(C)C ZINC000004296886 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@@H](c2c(F)cccc2Cl)[C@@H]1C(=O)N(C)C ZINC000004296887 GI Annotated Anodyne CN(C)C(=O)[C@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1c(F)cccc1Cl ZINC000004310408 GI Annotated Anodyne CN(C)C(=O)[C@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1c(F)cccc1Cl ZINC000004310409 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2c(F)cccc2Cl)[C@@H]1C(=O)NC[C@H](O)CC ZINC000004310526 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2c(F)cccc2Cl)[C@@H]1C(=O)NC[C@H](O)CC ZINC000004310527 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2c(F)cccc2Cl)[C@H]1C(=O)NC[C@H](O)CC ZINC000004310528 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2c(F)cccc2Cl)[C@H]1C(=O)NC[C@H](O)CC ZINC000004310529 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2c(F)cccc2Cl)[C@@H]1C(=O)N1CCOCC1 ZINC000004310694 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2c(F)cccc2Cl)[C@@H]1C(=O)N1CCOCC1 ZINC000004310695 GI Annotated Anodyne CCCCCCC1=NO[C@H](c2c(F)cccc2Cl)[C@H]1C(=O)N1CCOCC1 ZINC000004310696 GI Annotated Anodyne CCCCCCC1=NO[C@@H](c2c(F)cccc2Cl)[C@H]1C(=O)N1CCOCC1 ZINC000004310697 GI Annotated Anodyne CCOc1ccc(C(=O)c2cnc3ccccc3c2N2CCN(CC)CC2)cc1 ZINC000004313813 GI Annotated Anodyne COC(=O)[C@H]1C(=O)C2=C(C[C@H]1C)Nc1ccccc1N[C@H]2c1cccc(F)c1 ZINC000004406216 GI Annotated Mild COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@H]2c1cccc(F)c1 ZINC000004406219 GI Annotated Mild COC(=O)[C@H]1C(=O)C2=C(C[C@H]1C)Nc1ccccc1N[C@@H]2c1cccc(F)c1 ZINC000004406220 GI Annotated Mild COC(=O)[C@H]1C(=O)C2=C(C[C@@H]1C)Nc1ccccc1N[C@@H]2c1cccc(F)c1 ZINC000004406221 GI Annotated Mild CC(=O)c1ccc(N(CC(=O)NC2CCCCC2)C(=O)c2ccc(C)s2)cc1 ZINC000040011565 GI Annotated Anodyne Cn1cc(-c2ccc3c(c2)N(c2nc4c(s2)C(=O)CC(C)(C)C4)CCO3)cn1 ZINC000040379053 GI Annotated Anodyne CN(Cc1ccccc1)C(=S)N1CCC(c2cccc(Br)c2)=N1 ZINC000040379172 GI Annotated Anodyne Cc1cccc(CN2CCN(c3cc(N(C)c4cccc(C)c4)ncn3)CC2)c1 ZINC000040379281 GI Annotated Anodyne CC[C@H](O)c1cc(=O)oc2c(C(=O)CC(C)C)c(O)c3c(c12)OC(C)(C)C=C3 ZINC000040379452 GI Annotated Anodyne CNc1ccc(-c2nc(-c3ccc(I)cc3)no2)cc1 ZINC000040379549 GI Annotated Anodyne Cc1cc(C)c(-c2csc(N(CC(=O)O)C(=O)c3ccccc3)n2)c(C)c1 ZINC000040379583 GI Annotated Anodyne Cc1cnc(N2C(=N)S/C(=C\c3c[nH]nc3-c3ccc(F)cc3)C2=O)s1 ZINC000040379724 GI Annotated Anodyne CCCOC(=O)C1=CN(C(=O)c2ccc(F)cc2)CCc2c1[nH]c1ccccc21 ZINC000040379787 GI Annotated Anodyne COc1cc2ccc3c4cc(OC)c(OC)cc4c(OC)[n+](C)c3c2cc1OC ZINC000040379966 GI Annotated Bother CCCCCCN1C(=O)/C(=N\NC(=O)c2ccccc2)c2cccc(Cl)c21 ZINC000040379972 GI Annotated Reactive O=C(N/N=C1\C(=O)N(CCC2CCCCC2)c2ccccc21)c1ccccc1 ZINC000040380321 GI Annotated Reactive Fc1ccc(Sc2ncnc3ncn([C@@H]4COc5ccccc5CO4)c23)cc1 ZINC000040392266 GI Annotated Anodyne Fc1ccc(Sc2ncnc3ncn([C@H]4COc5ccccc5CO4)c23)cc1 ZINC000040392269 GI Annotated Anodyne CC[C@@]1(Cc2ccccc2)OS(=O)(=O)C=C1OCc1cccc(Cl)c1 ZINC000040392689 GI Annotated Mild CC[C@]1(Cc2ccccc2)OS(=O)(=O)C=C1OCc1cccc(Cl)c1 ZINC000040392690 GI Annotated Mild O=S(=O)(Nc1ccc2c(c1)ncn2Cc1ccccc1)c1ccccc1F ZINC000040392807 GI Annotated Anodyne O[C@@]1(c2ccc(-c3ccc(Br)s3)cc2)CN2CCCC[C@@H]2CO1 ZINC000040393071 GI Annotated Anodyne in-vitro O[C@]1(c2ccc(-c3ccc(Br)s3)cc2)CN2CCCC[C@@H]2CO1 ZINC000040393072 GI Annotated Anodyne in-vitro CCOC(=O)CSc1nc(Cl)cc(Oc2ccc3ncccc3c2)n1 ZINC000040393252 GI Annotated Anodyne c1ccc(Sc2ncnc3c2ncn3[C@@H]2COc3ccccc3CO2)cc1 ZINC000040393348 GI Annotated Anodyne c1ccc(Sc2ncnc3c2ncn3[C@H]2COc3ccccc3CO2)cc1 ZINC000040393349 GI Annotated Anodyne Nn1c(S)nnc1-c1cc2c([nH]c3ccccc32)c(-c2ccccc2Cl)n1 ZINC000040393441 GI Annotated Anodyne N=C(NO)c1ccc(-n2c3c(c4ccccc42)C(=O)CCC3)c(Br)c1 ZINC000040394417 GI Annotated Anodyne CC1(C)CC(=O)c2sc(N3CCOc4ccc(-c5cn[nH]c5)cc43)nc2C1 ZINC000040395153 GI Annotated Anodyne Cc1ccccc1C1CCN(C[C@@H]2CCc3cccnc3C3(C2)OCCO3)CC1 ZINC000040395636 GI Annotated Anodyne O=S(=O)(Cc1nnc(-c2ccccc2Cl)s1)c1ccc(Cl)cc1 ZINC000040403079 GI Annotated Anodyne O=C1OCC2=C1[C@H](c1cc(Cl)cc(Cl)c1)c1cc3c(cc1O2)OCO3 ZINC000040404752 GI Annotated Anodyne O=C1OCC2=C1[C@@H](c1cc(Cl)cc(Cl)c1)c1cc3c(cc1O2)OCO3 ZINC000040404755 GI Annotated Anodyne CCC[N+]12CCc3cc4c(cc3[C@@H]1Cc1cc(OC)c(OC)cc1C2)OCO4 ZINC000040404810 GI Annotated Bother CCC[N+]12CCc3cc4c(cc3[C@H]1Cc1cc(OC)c(OC)cc1C2)OCO4 ZINC000040404813 GI Annotated Bother CCCCSc1nc(N)c2ncn(Cc3c(F)ccc(Cl)c3F)c2n1 ZINC000040405309 GI Annotated Anodyne Cc1ccc(NC(=S)OCCN2C(=O)c3ccc(C(C)(C)C)cc3C2=O)cc1 ZINC000040405672 GI Annotated Anodyne [N-]=[N+]=NCC1=NO[C@H](c2ccc(N3CCN(Cc4ccccc4)CC3)cc2)C1 ZINC000040406618 GI Annotated Clean [N-]=[N+]=NCC1=NO[C@@H](c2ccc(N3CCN(Cc4ccccc4)CC3)cc2)C1 ZINC000040406621 GI Annotated Clean CCN(CC)CC(=O)N[C@@H]1C[C@H](c2ccccc2)Oc2c(C)c(C)c(O)c(C)c21 ZINC000040407389 GI Annotated Anodyne CCN(CC)CC(=O)N[C@H]1C[C@H](c2ccccc2)Oc2c(C)c(C)c(O)c(C)c21 ZINC000040407393 GI Annotated Anodyne CCN(CC)CC(=O)N[C@@H]1C[C@@H](c2ccccc2)Oc2c(C)c(C)c(O)c(C)c21 ZINC000040407397 GI Annotated Anodyne CCN(CC)CC(=O)N[C@H]1C[C@@H](c2ccccc2)Oc2c(C)c(C)c(O)c(C)c21 ZINC000040407400 GI Annotated Anodyne CCCCC[C@H](CC(C)C)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)s1 ZINC000040408017 GI Annotated Anodyne CCC(CC)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 ZINC000040409976 GI Annotated Anodyne CCC[C@@H](C)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 ZINC000040410028 GI Annotated Anodyne CCC[C@H](C)Nc1nc(C)nc2c(-c3c(C)cc(OC)cc3OC)c(C)nn12 ZINC000040410032 GI Annotated Anodyne COc1ccc2c(c1OC)OC1=C(C(=O)OC1)[C@@H]2c1cc(Cl)cc(Cl)c1 ZINC000040410079 GI Annotated Anodyne COc1ccc2c(c1OC)OC1=C(C(=O)OC1)[C@H]2c1cc(Cl)cc(Cl)c1 ZINC000040410083 GI Annotated Anodyne Cc1cc(=O)c(OCc2ccccc2)c(C(=O)Nc2cnc3ccccc3c2)o1 ZINC000040410765 GI Annotated Anodyne CC(C)c1ccc(C(=O)c2cnc(OCC3CCN(C(C)C)CC3)n2C)cc1 ZINC000040410879 GI Annotated Anodyne COc1cc(C#N)cc(Oc2c(Cl)ccc(Cc3cc(C)c(=O)[nH]n3)c2F)c1 ZINC000040411159 GI Annotated Mild CS(=O)(=O)c1nnc(-c2ccc(OCc3cccc(Cl)c3)c(Cl)c2)o1 ZINC000040411319 GI Annotated Anodyne O=C1C=CC(=O)[C@H]2[C@@H]1CC=C[C@H]2[C@H]1C(=O)N(C2CCCCC2)[C@H]1c1ccccc1 ZINC000040411862 GI Annotated Mild Cc1cccc(CN(C[C@H]2CCCN2)C(=O)[C@@H](C)Oc2ccccc2Cl)c1 ZINC000040412467 GI Annotated Anodyne Cc1cccc(CN(C[C@H]2CCCN2)C(=O)[C@H](C)Oc2ccccc2Cl)c1 ZINC000040412470 GI Annotated Anodyne C=C1C(=O)O[C@]2(C)CC[C@@H]1C[C@@H](O)/C(C)=C/C/C=C(\C)CC[C@@H]2OC(C)=O ZINC000040413419 GI Annotated Mild COc1ccc([C@@H]2CC3(N(C)C)CCNC2[C@H](c2ccc(OC)cc2)C3)cc1 ZINC000040413442 GI Annotated Anodyne COc1ccc([C@@H]2CC3(N(C)C)CCNC2[C@@H](c2ccc(OC)cc2)C3)cc1 ZINC000040413445 GI Annotated Anodyne COc1ccc([C@H]2CC3(N(C)C)CCNC2[C@@H](c2ccc(OC)cc2)C3)cc1 ZINC000040413448 GI Annotated Anodyne Cc1ccccc1CN(C[C@H]1CCCN1)C(=O)[C@@H](C)Oc1ccccc1Cl ZINC000040413875 GI Annotated Anodyne Cc1ccccc1CN(C[C@H]1CCCN1)C(=O)[C@H](C)Oc1ccccc1Cl ZINC000040413877 GI Annotated Anodyne C/C1=C/CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)[C@@H](CNCc3ccc4occc4c3)[C@@H]2CC1 ZINC000040414222 GI Annotated Anodyne Cc1cccc2c1CC[C@@]21CCc2c(C(=O)N(C)C)cn3c(C)c(C)nc3c2O1 ZINC000040420210 GI Annotated Anodyne Cc1cccc2c1CC[C@]21CCc2c(C(=O)N(C)C)cn3c(C)c(C)nc3c2O1 ZINC000040420212 GI Annotated Anodyne O=C1CS[C@H](c2c(Cl)cccc2Cl)N1[C@@H]1CC[C@@H]1Br ZINC000040420244 GI Annotated Reactive O=C1CS[C@@H](c2c(Cl)cccc2Cl)N1[C@@H]1CC[C@@H]1Br ZINC000040420246 GI Annotated Reactive O=C1CS[C@H](c2c(Cl)cccc2Cl)N1[C@H]1CC[C@@H]1Br ZINC000040420247 GI Annotated Reactive O=C1CS[C@@H](c2c(Cl)cccc2Cl)N1[C@H]1CC[C@@H]1Br ZINC000040420249 GI Annotated Reactive CC(C)NC(=N)c1ccc(-c2cc3cc(C(=N)NC(C)C)cc(O)c3o2)cc1 ZINC000040420404 GI Annotated Anodyne C=CC[C@@]1(O)C[C@]2(C)[C@@H](OC(C)=O)CC[C@H]2C2=C1c1ccc(OC)cc1CC2 ZINC000040421298 GI Annotated Mild C=CC[C@]1(O)C[C@]2(C)[C@@H](OC(C)=O)CC[C@H]2C2=C1c1ccc(OC)cc1CC2 ZINC000040421300 GI Annotated Mild O=C1OCC2=C1[C@H](c1cccc(Cl)c1Cl)c1cc3c(cc1N2)OCO3 ZINC000040421506 GI Annotated Anodyne O=C1OCC2=C1[C@@H](c1cccc(Cl)c1Cl)c1cc3c(cc1N2)OCO3 ZINC000040421508 GI Annotated Anodyne C=CCc1c(C)nc(N2C(=O)CS[C@H]2c2c(F)cccc2Cl)nc1C ZINC000040421534 GI Annotated Mild C=CCc1c(C)nc(N2C(=O)CS[C@@H]2c2c(F)cccc2Cl)nc1C ZINC000040421536 GI Annotated Mild COc1ccccc1-n1cc(Cn2c(-c3cccc(F)c3)nc3ccccc32)nn1 ZINC000040422832 GI Annotated Anodyne CC[C@H](O)c1cc(=O)oc2c(CC=C(C)C)c(O)c(C(=O)CC(C)C)c(O)c12 ZINC000040423397 GI Annotated Anodyne CC[C@@H]1C=CC(=O)O[C@@H]1[C@H](C)CC[C@@H](O)C[C@H](O)/C=C/C=C/c1ccccc1 ZINC000040423629 GI Annotated Anodyne Cc1c(OS(=O)(=O)c2ccc3ccccc3c2)cccc1C1CCNCC1 ZINC000040428712 GI Annotated Anodyne C=C(Br)C(=O)Nc1ccc(C(=O)/C=C/c2ccc(N(C)C)cc2)cc1 ZINC000040429012 GI Annotated Mild CCCCN(CC(=O)N1c2ccccc2-n2cccc2[C@@H]1C)C(=O)[C@@H](C)Cl ZINC000040430135 GI Annotated Reactive CCCCN(CC(=O)N1c2ccccc2-n2cccc2[C@H]1C)C(=O)[C@@H](C)Cl ZINC000040430137 GI Annotated Reactive CCCCN(CC(=O)N1c2ccccc2-n2cccc2[C@@H]1C)C(=O)[C@H](C)Cl ZINC000040430139 GI Annotated Reactive CCCCN(CC(=O)N1c2ccccc2-n2cccc2[C@H]1C)C(=O)[C@H](C)Cl ZINC000040430141 GI Annotated Reactive CCOC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@@]4(C)C[C@]3(CC[C@@H]21)[C@H](CO)C4=O ZINC000040430461 GI Annotated Anodyne COC(=O)c1cccc(C2=NCC(c3ccc(F)cc3)(c3ccc(F)cc3)N2)c1 ZINC000040431116 GI Annotated Anodyne CCO/C(O)=C1\C(CSc2ccncc2)=NC(C)=C(C#N)[C@H]1c1ccccn1 ZINC000040442351 GI Annotated Reactive CCO/C(O)=C1\C(CSc2ccncc2)=NC(C)=C(C#N)[C@@H]1c1ccccn1 ZINC000040442353 GI Annotated Reactive CC(C)N(CC[C@](CCN(C)C)(C(N)=O)c1ccc(C(C)(C)C)cc1)C(C)C ZINC000040465213 GI Annotated Anodyne CC(C)N(CC[C@@](CCN(C)C)(C(N)=O)c1ccc(C(C)(C)C)cc1)C(C)C ZINC000040465214 GI Annotated Anodyne CCCCC[C@](C)(O)/C=C/[C@H]1[C@H](O)C[C@@H]2OC(=O)C(F)(F)CC/C=C\C[C@@H]21 ZINC000040465278 GI Annotated Anodyne CCCCC[C@](C)(O)/C=C/[C@@H]1[C@H](O)C[C@@H]2OC(=O)C(F)(F)CC/C=C\C[C@@H]21 ZINC000040465280 GI Annotated Anodyne CCOCCOC(=O)[C@@H](C)c1ccc2c(c1)SC[C@@H]1CCCC[C@@H]1C2=O ZINC000040499088 GI Annotated Anodyne CCOCCOC(=O)[C@H](C)c1ccc2c(c1)SC[C@@H]1CCCC[C@@H]1C2=O ZINC000040499089 GI Annotated Anodyne COc1ccc(-c2nc3n(c2-c2ccc(OC)c(OC)c2)CCS3)cc1OC ZINC000040503991 GI Annotated Anodyne Cc1c2cc[n+](C)cc2c(C)c2c1[nH]c1ccc(O)c(/N=C(/C(=O)O)C(C)C)c12 ZINC000040504561 GI Annotated Mild COc1cc2cc([C@H]3CC[N+](C)(Cc4ccccc4)C[C@H]3O)sc2cc1OC ZINC000040538140 GI Annotated Bother COc1cc2cc([C@@H]3CC[N+](C)(Cc4ccccc4)C[C@H]3O)sc2cc1OC ZINC000040538142 GI Annotated Bother C=C1CC[C@@H]2[C@](C)(CO)[C@H](O)CC[C@@]2(C)[C@@H]1/C=C/C1=C/C(=C/CCC)OC1=O ZINC000040563897 GI Annotated Mild CCn1c(Nc2ccccc2O)nc2cnc(Oc3c(F)cccc3F)nc21 ZINC000040565980 GI Annotated Anodyne CN(C(=O)Nc1c(Cl)cccc1Cl)c1cc(NC2CCOCC2)ncn1 ZINC000040566747 GI Annotated Anodyne COC(=O)CCC/C=C(/c1cccc(C#N)c1)c1cc(C)c2on(C)c(=O)c2c1 ZINC000040567010 GI Annotated Mild CO/N=C1/C(c2c(O)n(C)c3c(Br)cccc23)=Nc2ccccc21 ZINC000040567190 GI Annotated Mild CCn1c(C(=O)c2ccccc2F)nc2cnc(Oc3c(F)cccc3F)nc21 ZINC000040567272 GI Annotated Anodyne COc1ccc2c(c1)Oc1cc(OC(C)=O)ccc1[C@@]21OC(=O)c2ccccc21 ZINC000040567282 GI Annotated Anodyne COc1ccc2c(c1)Oc1cc(OC(C)=O)ccc1[C@]21OC(=O)c2ccccc21 ZINC000040567283 GI Annotated Anodyne CCn1c(Nc2ccccc2N)nc2cnc(Oc3c(F)cccc3F)nc21 ZINC000040567625 GI Annotated Anodyne CCC[C@H]1OC(O)=C2C1=NC1=C(C(=O)COC1)[C@H]2c1ccc(Cl)c(Cl)c1 ZINC000040568149 GI Annotated Mild CC[C@H]1OCC(O)=C2C1=NC1=C(C(=O)COC1)[C@H]2c1ccc(Cl)c(Cl)c1 ZINC000040575329 GI Annotated Mild O=C(NO)c1ccc(-c2ccc(CNCCc3cccc4occc34)cn2)s1 ZINC000040575809 GI Annotated Anodyne CCc1c2c(n(C)c1CC)CCC/C2=N\N(C)C(=O)Nc1ccc(OC)cc1 ZINC000040576181 GI Annotated Reactive COc1ccc([C@H]2CC3(N(C)C)CC(=O)C2[C@H](c2ccc(OC)cc2)C3)cc1 ZINC000040576572 GI Annotated Anodyne COc1ccc([C@H]2CC3(N(C)C)CC(=O)C2[C@@H](c2ccc(OC)cc2)C3)cc1 ZINC000040576574 GI Annotated Anodyne CC(=O)C1=NN(c2ccccc2)/C(=C(\C#N)C(=O)c2c[nH]c3ccccc23)S1 ZINC000040602301 GI Annotated Reactive Cc1ccccc1/C=C1\CN(C)CC2=C1OC(N)=C(C#N)[C@@H]2c1ccccc1C ZINC000040605950 GI Annotated Reactive Cc1ccccc1/C=C1\CN(C)CC2=C1OC(N)=C(C#N)[C@H]2c1ccccc1C ZINC000040605951 GI Annotated Reactive CCN(CC)CCOc1ccccc1/C=C(\C#N)c1noc2ccc(O)cc12 ZINC000040639632 GI Annotated Reactive CCN(CC)[P@](N)(=O)O[C@H](C[C@@H]1NC(C)(C)C[C@H](C)O1)c1ccccc1 ZINC000040690415 GI Annotated Anodyne CC1(C)CC[C@@H]2Nc3ccnn3[C@@H](c3ccc(F)c(Br)c3)[C@H]2C1=O ZINC000040723436 GI Annotated Anodyne Cc1ccc([C@@H]2C[C@H]3C(=O)c4ccccc4NC(=O)[C@@H]3[C@@]2(O)c2ccccc2)cc1 ZINC000040763368 GI Annotated Anodyne O=C1Nc2ccccc2C(=O)[C@@H]2C[C@@H](c3ccccc3)[C@](O)(c3ccccc3)[C@@H]12 ZINC000040764129 GI Annotated Anodyne COc1cc(OCc2ccncc2)c(/C(N)=N\c2ccccc2Cl)cc1OC ZINC000040764185 GI Annotated Mild CC(=O)O[C@@H]1Cc2c(c3ccccc3c3nc4c(nc23)CCCC4)OC1(C)C ZINC000040764335 GI Annotated Bother CC(=O)O[C@H]1Cc2c(c3ccccc3c3nc4c(nc23)CCCC4)OC1(C)C ZINC000040764336 GI Annotated Bother CC(/C=C/C(=O)Nc1ccccc1N)=C\[C@]1(C)Cc2cc(N(C)C)ccc2C1=O ZINC000040766792 GI Annotated Anodyne CC(/C=C/C(=O)Nc1ccccc1N)=C\[C@@]1(C)Cc2cc(N(C)C)ccc2C1=O ZINC000040766795 GI Annotated Anodyne CCO/C(O)=C1\C(C[S@@](=O)c2ccccc2)=NC(C)=C(C#N)[C@H]1c1ccco1 ZINC000040810744 GI Annotated Reactive CCO/C(O)=C1\C(C[S@@](=O)c2ccccc2)=NC(C)=C(C#N)[C@@H]1c1ccco1 ZINC000040810745 GI Annotated Reactive CCO/C(O)=C1\C(C[S@](=O)c2ccccc2)=NC(C)=C(C#N)[C@H]1c1ccco1 ZINC000040810746 GI Annotated Reactive CCO/C(O)=C1\C(C[S@](=O)c2ccccc2)=NC(C)=C(C#N)[C@@H]1c1ccco1 ZINC000040810747 GI Annotated Reactive COc1ccc([C@H]2CC3(N(C)C)C[C@@H](O)C2[C@H](c2ccc(OC)cc2)C3)cc1 ZINC000040812438 GI Annotated Anodyne COc1ccc([C@H]2CC3(N(C)C)C[C@H](c4ccc(OC)cc4)C2[C@H](O)C3)cc1 ZINC000040812440 GI Annotated Anodyne O=C1CCCCC[C@H]1S(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000040834210 GI Annotated Anodyne O=C1CCCCC[C@@H]1S(=O)(=O)c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000040834212 GI Annotated Anodyne COc1cccc(OC)c1OC(=O)C=C1c2ccccc2C(=O)c2ccccc21 ZINC000040845213 GI Annotated Anodyne CC(C)(C(=O)Nc1ccc(Cl)cc1C#N)S(=O)(=O)c1ccc(Cl)cc1 ZINC000040845236 GI Annotated Mild Oc1c(-c2nnc(Cc3ccc(F)cc3)o2)nc(-c2ccc[nH]2)c2cccnc12 ZINC000040845969 GI Annotated Anodyne O=C(c1ccc([N+](=O)[O-])cc1)n1c(-c2ccccc2[N+](=O)[O-])nc2ccccc21 ZINC000040847051 GI Annotated Bother COc1cc(-c2nc(-c3nnc(S)o3)cc3c2[nH]c2ccccc23)ccc1O ZINC000040847079 GI Annotated Anodyne Cc1cc(C#N)ccc1N1CCc2c(-n3ccc(-c4ccccn4)n3)ccnc21 ZINC000040847164 GI Annotated Mild CN(C(=S)N1CCC(c2cccc(Br)c2)=N1)C1CCCCC1 ZINC000040847168 GI Annotated Anodyne Cc1ccc(-n2ncc3c(N4CCC[C@H](C(F)(F)F)C4)ncnc32)c(C)c1 ZINC000040847705 GI Annotated Anodyne Cc1ccc(-n2ncc3c(N4CCC[C@@H](C(F)(F)F)C4)ncnc32)c(C)c1 ZINC000040847707 GI Annotated Anodyne COc1cc2cc(CN(C)C)c3c4cc5c(cc4ncc3c2cc1OC)OCO5 ZINC000040848218 GI Annotated Bother O=C1C(Nc2cccc(Cl)c2)=C(Cl)C(=O)c2[nH]c(-c3ccccn3)nc21 ZINC000040848679 GI Annotated Mild CCN(CC)CCCc1ccc(O[C@@H]2Cc3cc(OC)c(OC)cc3C2=O)cc1 ZINC000040849207 GI Annotated Anodyne CCN(CC)CCCc1ccc(O[C@H]2Cc3cc(OC)c(OC)cc3C2=O)cc1 ZINC000040849209 GI Annotated Anodyne CCOc1nc(S(=O)(=O)c2ccccc2)cc(O)c1Oc1cc(C)cc(C)c1 ZINC000040860165 GI Annotated Anodyne CCOC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@@]4(C)C[C@]3(CC[C@@H]21)[C@@H]1CON[C@@H]14 ZINC000040860233 GI Annotated Anodyne CC(C)NC(=N)c1ccc(O)c(-c2cc3ccc(C(=N)NC(C)C)cc3o2)c1 ZINC000040860360 GI Annotated Anodyne CC[C@@]1(Cc2ccccc2)OS(=O)(=O)C=C1OCc1ccccc1Cl ZINC000040861077 GI Annotated Mild CC[C@]1(Cc2ccccc2)OS(=O)(=O)C=C1OCc1ccccc1Cl ZINC000040861079 GI Annotated Mild Fc1ccc(Sc2ncnc3c2ncn3[C@@H]2COc3ccccc3CO2)cc1 ZINC000040861247 GI Annotated Anodyne Fc1ccc(Sc2ncnc3c2ncn3[C@H]2COc3ccccc3CO2)cc1 ZINC000040861249 GI Annotated Anodyne C=CCOC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@@]4(C)C[C@]3(CC[C@@H]21)[C@H](CO)[C@H]4O ZINC000040862450 GI Annotated Mild Cc1cc(-n2ccc(-c3nccs3)n2)c2cnn(-c3ccc(C#N)cc3C)c2n1 ZINC000040862572 GI Annotated Mild Cc1nc(/C=C/[C@@H]2C/C=C\CCC[C@H](C)C(=O)[C@H](C)[C@@H](O)CC(=O)O2)cs1 ZINC000040862720 GI Annotated Anodyne Cc1nc(/C=C/[C@@H]2C/C=C\CCC[C@@H](C)C(=O)[C@H](C)[C@@H](O)CC(=O)O2)cs1 ZINC000040862722 GI Annotated Anodyne Cc1nc(/C=C/[C@@H]2C/C=C\CCC[C@H](C)C(=O)[C@@H](C)[C@@H](O)CC(=O)O2)cs1 ZINC000040862724 GI Annotated Anodyne Cc1nc(/C=C/[C@@H]2C/C=C\CCC[C@@H](C)C(=O)[C@@H](C)[C@@H](O)CC(=O)O2)cs1 ZINC000040862726 GI Annotated Anodyne Cc1c([C@H](C)[C@H](C)O)c(O)c2oc3cc(=O)c(C)c4c-3c(c2c1O)O[C@H](C)[C@H]4C ZINC000040862937 GI Annotated Bother COc1ccc(C[C@@H]2CCCCc3c2cc(OC)c(OC)c3OC)c(O)c1O ZINC000040863737 GI Annotated Clean COc1ccc(C[C@H]2CCCCc3c2cc(OC)c(OC)c3OC)c(O)c1O ZINC000040863739 GI Annotated Clean CCCOC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@@]4(C)C[C@]3(CC[C@@H]21)[C@H](CO)[C@H]4O ZINC000040864042 GI Annotated Anodyne CC(C)OC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@@]4(C)C[C@]3(CC[C@@H]21)[C@H](CO)[C@H]4O ZINC000040864346 GI Annotated Anodyne Cc1cc(C#N)ccc1N1CCc2c(-n3ccc(-c4nccs4)n3)ccnc21 ZINC000040864677 GI Annotated Mild Oc1c(-c2nnc(Cc3ccc(F)cc3)o2)nc(-c2ccncc2)c2cccnc12 ZINC000040866152 GI Annotated Anodyne CC(C)NC(=N)c1ccc(-c2cc3ccc(C(=N)NC(C)C)cc3o2)c(O)c1 ZINC000040866245 GI Annotated Anodyne c1ccc(Sc2ncnc3ncn([C@@H]4COc5ccccc5CO4)c23)cc1 ZINC000040866607 GI Annotated Anodyne c1ccc(Sc2ncnc3ncn([C@H]4COc5ccccc5CO4)c23)cc1 ZINC000040866609 GI Annotated Anodyne Cc1nc2c3c(c(C(=O)NC4CC4)cn2c1C)CC[C@]1(CCc2ccccc21)O3 ZINC000040866964 GI Annotated Anodyne Cc1nc2c3c(c(C(=O)NC4CC4)cn2c1C)CC[C@@]1(CCc2ccccc21)O3 ZINC000040866966 GI Annotated Anodyne O=C1c2ccccc2C(=O)C12Nc1ccc(Br)cc1[C@H]1OCCC[C@H]12 ZINC000040867024 GI Annotated Clean CC[C@@]1(Cc2ccccc2)OS(=O)(=O)C=C1OCc1ccc(Cl)cc1 ZINC000040867036 GI Annotated Mild CC[C@]1(Cc2ccccc2)OS(=O)(=O)C=C1OCc1ccc(Cl)cc1 ZINC000040867038 GI Annotated Mild CCC[N+]1(C)CCc2c(c(O)c(OC)c3c2ccc2cc(O)c(OC)cc23)C1 ZINC000040872467 GI Annotated Clean in-vivo CCC(CC)Nc1c(C(=O)N(CC)CC)c2nnc(C(C)C)n2c2ncccc12 ZINC000040872772 GI Annotated Anodyne COc1c2c(cc3c1-c1c(cc4c(c1OC)OCO4)[C@@H]1O[C@H]3[C@H](C)[C@@H]1C)OCO2 ZINC000040872975 GI Annotated Anodyne O=C(c1ccc2ccccc2c1)[C@@H]1NS(=O)(=O)c2ccc(Cl)cc2S1 ZINC000040873452 GI Annotated Anodyne O=C(c1ccc2ccccc2c1)[C@H]1NS(=O)(=O)c2ccc(Cl)cc2S1 ZINC000040873454 GI Annotated Anodyne C=C1CCCC(C)(C)[C@@H]2CC[C@@](C)([C@@H]3[C@@H]4OC(=O)C[C@H]3[C@H](OC(C)=O)O4)[C@H]12 ZINC000040873765 GI Annotated Mild CN1C[C@](O)(c2ccc(-c3nc4ccccc4s3)cc2)O[C@H]2CCCC[C@@H]21 ZINC000040873884 GI Annotated Anodyne CN1C[C@@](O)(c2ccc(-c3nc4ccccc4s3)cc2)O[C@H]2CCCC[C@@H]21 ZINC000040873886 GI Annotated Anodyne c1ccc(-c2cn(-c3ccc4ccccc4n3)nn2)c(NCc2ccncc2)c1 ZINC000040874061 GI Annotated Anodyne C=CCc1cc(OC)c(O[C@@H](C)C(=O)c2ccc(OC)c(OC)c2)c(OC)c1 ZINC000040874237 GI Annotated Mild C=CCc1cc(OC)c(O[C@H](C)C(=O)c2ccc(OC)c(OC)c2)c(OC)c1 ZINC000040874239 GI Annotated Mild O=C1C(=O)N(Cc2ccc(Br)cc2)c2c(Cl)ccc(Cl)c21 ZINC000040874668 GI Annotated Anodyne CC(C)CCc1nc(C2=NS(=O)(=O)c3ccccc32)c(O)c2ccccc12 ZINC000040875268 GI Annotated Anodyne COc1ccc(N[C@H]2N(OC)c3ccccc3[C@@]23CN=C(SC)S3)cc1 ZINC000040875340 GI Annotated Anodyne COc1ccc(N[C@@H]2N(OC)c3ccccc3[C@@]23CN=C(SC)S3)cc1 ZINC000040875342 GI Annotated Anodyne O=C(NCC1CCOCC1)c1cnc(Nc2cccc(F)c2)cc1C(F)(F)F ZINC000040877948 GI Annotated Anodyne COCOc1ccccc1-c1c(Br)c2ccc(C)cc2c(=O)n1C ZINC000040878101 GI Annotated Anodyne CN(C(=O)c1cccc2c1C(=O)c1ccccc1-2)c1ccccc1-n1cccn1 ZINC000040878530 GI Annotated Anodyne COc1ccc([C@@H](Cc2cc([N+](=O)[O-])ccc2OC)c2csc(N)n2)cc1 ZINC000040880709 GI Annotated Bother COc1ccc([C@H](Cc2cc([N+](=O)[O-])ccc2OC)c2csc(N)n2)cc1 ZINC000040880713 GI Annotated Bother Cn1c(Cc2ccc(C3CC3)c(Oc3cc(Cl)cc(C#N)c3)c2F)n[nH]c1=O ZINC000040880857 GI Annotated Mild CN(C)CCN1C(=O)c2cccc3c(SCc4ccccc4)ccc(c23)C1=O ZINC000040891509 GI Annotated Anodyne C=C1C(=O)O[C@]2(C)CC[C@@H]1C[C@H](O)/C(C)=C/C/C=C(\C)CC[C@@H]2OC(C)=O ZINC000040891984 GI Annotated Mild CCOC(=O)C1=C(c2ccc(C#N)cc2)NC(C)=C(C(=O)SCC)[C@H]1CC ZINC000040892026 GI Annotated Mild CCOC(=O)C1=C(c2ccc(C#N)cc2)NC(C)=C(C(=O)SCC)[C@@H]1CC ZINC000040892027 GI Annotated Mild C[C@H]1CC[C@@H]2[C@@H]1C1=C(OC2(C)C)[C@H]2OC(C)(C)[C@@H]3CC[C@H](C)[C@H]3[C@H]2C(=O)C1=O ZINC000040895054 GI Annotated Mild C[C@H]1CC[C@@H]2[C@@H]1C1=C(OC2(C)C)[C@H]2OC(C)(C)[C@@H]3CC[C@H](C)[C@H]3[C@@H]2C(=O)C1=O ZINC000040895056 GI Annotated Mild C[C@H]1CC[C@@H]2[C@@H]1C1=C(OC2(C)C)[C@@H]2OC(C)(C)[C@@H]3CC[C@H](C)[C@H]3[C@H]2C(=O)C1=O ZINC000040895059 GI Annotated Mild C[C@H]1CC[C@@H]2[C@@H]1C1=C(OC2(C)C)[C@@H]2OC(C)(C)[C@@H]3CC[C@H](C)[C@H]3[C@@H]2C(=O)C1=O ZINC000040895062 GI Annotated Mild COc1ccc(C(=O)/N=c2\scc(-c3c(C)cc(C)cc3C)n2C)c(OC)c1 ZINC000040896190 GI Annotated Anodyne CCOC(=O)c1cc(COc2cc(C(F)(F)F)nc3c(C)cccc23)on1 ZINC000040897758 GI Annotated Anodyne CCCCOc1c(C(=O)N(CC)CC)c2nnc(C(C)C)n2c2ncccc12 ZINC000040897960 GI Annotated Anodyne Cc1ccc2c(c1)C(=O)N([C@@H](C)COC(=S)Nc1ccc(Cl)cc1)C2=O ZINC000040898580 GI Annotated Anodyne Cc1ccc2c(c1)C(=O)N([C@H](C)COC(=S)Nc1ccc(Cl)cc1)C2=O ZINC000040898583 GI Annotated Anodyne CCOC(=O)c1cc(COc2cc(C(F)(F)F)nc3c(F)cccc23)on1 ZINC000040899098 GI Annotated Anodyne COc1ccc(/C=C2/C(=O)/C(=C/c3ccc(OC)cc3)[C@H]3CC[C@@H]2N3C)cc1 ZINC000040900185 GI Annotated Mild COc1cc2c(cc1OC)C(=O)/C(=C/c1cccc(CN3CCCCC3)c1)O2 ZINC000040900711 GI Annotated Mild O=c1oc2ccc(Br)cc2cc1CSc1nc2ncccc2[nH]1 ZINC000040900885 GI Annotated Anodyne CCCCCC[C@@H](C(C)C)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)s1 ZINC000040913347 GI Annotated Anodyne Cc1cc(Cl)nc(N2C(=O)CS[C@H]2CC23CC4CC(CC(C4)C2)C3)n1 ZINC000040914088 GI Annotated Anodyne Cc1cc(Cl)nc(N2C(=O)CS[C@@H]2CC23CC4CC(CC(C4)C2)C3)n1 ZINC000040914090 GI Annotated Anodyne CCc1cccc2c(C3=C(Br)C(=O)NC3=O)c(-c3ccccc3)[nH]c12 ZINC000040916509 GI Annotated Anodyne CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@H]1Nc1ccc(Br)cc1 ZINC000040916775 GI Annotated Mild CC1(C)OC2=C(C(=O)C(=O)c3ccccc32)[C@@H]1Nc1ccc(Br)cc1 ZINC000040916777 GI Annotated Mild Cc1csc(N2C(=N)S/C(=C\c3c[nH]nc3-c3ccc(F)cc3)C2=O)n1 ZINC000040916815 GI Annotated Anodyne Fc1cccc2c1CC[C@H](Cn1cncn1)/C2=N/OCc1cccc(Cl)c1 ZINC000040917191 GI Annotated Mild Fc1cccc2c1CC[C@@H](Cn1cncn1)/C2=N/OCc1cccc(Cl)c1 ZINC000040917193 GI Annotated Mild O=C(/C=C/c1ccc(SCCCCN2CCNCC2)cc1)c1ccccc1 ZINC000040917495 GI Annotated Mild Cc1cc(Cc2ccc(Cl)c(Oc3cc(F)cc(C#N)c3)c2F)n[nH]c1=O ZINC000040918641 GI Annotated Mild CCCCCC[C@@H](CCC)[C@@H](CO)NS(=O)(=O)c1ccc(Cl)s1 ZINC000040919114 GI Annotated Anodyne CCCCNc1nc2c(ncn2-c2ccccc2)c(=O)n1-c1ccc(Cl)cc1 ZINC000040919267 GI Annotated Anodyne CC(C)N(c1nc2c(ncn2-c2ccccc2)c(=O)n1-c1ccccc1)C(C)C ZINC000040919278 GI Annotated Anodyne C/C1=C/CC[C@@]2(C)O[C@H]2[C@H]2OC(=O)[C@@H](CN[C@H]3CCCc4ccccc43)[C@@H]2CC1 ZINC000040933455 GI Annotated Anodyne Cc1ccccc1CN(C[C@H]1CCCN1)C(=O)[C@@H](C)Oc1cccc(Cl)c1 ZINC000040933615 GI Annotated Anodyne Cc1ccccc1CN(C[C@H]1CCCN1)C(=O)[C@H](C)Oc1cccc(Cl)c1 ZINC000040933617 GI Annotated Anodyne O=[N+]([O-])c1cn2c(n1)SC[C@H](OCc1ccc(OCc3ccccc3)cc1)C2 ZINC000040934139 GI Annotated Bother O=[N+]([O-])c1cn2c(n1)SC[C@@H](OCc1ccc(OCc3ccccc3)cc1)C2 ZINC000040934140 GI Annotated Bother CC(C)N1C(=O)C(c2ccccc2)(c2ccccc2)[C@]12C(=O)N(C)c1ccccc12 ZINC000040935318 GI Annotated Anodyne CC(C)N1C(=O)C(c2ccccc2)(c2ccccc2)[C@@]12C(=O)N(C)c1ccccc12 ZINC000040935319 GI Annotated Anodyne C[S@@](=O)c1nnc(-c2ccc(OCc3cccc(Cl)c3)c(Cl)c2)o1 ZINC000040935563 GI Annotated Anodyne C[S@](=O)c1nnc(-c2ccc(OCc3cccc(Cl)c3)c(Cl)c2)o1 ZINC000040935565 GI Annotated Anodyne Cc1ncccc1Oc1ccc(NS(=O)(=O)c2coc3ccccc23)cn1 ZINC000040935743 GI Annotated Anodyne CSc1ccc(Sc2ccc(N(C)S(C)(=O)=O)cc2CN(C)C)cc1 ZINC000040935958 GI Annotated Anodyne CCCCCCSc1nnc(CSc2nc3nc(C)cc(C)n3n2)o1 ZINC000040936211 GI Annotated Anodyne CC(C)NC(=N)c1ccc(-c2cc3cc(C(=N)NC(C)C)cc(O)c3o2)c(O)c1 ZINC000040937095 GI Annotated Anodyne O=C1OCC2=C1[C@H](c1cc(Cl)cc(Cl)c1)c1cc3c(cc1N2)OCO3 ZINC000040937300 GI Annotated Anodyne O=C1OCC2=C1[C@@H](c1cc(Cl)cc(Cl)c1)c1cc3c(cc1N2)OCO3 ZINC000040937302 GI Annotated Anodyne CCn1ccc2cc(/C(=N/OC(C)=O)c3cc(OC)c(OC)c(OC)c3)ccc21 ZINC000040937546 GI Annotated Mild CC(C)NC(=N)c1ccc(-c2cc3cc(C(=N)NC(C)C)ccc3o2)c(O)c1 ZINC000040939423 GI Annotated Anodyne COC(=O)[C@@H]1C[C@@]2(CC=C(C)C)c3ccccc3N3C(=N)[C@H](C(C)(C)C)N1[C@H]32 ZINC000040939447 GI Annotated Anodyne O=C(CSc1snnc1-c1ccc(F)cc1F)Nc1ccccc1F ZINC000040939663 GI Annotated Anodyne CCCCn1c(=O)c2ccc([N+](=O)[O-])cc2c2cnc3cc4c(cc3c21)OCO4 ZINC000040939891 GI Annotated Bother CC(C)NC(=N)c1ccc(O)c(-c2cc3cc(C(=N)NC(C)C)ccc3o2)c1 ZINC000040940069 GI Annotated Anodyne COc1cc2cnc3c4cc(OC)c(OC(C)=O)cc4ccc3c2cc1OC ZINC000040940168 GI Annotated Bother CCCCN(CCC)c1nc(C)nc2c(-c3ccc(OC)nc3C)c(C)nn12 ZINC000040940182 GI Annotated Anodyne COc1cc(Cn2c3ccccc3c(=O)c3ccccc32)cc(OC)c1OC ZINC000040940327 GI Annotated Bother CCOc1ccc(C[C@@H]2CN3C(=NC[C@@H]3C)N2CC[C@@H]2C[C@H]3CC[C@@H]2C3)cc1 ZINC000040940633 GI Annotated Anodyne CCOc1ccc(C[C@@H]2CN3C(=NC[C@@H]3C)N2CC[C@H]2C[C@H]3CC[C@@H]2C3)cc1 ZINC000040940635 GI Annotated Anodyne CCn1ccc2cc(/C(=N\OC(C)=O)c3cc(OC)c(OC)c(OC)c3)ccc21 ZINC000040943361 GI Annotated Mild CCC(=O)S[C@@H](CC=C(C)C)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O ZINC000040943419 GI Annotated Mild CCC(=O)S[C@H](CC=C(C)C)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O ZINC000040943421 GI Annotated Mild CN1OC(C)(C)C2=C(C1=O)[C@H](c1cccc(Cl)c1)c1cc3c(cc1N2)OCO3 ZINC000040943423 GI Annotated Anodyne CN1OC(C)(C)C2=C(C1=O)[C@@H](c1cccc(Cl)c1)c1cc3c(cc1N2)OCO3 ZINC000040943425 GI Annotated Anodyne O=S1(=O)CCCC2=C1[C@H](c1cccc(Cl)c1)c1cc3c(cc1N2)OCO3 ZINC000040943427 GI Annotated Anodyne O=S1(=O)CCCC2=C1[C@@H](c1cccc(Cl)c1)c1cc3c(cc1N2)OCO3 ZINC000040943429 GI Annotated Anodyne Cc1cccc(CN(C[C@H]2CCCN2)C(=O)[C@@H](C)Oc2cccc(Cl)c2)c1 ZINC000040943685 GI Annotated Anodyne Cc1cccc(CN(C[C@H]2CCCN2)C(=O)[C@H](C)Oc2cccc(Cl)c2)c1 ZINC000040943687 GI Annotated Anodyne CC[C@@H]1NC(c2cc(C#N)ccn2)=NC1(c1ccc(F)cc1)c1ccc(F)cc1 ZINC000040949871 GI Annotated Mild C[C@@H]1NC(c2cc(Cl)ccn2)=N[C@@]1(c1ccc(F)cc1)c1ccc(F)nc1 ZINC000040950397 GI Annotated Anodyne O=C1O[C@H](O)C(c2cccc(-c3ccc4ccccc4c3)c2)=C1Br ZINC000040950421 GI Annotated Anodyne O=C1O[C@@H](O)C(c2cccc(-c3ccc4ccccc4c3)c2)=C1Br ZINC000040950423 GI Annotated Anodyne COc1cc(-c2nc(C=O)cc3c4ccccc4n(C)c23)cc(OC)c1OC ZINC000040950890 GI Annotated Anodyne C/C(=C/SCc1ccccc1)n1c(C(=O)c2ccc(Cl)cc2)noc1=O ZINC000040951465 GI Annotated Anodyne Cn1c(-c2cc(-c3c(F)cccc3Cl)no2)cnc1C1(F)CCNCC1 ZINC000040951805 GI Annotated Anodyne CNc1noc2c(-c3ccc4c(N5CCOC[C@@H]5C)nncc4c3)c(C)ccc12 ZINC000040952654 GI Annotated Anodyne Cc1cc(C)c(-n2cc[n+](CC(=O)c3ccc(Br)cc3)c2)c(C)c1 ZINC000040952977 GI Annotated Mild CCn1c(COc2ccc(NC(=S)Nc3ccccc3)cc2)n[nH]c1=S ZINC000040953193 GI Annotated Anodyne O[C@@]1(c2ccc(-c3ccc(Br)cc3)cc2)CN2CCCC[C@@H]2CO1 ZINC000040954611 GI Annotated Anodyne in-vitro O[C@]1(c2ccc(-c3ccc(Br)cc3)cc2)CN2CCCC[C@@H]2CO1 ZINC000040954613 GI Annotated Anodyne in-vitro CC[C@@H](CF)Oc1ccc(COc2cnn(C(C)(C)C)c(=O)c2Cl)cc1 ZINC000040955981 GI Annotated Anodyne CC[C@H](CF)Oc1ccc(COc2cnn(C(C)(C)C)c(=O)c2Cl)cc1 ZINC000040955984 GI Annotated Anodyne CNc1noc2c(-c3ccc4c(N5CCOC[C@H]5C)nncc4c3)c(C)ccc12 ZINC000040956444 GI Annotated Anodyne CCN(CC)CC(=O)N1C[C@@H](c2ccccc2)Oc2c(C)c(C)c(OC)c(C)c21 ZINC000040956447 GI Annotated Anodyne COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C(=O)N1CCC[C@H]1C3 ZINC000040956947 GI Annotated Bother COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C(=O)N1CCC[C@@H]1C3 ZINC000040956950 GI Annotated Bother CC(=O)c1cccc(C2=NC(c3ccc(F)cc3)(c3ccc(F)cc3)CN2)c1 ZINC000040972258 GI Annotated Anodyne CCCCC1(CCCC)OC(c2cc(OC)c(OC)c(OC)c2)=NN1C(C)=O ZINC000040973735 GI Annotated Anodyne CN(C)CCOc1cccc2c1ccc1c(C#N)cc(C(=O)c3ccccc3)n12 ZINC000040974403 GI Annotated Mild CCCCCN1C(=O)/C(=N\NC(=O)CC2CCCCC2)c2ccc(OC)cc21 ZINC000040974531 GI Annotated Reactive C[C@@H](COC(=O)[C@@H](C)c1ccc2c(c1)[nH]c1ccc(Cl)cc12)O[N+](=O)[O-] ZINC000040974708 GI Annotated Anodyne C[C@H](C(=O)OC[C@@H](C)O[N+](=O)[O-])c1ccc2c(c1)[nH]c1ccc(Cl)cc12 ZINC000040974710 GI Annotated Anodyne C[C@@H](COC(=O)[C@H](C)c1ccc2c(c1)[nH]c1ccc(Cl)cc12)O[N+](=O)[O-] ZINC000040974712 GI Annotated Anodyne C[C@H](COC(=O)[C@H](C)c1ccc2c(c1)[nH]c1ccc(Cl)cc12)O[N+](=O)[O-] ZINC000040974714 GI Annotated Anodyne COc1ccc2c(c1)N(CC1CCCCC1)C(=O)/C2=N\NC(=O)C1CCCCC1 ZINC000040974790 GI Annotated Reactive C[C@@H]([C@H]1CC[C@H]2[C@@H]3CC[C@H]4C(=O)C(NC=O)=CC[C@]4(C)[C@H]3CC[C@@]21C)N(C)C ZINC000040975614 GI Annotated Mild in-vitro CCOc1ccc2nc(C)cc(Nc3cc(OC)c(OC)cc3C(=O)OC)c2c1 ZINC000040975731 GI Annotated Anodyne Cc1ccn(-c2ccc(Cl)c(F)c2)c(=O)c1-c1ccc2nc(N)ncc2c1 ZINC000040976821 GI Annotated Anodyne COc1cc(OC)cc([C@H]2C3=C(COC3=O)Nc3cc(C(C)(C)C)ccc32)c1 ZINC000042878059 GI Annotated Anodyne COc1cc(OC)cc([C@@H]2C3=C(COC3=O)Nc3cc(C(C)(C)C)ccc32)c1 ZINC000042878062 GI Annotated Anodyne CCn1ccc2cc([C@H](OC(C)=O)c3cc(OC)c(OC)c(OC)c3)ccc21 ZINC000042888557 GI Annotated Anodyne CCn1ccc2cc([C@@H](OC(C)=O)c3cc(OC)c(OC)c(OC)c3)ccc21 ZINC000042888561 GI Annotated Anodyne Cc1cccc(SC[C@@H](C)CN[C@@H]2COc3ccccc3SC2)c1CO ZINC000042920487 GI Annotated Anodyne O=c1cc(CSC(=S)N(CCCl)CCCl)oc2ccccc12 ZINC000042921917 GI Annotated Reactive C[C@@H](CN[C@@H]1COc2ccccc2SC1)CSc1cccc(F)c1N ZINC000042922350 GI Annotated Anodyne O=C1OCC2=C1[C@H](c1cc(Cl)ccc1Cl)c1cc3c(cc1N2)OCO3 ZINC000042922776 GI Annotated Anodyne O=C1OCC2=C1[C@@H](c1cc(Cl)ccc1Cl)c1cc3c(cc1N2)OCO3 ZINC000042922779 GI Annotated Anodyne COc1cc(N[C@@H](C)CCCNC(=O)NCc2ccccc2)c2ncccc2c1 ZINC000042922884 GI Annotated Anodyne COc1cc(N[C@H](C)CCCNC(=O)NCc2ccccc2)c2ncccc2c1 ZINC000042922887 GI Annotated Anodyne COc1ccc(-c2[nH]c3ccc(C)cc3c2/C=N/NC(=O)c2ccncc2)cc1 ZINC000042923148 GI Annotated Reactive Cc1c(C2CC2)nc2ccc(NC(=O)c3ncc(-c4ccc(F)cc4)cn3)cn12 ZINC000042966624 GI Annotated Anodyne CN(C)CCCNC(=O)c1cc2c3cccc(Cl)c3[nH]c2c2ncccc12 ZINC000043010058 GI Annotated Bother Cc1c2c(c3cc(-c4ccc(-c5nnn[nH]5)nc4)oc3c1C)CCC(C)(C)O2 ZINC000043011734 GI Annotated Anodyne Cc1c(NS(C)(=O)=O)c(C)c2ccn(CC(C)C)c2c1NC(=O)C(C)(C)C ZINC000043012034 GI Annotated Anodyne CCN(CC)C(=O)c1cc(C2=CC3(CCNCC3)Oc3ccccc32)cs1 ZINC000043012106 GI Annotated Anodyne O=C(c1ccc(C2=CC3(CCNCC3)Oc3ccccc32)cc1)N1CCCCC1 ZINC000043012759 GI Annotated Anodyne CCN(CC)C(=O)c1ccc(C2=CC3(CCNCC3)Oc3ccccc32)cc1F ZINC000043013136 GI Annotated Anodyne COc1ccc([C@@H]2[C@@H]3CCCCC3=NN2S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000043013294 GI Annotated Anodyne COc1ccc([C@H]2[C@@H]3CCCCC3=NN2S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000043013296 GI Annotated Anodyne C[C@H](Oc1ccnc2ccccc12)c1cn(-c2ccc(C#N)c(Cl)c2)nn1 ZINC000043013733 GI Annotated Mild C[C@@H](Oc1ccnc2ccccc12)c1cn(-c2ccc(C#N)c(Cl)c2)nn1 ZINC000043013735 GI Annotated Mild Nc1c(C(=O)c2ccccc2C(F)(F)F)cc[n+]([O-])c1-c1ccccc1Cl ZINC000043014352 GI Annotated Anodyne CC(C)(CC(=O)NC1C2CC3CC(C2)CC1C3)Cc1nc(-c2ccccn2)no1 ZINC000043014494 GI Annotated Anodyne Cc1cc(C)cc(C(=O)c2c(C(C)C)c(=O)[nH]c(=O)n2CCC2CCCC2)c1 ZINC000043016127 GI Annotated Anodyne CCCC(CCC)C(=O)NCc1ccc2c(cnn2-c2ccc(OC)nc2)c1 ZINC000043016412 GI Annotated Anodyne Cc1ccc2c(=O)c(CSC(=S)N(CCCl)CCCl)coc2c1 ZINC000043017241 GI Annotated Reactive CCN(CC)C(=O)c1ccc(C2=CC3(CCNCC3)Oc3ccccc32)s1 ZINC000043017762 GI Annotated Anodyne Cc1cnc(NC(=O)N2CCN(Cc3sc4ccccc4c3C)CC2)s1 ZINC000043017936 GI Annotated Anodyne Cc1nc2c(-c3ccc(C(F)(F)F)cc3)[nH]c(-c3ccc(O)cc3)cn-2c1=O ZINC000043018204 GI Annotated Anodyne C[C@@H](CN[C@@H]1COc2ccccc2SC1)CSc1cccc2c1OCO2 ZINC000043018350 GI Annotated Anodyne CC[C@H](C)N(C[C@H](O)CO/N=C(\Cl)c1nc2ccccc2o1)[C@H](C)CC ZINC000043019000 GI Annotated Mild CC[C@H](C)N(C[C@H](O)CO/N=C(\Cl)c1nc2ccccc2o1)[C@@H](C)CC ZINC000043019002 GI Annotated Mild CC[C@H](C)N(C[C@@H](O)CO/N=C(\Cl)c1nc2ccccc2o1)[C@H](C)CC ZINC000043019004 GI Annotated Mild CC[C@H](C)N(C[C@@H](O)CO/N=C(\Cl)c1nc2ccccc2o1)[C@@H](C)CC ZINC000043019006 GI Annotated Mild Cc1ccc(NC(=O)N2CCN(Cc3sc4ccc(F)cc4c3C)CC2)cn1 ZINC000043020711 GI Annotated Anodyne COc1cccc(SC[C@@H](C)CN[C@@H]2COc3ccccc3SC2)c1N ZINC000043021169 GI Annotated Anodyne O=c1c(CSC(=S)N2CCN(c3ccccc3)CC2)coc2ccccc12 ZINC000043021995 GI Annotated Anodyne O=[N+]([O-])c1ccc(-c2cn3nc(Cc4noc5ccccc45)sc3n2)cc1 ZINC000043024751 GI Annotated Bother COc1cccc(N2CCN(CCN(C)CC34CCC(CC3)C4(C)C)C2=O)c1 ZINC000043025133 GI Annotated Anodyne COc1ccc(COc2ccc(C(=O)[C@H]3CN=C4C=C(C)C=CN4C3)cc2)cc1 ZINC000043025535 GI Annotated Anodyne COc1ccc(COc2ccc(C(=O)[C@@H]3CN=C4C=C(C)C=CN4C3)cc2)cc1 ZINC000043025540 GI Annotated Anodyne CCCC(CCC)C(=O)NCc1ccc2c(cnn2-c2cccnc2OC)c1 ZINC000043060260 GI Annotated Anodyne CC[N+](C)(CC)CCC(=O)Nc1ccc2c(c1)C(=O)c1cccc3ccnc-2c13 ZINC000043062316 GI Annotated Bother Cc1c(C2CC2)nc2ccc(NC(=O)c3cnc(-c4ccc(F)cc4)cn3)cn12 ZINC000043062655 GI Annotated Anodyne C[C@@H](c1nnnn1C)N(Cc1ccccc1Cl)c1ccc(C#N)c(Cl)c1 ZINC000043063299 GI Annotated Mild C[C@H](c1nnnn1C)N(Cc1ccccc1Cl)c1ccc(C#N)c(Cl)c1 ZINC000043063303 GI Annotated Mild O=C1N(CCN2Cc3ccccc3C2)CCN1c1cscc1-c1ccccn1 ZINC000043064586 GI Annotated Anodyne C[C@@H](CN[C@@H]1COc2ccccc2SC1)CSc1cccc2cn[nH]c12 ZINC000043066883 GI Annotated Anodyne Cc1c(C2CC2)nc2ccc(NC(=O)c3ccc(-c4ccc(F)nc4)cn3)cn12 ZINC000043068552 GI Annotated Anodyne CC(C)CNC(=O)c1ccc(C2=CC3(CCNCC3)Oc3ccccc32)cc1 ZINC000043069600 GI Annotated Anodyne CCCCN(CCCC)C[C@H](O)CO/N=C(\Cl)c1nc2ccccc2o1 ZINC000043073426 GI Annotated Mild CCCCN(CCCC)C[C@@H](O)CO/N=C(\Cl)c1nc2ccccc2o1 ZINC000043073429 GI Annotated Mild COc1cc2nc3c(cc2c(CN2CCOCC2)c1O)CSc1ccccc1-3 ZINC000043073476 GI Annotated Clean COc1cc(N[C@H](C)CCCN2C(=O)[C@@H](C(C)C)NC2(C)C)c2ncccc2c1 ZINC000043075487 GI Annotated Anodyne COc1cc(N[C@@H](C)CCCN2C(=O)[C@@H](C(C)C)NC2(C)C)c2ncccc2c1 ZINC000043075489 GI Annotated Anodyne Cc1cc(-c2ccc(Cl)c(C(=O)NC[C@]3(O)CCCC(C)(C)C3)c2)n[nH]1 ZINC000043076650 GI Annotated Anodyne Cc1cc(-c2ccc(Cl)c(C(=O)NC[C@@]3(O)CCCC(C)(C)C3)c2)n[nH]1 ZINC000043076653 GI Annotated Anodyne Cc1cc(C)cc(C(=O)c2c(C(C)C)c(=O)[nH]c(=O)n2CCC2=CCCC2)c1 ZINC000043077402 GI Annotated Anodyne CC1=CC2=NC[C@H](C(=O)c3ccc(OCc4ccc(C#N)cc4)cc3)CN2C=C1 ZINC000043077882 GI Annotated Mild CC1=CC2=NC[C@@H](C(=O)c3ccc(OCc4ccc(C#N)cc4)cc3)CN2C=C1 ZINC000043077885 GI Annotated Mild N#Cc1ccccc1NC1=C(Nc2ccccc2C#N)C(=O)c2ccccc2C1=O ZINC000043078317 GI Annotated Mild Cc1cccc(C)c1-c1nnc(NC(=O)c2ccc3c(c2)OCCCO3)s1 ZINC000043079221 GI Annotated Anodyne C[C@@H](CN[C@@H]1COc2ccccc2SC1)CSc1cccc(F)c1O ZINC000043079951 GI Annotated Anodyne CCC[C@H](Nc1cncc(-c2ccc(NC(C)=O)c(OC)c2)n1)c1cccnc1 ZINC000043080577 GI Annotated Anodyne CCC[C@@H](Nc1cncc(-c2ccc(NC(C)=O)c(OC)c2)n1)c1cccnc1 ZINC000043080580 GI Annotated Anodyne CN(C)CCCNC(=O)c1cc2c3cc(Cl)ccc3[nH]c2c2ncccc12 ZINC000043120386 GI Annotated Bother Nc1ccccc1-c1nnc(C(=O)NCc2ccc(Oc3ccccc3)cc2)o1 ZINC000043120874 GI Annotated Anodyne Cc1c(CN2CCN(C(=O)NCc3ccccc3)CC2)sc2ccccc12 ZINC000043120904 GI Annotated Anodyne Nc1c(C(=O)c2ccc(F)cc2F)cc[n+]([O-])c1-c1c(Cl)cccc1Cl ZINC000043121610 GI Annotated Anodyne CN(Cc1ccccc1)C(=O)N1CCc2c(nc(C(C)(C)C)n2CC2CC2)C1 ZINC000043122083 GI Annotated Anodyne Cc1noc(NC(=O)N2CCN(Cc3sc4ccccc4c3C)CC2)c1C ZINC000043122250 GI Annotated Anodyne O=C1N(CCN2CCCc3sccc3C2)CCN1c1cccc(Cl)c1 ZINC000043123160 GI Annotated Anodyne C=C(c1ccc(Cl)cc1)[C@H]1COC2(CCC(=CC(=O)OCC)CC2)OO1 ZINC000043130465 GI Annotated Reactive C=C(c1ccc(Cl)cc1)[C@@H]1COC2(CCC(=CC(=O)OCC)CC2)OO1 ZINC000043130467 GI Annotated Reactive O=S(=O)(c1cccs1)N1c2cc(F)c(F)cc2-c2n[nH]cc2[C@@H]1C1CC1 ZINC000043176067 GI Annotated Anodyne O=S(=O)(c1cccs1)N1c2cc(F)c(F)cc2-c2n[nH]cc2[C@H]1C1CC1 ZINC000043176069 GI Annotated Anodyne COc1cc2c(cc1OC)C(=O)N1C=C(c3ccc4ncccc4c3)C[C@H]1C=N2 ZINC000043200380 GI Annotated Anodyne Cc1cnc(-c2cccc(Cn3nc(-c4cc(F)cc(F)c4)ccc3=O)c2)nc1 ZINC000043202023 GI Annotated Anodyne O=C1c2ccc(-c3cccc(C(F)(F)F)c3)cc2CCN1CCN1CCCC1 ZINC000043203677 GI Annotated Anodyne Cc1cccc(C(=O)Nc2ccc(N3CC[C@H](N4CCC[C@@H]4C)C3)cc2C)n1 ZINC000043204808 GI Annotated Anodyne Cc1cc(N2CC[C@H](N3CCC[C@@H]3C)C2)ccc1NC(=O)[C@@H]1C[C@H]2CC[C@@H]1C2 ZINC000043204907 GI Annotated Anodyne Cc1cc(N2CC[C@H](N3CCC[C@@H]3C)C2)ccc1NC(=O)[C@H]1C[C@H]2CC[C@@H]1C2 ZINC000043204908 GI Annotated Anodyne C[C@@H]1CCCN1[C@@H]1CCN(c2ccc(NC(=O)NCc3cccs3)cc2)C1 ZINC000043204917 GI Annotated Anodyne C[C@H]1CCCN1[C@@H]1CCN(c2ccc(NC(=O)NCc3cccs3)cc2)C1 ZINC000043204918 GI Annotated Anodyne Cc1cc(NC(=O)NCc2cccs2)ccc1N1CC[C@H](N2CCC[C@@H]2C)C1 ZINC000043204925 GI Annotated Anodyne Cc1cc(NC(=O)NCc2cccs2)ccc1N1CC[C@@H](N2CCC[C@@H]2C)C1 ZINC000043204926 GI Annotated Anodyne C[C@@H]1CC[C@H]2CC(=O)N(Cc3ccc(Cl)cc3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000043380056 GI Annotated Reactive C[C@@H]1CC[C@H]2CC(=O)N(Cc3ccc(Cl)cc3)[C@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000043397051 GI Annotated Reactive C[C@@H]1CC[C@H]2C(C)(C)[C@H](O)CC[C@@]2(C)[C@]12Cc1c(O)cc3c(c1O2)CN=C3O ZINC000043509653 GI Annotated Anodyne C=C(c1ccc(OC)cc1)[C@H]1COC2(CCC(=C(C)C(=O)OCC)CC2)OO1 ZINC000043523742 GI Annotated Reactive C=C(c1ccc(OC)cc1)[C@@H]1COC2(CCC(=C(C)C(=O)OCC)CC2)OO1 ZINC000043523745 GI Annotated Reactive O=C(Nc1ccccc1)N1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3 ZINC000043543983 GI Annotated Reactive CC(C)N(C(=O)N1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3)C(C)C ZINC000043552620 GI Annotated Reactive C[C@@H]1CC[C@H]2CC(=O)N(CCCc3ccccc3)[C@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000043967655 GI Annotated Reactive C[C@@H]1CC[C@H]2CC(=O)N(CCCc3ccccc3)[C@@H]3O[C@@]4(C)CC[C@@H]1[C@@]23OO4 ZINC000043967657 GI Annotated Reactive Cc1ccc(NC(=O)N2CCC3(CC2)OOC2(O3)C3CC4CC(C3)CC2C4)cc1 ZINC000044202068 GI Annotated Reactive CCCCCCCCCNC1=NC(C)(C)NC(NCc2ccc(OC)cc2)=N1 ZINC000044431761 GI Annotated Mild CN(C)c1ccc([C@H]2N[C@@H](c3ccc(N(C)C)cc3)[C@H]3CCC[C@@H]2C3=O)cc1 ZINC000044681648 GI Annotated Clean CN(C)c1ccc([C@@H]2N[C@@H](c3ccc(N(C)C)cc3)[C@H]3CCC[C@@H]2C3=O)cc1 ZINC000044681653 GI Annotated Clean O=C(N[C@H]1CCc2ccccc2C1)c1cc2c(=O)oc3ccccc3c2s1 ZINC000004563750 GI Annotated Anodyne O=C(N[C@@H]1CCc2ccccc2C1)c1cc2c(=O)oc3ccccc3c2s1 ZINC000004563751 GI Annotated Anodyne C[C@H]1C[C@H](C)CN(C(=O)N[C@]2(C(F)(F)F)Oc3ccc(Cl)cc3O2)C1 ZINC000004575099 GI Annotated Anodyne C/C(=N\Nc1cc(N2CCCCC2)nc(C)n1)c1ccc(Br)cc1 ZINC000004595629 GI Annotated Mild CC1=C(C(=O)N2CCCCC2)[C@H](c2cccs2)n2c(nc3ccccc32)N1 ZINC000004597491 GI Annotated Anodyne CC1=C(C(=O)N2CCCCC2)[C@@H](c2cccs2)n2c(nc3ccccc32)N1 ZINC000004597492 GI Annotated Anodyne C[C@H]1C[C@H](C)CN(C(=O)[C@@H]2c3ccccc3C(=O)N3CCc4ccccc4[C@H]23)C1 ZINC000004598106 GI Annotated Anodyne C[C@@H]1C[C@@H](C)CN(C(=O)[C@@H]2c3ccccc3C(=O)N3CCc4ccccc4[C@H]23)C1 ZINC000004598107 GI Annotated Anodyne C[C@@H]1CCCC[C@@H]1NC(=O)CCCCCn1c(=S)[nH]c2ccccc2c1=O ZINC000004598963 GI Annotated Anodyne C[C@H]1CCCC[C@@H]1NC(=O)CCCCCn1c(=S)[nH]c2ccccc2c1=O ZINC000004598964 GI Annotated Anodyne C[C@@H]1CCCC[C@H]1NC(=O)CCCCCn1c(=S)[nH]c2ccccc2c1=O ZINC000004598966 GI Annotated Anodyne C[C@H]1CCCC[C@H]1NC(=O)CCCCCn1c(=S)[nH]c2ccccc2c1=O ZINC000004598968 GI Annotated Anodyne CCC(C)(C)n1nnnc1[C@@H](c1ccc2ncccc2c1)N1CCC[C@@H](C)C1 ZINC000004618579 GI Annotated Anodyne CCOC(=O)[C@@H](C(=O)Nc1ccccc1Cl)C1=NC(C)(C)Cc2ccccc21 ZINC000004646054 GI Annotated Anodyne O=[N+]([O-])c1cc(/C(O)=N/Cc2ccccc2Cl)ccc1NC[C@@H]1CCCO1 ZINC000004660497 GI Annotated Anodyne O=[N+]([O-])c1cc(/C(O)=N/Cc2ccccc2Cl)ccc1NC[C@H]1CCCO1 ZINC000004660498 GI Annotated Anodyne Cc1ccc(-n2c(SCc3ccccc3C)nc3[nH]ncc3c2=O)cc1C ZINC000004687701 GI Annotated Anodyne aggregator CC[C@@H](C(=O)NCCC1=CCCCC1)N1C(=O)COc2ccc(C(C)(C)C)cc21 ZINC000004688067 GI Annotated Anodyne CC[C@H](C(=O)NCCC1=CCCCC1)N1C(=O)COc2ccc(C(C)(C)C)cc21 ZINC000004688068 GI Annotated Anodyne C/C(=N\O)c1ccc(NC2=C(N3CCCCC3)C(=O)c3ccccc3C2=O)cc1 ZINC000004733854 GI Annotated Mild COc1ccccc1Nc1ncc(C(=O)NCc2ccccn2)c2ccccc12 ZINC000004760847 GI Annotated Anodyne O=C(CSc1nc2ccc(Cl)cc2o1)Nc1nc(-c2ccccc2)no1 ZINC000004769806 GI Annotated Anodyne CCn1cc(/C(O)=N/Cc2ccc(F)cc2)c2c3ccccc3n(C)c2c1=O ZINC000004788925 GI Annotated Mild CCn1cc(/C(O)=N/Cc2ccc(OC)cc2)c2c3ccccc3n(C)c2c1=O ZINC000004788949 GI Annotated Mild CC(=O)N(C1=C(N2CCCCC2)C(=O)c2ccccc2C1=O)c1ccccc1C ZINC000004819423 GI Annotated Mild O=C(COc1ccc2c(c1)C(=O)CC1(CCCCC1)O2)NCc1ccc(F)cc1 ZINC000004879657 GI Annotated Anodyne CSc1cccc(/N=C(\O)CCS(=O)(=O)c2cccc3cccnc23)c1 ZINC000004880429 GI Annotated Mild Cc1ccc2cc3cc(C(=O)NC[C@@H]4COc5ccccc5O4)sc3nc2c1 ZINC000004885978 GI Annotated Anodyne Cc1ccc2cc3cc(C(=O)NC[C@H]4COc5ccccc5O4)sc3nc2c1 ZINC000004885981 GI Annotated Anodyne C[C@@H]1CCC[C@H](NC(=O)[C@@H]2c3ccccc3C(=O)N2Cc2cccs2)[C@@H]1C ZINC000004894181 GI Annotated Anodyne C[C@H]1CCC[C@H](NC(=O)[C@@H]2c3ccccc3C(=O)N2Cc2cccs2)[C@@H]1C ZINC000004894187 GI Annotated Anodyne C[C@@H]1CCC[C@@H](NC(=O)[C@@H]2c3ccccc3C(=O)N2Cc2cccs2)[C@@H]1C ZINC000004894191 GI Annotated Anodyne C[C@H]1CCC[C@@H](NC(=O)[C@@H]2c3ccccc3C(=O)N2Cc2cccs2)[C@@H]1C ZINC000004894200 GI Annotated Anodyne COc1ccc(NC(=O)[C@H](c2ccccn2)N(C(C)=O)c2ccc(C)cc2)cc1 ZINC000004903313 GI Annotated Anodyne COc1ccc(NC(=O)[C@@H](c2ccccn2)N(C(C)=O)c2ccc(C)cc2)cc1 ZINC000004903325 GI Annotated Anodyne CC(C)CCNC(=O)c1cn(C2CCCC2)c(=O)c2c1c1ccccc1n2C ZINC000004904650 GI Annotated Anodyne CC(C)(C)c1nn(-c2ccccc2)c2[nH]c(=O)c(CNC3CCCCC3)cc12 ZINC000004905549 GI Annotated Anodyne Cc1ccc2cc3cc(C(=O)N4CCN(c5ccccc5F)CC4)oc3nc2c1 ZINC000004906022 GI Annotated Anodyne COc1ccc(CCNC(=O)c2cc3cc4ccc(C)cc4nc3o2)cc1OC ZINC000004906198 GI Annotated Anodyne CCOc1ccc(N(CC)C(=O)CCc2nc(-c3ccccc3F)no2)cc1 ZINC000004921500 GI Annotated Anodyne COc1cc(-c2nc3ccccn3c2Nc2ccc3c(c2)OCO3)ccc1O ZINC000004921827 GI Annotated Anodyne N#CC1=C2SCN(c3ccc(F)cc3)CN2C(=O)C[C@H]1c1cccc(F)c1 ZINC000004923479 GI Annotated Reactive aggregator N#CC1=C2SCN(c3ccc(F)cc3)CN2C(=O)C[C@@H]1c1cccc(F)c1 ZINC000004923482 GI Annotated Reactive aggregator Cc1ccc(CNC(=O)C2(NC(=O)Nc3ccc(C)cc3)CCCCC2)cc1 ZINC000004965415 GI Annotated Anodyne COc1ccccc1CNC(=O)C1(NC(=O)Nc2ccc(C)cc2)CCCCC1 ZINC000004967921 GI Annotated Anodyne CCOC(=O)Cn1nc(-c2ccccc2)c2cnc3ccc(OCC)cc3c21 ZINC000004969960 GI Annotated Anodyne COc1ccccc1/N=C(\O)CN1C(=O)CN=C(c2ccccc2)c2ccccc21 ZINC000004972142 GI Annotated Mild CCC/C(=N\NC(=O)c1ccc(CSc2nncn2C)cc1)c1ccccc1 ZINC000004984986 GI Annotated Reactive FC(F)(F)c1cc(CNCCCNc2nc3cnccc3[nH]2)ccc1Cl ZINC000045189391 GI Annotated Anodyne COc1ccc(CNc2cc(C)nc3sc4c(c23)CCC2(C4)OCCO2)cc1 ZINC000045189461 GI Annotated Anodyne CC(C)(C)c1ccc(CNC(=O)c2ccc(CNC3CCC(N)CC3)s2)cc1 ZINC000045191259 GI Annotated Anodyne COc1ccccc1Nc1nc(C)cc(NCc2ccc(-n3ccnc3)cc2)n1 ZINC000045191806 GI Annotated Anodyne CNCCNCc1ccc(-c2ccc(-c3nc4cc(F)ccc4[nH]3)s2)cc1 ZINC000045191869 GI Annotated Anodyne CCC[C@@H](C)Nc1nc(C)cc(N[C@@H](CC(C)C)C(=O)NC2CCCC2)n1 ZINC000045192739 GI Annotated Anodyne CCC[C@H](C)Nc1nc(C)cc(N[C@@H](CC(C)C)C(=O)NC2CCCC2)n1 ZINC000045192742 GI Annotated Anodyne Cc1c(-c2ccc3c(c2)[C@H](NCCCN2CCCCC2)CC3)cnc(N)c1C ZINC000045193059 GI Annotated Anodyne Cc1c(-c2ccc3c(c2)[C@@H](NCCCN2CCCCC2)CC3)cnc(N)c1C ZINC000045193062 GI Annotated Anodyne CN(C)c1ccc2c(c1)Sc1cc(N(C)C)ccc1N2C(=O)CCCC(=O)O ZINC000045195767 GI Annotated Anodyne CC(C)c1sc(N2CCN(C)CC2)nc1C(=O)Nc1cccc2c1CCCC2 ZINC000045196017 GI Annotated Anodyne CCN1CCC(N2CCC(n3c(C)nc4cc(C(F)(F)F)ccc43)CC2)CC1 ZINC000045196317 GI Annotated Anodyne Cc1nc(Nc2ccc(F)cc2)nc(N2CCc3ccccc3[C@@H]2C)c1CO ZINC000045196381 GI Annotated Anodyne Cc1nc(Nc2ccc(F)cc2)nc(N2CCc3ccccc3[C@H]2C)c1CO ZINC000045196382 GI Annotated Anodyne COc1ccccc1N(C)CCNc1cc(C)nc(Nc2ccc(C)cc2)n1 ZINC000045202971 GI Annotated Anodyne CCCn1c(Sc2ccc(C#N)c([N+](=O)[O-])c2)nnc1-c1ccc(OC)cc1 ZINC000045210041 GI Annotated Mild CN1CCOc2ccc(Nc3nnc(-c4cccc(-c5cccnc5)c4)o3)cc2C1 ZINC000045227180 GI Annotated Anodyne Cc1cc(NCCC(=O)Nc2ccccc2)nc(NCc2ccccc2C)n1 ZINC000045228413 GI Annotated Anodyne CC(=O)Oc1c([C@H]2C=CCCC2)c(OC(C)=O)c2ccccc2c1OC(C)=O ZINC000045238543 GI Annotated Anodyne CC(=O)Oc1c([C@@H]2C=CCCC2)c(OC(C)=O)c2ccccc2c1OC(C)=O ZINC000045238546 GI Annotated Anodyne CCOc1ccc(Nc2c(C)c(NCCCCCN)c(C#N)c3ccnn23)cc1 ZINC000045244882 GI Annotated Mild CCc1nnc2n(-c3ccc(Cl)cc3)c(=O)c3c4c(sc3n12)CCCC4 ZINC000045245532 GI Annotated Anodyne N[C@@H](CCN1CCC[C@H]1c1ccn(-c2ccccc2)n1)Cc1ccccc1F ZINC000045245676 GI Annotated Anodyne CNc1ccc(/C=C/C(=O)c2ccc(OCCOCCOCCF)cc2)cc1 ZINC000045245684 GI Annotated Mild CCOC(=O)c1cc(-c2csc(-c3ccncc3)n2)c(O)nc1C(F)(F)F ZINC000045245797 GI Annotated Anodyne Clc1ccc([C@H]2NC(N3CCOCC3)=NC3=C2CCc2ccccc23)cc1 ZINC000045253001 GI Annotated Anodyne Clc1ccc([C@@H]2NC(N3CCOCC3)=NC3=C2CCc2ccccc23)cc1 ZINC000045253003 GI Annotated Anodyne Cc1cncn1CCCN1Cc2cc(Cc3ccccc3)sc2NC1=S ZINC000045253193 GI Annotated Anodyne Cc1cccc(C)c1-c1ccc(CO[C@@H]2COc3nc([N+](=O)[O-])cn3C2)cc1 ZINC000045254225 GI Annotated Bother COC(=O)c1[nH]c2ccc(Cl)cc2c1Cc1cc(OC)c(OC)c(OC)c1 ZINC000045254671 GI Annotated Anodyne CCOC(=O)c1c(CC)c(C)c(CC)n1Cc1cc(OC)c(OC)c(OC)c1 ZINC000045254804 GI Annotated Anodyne CSc1cccc(-c2cccc(CO[C@@H]3COc4nc([N+](=O)[O-])cn4C3)c2)c1 ZINC000045255128 GI Annotated Bother C[C@@H]1c2c[nH]nc2-c2cc(F)ccc2N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000045256345 GI Annotated Anodyne C[C@H]1c2c[nH]nc2-c2cc(F)ccc2N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000045256348 GI Annotated Anodyne C[C@@H]1c2c[nH]nc2-c2c(F)cccc2N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000045256352 GI Annotated Anodyne C[C@H]1c2c[nH]nc2-c2c(F)cccc2N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000045256355 GI Annotated Anodyne CSc1ccccc1-c1ccc(CO[C@@H]2COc3nc([N+](=O)[O-])cn3C2)cc1 ZINC000045256385 GI Annotated Bother CC(C)(C)c1ccc(-n2ncc3c2CCC[C@H]3NC(=O)c2ncccc2O)cc1 ZINC000045256441 GI Annotated Anodyne CC(C)(C)c1ccc(-n2ncc3c2CCC[C@@H]3NC(=O)c2ncccc2O)cc1 ZINC000045256444 GI Annotated Anodyne CSc1cccc(-c2ccccc2CO[C@@H]2COc3nc([N+](=O)[O-])cn3C2)c1 ZINC000045256897 GI Annotated Bother CCCSC1=C(/C=N/O)CCc2c1sc1nc3n(c(=O)c21)CCCCC3 ZINC000045256950 GI Annotated Mild COc1ccc([C@H](Cc2ccc(C(F)(F)F)cc2)c2cn(C)c(N)n2)cc1 ZINC000045261087 GI Annotated Anodyne COc1ccc([C@@H](Cc2ccc(C(F)(F)F)cc2)c2cn(C)c(N)n2)cc1 ZINC000045261090 GI Annotated Anodyne CCn1c(=S)sc2c(NC(=S)Nc3ccc(OC)cc3)ncnc21 ZINC000045283487 GI Annotated Anodyne O=c1c(-c2nnc(S)n2-c2ccccc2)c[nH]c2c(C(F)(F)F)cccc12 ZINC000045283612 GI Annotated Anodyne Fc1ccc(-c2cnc3nc(N4CCC(N5CCCCC5)CC4)sc3c2)cn1 ZINC000045283901 GI Annotated Anodyne CNCCN1CCC(c2cc(C)c3[nH]c(-c4c(F)cccc4OC)nc3c2)CC1 ZINC000045284264 GI Annotated Anodyne CCn1c(=S)sc2c(NC(=S)Nc3ccccc3OC)ncnc21 ZINC000045285070 GI Annotated Anodyne CSc1ccc(-c2ccccc2CO[C@@H]2COc3nc([N+](=O)[O-])cn3C2)cc1 ZINC000045285448 GI Annotated Bother Fc1cc(-c2cc3sc(N4CCC(N5CCCCC5)CC4)nc3cn2)ccn1 ZINC000045285949 GI Annotated Anodyne O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3cccc(Cl)c3)cc1)C2 ZINC000045286027 GI Annotated Bother CC[C@@H]1/C(=N/N=C2\NC(=O)CS2)C[C@@H](c2ccccc2)N[C@H]1c1ccccc1 ZINC000045286935 GI Annotated Mild CC[C@H]1/C(=N/N=C2\NC(=O)CS2)C[C@@H](c2ccccc2)N[C@@H]1c1ccccc1 ZINC000045286937 GI Annotated Mild CC[C@@H]1/C(=N/N=C2\NC(=O)CS2)C[C@@H](c2ccccc2)N[C@@H]1c1ccccc1 ZINC000045286939 GI Annotated Mild C[C@@H]1c2c[nH]nc2-c2ccc(F)cc2N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000045287213 GI Annotated Anodyne C[C@H]1c2c[nH]nc2-c2ccc(F)cc2N1S(=O)(=O)c1ccc(Cl)cc1 ZINC000045287217 GI Annotated Anodyne CN(CCN=[N+]=[N-])CCn1nc2c3c(cccc31)C(=O)c1c(Cl)cccc1-2 ZINC000045287439 GI Annotated Clean CSc1cccc(-c2ccc(CO[C@@H]3COc4nc([N+](=O)[O-])cn4C3)cc2)c1 ZINC000045287611 GI Annotated Bother O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccc(Cl)cc3)cc1)C2 ZINC000045288048 GI Annotated Bother Fc1ncccc1-c1cnc2nc(N3CCC(N4CCCCC4)CC3)sc2c1 ZINC000045291200 GI Annotated Anodyne C[C@@H]1/C(=N/N=C2\NC(=O)CS2)C[C@@H](c2ccccc2)N(C)[C@H]1c1ccccc1 ZINC000045291258 GI Annotated Mild C[C@H]1/C(=N/N=C2\NC(=O)CS2)C[C@@H](c2ccccc2)N(C)[C@@H]1c1ccccc1 ZINC000045291261 GI Annotated Mild C[C@@H]1/C(=N/N=C2\NC(=O)CS2)C[C@@H](c2ccccc2)N(C)[C@@H]1c1ccccc1 ZINC000045291264 GI Annotated Mild COc1ccc(/C=N/c2c(C#N)c3n(c2C(=O)Nc2ccccc2)CCC3)cc1 ZINC000045291399 GI Annotated Mild CC(=O)Nc1ccc(CN2C(=N)[C@@]3(CC(C)(C)Oc4ccccc43)OC2=O)cc1 ZINC000045299292 GI Annotated Anodyne CC(=O)Nc1ccc(CN2C(=N)[C@]3(CC(C)(C)Oc4ccccc43)OC2=O)cc1 ZINC000045299295 GI Annotated Anodyne c1cnc(NCc2cccc3cc4cccc(CNc5ncccn5)c4nc23)nc1 ZINC000045299930 GI Annotated Bother CSCCC(=O)N[C@@H]1CCCc2c1cnn2-c1ccc(OC(F)(F)F)cc1 ZINC000045300861 GI Annotated Anodyne CSCCC(=O)N[C@H]1CCCc2c1cnn2-c1ccc(OC(F)(F)F)cc1 ZINC000045300863 GI Annotated Anodyne CSc1ccc(-c2ccc(CO[C@@H]3COc4nc([N+](=O)[O-])cn4C3)cc2)cc1 ZINC000045301000 GI Annotated Bother Fc1ccc(-c2cc3sc(N4CCC(N5CCCCC5)CC4)nc3cn2)cn1 ZINC000045301018 GI Annotated Anodyne O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(-c3ccccc3Cl)cc1)C2 ZINC000045301135 GI Annotated Bother O=C(Cn1ccc(=NCc2ccccc2)cc1)c1cccc(Br)c1 ZINC000045301490 GI Annotated Anodyne CCC(N)(C#Cc1ccc(-c2c(C)[nH]c(C)c(Br)c2=O)cc1)CC ZINC000045302210 GI Annotated Mild COc1ccc2c(c1)N(S(=O)(=O)c1ccc(Cl)cc1)[C@H](C)c1c[nH]nc1-2 ZINC000045316646 GI Annotated Anodyne COc1ccc2c(c1)N(S(=O)(=O)c1ccc(Cl)cc1)[C@@H](C)c1c[nH]nc1-2 ZINC000045316650 GI Annotated Anodyne Fc1cc(-c2cnc3nc(N4CCC(N5CCCCC5)CC4)sc3c2)ccn1 ZINC000045317079 GI Annotated Anodyne CC(=O)Nc1ccc(CN2C[C@@]3(CC(C)(C)Oc4ccccc43)OC2=O)cc1 ZINC000045317549 GI Annotated Anodyne CC(=O)Nc1ccc(CN2C[C@]3(CC(C)(C)Oc4ccccc43)OC2=O)cc1 ZINC000045317554 GI Annotated Anodyne CSc1ccc(-c2cccc(CO[C@@H]3COc4nc([N+](=O)[O-])cn4C3)c2)cc1 ZINC000045317673 GI Annotated Bother Fc1ncccc1-c1cc2sc(N3CCC(N4CCCCC4)CC3)nc2cn1 ZINC000045320225 GI Annotated Anodyne N#Cc1ccc(N(CC(=O)NCCc2ccccc2)CC2CC2)c2ccccc12 ZINC000045322116 GI Annotated Mild Cc1cc(NCCC(=O)Nc2ccccc2)nc(NCCc2ccc(F)cc2)n1 ZINC000045325159 GI Annotated Anodyne Cc1[nH]c(C)c(-c2ccc(-c3ccc(C#N)cc3)nc2)c(=O)c1Br ZINC000045334550 GI Annotated Mild O=C(CSc1snnc1-c1ccc2ccccc2c1)Nc1ccccn1 ZINC000045334574 GI Annotated Anodyne Fc1ccc(OC2CN(c3nccc(NCc4ccccc4Cl)n3)C2)cc1 ZINC000045335174 GI Annotated Anodyne O=C(O)c1cn(Cc2ccc(-c3ccc(F)cc3)nc2)c2c(F)cccc2c1=O ZINC000045337021 GI Annotated Anodyne CN(CCN)Cc1ccc(-c2ccc(-c3nc4cc(F)ccc4[nH]3)s2)cc1 ZINC000045337047 GI Annotated Anodyne COC(=O)/C=C1\CC[C@@]2(O1)[C@H](C)CC[C@H]1C(C)(C)[C@@H](OC(C)=O)CC[C@@]12C ZINC000045337337 GI Annotated Anodyne COc1ccc(N2CCN(C(=S)Nc3ccccc3Cl)C[C@H]2C)cc1 ZINC000045337341 GI Annotated Clean COc1ccc(N2CCN(C(=S)Nc3ccccc3Cl)C[C@@H]2C)cc1 ZINC000045337343 GI Annotated Clean Cc1ccc(-c2nc(C(=O)N(CCC#N)Cc3cccnc3)cs2)cc1F ZINC000045337345 GI Annotated Mild Nc1nc(-c2ccccc2Nc2ccnc3cc(-c4nccs4)ccc23)n[nH]1 ZINC000045338123 GI Annotated Anodyne COC(=O)N1CC[C@H](N(Cc2ccccc2C)c2ccc(C#N)c(Cl)c2)C1 ZINC000045338830 GI Annotated Mild O=C(O)c1cn(Cc2ccc(-c3cccs3)cn2)c2c(F)cccc2c1=O ZINC000045339894 GI Annotated Anodyne O=C1N=C(O)/C(=C/c2cn(Cc3ccccc3)c3ccc(Br)cc23)N1 ZINC000045340231 GI Annotated Anodyne Nc1cc(-n2cc(C(=O)C(=O)Nc3ccncc3)c3ccccc32)ccc1Cl ZINC000045340245 GI Annotated Anodyne COc1ccc(-c2nnc(-c3ccc(I)cc3)o2)cc1 ZINC000045347489 GI Annotated Anodyne C/C=C1\[C@H]2C=C(C)C[C@]1(/N=C/c1ccc(OC)cc1OC)c1ccc(=O)[nH]c1C2 ZINC000045349390 GI Annotated Mild CC1(C)C[C@H](NC(=S)Nc2cccnc2)c2cc(Br)ccc2O1 ZINC000045350376 GI Annotated Anodyne CC1(C)C[C@@H](NC(=S)Nc2cccnc2)c2cc(Br)ccc2O1 ZINC000045350379 GI Annotated Anodyne Cn1c(-c2ccc3nccnc3c2)c(-c2cccc(C(F)(F)F)c2)c(=O)n1C ZINC000045350488 GI Annotated Anodyne Cc1ccc2nc(/N=C3\C(=O)N(CN(C)C)c4cccc(Cl)c43)sc2c1 ZINC000045351109 GI Annotated Mild Cc1ccc(S(=O)(=O)N2Cc3ccccc3OC[C@H]2Cc2ccccc2)cc1 ZINC000045351667 GI Annotated Anodyne O=[N+]([O-])c1ccc(C[n+]2ccc3c(c2)[nH]c2ccc(Br)cc23)cc1 ZINC000045356044 GI Annotated Bother CC(C)c1cc(CCCC[C@@](O)(C(N)=O)C(F)(F)F)cc(C(C)C)c1O ZINC000045357152 GI Annotated Anodyne CC(C)c1cc(CCCC[C@](O)(C(N)=O)C(F)(F)F)cc(C(C)C)c1O ZINC000045357155 GI Annotated Anodyne NC(=O)C1(c2cccc(Sc3ccc(-n4cccc4)cc3)c2)CCOCC1 ZINC000045358227 GI Annotated Anodyne COCCCNc1nc2cc(C)c(C)cc2n1CC(=O)c1cc(C)c(O)c(C)c1 ZINC000045358753 GI Annotated Anodyne NCCCCCNc1nc(Nc2cccc(F)c2)nc(-c2ccc(F)cc2)n1 ZINC000045367736 GI Annotated Anodyne O=C(O)c1cn(Cc2ccc(-c3ccc(F)cc3)cn2)c2c(F)cccc2c1=O ZINC000045367882 GI Annotated Anodyne O=C1O/C(=C\COC(=O)c2ccccc2)C=C1c1ccc(Br)cc1 ZINC000045368108 GI Annotated Anodyne N#CCSc1ncccc1C(=O)NCCc1ccc(Oc2ccccc2)cc1 ZINC000045368527 GI Annotated Mild CCNC(=O)Nc1ccc(-c2nc(C3=CCOCC3)c3sccc3n2)cc1 ZINC000045371040 GI Annotated Anodyne O=C1N(Cc2cc3ccccc3s2)C[C@@H]2CN(Cc3ccsc3)CCN12 ZINC000045372037 GI Annotated Anodyne O=C1N(Cc2cc3ccccc3s2)C[C@H]2CN(Cc3ccsc3)CCN12 ZINC000045372043 GI Annotated Anodyne NCCCCCNc1nc(Nc2cccc(F)c2)nc(-c2ccccc2F)n1 ZINC000045372752 GI Annotated Anodyne CC1(C)CC(=O)C2=C(C1)NC(c1cnccn1)=N[C@H]2c1ccc(F)cc1Cl ZINC000045374979 GI Annotated Mild CC1(C)CC(=O)C2=C(C1)NC(c1cnccn1)=N[C@@H]2c1ccc(F)cc1Cl ZINC000045374983 GI Annotated Mild C/C=C1\[C@H]2C=C(C)C[C@]1(/N=C/c1cc(OC)cc(OC)c1)c1ccc(=O)[nH]c1C2 ZINC000045385532 GI Annotated Mild Nc1cc(Cl)ccc1-n1cc(C(=O)C(=O)Nc2ccncc2)c2ccccc21 ZINC000045385853 GI Annotated Anodyne C/C=C1\[C@H]2C=C(C)C[C@]1(/N=C/c1ccc(O)c(OCC)c1)c1ccc(=O)[nH]c1C2 ZINC000045387630 GI Annotated Mild CS(=O)(=O)Nc1ccc([C@H]2Nc3ccccc3-c3ccnc4[nH]cc2c34)cc1 ZINC000045388091 GI Annotated Anodyne CS(=O)(=O)Nc1ccc([C@@H]2Nc3ccccc3-c3ccnc4[nH]cc2c34)cc1 ZINC000045388095 GI Annotated Anodyne C[C@@H]1CCCN(CCc2cccc3[nH]cc(S(=O)(=O)c4ccccc4)c23)C1 ZINC000045389323 GI Annotated Anodyne C[C@H]1CCCN(CCc2cccc3[nH]cc(S(=O)(=O)c4ccccc4)c23)C1 ZINC000045389328 GI Annotated Anodyne Cc1ccc(S(=O)(=O)N2Cc3ccccc3OC[C@@H]2Cc2ccccc2)cc1 ZINC000045389959 GI Annotated Anodyne OCc1cc(COc2cc(C(F)(F)F)nc3c(C(F)(F)F)cccc23)on1 ZINC000045390071 GI Annotated Anodyne O=C(O)c1cn(Cc2ccc(C(F)(F)F)cc2)c2c(F)ccc(F)c2c1=O ZINC000045390639 GI Annotated Anodyne O=C(Nc1ccccc1-n1cccn1)c1cccc2c1S(=O)c1ccccc1-2 ZINC000045391688 GI Annotated Anodyne CN(C)c1ccc(-c2nnc(-c3ccc(I)cc3)o2)cc1 ZINC000045392318 GI Annotated Anodyne O=C1C(N2CCCC2)=NN(c2ccc(Cl)cc2)CN1c1ccccc1Cl ZINC000045392768 GI Annotated Anodyne COc1ccc(-c2csc3c2-n2cc(Br)cc2C3=O)cc1O ZINC000045392895 GI Annotated Anodyne COc1ccccc1SC[C@@H](F)CN[C@@H]1COc2ccccc2SC1 ZINC000045495760 GI Annotated Anodyne C/C(=C/SCC(C)C)n1c(C(=O)c2ccc(Br)cc2)noc1=O ZINC000045495830 GI Annotated Anodyne Cc1nc(N2C(=O)CS[C@H]2c2c(F)cccc2Cl)nc(C)c1CCC#N ZINC000045495882 GI Annotated Mild Cc1nc(N2C(=O)CS[C@@H]2c2c(F)cccc2Cl)nc(C)c1CCC#N ZINC000045495884 GI Annotated Mild O=[N+]([O-])c1ccc(NC(=S)OCCc2ccc(Br)cc2)cc1 ZINC000045497160 GI Annotated Bother O=C1N/C(=N\c2nc3ccccc3s2)S/C1=C/c1ccc([N+](=O)[O-])cc1 ZINC000045498049 GI Annotated Mild CC(C)[C@H](Cn1nccc1C(F)(F)F)OC(=O)Nc1ccc(F)cc1F ZINC000045498238 GI Annotated Anodyne CC(C)Sc1ccc(C(=O)n2nc(O)c3cc(Br)ccc32)cn1 ZINC000045498359 GI Annotated Anodyne CSc1ccc(Cc2nnc3sc(-c4ccc([N+](=O)[O-])cc4)nn23)cc1 ZINC000045498866 GI Annotated Bother CCn1c2ccccc2c2cc(CO)nc(-c3cc(OC)c(OC)c(OC)c3)c21 ZINC000045505945 GI Annotated Anodyne O=C(CCSc1nnc(-c2ccncc2)s1)NCc1ccccc1Cl ZINC000473081290 GI Annotated Anodyne O=C(CCSc1nnc(-c2ccncc2)s1)NCc1ccc(Cl)cc1 ZINC000473081781 GI Annotated Anodyne Cc1cc2c(c3oc(C(=O)c4ccccc4)cc13)C(=O)c1c(O)cccc1C2=O ZINC000473082037 GI Annotated Clean C[C@H](Sc1nnc(-c2ccncc2)s1)C(=O)Nc1ccccc1Cl ZINC000473082468 GI Annotated Anodyne C[C@@H](Sc1nnc(-c2ccncc2)s1)C(=O)Nc1ccccc1Cl ZINC000473082469 GI Annotated Anodyne CN=c1[nH]c(=NC(C)(C)C)c2sc(-c3ccc(C(F)(F)F)cc3)cc2[nH]1 ZINC000473082825 GI Annotated Anodyne C[C@H](Sc1nnc(-c2ccncc2)s1)C(=O)Nc1ccc(Cl)cc1 ZINC000473083003 GI Annotated Anodyne C[C@@H](Sc1nnc(-c2ccncc2)s1)C(=O)Nc1ccc(Cl)cc1 ZINC000473083006 GI Annotated Anodyne O=[N+]([O-])c1cn2c(n1)O[C@@H](CCOCc1ccc(-c3ccccc3)cc1)CC2 ZINC000473084185 GI Annotated Bother CCc1cc(=O)c2c(C)cc3c(c2o1)C(=O)c1c(OC(C)C)cccc1C3=O ZINC000473084595 GI Annotated Clean O=C(CCSc1nnc(-c2ccncc2)s1)Nc1ccccc1Cl ZINC000473084650 GI Annotated Anodyne CN(C)CCCNc1nc(=N)[nH]c2cc(-c3ccc(C(F)(F)F)cc3)sc12 ZINC000473086359 GI Annotated Anodyne CC(C)(C)c1cc(=NC(=O)Nc2cccc(Oc3cncc(Cl)n3)c2)[nH]o1 ZINC000473086398 GI Annotated Anodyne Cc1ccc(C(C)C)cc1O[C@@H](C)C(=O)Nc1ccc(OCC(=O)O)c(F)c1 ZINC000473086963 GI Annotated Anodyne Cc1ccc(C(C)C)cc1O[C@H](C)C(=O)Nc1ccc(OCC(=O)O)c(F)c1 ZINC000473086965 GI Annotated Anodyne O=[N+]([O-])c1cn2c(n1)O[C@@H](CCOc1ccc(-c3ccc(F)cc3)cc1)CC2 ZINC000473087864 GI Annotated Bother COc1ccc(/C=C(/C(=O)N2CC(=O)Nc3ccccc32)c2cccs2)cc1 ZINC000473088689 GI Annotated Anodyne Nc1nccc2cc(N[C@@H](C(=O)NCc3ccccc3)c3ccccc3)ccc12 ZINC000473088698 GI Annotated Anodyne Nc1nccc2cc(N[C@H](C(=O)NCc3ccccc3)c3ccccc3)ccc12 ZINC000473088700 GI Annotated Anodyne CSc1cccc(N=c2[nH]c(-c3ccc(S(C)(=O)=O)cc3)cs2)c1 ZINC000473089033 GI Annotated Anodyne Cc1ccc(-c2cnc(C3(NCc4c[nH]c5ccccc45)CCNCC3)[nH]2)cc1 ZINC000473089351 GI Annotated Anodyne CN1CCN(Cc2ccccc2CNC2(c3ccccc3F)CCCC2)CC1 ZINC000473090831 GI Annotated Anodyne CN(C)c1ccc([C@@H]2SCC(=O)N2c2ccc(Br)cc2)cc1 ZINC000473090876 GI Annotated Clean CN(C)c1ccc([C@H]2SCC(=O)N2c2ccc(Br)cc2)cc1 ZINC000473090877 GI Annotated Clean Cc1cc(NCc2cccc(Cl)c2Cl)c2cccc(S(N)(=O)=O)c2n1 ZINC000473093340 GI Annotated Anodyne O=c1oc2ccc(Cl)cc2c(=O)n1-c1ccc(C(F)(F)F)cc1Cl ZINC000473094003 GI Annotated Anodyne COc1ccc(/C=C(/C(=O)Nc2c(C)noc2C)c2ccc(OC)cc2)cc1 ZINC000473094053 GI Annotated Anodyne CCc1ccnc(-c2nccn2Cc2nnc(COc3ccc(Cl)cc3)o2)c1 ZINC000473094119 GI Annotated Anodyne CC1(C)CN(C(=O)c2ccc(F)cc2)Cc2oc(COc3ccccc3)nc21 ZINC000473096824 GI Annotated Anodyne Cc1cccc(N2C[C@@H](C)n3nc(COc4ccc(Cl)cn4)cc3C2=O)c1 ZINC000473096836 GI Annotated Anodyne COc1cc(CCNCc2cccc3cc[nH]c23)c(OC)cc1Br ZINC000473097934 GI Annotated Anodyne C#Cc1ccn2cc(-c3ccc(NC(=O)N=c4cc(C(C)(C)C)o[nH]4)cc3)nc2c1 ZINC000473100543 GI Annotated Mild Cc1ccccc1N1C[C@@H](C)n2nc(COc3ccc(Cl)cn3)cc2C1=O ZINC000473100629 GI Annotated Anodyne CCC[C@@H](NC(=O)c1ncco1)c1cnc(Nc2ccc(C)nc2)c(Cl)c1 ZINC000473100662 GI Annotated Anodyne C#Cc1ccc2nc(-c3ccc(NC(=O)N=c4cc(C(C)(C)C)o[nH]4)cc3)cn2c1 ZINC000473101598 GI Annotated Mild C[C@@H]1CN(c2ccc(F)cc2)C(=O)c2cc(COc3ccccc3Cl)nn21 ZINC000473102956 GI Annotated Anodyne N=c1nc(NC2CCOCC2)c2sc(-c3ccc(C(F)(F)F)cc3)cc2[nH]1 ZINC000473105514 GI Annotated Anodyne CCC[C@@H](NC(=O)c1cocn1)c1cnc(Nc2ccc(C)nc2)c(Cl)c1 ZINC000473105541 GI Annotated Anodyne Cc1ccc(N2C[C@@H](C)n3nc(COc4ccc(Cl)cn4)cc3C2=O)cc1 ZINC000473106525 GI Annotated Anodyne COc1ccc(-n2nc(OC(C)C)c(Oc3c(F)cccc3F)c2C)nc1 ZINC000473107486 GI Annotated Anodyne CN1CCN(Cc2cccc(CNC3(c4ccccc4F)CCCC3)c2)CC1 ZINC000473107758 GI Annotated Anodyne CC(C)(C)c1cc(=NC(=O)Nc2ccc(-c3cn4cccc(F)c4n3)cc2)[nH]o1 ZINC000473108509 GI Annotated Anodyne N#Cc1ccc(NC(=O)Nc2ccc(N=C3C(=O)Nc4ccc(F)cc43)cc2)cc1 ZINC000473108554 GI Annotated Mild COc1ccc(OC)c(/C=N/c2c(C#N)ncn2Cc2ccccc2Cl)c1 ZINC000473108563 GI Annotated Mild CC(C)(C)c1cc(C(=O)/C(C#N)=N/Nc2cc(F)cc(C(F)(F)F)c2)no1 ZINC000473109204 GI Annotated Mild COc1ccc(/C=N/c2c(C#N)ncn2Cc2ccccc2Cl)cc1OC ZINC000473110466 GI Annotated Mild CC1=C2[C@H]3OC(=O)[C@@H](CSc4ccc(F)c(F)c4)[C@@H]3CC[C@@]2(C)C=CC1=O ZINC000473111867 GI Annotated Mild COc1ccc(SC[C@@H]2C(=O)O[C@@H]3C4=C(C)C(=O)C=C[C@]4(C)CC[C@@H]23)cc1 ZINC000473113621 GI Annotated Mild COc1ccccc1SC[C@@H]1C(=O)O[C@@H]2C3=C(C)C(=O)C=C[C@]3(C)CC[C@@H]12 ZINC000473114010 GI Annotated Mild N#Cc1ccc(Nc2nccc(=Nc3ccc4cc(C#N)ccc4c3F)[nH]2)cc1 ZINC000473114361 GI Annotated Mild CC(=O)NC[C@]1(C)CCC[C@]2(C)c3ccc(C(C)C)cc3/C(=N/NC(C)=O)C[C@H]21 ZINC000473115498 GI Annotated Reactive Cn1cc(Oc2cccc([N+](=O)[O-])c2Cl)c(=O)cc1COc1ccccc1 ZINC000473119860 GI Annotated Bother Cc1cc(-c2ccc(CCC(=O)Nc3ccc(-c4cnccn4)cn3)cc2)ccn1 ZINC000473123200 GI Annotated Anodyne COc1cc(-n2ccc3ccccc32)cc2c1OCCN(Cc1cccnc1)C2 ZINC000473128644 GI Annotated Anodyne Cc1ccc(C2=C(c3ccccc3)C3(C=CC(=O)C=C3)N(C)C2=O)cc1Cl ZINC000473133138 GI Annotated Mild CO[C@@H](Cn1nc(-c2ccccc2)c2c(N)nc(SC)nc21)c1ccccc1 ZINC000473134917 GI Annotated Anodyne CO[C@H](Cn1nc(-c2ccccc2)c2c(N)nc(SC)nc21)c1ccccc1 ZINC000473134918 GI Annotated Anodyne C=CCc1cc2c(c3c1O[C@H](c1cc(OC)c(OC)c(OC)c1)[C@H]3C)OCO2 ZINC000473136185 GI Annotated Mild CC1=CCC[C@@H]2[C@]1(C)CC[C@H](C)[C@@]2(C)CC1=CC(=O)C=C(N[C@@H](C)C(=O)O)C1=O ZINC000473151232 GI Annotated Mild CC1=CCC[C@@H]2[C@]1(C)CC[C@H](C)[C@@]2(C)CC1=CC(=O)C=C(NCCC(=O)O)C1=O ZINC000473151270 GI Annotated Mild Clc1cccc(N2CCN(c3noc(-c4ccc5[nH]ccc5c4)n3)CC2)c1 ZINC000473152169 GI Annotated Anodyne CCCCOc1cccc2c1C(=O)c1c(OCCCC)cc(CO)cc1C2=O ZINC000473154723 GI Annotated Clean O=Cc1cn2c3c1ccc1c4ccccc4n(c13)C[C@H](OCCN1CCCC1)C2 ZINC000473154765 GI Annotated Bother O=Cc1cn2c3c1ccc1c4ccccc4n(c13)C[C@@H](OCCN1CCCC1)C2 ZINC000473154766 GI Annotated Bother CCCCOCCCNCc1cc2c(cc1O)OC=C(c1ccc(O)cc1)C2 ZINC000473155066 GI Annotated Clean O=C(Nc1cccc(C(F)(F)F)c1)c1c(NO)cc(-c2cccs2)oc1=O ZINC000473160539 GI Annotated Anodyne CC(C)(OC(=O)c1ccc(C2CCCC2)c(OCC2CC2)n1)c1cc(N)on1 ZINC000473166100 GI Annotated Anodyne O=c1c2ccc(Cl)cc2sc2c(N3CCNCC3)nc3ccccc3c12 ZINC000473166245 GI Annotated Bother Cc1ccoc1C(=O)Nc1ccc(N2C(=O)c3ccccc3C2=O)cc1Cl ZINC000473172550 GI Annotated Anodyne CN(C)C(=O)[C@H]1CC[C@@H](C(=O)N2CC[C@]3(C)c4ccccc4C[C@@H]2C3(C)C)CC1 ZINC000473182985 GI Annotated Anodyne COC(=O)[C@H]1CCC[C@H](C(=O)N2CC[C@]3(C)c4ccccc4C[C@@H]2C3(C)C)C1 ZINC000473183007 GI Annotated Anodyne CCc1ccccc1Oc1ccc(S(=O)(=O)Nc2ccc(F)cn2)cc1C#N ZINC000473198556 GI Annotated Mild Cc1cc(C)cc(Oc2ccc(S(=O)(=O)Nc3ccc(F)cn3)cc2C#N)c1 ZINC000473200894 GI Annotated Mild Cc1ccc(NCc2c(F)cc3c(=O)c(C(=O)O)cn4c3c2OC[C@@H]4C)cc1C ZINC000473243956 GI Annotated Anodyne COc1cc2ccc3c(CC[N+](C)(C)[O-])cc(OC)c(OC)c3c2cc1OC ZINC000473245315 GI Annotated Bother N#Cc1cc(Cl)cc(C#CC=C2CCN(c3ncccc3[N+](=O)[O-])CC2)c1 ZINC000473249388 GI Annotated Mild Oc1ccc(N=c2[nH]c3ccc(Cl)cc3[nH]c2=Nc2ccc(O)cc2)cc1 ZINC000474603655 GI Annotated Anodyne COc1ccc(CN2C(=O)/C(=C\c3ccc(N(C)C)cc3)c3cccnc32)cc1 ZINC000474605927 GI Annotated Clean CCOc1nn(-c2ncc(Br)cc2F)c(C)c1Cc1ccccc1 ZINC000474609322 GI Annotated Anodyne COc1ccc2c([C@@H]3CCc4ccc(Br)cc43)ncnc2c1OC ZINC000474609649 GI Annotated Anodyne COc1ccc2c([C@H]3CCc4ccc(Br)cc43)ncnc2c1OC ZINC000474609650 GI Annotated Anodyne Cc1c(Oc2c(F)cccc2F)c(OC(C)C)nn1-c1ccc(Cl)nn1 ZINC000474609736 GI Annotated Anodyne CCOc1ccc(-n2nc(OC(C)C)c(Oc3c(F)cccc3F)c2C)nn1 ZINC000474609771 GI Annotated Anodyne COc1cc2c(c(C)c1C(=O)C=C(C)C)OC(=O)c1c(C)cc(O)c(C=O)c1O2 ZINC000048999006 GI Annotated Mild in-vitro CC(=O)O[C@@H]1O[C@H]2OC(=O)[C@H](C)C3=C([C@@]4(C)CCCC(C)(C)C4)CC[C@@H]1[C@H]32 ZINC000048999161 GI Annotated Anodyne Cc1ccc(C(=O)c2nc(NCCc3ccccn3)nc3ccsc23)s1 ZINC000048999173 GI Annotated Anodyne O=S(=O)(Cc1ccc2c(c1)CCNCC2)c1ccc(-c2ccc(F)cc2)cc1 ZINC000049013974 GI Annotated Anodyne NC(=O)c1ccc2c(n1)nc(NCc1ccccc1Cl)n2CC1CCCCC1 ZINC000049021127 GI Annotated Anodyne NC(=O)c1ccc2c(n1)nc(NCc1ccccc1Cl)n2C1CCCCC1 ZINC000049031414 GI Annotated Anodyne CCNc1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 ZINC000049032735 GI Annotated Anodyne CN(C)c1cc2nc(NCc3cccnc3)nc(C(=O)c3cccs3)c2s1 ZINC000049033046 GI Annotated Anodyne C=C(C)[C@H]1CC=C(C)[C@]2(O)[C@@H](C(=O)OC)O[C@@H](c3cccc4ccccc34)[C@H]12 ZINC000049033717 GI Annotated Mild CC1(C)OC(=O)C(=CNc2ccccc2-c2nc3ccccc3s2)C(=O)O1 ZINC000049033987 GI Annotated Clean CC(=O)Oc1c2c(c(OC(C)=O)c3ccccc13)[C@@]1(C)C[C@]2(C)[C@]2(C)O[C@@]21C ZINC000049034705 GI Annotated Anodyne CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=C/c1ccccc1Br ZINC000049035303 GI Annotated Reactive Cc1nc(Nc2c(Cl)cc(C#N)c(Cl)c2Cl)c(=O)n([C@@H](C)C2CC2)n1 ZINC000049035846 GI Annotated Mild Cc1nc(Nc2c(Cl)cc(C#N)c(Cl)c2Cl)c(=O)n([C@H](C)C2CC2)n1 ZINC000049035848 GI Annotated Mild CCOC(=O)c1c(C)noc1-c1ccc2cc(CCN3CCC[C@H]3C)ccc2n1 ZINC000049035932 GI Annotated Anodyne NC(=O)c1ccccc1S(=O)(=O)c1ccc(/C=C/c2ccc(F)cc2F)cc1 ZINC000049036141 GI Annotated Anodyne NC(=O)c1ccc(S(=O)(=O)c2ccc(/C=C/c3ccc(F)cc3F)cc2)cc1 ZINC000049037320 GI Annotated Anodyne C[C@@H]1CCc2c([nH]c3ccccc23)[C@]2(N1)C(=O)Nc1ccc(Br)cc12 ZINC000049037513 GI Annotated Anodyne C[C@H]1CCc2c([nH]c3ccccc23)[C@]2(N1)C(=O)Nc1ccc(Br)cc12 ZINC000049037515 GI Annotated Anodyne C[C@@H]1CCc2c([nH]c3ccccc23)[C@@]2(N1)C(=O)Nc1ccc(Br)cc12 ZINC000049037517 GI Annotated Anodyne C[C@H]1CCc2c([nH]c3ccccc23)[C@@]2(N1)C(=O)Nc1ccc(Br)cc12 ZINC000049037519 GI Annotated Anodyne COc1ccc([C@@H](N)c2ccc3sc(-c4ccnc(N)n4)c(C)c3c2)cc1 ZINC000049045247 GI Annotated Anodyne COc1ccc([C@H](N)c2ccc3sc(-c4ccnc(N)n4)c(C)c3c2)cc1 ZINC000049045251 GI Annotated Anodyne C/C=C(/C)C(=O)OC/C=C/c1cc(OC)c(OC(=O)[C@@H](C)CC)c(OC)c1 ZINC000049047534 GI Annotated Anodyne C[C@H]1CNCC[C@]1(F)CNC(=O)c1c(F)cccc1-c1cccc(Cl)c1 ZINC000049047774 GI Annotated Anodyne Cc1cccc(NS(=O)(=O)c2cc3c(CN=[N+]=[N-])cc(=O)oc3cc2C)c1 ZINC000049048208 GI Annotated Clean COCCn1c([C@@H]2COc3ccccc3O2)nc2ccc(-c3ccncc3)cc21 ZINC000049048362 GI Annotated Anodyne COCCn1c([C@H]2COc3ccccc3O2)nc2ccc(-c3ccncc3)cc21 ZINC000049048366 GI Annotated Anodyne O=C(Nc1ccc(O)cc1C(F)(F)F)c1cc(NC2CCCCC2)ncn1 ZINC000049049046 GI Annotated Anodyne Cc1ccc(NS(=O)(=O)c2cc3c(CN=[N+]=[N-])cc(=O)oc3cc2C)c(C)c1 ZINC000049049150 GI Annotated Clean CCNC(=O)c1cc(-c2sc(-c3cccnc3)nc2-c2ccccc2)n[nH]1 ZINC000049050024 GI Annotated Anodyne Nc1nc(-c2ccccc2)c2c(n1)-c1c(CN3CCCCCC3)cccc1C2=O ZINC000049053467 GI Annotated Anodyne NC(=O)c1cccc(S(=O)(=O)c2ccc(/C=C/c3ccc(F)cc3F)cc2)c1 ZINC000049053973 GI Annotated Anodyne O=[N+]([O-])c1ccc(/N=C(/Cc2ccc(F)cc2)c2ccc(O)c(O)c2O)cc1 ZINC000049054029 GI Annotated Mild Cc1cc2oc(=O)cc(CN=[N+]=[N-])c2cc1S(=O)(=O)Nc1c(C)cccc1C ZINC000049054615 GI Annotated Clean NCCCCCCN(Cc1nc2ccccc2[nH]1)[C@@H]1CCCc2cccnc21 ZINC000049055701 GI Annotated Anodyne NCCCCCCN(Cc1nc2ccccc2[nH]1)[C@H]1CCCc2cccnc21 ZINC000049055704 GI Annotated Anodyne CC(C)=CCOc1ccc([C@@H]2C[C@@H]2C(=O)NNc2nncc3ccccc23)cc1 ZINC000049067069 GI Annotated Reactive CC(C)=CCOc1ccc([C@H]2C[C@@H]2C(=O)NNc2nncc3ccccc23)cc1 ZINC000049067071 GI Annotated Reactive CC(C)=CCOc1ccc([C@@H]2C[C@H]2C(=O)NNc2nncc3ccccc23)cc1 ZINC000049067073 GI Annotated Reactive CC(C)=CCOc1ccc([C@H]2C[C@H]2C(=O)NNc2nncc3ccccc23)cc1 ZINC000049067075 GI Annotated Reactive NC(=O)c1sc2nc3c(c(-c4ccc(C(=O)O)cc4)c2c1N)CCCCCC3 ZINC000049067143 GI Annotated Anodyne CC1=C(C#N)c2nc(N)c(C#N)c(C)c2/C1=C/c1cccc(Br)c1 ZINC000049067315 GI Annotated Reactive O=C(OCc1ccccc1)c1sc2c([N+](=O)[O-])c(O)c(O)cc2c1Cl ZINC000049068034 GI Annotated Clean COc1ccc(CC/C=C/C(=O)CCc2ccc(OC)c(OC)c2)cc1OC ZINC000049068622 GI Annotated Mild CCOC(=O)c1c(-c2cccc(C(F)(F)F)c2)[nH]c2cccc(OC)c2c1=O ZINC000049069215 GI Annotated Anodyne CC(C)CCN1CCC(Oc2ccc3[nH]c(=O)c4c(c3c2)CCSC4)CC1 ZINC000049069975 GI Annotated Anodyne Cc1ccccc1[C@@H]1CCc2c(C(=O)NCC3CC3)cc3c(nc(C)n3C)c2O1 ZINC000049070969 GI Annotated Anodyne NCc1ccccc1CN(Cc1nc2ccccc2[nH]1)[C@@H]1CCCc2cccnc21 ZINC000049071504 GI Annotated Anodyne NCc1ccccc1CN(Cc1nc2ccccc2[nH]1)[C@H]1CCCc2cccnc21 ZINC000049071506 GI Annotated Anodyne CCN(C(=O)c1cccc2c1OCC2)c1ccnc(N[C@@H](C)c2ccccc2)n1 ZINC000049072333 GI Annotated Anodyne COc1ccc(N(C(=O)c2cnc(-c3cccc(C)c3C)cn2)C(C)C)cn1 ZINC000049072390 GI Annotated Anodyne CCN1CCC(N(C(=O)NCc2ccc(F)cc2)c2ccc(Cl)cn2)CC1 ZINC000049072705 GI Annotated Anodyne N#Cc1ccc(Nc2nccc(/C(=N\O)c3ccccc3Br)n2)cc1 ZINC000049072767 GI Annotated Mild N#Cc1ccc(Nc2nccc(/C(=N\O)c3cccc(Br)c3)n2)cc1 ZINC000049072769 GI Annotated Mild N#Cc1ccc(Nc2nccc(/C(=N\O)c3ccc(Br)cc3)n2)cc1 ZINC000049073061 GI Annotated Mild CCCCCN1CCC(Oc2ccc3[nH]c(=O)c4c(c3c2)CCSC4)CC1 ZINC000049073344 GI Annotated Anodyne On1ncc(C2CCNCC2)c1Cc1ccc2ccccc2c1Br ZINC000049087624 GI Annotated Anodyne Cn1cc(/C=C2\Oc3cc(O)cc(O)c3C2=O)c2c(-c3ccccc3)ccnc21 ZINC000049087678 GI Annotated Mild COc1cc(-n2ncnc2-c2ccc(Cl)c(Cl)c2)cc(OC)c1OC ZINC000049088145 GI Annotated Anodyne S=C(N/N=C/c1ccc2ccccc2n1)Nc1ccccc1Br ZINC000049088504 GI Annotated Mild Cc1ccccc1[C@@H]1CCc2c(C(=O)NC(C)C)cc3c(nc(C)n3C)c2O1 ZINC000049088589 GI Annotated Anodyne Nc1cccc(/C=C2\CN(Cc3ccccc3)C/C(=C\c3cccc(N)c3)C2=O)c1 ZINC000049088597 GI Annotated Mild CCCNC(=O)c1cc2c(nc(C)n2C)c2c1CC[C@@H](c1ccccc1C)O2 ZINC000049088912 GI Annotated Anodyne Cc1nc2c3c(c(C(=O)N(C)C)cc2n1C)CC[C@@H](c1ccc(Cl)cc1)O3 ZINC000049088959 GI Annotated Anodyne CNC(=O)c1cc2c(nc(C)n2C)c2c1CC[C@@H](c1ccc(Cl)cc1C)O2 ZINC000049089032 GI Annotated Anodyne Cc1ccc(C(=O)c2nc(NCCc3cccnc3)nc3ccsc23)s1 ZINC000049089937 GI Annotated Anodyne CC(C)=CC(=O)c1c(O)cc2c(c1C)OC(=O)c1c(C)cc(O)c(C=O)c1O2 ZINC000049110768 GI Annotated Mild in-vitro Cc1ccc(NS(=O)(=O)c2cc3c(CN=[N+]=[N-])cc(=O)oc3cc2C)cc1 ZINC000049112246 GI Annotated Clean CCOC(=O)c1cc(-c2sc(-c3cccnc3)nc2N2CCC(C)CC2)n[nH]1 ZINC000049112609 GI Annotated Anodyne CCN(C(=O)c1ccc2c(c1)CCO2)c1ccnc(N[C@@H](C)c2ccccc2)n1 ZINC000049112703 GI Annotated Anodyne Sc1nnc(COc2ccc(Cl)cc2Cl)n1/N=C/c1ccccc1 ZINC000049112923 GI Annotated Mild FC(F)(F)COc1ccc([C@H]2C[C@H]2c2nnc3c4ccccc4cnn23)cc1 ZINC000049113007 GI Annotated Anodyne FC(F)(F)COc1ccc([C@H]2C[C@@H]2c2nnc3c4ccccc4cnn23)cc1 ZINC000049113008 GI Annotated Anodyne FC(F)(F)COc1ccc([C@@H]2C[C@H]2c2nnc3c4ccccc4cnn23)cc1 ZINC000049113009 GI Annotated Anodyne FC(F)(F)COc1ccc([C@@H]2C[C@@H]2c2nnc3c4ccccc4cnn23)cc1 ZINC000049113010 GI Annotated Anodyne Cc1ccccc1[C@@H]1CCc2c(C(=O)N3CC(F)C3)cc3c(nc(C)n3C)c2O1 ZINC000049113012 GI Annotated Anodyne C=CCN(CC=C)c1ccc2nc(SC)n(Cc3ccccc3)c(=O)c2c1 ZINC000049113149 GI Annotated Mild Cc1[nH]c2ccc(Br)cc2c1/C=C1\Oc2cc(O)cc(O)c2C1=O ZINC000049113166 GI Annotated Mild Cc1nc2c3c(c(C(=O)N4CCC4)cc2n1C)CC[C@@H](c1ccc(Cl)cc1)O3 ZINC000049113246 GI Annotated Anodyne CC1(C)OC[C@@H]([C@]2(C)C=C3[C@@H](O)C[C@@H]4C(C)(C)[C@H](O)CC[C@@]4(C)[C@@H]3CC2)O1 ZINC000049115259 GI Annotated Anodyne CC1(C)OC[C@@H]([C@]2(C)C=C3[C@@H](O)C[C@@H]4C(C)(C)[C@H](O)CC[C@@]4(C)[C@H]3CC2)O1 ZINC000049115265 GI Annotated Anodyne CCOc1ccc(-c2ncnn2-c2cc(OC)c(OC)c(OC)c2)cc1Cl ZINC000049115443 GI Annotated Anodyne C[C@]1(CC(=O)NCc2ccccc2OC(F)(F)F)CC2(CCCCC2)OO1 ZINC000049678931 GI Annotated Reactive C[C@@]1(CC(=O)NCc2ccccc2OC(F)(F)F)CC2(CCCCC2)OO1 ZINC000049678936 GI Annotated Reactive C[C@]1(CC(=O)NCc2cccc(Br)c2)CC2(CCCCC2)OO1 ZINC000049694683 GI Annotated Reactive C[C@@]1(CC(=O)NCc2cccc(Br)c2)CC2(CCCCC2)OO1 ZINC000049694684 GI Annotated Reactive O=C(CC1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3)N1CCCCC1 ZINC000049723182 GI Annotated Reactive O=C(OCc1ccccc1)[C@@H]1COC(c2cccnc2Sc2ccccc2)=N1 ZINC000049781481 GI Annotated Anodyne CCO[P@@](=O)(O)CC1CCC2(CC1)OOC1(O2)C2CC3CC(C2)CC1C3 ZINC000049783880 GI Annotated Reactive CC(C)[C@H](C(=O)O)[C@@H]1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S ZINC000049784212 GI Annotated Mild CC(C)[C@@H](C(=O)O)[C@@H]1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S ZINC000049784213 GI Annotated Mild CC(C)[C@H](C(=O)O)[C@H]1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S ZINC000049784214 GI Annotated Mild CC(C)[C@@H](C(=O)O)[C@H]1C(=O)/C(=C/c2ccc(Br)cc2)SC1=S ZINC000049784215 GI Annotated Mild OCCNC[C@H]1CC[C@@H]2[C@H](O1)c1cc(Cl)cc(F)c1N[C@H]2c1ccccc1 ZINC000049784410 GI Annotated Anodyne NC(=O)c1c(F)ccc(OCc2nc3cc(Br)ccc3s2)c1F ZINC000049784442 GI Annotated Anodyne CC1(C)Oc2cc3oc(=O)ccc3cc2C[C@@H]1OC(=O)/C=C/c1ccccc1 ZINC000049784987 GI Annotated Anodyne N#Cc1ccc(-c2nc(N3CCCCC3)c3ncn(-c4ccc(F)cc4)c3n2)cc1 ZINC000049785833 GI Annotated Mild CCCCNCCC[PH](c1ccccc1)(c1ccccc1)c1ccccc1 ZINC000049803027 GI Annotated Reactive C#C[C@H]1C[C@H]2[C@@H]3CCC(=O)[C@@]3(C)CC[C@@H]2[C@@]2(C)CC/C(=N\OCCCNC)C[C@H]12 ZINC000049803187 GI Annotated Mild COc1cc2c(cc1OC)C(=O)N1C=C(/C=C/c3ccc(F)cc3)C[C@H]1C=N2 ZINC000049803314 GI Annotated Anodyne CCN(CC)CCNc1ccc2c(ccc3c4cc5c(cc4cnc23)OCO5)n1 ZINC000049803336 GI Annotated Bother C#C[C@H]1C[C@H]2[C@@H]3CCC(=O)[C@@]3(C)CC[C@@H]2[C@@]2(C)CC/C(=N\O[C@@H]3CCNC3)C[C@H]12 ZINC000049803502 GI Annotated Mild COc1cc2c(cc1OC)C(=O)N1C=C(c3cnc4ccccc4c3)C[C@H]1C=N2 ZINC000049803713 GI Annotated Anodyne COc1cc2cnc3c4ccc(NCCCN(C)C)nc4ccc3c2cc1OC ZINC000049803929 GI Annotated Bother Cc1c(C)c2c(c(Cc3noc(-c4ccc(O)c(O)c4)n3)c1O)CCC(C)(C)O2 ZINC000049807613 GI Annotated Clean Cc1c(C)c2c(c(CC(=O)/C=C/c3ccc(O)c(O)c3)c1O)CCC(C)(C)O2 ZINC000049807861 GI Annotated Mild Cc1oncc1CNC(=O)c1ccc2cc(-c3n[nH]cc3-c3ccccc3)[nH]c2c1 ZINC000049808378 GI Annotated Anodyne COc1cc2c(cc1OC)C(=O)N1C=C(c3ccc(SC)cc3)C[C@H]1C=N2 ZINC000049808407 GI Annotated Anodyne CC(C)N(C[C@H](O)Cn1c2ccccc2c(=O)c2cccc(Cl)c21)C(C)C ZINC000049816742 GI Annotated Bother CC(C)N(C[C@@H](O)Cn1c2ccccc2c(=O)c2cccc(Cl)c21)C(C)C ZINC000049816743 GI Annotated Bother O=C(NCC[S@](=O)Cc1cccc(Cl)c1)c1c(Cl)cccc1Cl ZINC000049853515 GI Annotated Anodyne O=C(NCC[S@@](=O)Cc1cccc(Cl)c1)c1c(Cl)cccc1Cl ZINC000049853516 GI Annotated Anodyne CCCCCCCCNC1=NC(C)(C)NC(NCc2ccc(Cl)cc2)=N1 ZINC000049867237 GI Annotated Mild CCCCCCCCNC1=NC(C)(C)NC(NCc2ccccc2Cl)=N1 ZINC000049867239 GI Annotated Mild Brc1ccc2c(c1)CC=C(c1ccccc1)C(N1CCNCC1)=N2 ZINC000049918215 GI Annotated Anodyne O=c1oc(Nc2ccccc2I)nc2cc(Cl)ccc12 ZINC000000538594 GI Annotated Anodyne COc1cc([C@H]2CN=C(c3ccc4c(c3)cc(C)n4C)O2)cc(OC)c1OC ZINC000000587638 GI Annotated Anodyne C1=C(c2c[nH]c3ccccc23)CCN(CCOc2cccc3c2OCCO3)C1 ZINC000000595485 GI Annotated Anodyne CCC(=O)Oc1c2c(c(OC(=O)CC)c3cc(Cl)ccc13)OCCCO2 ZINC000000603464 GI Annotated Anodyne O=C(Oc1ccccc1)N1c2ccccc2[C@@]23O[C@]24CCC[C@H]3C#C/C=C\C#C[C@H]14 ZINC000000604518 GI Annotated Mild O=C(c1ccc2c(c1)oc(=O)n2CCc1ccccn1)c1ccccc1Cl ZINC000000604887 GI Annotated Anodyne Cc1ccnc(N2CCN(CCc3c(C)n4c5c(cc(C)cc35)CCC4)CC2)c1 ZINC000000606587 GI Annotated Anodyne N#CC1=C(N)Oc2[nH]nc(-c3ccc(-c4ccccc4)cc3)c2[C@H]1c1ccccn1 ZINC000000646930 GI Annotated Reactive COc1cc(Br)c([C@H](C)NC(=O)c2ccc(C)cc2)cc1OC ZINC000000668029 GI Annotated Anodyne COc1cc(Br)c([C@@H](C)NC(=O)c2ccc(C)cc2)cc1OC ZINC000000668030 GI Annotated Anodyne COc1ccccc1-c1nnc(S[C@H]2CCc3ccccc3NC2=O)s1 ZINC000000684909 GI Annotated Anodyne COc1ccccc1-c1nnc(S[C@@H]2CCc3ccccc3NC2=O)s1 ZINC000000684910 GI Annotated Anodyne O=c1c2ccccc2ncn1CCCn1c(Cc2ccccc2)nc2ccccc21 ZINC000000704302 GI Annotated Anodyne O=c1c2cnn(-c3ccccc3)c2nc(-c2ccccc2F)n1-c1ccccc1 ZINC000000752757 GI Annotated Anodyne CC1(C)Cc2c(sc(N(C(=O)c3ccco3)C(=O)c3ccco3)c2C#N)CO1 ZINC000000752942 GI Annotated Mild Cc1nc(N2CCC(C)CC2)c2c(C)c(C(=O)Nc3cc(C)on3)sc2n1 ZINC000000753906 GI Annotated Anodyne Cc1nc(N2CCC(C)CC2)c2c(C)c(C(=O)N3CCC(C)CC3)sc2n1 ZINC000000753915 GI Annotated Anodyne CCOC(=O)Nc1ccc2c(c1)N(C(=O)CNC(C)C)c1ccccc1CC2 ZINC000000754979 GI Annotated Anodyne CCOC(=O)c1nc(Nc2ccc3c(c2)OCO3)c2c3c(sc2n1)CCCC3 ZINC000000755381 GI Annotated Anodyne CC(=O)N(Cc1ccccc1)[C@H]1CC(C)(C)Oc2ccc(C(=O)N(C)C)cc21 ZINC000000756203 GI Annotated Anodyne CC(=O)N(Cc1ccccc1)[C@@H]1CC(C)(C)Oc2ccc(C(=O)N(C)C)cc21 ZINC000000756204 GI Annotated Anodyne O=C1c2ccccc2[C@@](O)(c2ccc(Br)cc2)N1c1ccccc1 ZINC000000756254 GI Annotated Anodyne O=C1c2ccccc2[C@](O)(c2ccc(Br)cc2)N1c1ccccc1 ZINC000000756255 GI Annotated Anodyne Cc1cc(O)c(C2=NCCS[C@H](c3ccccc3Br)C2)c(=O)o1 ZINC000000756397 GI Annotated Anodyne CC(C)(C)C1CCC(OC(=O)[C@@H]2CC=CC[C@H]2C(=O)OC[C@H]2CCCO2)CC1 ZINC000000763008 GI Annotated Anodyne CC(=O)N(Cc1ccccc1)[C@H]1CC2(CCCCC2)Oc2ccc(C(N)=O)cc21 ZINC000000763119 GI Annotated Anodyne CC(=O)N(Cc1ccccc1)[C@@H]1CC2(CCCCC2)Oc2ccc(C(N)=O)cc21 ZINC000000763120 GI Annotated Anodyne C[C@H]1C[C@@H](C)CN(c2ccc3[nH]c(=O)c(CSCc4ccccc4)nc3n2)C1 ZINC000000766810 GI Annotated Anodyne C[C@@H]1C[C@@H](C)CN(c2ccc3[nH]c(=O)c(CSCc4ccccc4)nc3n2)C1 ZINC000000766811 GI Annotated Anodyne C[C@H]1C[C@H](C)CN(c2ccc3[nH]c(=O)c(CSCc4ccccc4)nc3n2)C1 ZINC000000766812 GI Annotated Anodyne O=C(NCCc1ccc(F)cc1)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000000766969 GI Annotated Anodyne O=C(NCCc1ccc(F)cc1)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccccc1 ZINC000000766970 GI Annotated Anodyne O=C(NCCc1ccc(F)cc1)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000000767028 GI Annotated Anodyne O=C(NCCc1ccc(F)cc1)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccsc1 ZINC000000767030 GI Annotated Anodyne C[C@H](NC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccoc1)c1ccc(F)cc1 ZINC000000767193 GI Annotated Anodyne CC(C)c1ccc([C@@H]2ON=C(c3ccccc3)[C@@H]2C(=O)NCC(C)(C)CO)cc1 ZINC000000767296 GI Annotated Anodyne CC(C)c1ccc([C@H]2ON=C(c3ccccc3)[C@@H]2C(=O)NCC(C)(C)CO)cc1 ZINC000000767297 GI Annotated Anodyne C[C@@]1(C(=O)NCCc2c(Cl)cccc2Cl)CON=C1c1ccccc1 ZINC000000767452 GI Annotated Anodyne C[C@]1(C(=O)NCCc2c(Cl)cccc2Cl)CON=C1c1ccccc1 ZINC000000767453 GI Annotated Anodyne O=C(NCCc1ccccc1F)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000000767587 GI Annotated Anodyne O=C(NCCc1ccccc1F)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccccc1 ZINC000000767588 GI Annotated Anodyne COc1ccccc1CNC(=O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccccc1 ZINC000000767595 GI Annotated Anodyne COc1ccccc1CNC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccccc1 ZINC000000767597 GI Annotated Anodyne O=C(NCCc1ccccc1F)[C@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000000767804 GI Annotated Anodyne O=C(NCCc1ccccc1F)[C@H]1C(c2ccccc2)=NO[C@@H]1c1ccsc1 ZINC000000767806 GI Annotated Anodyne COc1ccccc1CNC(=O)[C@@H]1C(c2ccccc2)=NO[C@@H]1c1ccsc1 ZINC000000767812 GI Annotated Anodyne COc1ccccc1CNC(=O)[C@@H]1C(c2ccccc2)=NO[C@H]1c1ccsc1 ZINC000000767814 GI Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1ccc(F)cc1Cl ZINC000000769259 GI Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccc(F)cc1Cl ZINC000000769261 GI Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1ccc(Cl)cc1F ZINC000000769344 GI Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1ccc(Cl)cc1F ZINC000000769346 GI Annotated Anodyne CN(C)c1ccc(C2=NOC[C@@]2(C)C(=O)NCc2ccc(C(C)(C)C)cc2)cc1 ZINC000000769655 GI Annotated Anodyne CN(C)c1ccc(C2=NOC[C@]2(C)C(=O)NCc2ccc(C(C)(C)C)cc2)cc1 ZINC000000769656 GI Annotated Anodyne CC(C)c1ccc([C@@H]2ON=C(c3ccc(N(C)C)cc3)[C@@H]2C(=O)N(C)C)cc1 ZINC000000770096 GI Annotated Anodyne CC(C)c1ccc([C@H]2ON=C(c3ccc(N(C)C)cc3)[C@@H]2C(=O)N(C)C)cc1 ZINC000000770097 GI Annotated Anodyne CN(C)C(=O)[C@H]1C(c2ccc(N(C)C)cc2)=NO[C@H]1c1cccc2ccccc12 ZINC000000770194 GI Annotated Anodyne CN(C)C(=O)[C@H]1C(c2ccc(N(C)C)cc2)=NO[C@@H]1c1cccc2ccccc12 ZINC000000770196 GI Annotated Anodyne CCOc1ccccc1C1=NOC[C@@]1(C)C(=O)NCc1ccc(C(C)(C)C)cc1 ZINC000000770856 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@@H](c2ccc(C(C)C)cc2)[C@H]1C(=O)N(C)C ZINC000000771599 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@H](c2ccc(C(C)C)cc2)[C@H]1C(=O)N(C)C ZINC000000771601 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@@H](c2cccc3ccccc23)[C@H]1C(=O)N(C)C ZINC000000771683 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@H](c2cccc3ccccc23)[C@H]1C(=O)N(C)C ZINC000000771685 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@@H](c2ccc(F)cc2Cl)[C@H]1C(=O)N(C)C ZINC000000771757 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@H](c2ccc(F)cc2Cl)[C@H]1C(=O)N(C)C ZINC000000771759 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@@H](c2ccc(Cl)cc2F)[C@H]1C(=O)N(C)C ZINC000000771957 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@H](c2ccc(Cl)cc2F)[C@H]1C(=O)N(C)C ZINC000000771959 GI Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1ccc(F)cc1Cl ZINC000000772730 GI Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1ccc(F)cc1Cl ZINC000000772732 GI Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1ccc(Cl)cc1F ZINC000000772815 GI Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1ccc(Cl)cc1F ZINC000000772817 GI Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@@H]1c1c(F)cccc1Cl ZINC000000773031 GI Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2ccc(Cl)cc2)=NO[C@H]1c1c(F)cccc1Cl ZINC000000773033 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@@H](c2c(F)cccc2Cl)[C@H]1C(=O)N(C)C ZINC000000773241 GI Annotated Anodyne CCOc1ccccc1C1=NO[C@H](c2c(F)cccc2Cl)[C@H]1C(=O)N(C)C ZINC000000773243 GI Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2cccc(Cl)c2)=NO[C@@H]1c1c(F)cccc1Cl ZINC000000773332 GI Annotated Anodyne CN(C)C(=O)[C@@H]1C(c2cccc(Cl)c2)=NO[C@H]1c1c(F)cccc1Cl ZINC000000773334 GI Annotated Anodyne CCOc1ccc(-c2onc(-c3ccc(F)cc3)c2C(=O)NC[C@@H](O)CC)cc1 ZINC000000773514 GI Annotated Anodyne CCOc1ccc(-c2onc(-c3ccc(F)cc3)c2C(=O)NC[C@H](O)CC)cc1 ZINC000000773515 GI Annotated Anodyne CC[C@@H](C)[C@@H](CO)NC(=O)c1c(-c2ccc(F)cc2)noc1-c1ccsc1 ZINC000000773563 GI Annotated Anodyne CC[C@H](C)[C@@H](CO)NC(=O)c1c(-c2ccc(F)cc2)noc1-c1ccsc1 ZINC000000773564 GI Annotated Anodyne CC[C@@H](C)[C@H](CO)NC(=O)c1c(-c2ccc(F)cc2)noc1-c1ccsc1 ZINC000000773565 GI Annotated Anodyne CC[C@H](C)[C@H](CO)NC(=O)c1c(-c2ccc(F)cc2)noc1-c1ccsc1 ZINC000000773566 GI Annotated Anodyne CCOc1cccc(-c2onc(-c3ccc(F)cc3)c2C(=O)NC[C@@H](O)CC)c1 ZINC000000773611 GI Annotated Anodyne CCOc1cccc(-c2onc(-c3ccc(F)cc3)c2C(=O)NC[C@H](O)CC)c1 ZINC000000773612 GI Annotated Anodyne CCOc1ccc(CCNC(=O)c2c(-c3ccc(OC)cc3)noc2C)cc1 ZINC000000774253 GI Annotated Anodyne COc1ccc(-c2noc(-c3ccccc3OC)c2C(=O)NCC(C)C)cc1 ZINC000000774488 GI Annotated Anodyne O=C(N[C@H]1CCCC[C@H]1O)c1c(-c2ccccc2Cl)noc1-c1ccoc1 ZINC000000774582 GI Annotated Anodyne O=C(N[C@@H]1CCCC[C@H]1O)c1c(-c2ccccc2Cl)noc1-c1ccoc1 ZINC000000774583 GI Annotated Anodyne O=C(N[C@H]1CCCC[C@@H]1O)c1c(-c2ccccc2Cl)noc1-c1ccoc1 ZINC000000774584 GI Annotated Anodyne O=C(N[C@@H]1CCCC[C@@H]1O)c1c(-c2ccccc2Cl)noc1-c1ccoc1 ZINC000000774585 GI Annotated Anodyne CC[C@@H](C)[C@@H](CO)NC(=O)c1c(-c2ccccc2Cl)noc1-c1ccoc1 ZINC000000774706 GI Annotated Anodyne CC[C@H](C)[C@@H](CO)NC(=O)c1c(-c2ccccc2Cl)noc1-c1ccoc1 ZINC000000774707 GI Annotated Anodyne CC[C@@H](C)[C@H](CO)NC(=O)c1c(-c2ccccc2Cl)noc1-c1ccoc1 ZINC000000774708 GI Annotated Anodyne CC[C@H](C)[C@H](CO)NC(=O)c1c(-c2ccccc2Cl)noc1-c1ccoc1 ZINC000000774709 GI Annotated Anodyne O=C(N[C@H]1CCCC[C@H]1O)c1c(-c2ccccc2F)noc1-c1ccccc1 ZINC000000774926 GI Annotated Anodyne O=C(N[C@@H]1CCCC[C@H]1O)c1c(-c2ccccc2F)noc1-c1ccccc1 ZINC000000774927 GI Annotated Anodyne O=C(N[C@H]1CCCC[C@@H]1O)c1c(-c2ccccc2F)noc1-c1ccccc1 ZINC000000774928 GI Annotated Anodyne O=C(N[C@@H]1CCCC[C@@H]1O)c1c(-c2ccccc2F)noc1-c1ccccc1 ZINC000000774929 GI Annotated Anodyne O=C(N[C@H]1CCCC[C@H]1O)c1c(-c2ccccc2F)noc1-c1ccsc1 ZINC000000774994 GI Annotated Anodyne O=C(N[C@@H]1CCCC[C@H]1O)c1c(-c2ccccc2F)noc1-c1ccsc1 ZINC000000774995 GI Annotated Anodyne O=C(N[C@H]1CCCC[C@@H]1O)c1c(-c2ccccc2F)noc1-c1ccsc1 ZINC000000774996 GI Annotated Anodyne O=C(N[C@@H]1CCCC[C@@H]1O)c1c(-c2ccccc2F)noc1-c1ccsc1 ZINC000000774997 GI Annotated Anodyne CCOc1ccccc1-c1onc(-c2ccccc2F)c1C(=O)NC[C@@H](O)CC ZINC000000775062 GI Annotated Anodyne CCOc1ccccc1-c1onc(-c2ccccc2F)c1C(=O)NC[C@H](O)CC ZINC000000775063 GI Annotated Anodyne CCOc1ccc(-c2onc(-c3ccccc3F)c2C(=O)NC[C@@H](O)CC)cc1 ZINC000000775100 GI Annotated Anodyne CCOc1ccc(-c2onc(-c3ccccc3F)c2C(=O)NC[C@H](O)CC)cc1 ZINC000000775101 GI Annotated Anodyne CC[C@@H](C)[C@@H](CO)NC(=O)c1c(-c2ccccc2F)noc1-c1ccsc1 ZINC000000775149 GI Annotated Anodyne CC[C@H](C)[C@@H](CO)NC(=O)c1c(-c2ccccc2F)noc1-c1ccsc1 ZINC000000775150 GI Annotated Anodyne CC[C@@H](C)[C@H](CO)NC(=O)c1c(-c2ccccc2F)noc1-c1ccsc1 ZINC000000775151 GI Annotated Anodyne CC[C@H](C)[C@H](CO)NC(=O)c1c(-c2ccccc2F)noc1-c1ccsc1 ZINC000000775152 GI Annotated Anodyne CCOc1ccccc1-c1onc(C(C)(C)C)c1C(=O)N[C@H]1CCCC[C@H]1O ZINC000000775483 GI Annotated Anodyne CCOc1ccccc1-c1onc(C(C)(C)C)c1C(=O)N[C@@H]1CCCC[C@H]1O ZINC000000775484 GI Annotated Anodyne CCOc1ccccc1-c1onc(C(C)(C)C)c1C(=O)N[C@H]1CCCC[C@@H]1O ZINC000000775485 GI Annotated Anodyne CCOc1ccccc1-c1onc(C(C)(C)C)c1C(=O)N[C@@H]1CCCC[C@@H]1O ZINC000000775486 GI Annotated Anodyne CCOc1ccc(-c2onc(C(C)(C)C)c2C(=O)N[C@H]2CCCC[C@H]2O)cc1 ZINC000000775515 GI Annotated Anodyne CCOc1ccc(-c2onc(C(C)(C)C)c2C(=O)N[C@@H]2CCCC[C@H]2O)cc1 ZINC000000775516 GI Annotated Anodyne CCOc1ccc(-c2onc(C(C)(C)C)c2C(=O)N[C@H]2CCCC[C@@H]2O)cc1 ZINC000000775517 GI Annotated Anodyne CCOc1ccc(-c2onc(C(C)(C)C)c2C(=O)N[C@@H]2CCCC[C@@H]2O)cc1 ZINC000000775518 GI Annotated Anodyne CCOc1cccc(-c2onc(C(C)(C)C)c2C(=O)N[C@H]2CCCC[C@H]2O)c1 ZINC000000775592 GI Annotated Anodyne CCOc1cccc(-c2onc(C(C)(C)C)c2C(=O)N[C@@H]2CCCC[C@H]2O)c1 ZINC000000775593 GI Annotated Anodyne CCOc1cccc(-c2onc(C(C)(C)C)c2C(=O)N[C@H]2CCCC[C@@H]2O)c1 ZINC000000775594 GI Annotated Anodyne CCOc1cccc(-c2onc(C(C)(C)C)c2C(=O)N[C@@H]2CCCC[C@@H]2O)c1 ZINC000000775595 GI Annotated Anodyne CC(C)(C)c1noc(-c2ccc(Cl)cc2F)c1C(=O)N[C@H]1CCCC[C@H]1O ZINC000000775615 GI Annotated Anodyne CC(C)(C)c1noc(-c2ccc(Cl)cc2F)c1C(=O)N[C@@H]1CCCC[C@H]1O ZINC000000775616 GI Annotated Anodyne CC(C)(C)c1noc(-c2ccc(Cl)cc2F)c1C(=O)N[C@H]1CCCC[C@@H]1O ZINC000000775617 GI Annotated Anodyne CC(C)(C)c1noc(-c2ccc(Cl)cc2F)c1C(=O)N[C@@H]1CCCC[C@@H]1O ZINC000000775618 GI Annotated Anodyne CCOc1ccccc1-c1onc(C(C)(C)C)c1C(=O)N[C@H](CO)[C@H](C)CC ZINC000000775629 GI Annotated Anodyne CCOc1ccccc1-c1onc(C(C)(C)C)c1C(=O)N[C@H](CO)[C@@H](C)CC ZINC000000775630 GI Annotated Anodyne CCOc1ccccc1-c1onc(C(C)(C)C)c1C(=O)N[C@@H](CO)[C@H](C)CC ZINC000000775631 GI Annotated Anodyne CCOc1ccccc1-c1onc(C(C)(C)C)c1C(=O)N[C@@H](CO)[C@@H](C)CC ZINC000000775632 GI Annotated Anodyne CCOc1ccc(-c2onc(C(C)(C)C)c2C(=O)N[C@H](CO)[C@H](C)CC)cc1 ZINC000000775672 GI Annotated Anodyne CCOc1ccc(-c2onc(C(C)(C)C)c2C(=O)N[C@H](CO)[C@@H](C)CC)cc1 ZINC000000775673 GI Annotated Anodyne CCOc1ccc(-c2onc(C(C)(C)C)c2C(=O)N[C@@H](CO)[C@H](C)CC)cc1 ZINC000000775674 GI Annotated Anodyne CCOc1ccc(-c2onc(C(C)(C)C)c2C(=O)N[C@@H](CO)[C@@H](C)CC)cc1 ZINC000000775675 GI Annotated Anodyne CC(C)(C)c1noc(-c2ccsc2)c1C(=O)N[C@H](CO)Cc1ccccc1 ZINC000000775736 GI Annotated Anodyne CC(C)(C)c1noc(-c2ccsc2)c1C(=O)N[C@@H](CO)Cc1ccccc1 ZINC000000775737 GI Annotated Anodyne COc1cccc(CNC(=O)c2c(C(C)(C)C)noc2-c2ccoc2)c1OC ZINC000000775770 GI Annotated Anodyne CCOc1cccc(-c2onc(C(C)(C)C)c2C(=O)N[C@H](CO)[C@H](C)CC)c1 ZINC000000775774 GI Annotated Anodyne CCOc1cccc(-c2onc(C(C)(C)C)c2C(=O)N[C@H](CO)[C@@H](C)CC)c1 ZINC000000775775 GI Annotated Anodyne CCOc1cccc(-c2onc(C(C)(C)C)c2C(=O)N[C@@H](CO)[C@H](C)CC)c1 ZINC000000775776 GI Annotated Anodyne CCOc1cccc(-c2onc(C(C)(C)C)c2C(=O)N[C@@H](CO)[C@@H](C)CC)c1 ZINC000000775777 GI Annotated Anodyne COc1cccc(CCNC(=O)c2c(C(C)(C)C)noc2-c2ccoc2)c1OC ZINC000000775893 GI Annotated Anodyne COc1cc(CCNC(=O)c2c(C(C)(C)C)noc2-c2ccoc2)cc(OC)c1 ZINC000000775895 GI Annotated Anodyne CC(C)(CO)CNC(=O)c1c(C(C)(C)C)noc1-c1ccc(Cl)cc1F ZINC000000775916 GI Annotated Anodyne COc1ccc(-c2onc(C(C)(C)C)c2C(=O)NCC(C)C)c(OC)c1OC ZINC000000776270 GI Annotated Anodyne COc1ccc(CCNC(=O)c2c(C(C)(C)C)noc2-c2ccoc2)cc1OC ZINC000000776324 GI Annotated Anodyne COc1ccc(-c2onc(-c3ccc(F)cc3)c2C(=O)NC(C)C)c(OC)c1 ZINC000000776853 GI Annotated Anodyne CC(C)(C)c1noc(-c2c(F)cccc2Cl)c1C(=O)N[C@H]1CCCC[C@H]1O ZINC000000777197 GI Annotated Anodyne CC(C)(C)c1noc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1CCCC[C@H]1O ZINC000000777198 GI Annotated Anodyne CC(C)(C)c1noc(-c2c(F)cccc2Cl)c1C(=O)N[C@H]1CCCC[C@@H]1O ZINC000000777199 GI Annotated Anodyne CC(C)(C)c1noc(-c2c(F)cccc2Cl)c1C(=O)N[C@@H]1CCCC[C@@H]1O ZINC000000777200 GI Annotated Anodyne CCS(=O)(=O)c1ccc(OC)c(-c2ccc([C@H](C)N3CCCCC3)[nH]2)c1 ZINC000000835058 GI Annotated Anodyne NC(=O)N(O)Cc1ccc(OCc2csc(-c3ccc(Cl)cc3)n2)cc1 ZINC000000836110 GI Annotated Anodyne CC(=O)N(C)c1ccc(Sc2ncc([C@]3(C)COC(C)(C)O3)s2)cc1 ZINC000000837946 GI Annotated Clean CCSc1nc(O)c2c(n1)N=C1CCCC(O)=C1[C@H]2c1ccc(O)c(OC)c1 ZINC000000959849 GI Annotated Anodyne CCSc1nc(O)c2c(n1)N=C1CCCC(O)=C1[C@@H]2c1ccc(O)c(OC)c1 ZINC000000959850 GI Annotated Anodyne COc1ccc(/N=C2\NC[C@@H](Cc3ccc(Br)cc3)S2)cc1 ZINC000000974836 GI Annotated Mild COc1ccc(/N=C2\NC[C@H](Cc3ccc(Br)cc3)S2)cc1 ZINC000000974837 GI Annotated Mild CCOC(=O)c1c(C)oc2c(CC(=O)c3ccccc3)c(Cl)c(O)c(O)c12 ZINC000000977813 GI Annotated Clean Cc1cccc(C)c1NC(=O)[C@@H](c1ccccc1)N(C)C(=O)c1ccccc1O ZINC000000994939 GI Annotated Anodyne Cc1cccc(C)c1NC(=O)[C@H](c1ccccc1)N(C)C(=O)c1ccccc1O ZINC000000994940 GI Annotated Anodyne O=C(Cn1ncc2c1-c1ccccc1OC2)N(Cc1ccco1)C1CCCCC1 ZINC000005055204 GI Annotated Anodyne CC1=C(C(=O)Nc2c(F)c(F)c(F)c(F)c2F)C2(CCC(C)CC2)OC1=O ZINC000005058741 GI Annotated Anodyne CCn1c(=O)cc(OCC(=O)N(C)c2cc(Cl)ccc2C)c2ccccc21 ZINC000005067264 GI Annotated Anodyne CC1(C)C[C@H](NC[C@@H]2CCCO2)c2cc(C(=O)NC3CCCCC3)ccc2O1 ZINC000005070350 GI Annotated Anodyne CC1(C)C[C@@H](NC[C@@H]2CCCO2)c2cc(C(=O)NC3CCCCC3)ccc2O1 ZINC000005070354 GI Annotated Anodyne CC1(C)C[C@H](NC[C@H]2CCCO2)c2cc(C(=O)NC3CCCCC3)ccc2O1 ZINC000005070360 GI Annotated Anodyne CC1(C)C[C@@H](NC[C@H]2CCCO2)c2cc(C(=O)NC3CCCCC3)ccc2O1 ZINC000005070363 GI Annotated Anodyne COC(=O)c1cc2sc(Cl)cc2n1CC(=O)Nc1cc(C)cc(C)c1 ZINC000005084898 GI Annotated Anodyne CCc1cccc(NC(=O)Cn2c(C(=O)OC)cc3sc(Cl)cc32)c1 ZINC000005084952 GI Annotated Anodyne CC(C)c1cc(C(=O)/N=N/c2c(O)[nH]c3ccc(Br)cc23)[nH]n1 ZINC000005093449 GI Annotated Clean CCOc1cc([C@H]2C3=C(CCCC3=O)N=C3CCCC(=O)[C@@H]32)cc(Cl)c1O ZINC000005095293 GI Annotated Mild O=C1[C@@H]2[C@@H](c3ccccc3)C=C[C@@H](c3ccccc3)[C@H]2C(=O)N1c1nccs1 ZINC000005101123 GI Annotated Anodyne O=C1[C@@H]2[C@@H](c3ccccc3)C=C[C@H](c3ccccc3)[C@H]2C(=O)N1c1nccs1 ZINC000005101124 GI Annotated Anodyne O=C1[C@@H]2[C@H](c3ccccc3)C=C[C@@H](c3ccccc3)[C@H]2C(=O)N1c1nccs1 ZINC000005101125 GI Annotated Anodyne CCOc1ccc(OCc2ccc(C(=O)N/N=C(\C)c3ccccn3)cc2)cc1 ZINC000005119709 GI Annotated Reactive CCOc1ccc(NC2=NC(=O)[C@H](CC(=O)Nc3cc(C)ccc3C)S2)cc1 ZINC000005126938 GI Annotated Anodyne CCOc1ccc(NC2=NC(=O)[C@@H](CC(=O)Nc3cc(C)ccc3C)S2)cc1 ZINC000005126941 GI Annotated Anodyne CCN1/C(=C/c2sc3ccccc3[n+]2CCO)C=Cc2cc(OC)ccc21 ZINC000005128485 GI Annotated Clean C[C@@H]1CCCC[C@@H]1NC(=O)C1CCN(C(=O)c2sccc2-n2cccc2)CC1 ZINC000005135459 GI Annotated Anodyne C[C@H]1CCCC[C@@H]1NC(=O)C1CCN(C(=O)c2sccc2-n2cccc2)CC1 ZINC000005135461 GI Annotated Anodyne C[C@@H]1CCCC[C@H]1NC(=O)C1CCN(C(=O)c2sccc2-n2cccc2)CC1 ZINC000005135463 GI Annotated Anodyne C[C@H]1CCCC[C@H]1NC(=O)C1CCN(C(=O)c2sccc2-n2cccc2)CC1 ZINC000005135465 GI Annotated Anodyne CS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc3ccccc23)c(N)c1 ZINC000005138655 GI Annotated Clean CS(=O)(=O)Nc1ccc(Nc2c3ccccc3nc3cc(C#N)ccc23)cc1 ZINC000005138674 GI Annotated Mild CCN(C(=O)c1ccc2c(=O)n3c(nc2c1)CCCCC3)c1cc(C)ccc1C ZINC000005141039 GI Annotated Anodyne O=C(Cn1cc2c(n1)CCCC2)Nc1ccc(Cl)cc1C(=O)c1ccccc1 ZINC000005146783 GI Annotated Anodyne O=C(/C(=C(/S)Nc1ccccc1F)[n+]1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000005156449 GI Annotated Mild C/C(=N\NC(=O)c1ccc(CSc2nc(C)cc(C)n2)cc1)c1ccco1 ZINC000005164299 GI Annotated Reactive C=CC[n+]1c(-c2ccc(OCC)cc2)csc1NNC(=O)Nc1ccccc1 ZINC000005165399 GI Annotated Reactive aggregator C=C1C[C@H]2[C@@H]3C=CC4=CC(=O)CC[C@]4(C)[C@H]3CC[C@]2(C)[C@@]1(OC(C)=O)C(C)=O ZINC000005167228 GI Annotated Mild CCOc1ccccc1N1C(=O)[C@@H]2[C@H]3C=C(Cl)[C@H](c4ccccc43)[C@@H]2C1=O ZINC000005175278 GI Annotated Anodyne CCOc1ccccc1N1C(=O)[C@H]2[C@H]3C=C(Cl)[C@H](c4ccccc43)[C@@H]2C1=O ZINC000005175279 GI Annotated Anodyne CC(C)(C)Oc1ncc(-c2nccc(Br)n2)c(OC(C)(C)C)n1 ZINC000005175926 GI Annotated Anodyne O=C1[C@@H]2C3c4ccccc4C(c4ccccc43)[C@H]2C(=O)N1c1ccc(Cl)cn1 ZINC000005205484 GI Annotated Anodyne O=C1[C@H]2C3c4ccccc4C(c4ccccc43)[C@H]2C(=O)N1c1ccc(Cl)cn1 ZINC000005205486 GI Annotated Anodyne O=C1[C@H]2C3c4ccccc4C(c4ccccc43)[C@@H]2C(=O)N1c1ccc(Cl)cn1 ZINC000005205492 GI Annotated Anodyne C[C@]12CC[C@H](O)C=C1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@H](c3ccc(=O)oc3)CC[C@]12O ZINC000005350966 GI Annotated Anodyne Cc1cc(O)c(C2=NCCS[C@H](c3cccc(Br)c3)C2)c(=O)o1 ZINC000005441492 GI Annotated Anodyne Cc1cc(O)c(C2=NCCS[C@@H](c3cccc(Br)c3)C2)c(=O)o1 ZINC000005441581 GI Annotated Anodyne COc1ccc(/C=N/Nc2ncc(C(F)(F)F)cc2Cl)c(OC)c1OC ZINC000005446414 GI Annotated Mild C=C1[C@@H](OC(=O)/C=C(\C)CC)C[C@H](C(C)C)[C@@H]2[C@@H]1CC(=O)[C@@H]2[C@@H](C)OC(C)=O ZINC000005458992 GI Annotated Mild in-man COc1ccc(C(=O)NN=C2C=C(C(C)(C)C)C(=O)C(C(C)(C)C)=C2)cc1OC ZINC000005460444 GI Annotated Reactive CCOC(=O)Nc1cc2c(c(N)n1)N=C(c1ccc(Cl)c(Cl)c1)CN2 ZINC000005463814 GI Annotated Anodyne C=C(CC(=O)[C@H](C)CCC[C@]1(CO)O[C@@H]1CC/C(C)=C/COC(C)=O)C(C)C ZINC000523041999 GI Annotated Mild CO[C@@H]1C[C@@H](CC[C@@]2(C)[C@H](C)[C@H](O)C[C@@]3(C)C(COC(C)=O)=CCC[C@@H]32)CO1 ZINC000523042001 GI Annotated Anodyne C=C(CC(=O)[C@H](C)CCC[C@@]1(CO)O[C@@H]1CC/C(C)=C/COC(C)=O)C(C)C ZINC000523042002 GI Annotated Mild C=C(CC(=O)[C@H](C)CCC[C@@]1(CO)O[C@H]1CC/C(C)=C/COC(C)=O)C(C)C ZINC000523042005 GI Annotated Mild C=C(CC(=O)[C@H](C)CCC[C@]1(CO)O[C@H]1CC/C(C)=C/COC(C)=O)C(C)C ZINC000523042006 GI Annotated Mild CC(=O)OC/C(=C\CC/C(C)=C\CO)[C@H]1CC=C(CCC=C(C)C)C(=O)O1 ZINC000523042038 GI Annotated Anodyne CC(=O)OC/C=C(\C)CC[C@@H]1O[C@@]1(CO)CCC[C@H](C)C(=O)/C=C(\C)C(C)C ZINC000523042406 GI Annotated Mild CC(=O)OC/C=C(\C)CC[C@@H]1O[C@@]1(CO)CCC[C@@H](C)C(=O)/C=C(\C)C(C)C ZINC000523042407 GI Annotated Mild CC(=O)OC/C=C(\C)CC[C@@H]1O[C@]1(CO)CCC[C@@H](C)C(=O)/C=C(\C)C(C)C ZINC000523042408 GI Annotated Mild CC(=O)OC/C=C(\C)CC[C@@H]1O[C@]1(CO)CCC[C@H](C)C(=O)/C=C(\C)C(C)C ZINC000523042409 GI Annotated Mild CN(C)c1ccc(Nc2ccc(CN3CCO[C@@H](c4ccccc4)C3)cn2)cc1 ZINC000052551183 GI Annotated Anodyne CCN(CC)CCn1nc2c3ccccc3n(C)c3c(/N=C/N(C)C)ccc1c23 ZINC000053006947 GI Annotated Mild COc1cccc(O)c1CN1CC[C@@]2(CCCN(Cc3ccc(F)cc3)C2)C1 ZINC000053201228 GI Annotated Clean N#C/C(=C1\SCCCN1c1ccccc1)c1nc2cc(C(=O)O)ccc2[nH]1 ZINC000053226500 GI Annotated Reactive C=CCN(C(=O)[C@]12C=CC(=O)[C@H](C1)C(=C)C2)c1ccc(Br)cc1F ZINC000053229236 GI Annotated Mild Cc1ccc(C(=O)CSc2nc(N)c(C#N)c(-c3ccsc3)c2C#N)cc1 ZINC000053242797 GI Annotated Mild Cc1ccc(C(=O)N2Cc3[nH]nc(NC(=O)c4ccc5ccccc5c4)c3C2)cc1 ZINC000053242818 GI Annotated Anodyne N#Cc1c(N)nc(SCC(=O)c2ccccc2)c(C#N)c1-c1ccsc1 ZINC000053243451 GI Annotated Mild Oc1ccc(/C=N/c2nnc(Cn3c4ccccc4c4ccccc43)o2)c(O)c1 ZINC000053243577 GI Annotated Mild O=C(NCc1ccccc1O)c1cc(C(=O)c2csc3ccccc23)c[nH]1 ZINC000053243618 GI Annotated Clean O=C(Nc1n[nH]c2ncc(Br)cc12)c1cc(Cl)cc(Cl)c1 ZINC000053295318 GI Annotated Anodyne NNc1nc(N)c2c(-c3ccccc3)cn(-c3ccc(Cl)c(Cl)c3)c2n1 ZINC000053297074 GI Annotated Anodyne CN(C)[C@H]1CCN(c2c(-c3ccccc3)cc(C#N)c3nc4ccccc4n23)C1 ZINC000053298456 GI Annotated Mild CCCCc1c(C)c(C#N)c2nc3ccccc3n2c1N1CC[C@H](N(C)C)C1 ZINC000053298505 GI Annotated Mild Nc1nc(N)c2c(n1)N[C@H](c1ccc(Cl)cc1)[C@@H]1CCc3ccccc3C1=N2 ZINC000053298739 GI Annotated Anodyne Nc1nc(N)c2c(n1)N[C@H](c1ccc(Cl)cc1)[C@H]1CCc3ccccc3C1=N2 ZINC000053298741 GI Annotated Anodyne Nc1nc(N)c2c(n1)N[C@@H](c1ccc(Cl)cc1)[C@@H]1CCc3ccccc3C1=N2 ZINC000053298745 GI Annotated Anodyne Nc1nc(N)c2c(n1)N[C@@H](c1ccc(Cl)cc1)[C@H]1CCc3ccccc3C1=N2 ZINC000053298747 GI Annotated Anodyne N#Cc1cc(NC(=O)Cn2c(-c3cscn3)nc3ccccc32)ccc1Cl ZINC000053887974 GI Annotated Mild COc1ccc(-c2nc(SCc3cccc(F)c3F)nc(O)c2C#N)cc1 ZINC000054749528 GI Annotated Anodyne CCCCCc1c(CCCC)c(=O)[nH]c2cc(CNCC(OC)OC)ccc12 ZINC000005501718 GI Annotated Anodyne O=S(=O)(Nc1cc(Br)c(O)c2ccccc12)c1cccs1 ZINC000005508709 GI Annotated Clean COc1cc(/C=N/Nc2ncnc3sc4c(c23)CCCC4)cc(OC)c1OC ZINC000005512438 GI Annotated Mild OC1C[C@H](c2ccccc2)C2([C@@H](O)c3ccccc3[C@@H]2O)[C@@H](c2ccccc2)C1 ZINC000005538422 GI Annotated Anodyne OC1C[C@H](c2ccccc2)C2([C@H](O)c3ccccc3[C@H]2O)[C@@H](c2ccccc2)C1 ZINC000005538423 GI Annotated Anodyne COC(=O)c1ccccc1[C@@H]1CN=N[C@@]12Cc1c(C)c3c(c(C)c1C2=O)CCC3 ZINC000005539847 GI Annotated Anodyne COC(=O)c1ccccc1[C@@H]1CN=N[C@]12Cc1c(C)c3c(c(C)c1C2=O)CCC3 ZINC000005539848 GI Annotated Anodyne COC(=O)c1ccccc1[C@H]1CN=N[C@@]12Cc1c(C)c3c(c(C)c1C2=O)CCC3 ZINC000005539851 GI Annotated Anodyne COC(=O)c1ccccc1[C@H]1CN=N[C@]12Cc1c(C)c3c(c(C)c1C2=O)CCC3 ZINC000005539856 GI Annotated Anodyne O=C([C@@H]1O[C@@H]1c1ccc(Br)cc1O)C12CC3CC(CC(C3)C1)C2 ZINC000005540331 GI Annotated Anodyne O=C([C@@H]1O[C@H]1c1ccc(Br)cc1O)C12CC3CC(CC(C3)C1)C2 ZINC000005540338 GI Annotated Anodyne O=C([C@H]1O[C@@H]1c1ccc(Br)cc1O)C12CC3CC(CC(C3)C1)C2 ZINC000005540340 GI Annotated Anodyne O=C([C@H]1O[C@H]1c1ccc(Br)cc1O)C12CC3CC(CC(C3)C1)C2 ZINC000005540345 GI Annotated Anodyne CCN(CC)C(=O)[C@H]1C2=C(C[C@@H](c3ccccc3)[C@@H]1C(=O)O)CC(C)(C)CC2=O ZINC000005561468 GI Annotated Mild in-man C/C=C(/C)C(=O)O[C@H]1C[C@H](C)[C@H]2CC(=O)C(C)=C2C[C@@H]1C(C)(C)OC(C)=O ZINC000005566275 GI Annotated Mild N#CCCC1(CCC#N)CCCCCCC(CCC#N)(CCC#N)[C@H](O)[C@H]1O ZINC000005566816 GI Annotated Mild N#CCCC1(CCC#N)CCCCCCC(CCC#N)(CCC#N)[C@@H](O)[C@@H]1O ZINC000005566817 GI Annotated Mild O=c1c2ncn([C@H]3CCCO3)c2n(-c2ccccc2)c(=S)n1-c1ccccc1 ZINC000005581049 GI Annotated Anodyne O=C(O)C1=CN(c2ccncc2)C(c2ccco2)=C[C@@H]1c1ccccc1[N+](=O)[O-] ZINC000005581870 GI Annotated Bother Nc1ccc2[nH]c(C(=O)N3C[C@H](CCl)c4c3cc(N)c3ccccc43)cc2c1 ZINC000005581978 GI Annotated Reactive CN(C)c1ccc(/C=c2/c3ccccc3n3c2cc(-c2ccccc2)[n+]3C)cc1 ZINC000005581987 GI Annotated Clean in-vivo Cc1ccc2[nH]c(=O)c(CN(Cc3ccco3)C(=O)c3ccc(F)cc3)cc2c1 ZINC000005594379 GI Annotated Anodyne COc1ccc(C(=O)Cn2c(C(=O)/C=C/c3ccco3)nc3ccccc32)cc1 ZINC000005596396 GI Annotated Mild COc1ccccc1[C@H]1Nn2c(nc3ccccc3c2=O)N1c1ccc(C)cc1 ZINC000005596897 GI Annotated Anodyne C=C(Cl)Cc1c(O)c2c(c(O)c1CC(=C)Cl)C(=O)c1ccccc1C2=O ZINC000005600808 GI Annotated Mild COCCN(C(C)=O)[C@H]1CCC2(SCCS2)c2[nH]c3ccccc3c21 ZINC000005602020 GI Annotated Anodyne Clc1ccc2[nH]c(C3CCN(Cc4nnnn4C4CCCCC4)CC3)nc2c1 ZINC000005626291 GI Annotated Anodyne CC[C@H](C)/C=C(C)\C=C\C1=CC2=C(Cl)C(=O)[C@](C)(OC(C)=O)C(=O)C2=CO1 ZINC000005651372 GI Annotated Mild C[C@]1(C(=O)NC(=S)N(Cc2ccccc2)c2ccccn2)CC1(Cl)Cl ZINC000005657760 GI Annotated Anodyne C[C@@]1(C(=O)NC(=S)N(Cc2ccccc2)c2ccccn2)CC1(Cl)Cl ZINC000005657764 GI Annotated Anodyne C=C1[C@@H](NC)CC[C@]23C[C@]24CC[C@]2(C)[C@@H]([C@H](C)NC)[C@H](O)C[C@]2(C)[C@@H]4CC[C@@H]13 ZINC000005662448 GI Annotated Mild C=CCCCCCCCCCO[C@H]1C=C[C@H](OC(C)=O)[C@@H](COC(C)=O)O1 ZINC000005664135 GI Annotated Mild C=CCCCCCCCCCO[C@H]1C=C[C@H](OC(C)=O)[C@H](COC(C)=O)O1 ZINC000005664291 GI Annotated Mild COc1cc([C@H]2C3=C(N=C(C)[C@@H]2C#N)c2ccccc2C3=O)cc(OC)c1OC ZINC000005690708 GI Annotated Mild COc1cc([C@@H]2C3=C(N=C(C)[C@H]2C#N)c2ccccc2C3=O)cc(OC)c1OC ZINC000005690709 GI Annotated Mild Cc1ccc(-n2c(S)c(C(=O)N[C@@H](C)c3ccccc3)[n+]3ccccc23)cc1 ZINC000005694337 GI Annotated Anodyne Cc1ccc(-n2c(S)c(C(=O)N[C@H](C)c3ccccc3)[n+]3ccccc23)cc1 ZINC000005694338 GI Annotated Anodyne COc1ccc(-c2nn(-c3ccccc3)cc2/C=N/Nc2ccccn2)cc1OC ZINC000005694461 GI Annotated Mild CC(C)Oc1c(O)c2c3c(oc(=O)n3C=C[C@H]2c2ccccc2)c1OC(C)C ZINC000005732924 GI Annotated Anodyne CC1(C)COC(c2c(-c3ccccc3)noc2C[S@@](=O)c2ccccc2)=N1 ZINC000005741552 GI Annotated Anodyne CC1(C)COC(c2c(-c3ccccc3)noc2C[S@](=O)c2ccccc2)=N1 ZINC000005741554 GI Annotated Anodyne COc1cc(/C=N/N=C(/C(=O)c2ccccc2)c2ccccc2)cc(OC)c1O ZINC000005752471 GI Annotated Mild COc1cc(C(=O)O[C@H]2CC(C)=CC[C@@]3(C)CC[C@](O)(C(C)C)[C@H]23)ccc1O ZINC000005757684 GI Annotated Anodyne COc1cc(C(=O)O[C@@H]2CC(C)=CC[C@@]3(C)CC[C@](O)(C(C)C)[C@@H]23)ccc1O ZINC000005757687 GI Annotated Anodyne COc1cc(C(=O)O[C@H]2CC(C)=CC[C@@]3(C)CC[C@](O)(C(C)C)[C@@H]23)ccc1O ZINC000005757690 GI Annotated Anodyne Oc1ccc([C@@H]2C(c3ccccc3)=NN=C(c3ccc(Cl)cc3)N2O)c(O)c1 ZINC000005773122 GI Annotated Clean aggregator Oc1ccc([C@H]2C(c3ccccc3)=NN=C(c3ccc(Cl)cc3)N2O)c(O)c1 ZINC000005773124 GI Annotated Clean aggregator O=C1C2=C(c3ccccc31)[C@H](c1ccccc1Cl)N1C(=O)CCSC1=N2 ZINC000005809410 GI Annotated Mild O=C1C2=C(c3ccccc31)[C@H](c1ccc(Cl)cc1)N1C(=O)CCSC1=N2 ZINC000005809411 GI Annotated Mild CCOC(=O)c1csc(CCCCCCc2nc(C(=O)OCC)cs2)n1 ZINC000005811040 GI Annotated Anodyne CN1c2ccccc2N(C(=O)c2ccc(Cl)cc2)[C@H](CC(=O)O)c2cccn21 ZINC000005811166 GI Annotated Anodyne COc1nc2c(c(=O)n1C)N=C(c1ccc(Cl)cc1)C[C@H](c1ccccc1)N2 ZINC000005835942 GI Annotated Anodyne COc1cc2c(cc1OC)[C@H]1CN3CCC[C@H]3C=C1c1ccc(OC)c(O)c1-2 ZINC000005839269 GI Annotated Anodyne C=CC[C@@H](NCc1ccccc1)[C@H](OCc1ccccc1)[C@@H]1COC(C)(C)O1 ZINC000005840800 GI Annotated Mild C=CC[C@H](NCc1ccccc1)[C@H](OCc1ccccc1)[C@@H]1COC(C)(C)O1 ZINC000005840802 GI Annotated Mild CCN1c2ncc(CCc3ccncc3)cc2C(=O)N(C)c2ccc(Cl)nc21 ZINC000005841371 GI Annotated Anodyne CCN1c2ncc(CNc3ccccc3)cc2C(=O)N(C)c2ccc(Cl)nc21 ZINC000005841417 GI Annotated Anodyne CCN1c2ncc(CCc3cccc(F)c3)cc2C(=O)N(C)c2cccnc21 ZINC000005842279 GI Annotated Anodyne CCc1c(C)nc(OC)c(NC(C)=O)c1[C@](C)(OC(C)=O)c1cc(C)cc(C)c1 ZINC000005847245 GI Annotated Anodyne CCc1c(C)nc(OC)c(NC(C)=O)c1[C@@](C)(OC(C)=O)c1cc(C)cc(C)c1 ZINC000005847262 GI Annotated Anodyne CN(C)c1nc(Cc2c(Cl)cccc2Cl)nc(Nc2ccc(C#N)cc2)n1 ZINC000005849688 GI Annotated Mild COc1ccc(Oc2nc3cc(N)cc(N)c3nc2-c2ccccc2)cc1OC ZINC000005854350 GI Annotated Anodyne O=C1[C@@H]2c3[nH]c4ccccc4c3[C@@H]3CCSC[C@@H]3[C@@H]2C(=O)N1c1ccccc1 ZINC000005883140 GI Annotated Anodyne COc1ccc2c3c([nH]c2c1[N+](=O)[O-])[C@H](C)N(Cc1ccc([N+](=O)[O-])cc1)CC3 ZINC000005885847 GI Annotated Bother CCc1c(C)[nH]c(=O)c(NC(=O)C(C)(C)C)c1[C@](C)(O)c1cc(C)cc(C)c1 ZINC000005886634 GI Annotated Anodyne CCc1c(C)[nH]c(=O)c(NC(=O)C(C)(C)C)c1[C@@](C)(O)c1cc(C)cc(C)c1 ZINC000005886668 GI Annotated Anodyne CCc1cc([S@@](=O)Cc2nc3c(Cl)ccc(Cl)c3o2)c(=O)[nH]c1C ZINC000005887546 GI Annotated Anodyne CCc1cc([S@](=O)Cc2nc3c(Cl)ccc(Cl)c3o2)c(=O)[nH]c1C ZINC000005887551 GI Annotated Anodyne Cc1nc(CCCCCC[C@H](O)c2ccccc2)n2nc(-n3ccnc3)ccc12 ZINC000005891771 GI Annotated Anodyne Cc1nc(CCCCCC[C@@H](O)c2ccccc2)n2nc(-n3ccnc3)ccc12 ZINC000005891780 GI Annotated Anodyne COc1cc([C@@H]2[C@@H]3C=CC=C4CC=CC(=C43)[C@H]3CCC(=O)N23)cc(OC)c1OC ZINC000005922959 GI Annotated Anodyne COc1cc([C@@H]2[C@H]3C=CC=C4CC=CC(=C43)[C@H]3CCC(=O)N23)cc(OC)c1OC ZINC000005922963 GI Annotated Anodyne COc1ccc2oc(C(=O)N3C[C@@H](CCl)c4ccc([N+](=O)[O-])cc43)cc2c1 ZINC000005923375 GI Annotated Reactive CCN(CC)c1nnc(CCCCCCCCc2nnc(N(CC)CC)o2)o1 ZINC000005923504 GI Annotated Anodyne C=CC1(CC/C(=C\[N+](=O)[O-])c2ccc(OC)c(OC)c2)OCC(C)(C)CO1 ZINC000005923725 GI Annotated Mild COc1nc(Cc2c(Cl)cccc2Cl)nc(Nc2ccc(C#N)cc2)n1 ZINC000005929257 GI Annotated Mild N#Cc1ccc(Nc2nc(Cc3c(Cl)cccc3Cl)nc(NO)n2)cc1 ZINC000005932847 GI Annotated Mild aggregator N#Cc1ccc(Nc2nc(N)nc(Oc3c(Cl)cc(F)cc3Cl)n2)cc1 ZINC000005933186 GI Annotated Mild O=C(COc1ccc(-n2ccnc2)cc1C(=O)c1ccccc1)Nc1ccccc1 ZINC000005934110 GI Annotated Anodyne O=C1Nc2c(COCCc3ccccc3)ccnc2N(C2CC2)c2ncccc21 ZINC000005934152 GI Annotated Anodyne O=S1(=O)N=C(SCc2ccccc2)N(c2ccccc2)c2ccncc21 ZINC000005934235 GI Annotated Anodyne CC(C)(C)OC(=O)n1c2ccccc2c2c(=O)nc(N3CCCCC3)sc21 ZINC000005950507 GI Annotated Anodyne O=C1Nc2ccccc2C(=O)[C@H]2[C@H]1[C@@](O)(c1ccccc1)C[C@H]2c1ccccc1 ZINC000005956059 GI Annotated Anodyne O=C1Nc2ccccc2C(=O)[C@@H]2[C@@H](c3ccccc3)C[C@](O)(c3ccccc3)[C@@H]12 ZINC000005956061 GI Annotated Anodyne O=C1Nc2ccccc2C(=O)[C@H]2[C@H]1[C@](O)(c1ccccc1)C[C@H]2c1ccccc1 ZINC000005956064 GI Annotated Anodyne O=C1Nc2ccccc2C(=O)[C@@H]2[C@@H](c3ccccc3)C[C@@](O)(c3ccccc3)[C@@H]12 ZINC000005956066 GI Annotated Anodyne CC(C)Nc1[nH]c(C(=O)c2ccccc2)c(N)c1C(=S)Nc1ccccc1 ZINC000005962988 GI Annotated Anodyne CC1=NN(c2ccccc2)[C@@]2(C1)[C@H](Cl)C(=O)N2c1nc2ccccc2s1 ZINC000005964597 GI Annotated Reactive CC1=NN(c2ccccc2)[C@@]2(C1)[C@@H](Cl)C(=O)N2c1nc2ccccc2s1 ZINC000005964598 GI Annotated Reactive CC1=NN(c2ccccc2)[C@]2(C1)[C@H](Cl)C(=O)N2c1nc2ccccc2s1 ZINC000005964602 GI Annotated Reactive CC1=NN(c2ccccc2)[C@]2(C1)[C@@H](Cl)C(=O)N2c1nc2ccccc2s1 ZINC000005964603 GI Annotated Reactive CCCCCCc1cc2cc(C(=O)NCc3ccccc3)c(N)oc-2cc1=O ZINC000005973168 GI Annotated Anodyne COc1cccc(O)c1CN1CC[C@]2(CCCN(Cc3ccc(F)cc3)C2)C1 ZINC000055198807 GI Annotated Clean O[C@@H](c1ccc2c(c1)CN(Cc1c[nH]c3ccccc13)CCO2)c1ccccn1 ZINC000055401582 GI Annotated Anodyne O[C@H](c1ccc2c(c1)CN(Cc1c[nH]c3ccccc13)CCO2)c1ccccn1 ZINC000055401584 GI Annotated Anodyne C=C1[C@@H]2CC[C@H]3[C@@]45CCC[C@@](C)(CN6CCO[C@@H]64)[C@H]5CC[C@]3(C2)[C@@H]1OC(C)=O ZINC000056871278 GI Annotated Mild in-vitro biogenic C=C1[C@@H]2CC[C@H]3[C@@]45CCC[C@@](C)(CN6CCO[C@H]64)[C@H]5CC[C@]3(C2)[C@@H]1OC(C)=O ZINC000056871279 GI Annotated Mild in-vitro O=C1[C@H]2CCCN2[C@@H](c2ccc(Br)cc2)N1c1ccc(F)cc1 ZINC000057011172 GI Annotated Anodyne O=C1[C@H]2CCCN2[C@H](c2ccc(Br)cc2)N1c1ccc(F)cc1 ZINC000057011173 GI Annotated Anodyne C1=C([C@@H](c2nnnn2C2CCCCC2)N2CCCCC2)COc2ccccc21 ZINC000057613745 GI Annotated Anodyne C1=C([C@H](c2nnnn2C2CCCCC2)N2CCCCC2)COc2ccccc21 ZINC000057613746 GI Annotated Anodyne COc1ccc(Cl)cc1N1C(=O)[C@H]2CCCN2[C@H]1c1ccc(F)c(F)c1 ZINC000058046738 GI Annotated Anodyne COc1ccc(Cl)cc1N1C(=O)[C@H]2CCCN2[C@@H]1c1ccc(F)c(F)c1 ZINC000058046739 GI Annotated Anodyne O=C1[C@H]2CCCN2[C@@H](c2cccc(Br)c2)N1c1ccc(F)cc1 ZINC000058047381 GI Annotated Anodyne O=C1[C@H]2CCCN2[C@H](c2cccc(Br)c2)N1c1ccc(F)cc1 ZINC000058047382 GI Annotated Anodyne CCOc1ccc([C@H]2N(c3ccc(Cl)cc3)C(=O)[C@H]3CCCN32)cc1OC ZINC000058047493 GI Annotated Anodyne CCOc1ccc([C@@H]2N(c3ccc(Cl)cc3)C(=O)[C@H]3CCCN23)cc1OC ZINC000058047494 GI Annotated Anodyne CCOc1ccc2c(c1)O/C(=C\c1cc[n+](Cc3cccc(F)c3)cc1)C2=O ZINC000058468557 GI Annotated Mild C[C@@H]1/C(=N/N=C2\NC(=O)CS2)C[C@H](c2ccccc2)N(C)[C@@H]1c1ccccc1 ZINC000058480294 GI Annotated Mild CN1CCC[C@H]1CCNc1nc2cc(/N=C(\N)c3cccs3)ccc2s1 ZINC000058487022 GI Annotated Mild CCOC(=O)c1cc(-c2ccc(Cl)cc2)nn1C/C(=N/O)c1ccccc1 ZINC000058487764 GI Annotated Mild O=C(NC(=O)c1c(F)cccc1F)Nc1ccc(/C=N/Oc2ccccc2)cc1 ZINC000058494098 GI Annotated Mild CC(C)(C)O/N=C/c1ccc(NC(=O)NC(=O)c2c(F)cccc2F)c(F)c1 ZINC000058498661 GI Annotated Mild CC(C)(C)O/N=C/c1cccc(NC(=O)NC(=O)c2c(F)cccc2F)c1 ZINC000058499081 GI Annotated Mild O=C1NC(=Nc2ccccc2C(=O)O)S[C]1Cc1cccc2ccccc12 ZINC000584904637 GI Annotated Mild C[C@@]1(c2cc(CNC3(C(F)(F)F)CC3)c(F)cc2F)CCSC(=N)N1 ZINC000584905685 GI Annotated Anodyne C[C@@H]1C[C@@](C)(c2cc(CNC3(C(F)(F)F)CC3)c(F)cc2F)NC(=N)S1 ZINC000584905686 GI Annotated Anodyne CN(CCNCc1cc(Cl)cc(Cl)c1)c1nc2ccc(Cl)nc2[nH]1 ZINC000584905782 GI Annotated Anodyne CC(C)(C)O/N=C/Cc1ccc(NC(=O)NC(=O)c2c(F)cccc2F)cc1 ZINC000058502034 GI Annotated Mild CC(C)(C)O/N=C/c1ccccc1NC(=O)NC(=O)c1c(F)cccc1F ZINC000058502219 GI Annotated Mild C[C@H]1CN(C)C[C@@H](C)N1C(=O)c1cn2c3c(cccc13)OC[C@H]2C1CCCCC1 ZINC000058512463 GI Annotated Anodyne CC(C)O/N=C/c1ccc(NC(=O)NC(=O)c2c(F)cccc2F)cc1Cl ZINC000058523546 GI Annotated Mild O[C@@]1(c2ccc(-c3ccc(Br)s3)cc2)CN2CCCC[C@H]2CO1 ZINC000058528697 GI Annotated Anodyne in-vitro COc1cc(C2=C[C@@H](c3ccc(Cl)cc3)N=C(S)N2)cc(OC)c1OC ZINC000058528798 GI Annotated Anodyne COc1ccc(OC)c([C@@H]2CCN(Cc3cnn(-c4ccccc4F)c3C)C2)c1 ZINC000058534605 GI Annotated Anodyne COC(=O)[C@@H]1CSc2c(C3CC3)c(Cc3cccc4ccccc34)cc(=O)n21 ZINC000058541529 GI Annotated Anodyne O[C@@]1(c2ccc(-c3ccc(Br)cc3)cc2)CN2CCCC[C@H]2CO1 ZINC000058549789 GI Annotated Anodyne in-vitro Cn1cc([C@@H]2CCN([C@H]3Cc4cccc5cccc3c45)C[C@@H]2O)c2cccnc21 ZINC000058562951 GI Annotated Anodyne COc1c(-c2ccc(C(F)(F)F)cc2)oc2ccc(NC(C)=O)cc2c1=O ZINC000058563691 GI Annotated Anodyne C[n+]1c(-c2ccccc2)nn(CC(=O)CCc2ccccc2)c1-c1ccccc1 ZINC000058563844 GI Annotated Anodyne O=C1CS[C@H](c2c(Cl)cccc2Cl)N1[C@H]1CC[C@H]1Br ZINC000058566828 GI Annotated Anodyne C/C=C/C1=CC2=C(CO1)C(=O)[C@]1(C)OC(=O)[C@H](C(=O)CCCCCCC)[C@H]1C2 ZINC000058568788 GI Annotated Mild COc1c(-c2cccc(C(F)(F)F)c2)oc2ccc(NC(C)=O)cc2c1=O ZINC000058574948 GI Annotated Anodyne FCCCOc1ccccc1CN1CCN(Cc2cc3ccccc3o2)CC1 ZINC000058575548 GI Annotated Anodyne CCOc1ccc2c(c1)O/C(=C\c1cc[n+](Cc3ccccc3F)cc1)C2=O ZINC000058575869 GI Annotated Mild COc1ccc(-n2nc(C(F)(F)F)cc2-c2ccc3c(c2)oc(=O)n3C)cc1 ZINC000058581450 GI Annotated Anodyne CCOc1ccc2c(c1)O/C(=C\c1cc[n+](Cc3ccc(F)cc3)cc1)C2=O ZINC000058581994 GI Annotated Mild N#C[C@@]1(c2ccc(F)cc2)c2c(ccc(F)c2F)NC(=O)N1CC(F)(F)F ZINC000058591921 GI Annotated Mild COc1ccc([C@@H]2[C@H]3CCCCC3=NN2S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000058594179 GI Annotated Anodyne CC[C@H]1/C(=N/N=C2\NC(=O)CS2)C[C@H](c2ccccc2)N[C@H]1c1ccccc1 ZINC000058608767 GI Annotated Mild CCN1CCN(CCOc2ccccc2)[C@@H]2CCn3c(c(C)c4ccccc43)[C@H]21 ZINC000058623808 GI Annotated Anodyne COc1cc2c(/C=C3/C(=O)N(C)c4ccc(O)cc43)c(Cl)n(C)c2cc1C ZINC000058638880 GI Annotated Clean Cc1nc2cc(OC(F)(F)F)ccc2n1-c1ccc(C(=O)NC2CC2)s1 ZINC000058639005 GI Annotated Anodyne COC(=O)/C(C)=C1\C(=O)C[C@@H]2[C@]1(C)CC[C@H]1C(C)(C)[C@@H](OC(C)=O)CC[C@]21C ZINC000058649928 GI Annotated Mild C=NC(=O)c1cc2ccc(-c3cc(Nc4ccnc(N)n4)ccc3O)cc2s1 ZINC000058650277 GI Annotated Mild O=C(c1c(Cc2ccccc2)n(-c2ccccc2)c2ccccc12)N1CCNCC1 ZINC000058660699 GI Annotated Anodyne CCCC1(c2nc3c(I)cnc(Cl)c3[nH]2)CCC1 ZINC000586877698 GI Annotated Anodyne C#CCC1(c2nc3c(I)cnc(Cl)c3[nH]2)CCCCC1 ZINC000586877709 GI Annotated Mild C#CCC1(c2nc3cc(C(=O)OC)cc(Br)c3[nH]2)CCCCC1 ZINC000586877971 GI Annotated Mild O=C(O)c1ccccc1/C=C/c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000586878279 GI Annotated Anodyne O=C(O)c1ccccc1/C=C\c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000586878280 GI Annotated Anodyne O=C(O)/C=C/c1ccccc1-c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000586878305 GI Annotated Anodyne O=C(O)/C=C\c1ccccc1-c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000586878306 GI Annotated Anodyne O=C(O)c1ccccc1/C=C/c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000586878456 GI Annotated Clean O=C(O)c1ccccc1/C=C\c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000586878460 GI Annotated Clean O=C(O)c1ccccc1/C=C/c1nc2ccc(I)cc2[nH]1 ZINC000586878466 GI Annotated Anodyne O=C(O)c1ccccc1/C=C\c1nc2ccc(I)cc2[nH]1 ZINC000586878469 GI Annotated Anodyne O=C(O)/C=C/c1ccccc1-c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000586878725 GI Annotated Anodyne O=C(O)/C=C\c1ccccc1-c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000586878737 GI Annotated Anodyne CC(=O)c1ccc(-c2cccc(-c3nc4c(S)nc(S)nc4[nH]3)c2)cc1 ZINC000586879045 GI Annotated Anodyne O=C(O)/C=C/c1ccccc1-c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000586879374 GI Annotated Clean O=C(O)/C=C\c1ccccc1-c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000586879378 GI Annotated Clean O=C(O)c1ccccc1/C=C/c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000586879778 GI Annotated Anodyne O=C(O)c1ccccc1/C=C\c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000586879779 GI Annotated Anodyne Cc1cccc(-c2ccccc2)c1-c1nc2cccc(S(=O)(=O)N(C)C)c2[nH]1 ZINC000586880001 GI Annotated Anodyne CCc1ccc(-c2nc3ncc(I)cc3[nH]2)cc1CC ZINC000586880215 GI Annotated Anodyne Cc1cc(-c2nc3c(S)nc(S)nc3[nH]2)ccc1-c1ccc(C(=O)O)cc1 ZINC000586880239 GI Annotated Anodyne C#Cc1cccc(-c2nc3c(Br)cnc(Br)c3[nH]2)c1 ZINC000586880383 GI Annotated Mild Cc1ccc(C)c(C(=O)c2ccccc2-c2nc3cc4c(cc3[nH]2)OCC(=O)N4)c1 ZINC000586880606 GI Annotated Anodyne COC(=O)c1cc2nc(-c3ccccc3C(=O)c3cc(C)ccc3C)[nH]c2cn1 ZINC000586880623 GI Annotated Anodyne CC(=O)C(C(C)=O)c1ccccc1-c1nc2cc(Br)c(F)cc2[nH]1 ZINC000586880650 GI Annotated Anodyne CC(=O)C(C(C)=O)c1ccccc1-c1nc2cc(C#N)cc(Br)c2[nH]1 ZINC000586880693 GI Annotated Mild O=C(O)c1ccccc1/C=C/c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000586880813 GI Annotated Anodyne O=C(O)c1ccccc1/C=C\c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000586880831 GI Annotated Anodyne Ic1cnc2nc(-c3ccc(C4CCC4)cc3)[nH]c2c1 ZINC000586881076 GI Annotated Anodyne O=C(O)c1ccccc1/C=C/c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000586881451 GI Annotated Bother O=C(O)c1ccccc1/C=C\c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000586881457 GI Annotated Bother Cc1ccc(C)c(C(=O)c2ccccc2-c2nc3c(S)nc(S)nc3[nH]2)c1 ZINC000586881497 GI Annotated Anodyne O=C(O)c1ccccc1/C=C/c1nc2cccc(I)c2[nH]1 ZINC000586881601 GI Annotated Anodyne O=C(O)c1ccccc1/C=C\c1nc2cccc(I)c2[nH]1 ZINC000586881602 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1-c1ccc(-c2nc3c(S)nc(S)nc3[nH]2)cc1 ZINC000586881627 GI Annotated Anodyne CC(=O)C(C(C)=O)c1ccccc1-c1nc2ccc(Br)c(F)c2[nH]1 ZINC000586881723 GI Annotated Anodyne CC(=O)C(C(C)=O)c1ccccc1-c1nc2cccc(OC(F)(F)F)c2[nH]1 ZINC000586882382 GI Annotated Anodyne O=C(O)c1ccccc1/C=C/c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000586882402 GI Annotated Bother O=C(O)c1ccccc1/C=C\c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000586882403 GI Annotated Bother COC(=O)c1ccnc2[nH]c(-c3ccccc3C(=O)c3cc(C)ccc3C)nc12 ZINC000586882420 GI Annotated Anodyne Cc1ccc(C)c(C(=O)c2ccccc2-c2nc3ccc(-n4cnnn4)cc3[nH]2)c1 ZINC000586882424 GI Annotated Anodyne CC(=O)C(C(C)=O)c1ccccc1-c1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1 ZINC000586882437 GI Annotated Mild O=C(O)c1ccccc1/C=C/c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000586882491 GI Annotated Anodyne O=C(O)c1ccccc1/C=C\c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000586882492 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3ccccc3C(=O)c3cc(C)ccc3C)[nH]c2n1 ZINC000586882524 GI Annotated Anodyne CC(=O)C(C(C)=O)c1ccccc1-c1nc2cc(F)cc(Br)c2[nH]1 ZINC000586882535 GI Annotated Anodyne CC(=O)C(C(C)=O)c1ccccc1-c1nc2ccc(F)c(Br)c2[nH]1 ZINC000586882607 GI Annotated Anodyne O=S(=O)(c1ccc2nc([C@]34CCC[C@H]3[C@H]3CC[C@H]4C3)[nH]c2c1)C(F)(F)F ZINC000586884028 GI Annotated Anodyne O=S(=O)(c1ccc2nc([C@@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)[nH]c2c1)C(F)(F)F ZINC000586884035 GI Annotated Anodyne O=S(=O)(c1ccc2nc([C@@]34CCC[C@H]3[C@H]3CC[C@H]4C3)[nH]c2c1)C(F)(F)F ZINC000586884038 GI Annotated Anodyne O=S(=O)(c1ccc2nc([C@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)[nH]c2c1)C(F)(F)F ZINC000586884041 GI Annotated Anodyne Ic1cnc2[nH]c([C@@]34CCC[C@H]3[C@H]3CC[C@H]4C3)nc2c1 ZINC000586884162 GI Annotated Anodyne Ic1cnc2[nH]c([C@@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)nc2c1 ZINC000586884166 GI Annotated Anodyne Ic1cnc2[nH]c([C@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)nc2c1 ZINC000586884168 GI Annotated Anodyne Ic1cnc2[nH]c([C@]34CCC[C@H]3[C@H]3CC[C@H]4C3)nc2c1 ZINC000586884169 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)nc-2[nH]1 ZINC000586884529 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@@]34CCC[C@H]3[C@H]3CC[C@H]4C3)nc-2[nH]1 ZINC000586884530 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)nc-2[nH]1 ZINC000586884532 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@]34CCC[C@H]3[C@H]3CC[C@H]4C3)nc-2[nH]1 ZINC000586884533 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c([C@H]3CCCC(=O)CC3)nc2c1 ZINC000586884645 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c([C@@H]3CCCC(=O)CC3)nc2c1 ZINC000586884647 GI Annotated Anodyne O=C1CCC[C@@H](c2nc3c(Br)cnc(Br)c3[nH]2)CC1 ZINC000586885131 GI Annotated Anodyne O=C1CCC[C@H](c2nc3c(Br)cnc(Br)c3[nH]2)CC1 ZINC000586885132 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)[nH]c12 ZINC000586885487 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@]34CCC[C@H]3[C@H]3CC[C@H]4C3)[nH]c12 ZINC000586885488 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)[nH]c12 ZINC000586885489 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@@]34CCC[C@H]3[C@H]3CC[C@H]4C3)[nH]c12 ZINC000586885490 GI Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc([C@@]34CCC[C@H]3[C@H]3CC[C@H]4C3)[nH]c2c1 ZINC000586885857 GI Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc([C@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)[nH]c2c1 ZINC000586885882 GI Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc([C@@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)[nH]c2c1 ZINC000586885885 GI Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc([C@]34CCC[C@H]3[C@H]3CC[C@H]4C3)[nH]c2c1 ZINC000586885889 GI Annotated Anodyne Cc1ccc([C@@H](C)[C@@H](O)c2nc3ccc(I)cc3[nH]2)cc1 ZINC000586886607 GI Annotated Anodyne Cc1ccc([C@@H](C)[C@H](O)c2nc3ccc(I)cc3[nH]2)cc1 ZINC000586886608 GI Annotated Anodyne Cc1ccc([C@H](C)[C@@H](O)c2nc3ccc(I)cc3[nH]2)cc1 ZINC000586886609 GI Annotated Anodyne Cc1ccc([C@H](C)[C@H](O)c2nc3ccc(I)cc3[nH]2)cc1 ZINC000586886610 GI Annotated Anodyne Oc1cccc([C@@H](O)c2nc3cc(C(F)(F)F)cc(Br)c3[nH]2)c1 ZINC000586888086 GI Annotated Anodyne Oc1cccc([C@H](O)c2nc3cc(C(F)(F)F)cc(Br)c3[nH]2)c1 ZINC000586888091 GI Annotated Anodyne O=S(=O)(c1ccc2nc([C@@H]3C[C@@]34CCc3ccccc34)[nH]c2c1)C(F)(F)F ZINC000586888149 GI Annotated Anodyne O=S(=O)(c1ccc2nc([C@H]3C[C@]34CCc3ccccc34)[nH]c2c1)C(F)(F)F ZINC000586888153 GI Annotated Anodyne O=S(=O)(c1ccc2nc([C@@H]3C[C@]34CCc3ccccc34)[nH]c2c1)C(F)(F)F ZINC000586888157 GI Annotated Anodyne O=S(=O)(c1ccc2nc([C@H]3C[C@@]34CCc3ccccc34)[nH]c2c1)C(F)(F)F ZINC000586888158 GI Annotated Anodyne CCCCOc1cc2nc([C@@H](O)c3cccc(O)c3)[nH]c2cc1Br ZINC000586888166 GI Annotated Anodyne CCCCOc1cc2nc([C@H](O)c3cccc(O)c3)[nH]c2cc1Br ZINC000586888169 GI Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@@]34CCC[C@H]3[C@H]3CC[C@H]4C3)[nH]c2c1 ZINC000586888301 GI Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)[nH]c2c1 ZINC000586888307 GI Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@@]34CCC[C@@H]3[C@H]3CC[C@H]4C3)[nH]c2c1 ZINC000586888312 GI Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@]34CCC[C@H]3[C@H]3CC[C@H]4C3)[nH]c2c1 ZINC000586888314 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@H]3C[C@@]34CCc3ccccc34)[nH]c12 ZINC000586888627 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@@H]3C[C@@]34CCc3ccccc34)[nH]c12 ZINC000586888643 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@H]3C[C@]34CCc3ccccc34)[nH]c12 ZINC000586888645 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@@H]3C[C@]34CCc3ccccc34)[nH]c12 ZINC000586888646 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c([C@H]3C[C@@]34CCc3ccccc34)nc2c1 ZINC000586888966 GI Annotated Anodyne Cc1ccc([C@@H](C)[C@@H](O)c2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)cc1 ZINC000586888969 GI Annotated Anodyne Cc1ccc([C@@H](C)[C@H](O)c2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)cc1 ZINC000586888974 GI Annotated Anodyne Cc1ccc([C@H](C)[C@@H](O)c2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)cc1 ZINC000586888977 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c([C@@H]3C[C@@]34CCc3ccccc34)nc2c1 ZINC000586888979 GI Annotated Anodyne Cc1ccc([C@H](C)[C@H](O)c2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)cc1 ZINC000586888982 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c([C@H]3C[C@]34CCc3ccccc34)nc2c1 ZINC000586888984 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c([C@@H]3C[C@]34CCc3ccccc34)nc2c1 ZINC000586888987 GI Annotated Anodyne Oc1cccc([C@@H](O)c2nc3cc(C(F)(F)F)c(Br)cc3[nH]2)c1 ZINC000586889236 GI Annotated Anodyne Oc1cccc([C@H](O)c2nc3cc(C(F)(F)F)c(Br)cc3[nH]2)c1 ZINC000586889238 GI Annotated Anodyne Oc1cccc([C@@H](O)c2nc3cc(Br)cc(C(F)(F)F)c3[nH]2)c1 ZINC000586889885 GI Annotated Anodyne Oc1cccc([C@H](O)c2nc3cc(Br)cc(C(F)(F)F)c3[nH]2)c1 ZINC000586889887 GI Annotated Anodyne Oc1cccc([C@@H](O)c2nc3ccc(Br)c(C(F)(F)F)c3[nH]2)c1 ZINC000586889913 GI Annotated Anodyne Oc1cccc([C@H](O)c2nc3ccc(Br)c(C(F)(F)F)c3[nH]2)c1 ZINC000586889914 GI Annotated Anodyne Cc1ccc([C@@H](C)[C@H](O)c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)cc1 ZINC000586890460 GI Annotated Bother Cc1ccc([C@H](C)[C@@H](O)c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)cc1 ZINC000586890463 GI Annotated Bother Cc1ccc([C@H](C)[C@H](O)c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)cc1 ZINC000586890464 GI Annotated Bother Cc1ccc([C@@H](C)[C@@H](O)c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)cc1 ZINC000586890465 GI Annotated Bother Cc1ccc([C@@H](C)[C@H](O)c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)cc1 ZINC000586890516 GI Annotated Bother Cc1ccc([C@H](C)[C@@H](O)c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)cc1 ZINC000586890517 GI Annotated Bother Cc1ccc([C@H](C)[C@H](O)c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)cc1 ZINC000586890518 GI Annotated Bother Cc1ccc([C@@H](C)[C@@H](O)c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)cc1 ZINC000586890519 GI Annotated Bother CCCCNS(=O)(=O)c1ccc2nc([C@@H]3C[C@]34CCc3ccccc34)[nH]c2c1 ZINC000586890949 GI Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@H]3C[C@]34CCc3ccccc34)[nH]c2c1 ZINC000586890962 GI Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@@H]3C[C@@]34CCc3ccccc34)[nH]c2c1 ZINC000586890965 GI Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc([C@H]3C[C@@]34CCc3ccccc34)[nH]c2c1 ZINC000586890967 GI Annotated Anodyne COc1ccc(-c2nnc(-c3ccc4nc([C@@](C)(O)C(C)C)[nH]c4c3)o2)cc1 ZINC000586892395 GI Annotated Anodyne COc1ccc(-c2nnc(-c3ccc4nc([C@](C)(O)C(C)C)[nH]c4c3)o2)cc1 ZINC000586892402 GI Annotated Anodyne Oc1cccc([C@@H](O)c2nc3cc(C(F)(F)F)cc(C(F)(F)F)c3[nH]2)c1 ZINC000586892527 GI Annotated Anodyne Oc1cccc([C@H](O)c2nc3cc(C(F)(F)F)cc(C(F)(F)F)c3[nH]2)c1 ZINC000586892536 GI Annotated Anodyne CC(C)COc1cc2nc([C@@H](O)c3cccc(O)c3)[nH]c2cc1Br ZINC000586892665 GI Annotated Anodyne CC(C)COc1cc2nc([C@H](O)c3cccc(O)c3)[nH]c2cc1Br ZINC000586892667 GI Annotated Anodyne Cc1ccc([C@@H](C)[C@@H](O)c2nc3cccc(I)c3[nH]2)cc1 ZINC000586893953 GI Annotated Anodyne Cc1ccc([C@@H](C)[C@H](O)c2nc3cccc(I)c3[nH]2)cc1 ZINC000586893954 GI Annotated Anodyne Cc1ccc([C@H](C)[C@@H](O)c2nc3cccc(I)c3[nH]2)cc1 ZINC000586893955 GI Annotated Anodyne Cc1ccc([C@H](C)[C@H](O)c2nc3cccc(I)c3[nH]2)cc1 ZINC000586893956 GI Annotated Anodyne Cc1ccc([C@H](C)[C@H](O)c2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)cc1 ZINC000586893997 GI Annotated Clean Cc1ccc([C@@H](C)[C@@H](O)c2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)cc1 ZINC000586893998 GI Annotated Clean Cc1ccc([C@@H](C)[C@H](O)c2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)cc1 ZINC000586893999 GI Annotated Clean Cc1ccc([C@H](C)[C@@H](O)c2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)cc1 ZINC000586894000 GI Annotated Clean OCCCCCCCCCCCc1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000586894361 GI Annotated Anodyne COC(=O)c1ccc2nc(CCCCCCCCCCCO)[nH]c2c1OC ZINC000586894370 GI Annotated Anodyne CC1=C(c2ccc3nc(CCCCCCCCCCCO)[nH]c3c2)NNC(=O)C1 ZINC000586894378 GI Annotated Anodyne OCc1cccc(-c2nc3c(Br)ccc(Br)c3[nH]2)c1 ZINC000586894656 GI Annotated Anodyne OCc1cccc(-c2nc3cc(OC(F)(F)F)cc(Br)c3[nH]2)c1 ZINC000586894841 GI Annotated Anodyne COC(=O)c1cc2[nH]c(CCCCCCCCCCCO)nc2cc1OC ZINC000586894890 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(CCCCCCCCCCCO)[nH]c2cc1[N+](=O)[O-] ZINC000586894915 GI Annotated Bother OCc1cccc(-c2nc3cc(Br)cc(OC(F)(F)F)c3[nH]2)c1 ZINC000586894994 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cccc(-c4ccccc4CO)c3)[nH]c2c1OC ZINC000586895137 GI Annotated Anodyne OCc1cccc(-c2nc3cc(OC(F)(F)F)c(Br)cc3[nH]2)c1 ZINC000586895206 GI Annotated Anodyne COC(=O)c1cc2nc(-c3cccc(CO)c3)[nH]c2c(F)c1Nc1ccccc1 ZINC000586895290 GI Annotated Anodyne OCC12CCC(c3nc4cc(C(F)(F)C(F)(F)F)ncc4[nH]3)(CC1)CC2 ZINC000586895332 GI Annotated Anodyne OCc1ccc(-c2nc3c(Br)cc(OC(F)(F)F)cc3[nH]2)cc1 ZINC000586895476 GI Annotated Anodyne OCc1ccc(-c2nc3c(OC(F)(F)F)cc(Br)cc3[nH]2)cc1 ZINC000586895483 GI Annotated Anodyne OCc1ccc(-c2nc3c(Br)ccc(Br)c3[nH]2)cc1 ZINC000586895690 GI Annotated Anodyne Oc1cccc(CCCCc2nc3ccc(I)cc3[nH]2)c1 ZINC000586896250 GI Annotated Anodyne O=C1c2ccccc2C(=O)c2c1ccc1nc(C3(c4ccccc4O)CC3)[nH]c21 ZINC000586896376 GI Annotated Clean Oc1cccc(CCCCc2nc3cccc(I)c3[nH]2)c1 ZINC000586896484 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc(CCCCc3cccc(O)c3)[nH]c12 ZINC000586896576 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc(-c3ccc4c(c3O)CCCC4)[nH]c12 ZINC000586897371 GI Annotated Anodyne O=[N+]([O-])c1cc(Br)cc2nc(-c3ccc4c(c3O)CCCC4)[nH]c12 ZINC000586897699 GI Annotated Bother COC(=O)c1cc2nc([C@@H]3CC[C@H](O)CC3)[nH]c2c(F)c1Nc1ccccc1 ZINC000586898502 GI Annotated Anodyne O=[N+]([O-])c1c(Br)ccc2nc(-c3ccc4c(c3O)CCCC4)[nH]c12 ZINC000586898968 GI Annotated Bother COc1ccc(-c2nnc(-c3ccc4nc([C@@H]5CC[C@H](O)CC5)[nH]c4c3)o2)cc1 ZINC000586899172 GI Annotated Anodyne Oc1c(-c2nc3cccc(I)c3[nH]2)ccc2c1CCCC2 ZINC000586899344 GI Annotated Anodyne O=C1c2ccccc2C(=O)c2c1ccc1nc(C3(c4ccc(O)cc4)CC3)[nH]c21 ZINC000586899454 GI Annotated Clean O[C@H]1CC[C@@H](c2nc3cc(OC(F)(F)F)c(Br)cc3[nH]2)CC1 ZINC000586899527 GI Annotated Anodyne O[C@H]1CC[C@@H](c2nc3cc(Br)cc(OC(F)(F)F)c3[nH]2)CC1 ZINC000586899867 GI Annotated Anodyne O[C@H]1CC[C@@H](c2nc3cc(OC(F)(F)F)cc(Br)c3[nH]2)CC1 ZINC000586899930 GI Annotated Anodyne O=Cc1ccc(OCc2occc2-c2nc3cc4c(cc3[nH]2)OCCCO4)cc1 ZINC000586900375 GI Annotated Anodyne O=Cc1ccc(OCc2occc2-c2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)cc1 ZINC000586900377 GI Annotated Bother N#Cc1nc(Cl)cc2nc(-c3ccoc3COc3ccc(C=O)cc3)[nH]c12 ZINC000586900742 GI Annotated Mild O=Cc1ccc(OCc2occc2-c2nc3ccc(Br)nc3[nH]2)cc1 ZINC000586900749 GI Annotated Anodyne Cc1cc2[nH]c(-c3ccoc3COc3ccc(C=O)cc3)nc2cc1[N+](=O)[O-] ZINC000586900784 GI Annotated Bother Clc1ncc(I)c2nc(-c3ccoc3C3CC3)[nH]c12 ZINC000586900831 GI Annotated Anodyne O=Cc1ccc(OCc2occc2-c2nc3c(Br)ccnc3[nH]2)cc1 ZINC000586900839 GI Annotated Anodyne O=Cc1ccc(OCc2occc2-c2nc3cc(F)cc(C(=O)O)c3[nH]2)cc1 ZINC000586900849 GI Annotated Anodyne O=Cc1ccc(OCc2occc2-c2nc3cc(C(=O)O)c(F)cc3[nH]2)cc1 ZINC000586900888 GI Annotated Anodyne COc1cc(OC)c2[nH]c(-c3ccoc3COc3ccc(C=O)cc3)nc2c1 ZINC000586901145 GI Annotated Anodyne O=Cc1ccc(OCc2occc2-c2nc3ccnc(Br)c3[nH]2)cc1 ZINC000586901151 GI Annotated Anodyne COc1cc2nc(-c3ccoc3COc3ccc(C=O)cc3)[nH]c2cc1OC ZINC000586901180 GI Annotated Anodyne COC(=O)c1cccc2nc(-c3ccoc3COc3ccc(C=O)cc3)[nH]c12 ZINC000586901664 GI Annotated Anodyne O=Cc1ccc(OCc2occc2-c2nc3cc4c(cc3[nH]2)NC(=O)CC4)cc1 ZINC000586901668 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3ccoc3COc3ccc(C=O)cc3)[nH]c2c1 ZINC000586901688 GI Annotated Anodyne O=Cc1ccc(OCc2occc2-c2nc3cncc(Br)c3[nH]2)cc1 ZINC000586901691 GI Annotated Anodyne O=Cc1ccc(OCc2occc2-c2nc3cc(Br)ncc3[nH]2)cc1 ZINC000586901720 GI Annotated Anodyne O=Cc1ccc(OCc2occc2-c2nc3cc(Br)cnc3[nH]2)cc1 ZINC000586901736 GI Annotated Anodyne Cc1oc2c(c1-c1nc3ccc(Br)c([N+](=O)[O-])c3[nH]1)C(=O)CCC2 ZINC000586902493 GI Annotated Bother Cc1oc2c(c1-c1nc3cc(Br)cc([N+](=O)[O-])c3[nH]1)C(=O)CCC2 ZINC000586902600 GI Annotated Bother O=S(=O)(c1ccc2nc(CCc3cc4ccccc4o3)[nH]c2c1)C(F)(F)F ZINC000586902659 GI Annotated Anodyne Cc1oc2c(c1-c1nc3c(Cl)c(Br)cnc3[nH]1)C(=O)CCC2 ZINC000586902669 GI Annotated Anodyne COc1ccc(C=O)c2cc(-c3nc4nc(C)c(Br)cc4[nH]3)oc12 ZINC000586902811 GI Annotated Anodyne COc1ccc(C=O)c2cc(-c3nc4c(Br)cc(C#N)cc4[nH]3)oc12 ZINC000586902949 GI Annotated Mild COC(=O)c1cc(Cl)c2nc(-c3cc4c(C=O)ccc(OC)c4o3)[nH]c2c1 ZINC000586903350 GI Annotated Anodyne Cc1oc2c(c1-c1nc3ccc(I)cc3[nH]1)C(=O)CCC2 ZINC000586903557 GI Annotated Anodyne CCOCc1ccc(-c2nc3c(Br)cc(C(=O)OCC)cc3[nH]2)o1 ZINC000586903668 GI Annotated Anodyne COc1ccc(C=O)c2cc(-c3nc4c(O)c(Br)ccc4[nH]3)oc12 ZINC000586903688 GI Annotated Anodyne COc1ccc(C=O)c2cc(-c3nc4ncc(Br)c(C)c4[nH]3)oc12 ZINC000586903742 GI Annotated Anodyne COc1ccc(C=O)c2cc(-c3nc4nc(Cl)nc(C(F)(F)F)c4[nH]3)oc12 ZINC000586903808 GI Annotated Anodyne COc1ccc(C=O)c2cc(-c3nc4cc(F)c(-n5cccn5)cc4[nH]3)oc12 ZINC000586904184 GI Annotated Anodyne Cc1oc2c(c1-c1nc3c(Br)cnc(Cl)c3[nH]1)C(=O)CCC2 ZINC000586904377 GI Annotated Anodyne COc1ccc(C=O)c2cc(-c3nc4c(Br)ncc(F)c4[nH]3)oc12 ZINC000586904532 GI Annotated Anodyne Cc1oc2c(c1-c1nc3ccc4c(c3[nH]1)C(=O)c1ccccc1C4=O)C(=O)CCC2 ZINC000586904559 GI Annotated Clean Cc1oc2c(c1-c1nc3cccc(I)c3[nH]1)C(=O)CCC2 ZINC000586904736 GI Annotated Anodyne Cc1c(-c2nc3c(I)cccc3[nH]2)oc2c1[C@H](O)CCC2 ZINC000586904755 GI Annotated Anodyne Cc1c(-c2nc3c(I)cccc3[nH]2)oc2c1[C@@H](O)CCC2 ZINC000586904757 GI Annotated Anodyne Brc1cnc(Br)c2[nH]c(-c3occ4c3CCC4)nc12 ZINC000586904763 GI Annotated Anodyne Cc1oc2c(c1-c1nc3cc(Br)cc(C(=O)O)c3[nH]1)C(=O)CCC2 ZINC000586904776 GI Annotated Anodyne Cc1c(-c2nc3c4c(ccc3[nH]2)C(=O)c2ccccc2C4=O)oc2c1[C@@H](O)CCC2 ZINC000586904790 GI Annotated Clean Cc1c(-c2nc3c4c(ccc3[nH]2)C(=O)c2ccccc2C4=O)oc2c1[C@H](O)CCC2 ZINC000586904791 GI Annotated Clean Cc1c(-c2nc3ncc(Br)c(Cl)c3[nH]2)oc2c1[C@H](O)CCC2 ZINC000586905051 GI Annotated Anodyne Cc1c(-c2nc3ncc(Br)c(Cl)c3[nH]2)oc2c1[C@@H](O)CCC2 ZINC000586905061 GI Annotated Anodyne Cc1c(-c2nc3c([N+](=O)[O-])c(Br)ccc3[nH]2)oc2c1[C@@H](O)CCC2 ZINC000586905278 GI Annotated Bother Cc1c(-c2nc3c([N+](=O)[O-])c(Br)ccc3[nH]2)oc2c1[C@H](O)CCC2 ZINC000586905279 GI Annotated Bother Cc1c(-c2nc3cc(I)ccc3[nH]2)oc2c1[C@H](O)CCC2 ZINC000586905305 GI Annotated Anodyne Cc1c(-c2nc3cc(I)ccc3[nH]2)oc2c1[C@@H](O)CCC2 ZINC000586905306 GI Annotated Anodyne Cc1c(-c2nc3c([N+](=O)[O-])cc(Br)cc3[nH]2)oc2c1[C@H](O)CCC2 ZINC000586905520 GI Annotated Bother Cc1c(-c2nc3c([N+](=O)[O-])cc(Br)cc3[nH]2)oc2c1[C@@H](O)CCC2 ZINC000586905521 GI Annotated Bother CCOC(=O)c1cc(Br)c2[nH]c(-c3occ4c3CCC4)nc2c1 ZINC000586905620 GI Annotated Anodyne Cc1c(-c2nc3c(Cl)ncc(Br)c3[nH]2)oc2c1[C@H](O)CCC2 ZINC000586905645 GI Annotated Anodyne Cc1c(-c2nc3c(Cl)ncc(Br)c3[nH]2)oc2c1[C@@H](O)CCC2 ZINC000586905646 GI Annotated Anodyne CC1(C)OC(=O)C[C@@H]1c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000586905820 GI Annotated Anodyne CC1(C)OC(=O)C[C@H]1c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000586905821 GI Annotated Anodyne CC1(C)OC(=O)C[C@@H]1c1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000586906023 GI Annotated Anodyne CC1(C)OC(=O)C[C@H]1c1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000586906024 GI Annotated Anodyne CC1(C)OC(=O)C[C@@H]1c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000586906051 GI Annotated Anodyne CC1(C)OC(=O)C[C@H]1c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000586906052 GI Annotated Anodyne O=C1O/C(=C/c2nc3c(Br)cnc(Cl)c3[nH]2)c2ccccc21 ZINC000586906367 GI Annotated Anodyne O=C1O/C(=C\c2nc3c(Br)cnc(Cl)c3[nH]2)c2ccccc21 ZINC000586906374 GI Annotated Anodyne CC1(C)OC(=O)C[C@H]1c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000586906501 GI Annotated Anodyne CC1(C)OC(=O)C[C@@H]1c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000586906502 GI Annotated Anodyne Ic1cnc2[nH]c(CCc3cc4ccccc4o3)nc2c1 ZINC000586906723 GI Annotated Anodyne O=C1O/C(=C/c2nc3c(Cl)c(Br)cnc3[nH]2)c2ccccc21 ZINC000586906761 GI Annotated Anodyne O=C1O/C(=C\c2nc3c(Cl)c(Br)cnc3[nH]2)c2ccccc21 ZINC000586906762 GI Annotated Anodyne Oc1cccc2c1OCC(c1nc3c(Cl)ncc(Br)c3[nH]1)=C2 ZINC000586907050 GI Annotated Anodyne CCCCOc1cc2nc([C@@H]3CC(=O)OC3(C)C)[nH]c2cc1Br ZINC000586907113 GI Annotated Anodyne CCCCOc1cc2nc([C@H]3CC(=O)OC3(C)C)[nH]c2cc1Br ZINC000586907115 GI Annotated Anodyne Oc1cccc2c1OCC(c1nc3ncc(Br)c(Cl)c3[nH]1)=C2 ZINC000586907136 GI Annotated Anodyne CC1(C)OC(=O)C[C@@H]1c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000586907202 GI Annotated Anodyne CC1(C)OC(=O)C[C@H]1c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000586907203 GI Annotated Anodyne O=C1O/C(=C\c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c2ccccc21 ZINC000586907302 GI Annotated Anodyne O=C1O/C(=C/c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c2ccccc21 ZINC000586907307 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c([C@@H]3CCCO[C@@H]3CC)nc2c1 ZINC000586907461 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c([C@H]3CCCO[C@H]3CC)nc2c1 ZINC000586907474 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c([C@@H]3CCCO[C@H]3CC)nc2c1 ZINC000586907477 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c([C@H]3CCCO[C@@H]3CC)nc2c1 ZINC000586907480 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc(CCc3cc4ccccc4o3)nc-2[nH]1 ZINC000586907698 GI Annotated Anodyne CC(C)COc1cc2nc([C@@H]3CC(=O)OC3(C)C)[nH]c2cc1Br ZINC000586907754 GI Annotated Anodyne CC(C)COc1cc2nc([C@H]3CC(=O)OC3(C)C)[nH]c2cc1Br ZINC000586907756 GI Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc(CCc3cc4ccccc4o3)[nH]c2c1 ZINC000586907872 GI Annotated Anodyne Oc1cccc2c1OCC(c1nc3c(F)c(F)c(Br)cc3[nH]1)=C2 ZINC000586907986 GI Annotated Anodyne O=C1c2ccoc2CC[C@@H]1Cc1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000586908211 GI Annotated Anodyne O=C1c2ccoc2CC[C@H]1Cc1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000586908213 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(CCCCCC#CCO[C@@H]3CCCCO3)[nH]c2cc1F ZINC000586908382 GI Annotated Mild O=[N+]([O-])c1cc2nc(CCCCCC#CCO[C@H]3CCCCO3)[nH]c2cc1F ZINC000586908383 GI Annotated Mild Oc1cccc2c1OCC(c1nc3cnc(C(F)(F)C(F)(F)F)cc3[nH]1)=C2 ZINC000586908633 GI Annotated Anodyne COc1cc(OC)c2[nH]c(CCCCCC#CCO[C@@H]3CCCCO3)nc2c1 ZINC000586909446 GI Annotated Mild COc1cc(OC)c2[nH]c(CCCCCC#CCO[C@H]3CCCCO3)nc2c1 ZINC000586909454 GI Annotated Mild O=C1c2ccoc2CC[C@@H]1Cc1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000586909574 GI Annotated Anodyne O=C1c2ccoc2CC[C@H]1Cc1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000586909576 GI Annotated Anodyne Fc1cnc(Cl)c2[nH]c(CCCCCC#CCO[C@@H]3CCCCO3)nc12 ZINC000586909650 GI Annotated Mild Fc1cnc(Cl)c2[nH]c(CCCCCC#CCO[C@H]3CCCCO3)nc12 ZINC000586909656 GI Annotated Mild CCOC(=O)c1ccc2nc(CCCCCC#CCO[C@H]3CCCCO3)[nH]c2c1 ZINC000586909677 GI Annotated Mild CCOC(=O)c1ccc2nc(CCCCCC#CCO[C@@H]3CCCCO3)[nH]c2c1 ZINC000586909678 GI Annotated Mild C(#CCO[C@H]1CCCCO1)CCCCCc1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000586909802 GI Annotated Mild C(#CCO[C@@H]1CCCCO1)CCCCCc1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000586909803 GI Annotated Mild COC(=O)c1cc2nc([C@H]3CC(=O)OC3(C)C)[nH]c2c(F)c1Nc1ccccc1 ZINC000586910064 GI Annotated Anodyne COC(=O)c1cc2nc([C@@H]3CC(=O)OC3(C)C)[nH]c2c(F)c1Nc1ccccc1 ZINC000586910069 GI Annotated Anodyne COc1cc2nc(CCCCCC#CCO[C@H]3CCCCO3)[nH]c2cc1OC ZINC000586910177 GI Annotated Mild COc1cc2nc(CCCCCC#CCO[C@@H]3CCCCO3)[nH]c2cc1OC ZINC000586910178 GI Annotated Mild N#Cc1nc(Cl)cc2nc(CCCCCC#CCO[C@@H]3CCCCO3)[nH]c12 ZINC000586910437 GI Annotated Mild N#Cc1nc(Cl)cc2nc(CCCCCC#CCO[C@H]3CCCCO3)[nH]c12 ZINC000586910439 GI Annotated Mild CC1(C)OC(=O)C[C@@H]1c1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000586910476 GI Annotated Anodyne CC1(C)OC(=O)C[C@H]1c1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000586910477 GI Annotated Anodyne O=C(O)c1cc2nc(CCCCCC#CCO[C@@H]3CCCCO3)[nH]c2cc1F ZINC000586910527 GI Annotated Mild O=C(O)c1cc2nc(CCCCCC#CCO[C@H]3CCCCO3)[nH]c2cc1F ZINC000586910528 GI Annotated Mild O=C1CCc2cc3nc(CCCCCC#CCO[C@H]4CCCCO4)[nH]c3cc2N1 ZINC000586910902 GI Annotated Mild O=C1CCc2cc3nc(CCCCCC#CCO[C@@H]4CCCCO4)[nH]c3cc2N1 ZINC000586910908 GI Annotated Mild O=C(O)c1cc(F)cc2nc(CCCCCC#CCO[C@@H]3CCCCO3)[nH]c12 ZINC000586911202 GI Annotated Mild O=C(O)c1cc(F)cc2nc(CCCCCC#CCO[C@H]3CCCCO3)[nH]c12 ZINC000586911204 GI Annotated Mild Cc1cc2[nH]c(CCCCCC#CCO[C@@H]3CCCCO3)nc2cc1[N+](=O)[O-] ZINC000586911417 GI Annotated Mild Cc1cc2[nH]c(CCCCCC#CCO[C@H]3CCCCO3)nc2cc1[N+](=O)[O-] ZINC000586911418 GI Annotated Mild Oc1ccc(C2(c3nc4ccc(Br)c(F)c4[nH]3)CCOCC2)cc1 ZINC000586911867 GI Annotated Anodyne Oc1ccc(C2(c3nc4cccc(OC(F)(F)F)c4[nH]3)CCOCC2)cc1 ZINC000586911911 GI Annotated Anodyne Oc1ccc(C2(c3nc4cc5nc6ccccc6nc5cc4[nH]3)CCOCC2)cc1 ZINC000586911931 GI Annotated Bother Cc1cc(Br)c2[nH]c(C3(c4ccc(O)cc4)CCOCC3)nc2c1 ZINC000586912028 GI Annotated Anodyne Oc1ccc(C2(c3nc4c5cccnc5c5ncccc5c4[nH]3)CCOCC2)cc1 ZINC000586912295 GI Annotated Bother CC[C@@H]1OCCC[C@H]1c1nc2c(Br)cnc(Br)c2[nH]1 ZINC000586912844 GI Annotated Anodyne CC[C@@H]1OCCC[C@@H]1c1nc2c(Br)cnc(Br)c2[nH]1 ZINC000586912855 GI Annotated Anodyne CC[C@H]1OCCC[C@@H]1c1nc2c(Br)cnc(Br)c2[nH]1 ZINC000586912857 GI Annotated Anodyne CC[C@H]1OCCC[C@H]1c1nc2c(Br)cnc(Br)c2[nH]1 ZINC000586912860 GI Annotated Anodyne Cc1c(Br)ccc2nc(C3(c4ccc(O)cc4)CCOCC3)[nH]c12 ZINC000586913029 GI Annotated Anodyne N#Cc1cc2nc(C3(c4ccc(O)cc4)CCOCC3)[nH]c2cc1C(F)(F)F ZINC000586913061 GI Annotated Mild CC1(C)COc2c(-c3nc4cc(Br)cc(C(=O)O)c4[nH]3)cccc21 ZINC000586913063 GI Annotated Anodyne Cc1cc(Br)cc2nc(C3(c4ccc(O)cc4)CCOCC3)[nH]c12 ZINC000586913069 GI Annotated Anodyne CCCCCOc1cc2nc([C@@H](O)C3CCOCC3)[nH]c2cc1Br ZINC000586913078 GI Annotated Anodyne CCCCCOc1cc2nc([C@H](O)C3CCOCC3)[nH]c2cc1Br ZINC000586913083 GI Annotated Anodyne Cc1cc2nc(C3(c4ccc(O)cc4)CCOCC3)[nH]c2cc1Br ZINC000586913112 GI Annotated Anodyne Oc1ccc(C2(c3nc4cc(Br)cc(F)c4[nH]3)CCOCC2)cc1 ZINC000586913140 GI Annotated Anodyne CC1(C)OC(=O)C[C@H]1c1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000586913387 GI Annotated Anodyne CC1(C)OC(=O)C[C@@H]1c1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000586913389 GI Annotated Anodyne Oc1ccc(C2(c3nc4ccc(F)c(Br)c4[nH]3)CCOCC2)cc1 ZINC000586913544 GI Annotated Anodyne Oc1ccc(C2(c3nc4cc(Br)c(F)cc4[nH]3)CCOCC2)cc1 ZINC000586913602 GI Annotated Anodyne Oc1ccc(C2(c3nc4ccc(OC(F)(F)F)cc4[nH]3)CCOCC2)cc1 ZINC000586913691 GI Annotated Anodyne Oc1ccc(C2(c3nc4cc(F)cc(Br)c4[nH]3)CCOCC2)cc1 ZINC000586913925 GI Annotated Anodyne CC(C)CCOc1cc2nc([C@@H](O)C3CCOCC3)[nH]c2cc1Br ZINC000586914306 GI Annotated Anodyne CC(C)CCOc1cc2nc([C@H](O)C3CCOCC3)[nH]c2cc1Br ZINC000586914309 GI Annotated Anodyne O=C1CCc2cc3nc(-c4cc(O)cc(-c5ccc6c(c5)OCO6)c4)[nH]c3cc2N1 ZINC000586914480 GI Annotated Anodyne COC(=O)c1cccc2nc(-c3cc(O)cc(-c4ccc5c(c4)OCO5)c3)[nH]c12 ZINC000586914481 GI Annotated Anodyne COc1cc(OC)c2[nH]c(-c3cc(O)cc(-c4ccc5c(c4)OCO5)c3)nc2c1 ZINC000586914520 GI Annotated Anodyne O=[N+]([O-])c1cccc2nc(-c3cc(O)cc(-c4ccc5c(c4)OCO5)c3)[nH]c12 ZINC000586914578 GI Annotated Bother COc1cc2nc(-c3cc(O)cc(-c4ccc5c(c4)OCO5)c3)[nH]c2cc1OC ZINC000586914622 GI Annotated Anodyne COc1cc2nc(-c3cc(O)cc(-c4ccc5c(c4)OCO5)c3)[nH]c2cc1F ZINC000586915041 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000586915118 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000586915119 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000586915120 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000586915121 GI Annotated Anodyne N#Cc1nc(Cl)cc2nc(-c3cc(O)cc(-c4ccc5c(c4)OCO5)c3)[nH]c12 ZINC000586915223 GI Annotated Mild COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000586915304 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000586915305 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000586915306 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000586915307 GI Annotated Anodyne O=C(O)c1cc(F)cc2nc(-c3cc(O)cc(-c4ccc5c(c4)OCO5)c3)[nH]c12 ZINC000586915396 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000586915503 GI Annotated Bother COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000586915504 GI Annotated Bother COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000586915505 GI Annotated Bother COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000586915506 GI Annotated Bother COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000586915519 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000586915520 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000586915521 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000586915522 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000586915605 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000586915607 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000586915608 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000586915609 GI Annotated Anodyne FC(F)(F)Oc1cc2nc(C3CC4(COC4)C3)[nH]c2cc1Br ZINC000586915698 GI Annotated Anodyne FC(F)(F)Oc1cc(Br)cc2nc(C3CC4(COC4)C3)[nH]c12 ZINC000586916099 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3cc(O)cc(-c4ccc5c(c4)OCO5)c3)[nH]c2cc1F ZINC000586916144 GI Annotated Bother COc1ccc(-c2nnc(-c3ccc4nc(C5CC6(COC6)C5)[nH]c4c3)o2)cc1 ZINC000586916460 GI Annotated Anodyne O=c1ccc2cc(-c3nc4c([N+](=O)[O-])c(Br)ccc4[nH]3)ccc2o1 ZINC000586916534 GI Annotated Bother O=c1ccc2cc(-c3nc4c(Cl)ncc(Br)c4[nH]3)ccc2o1 ZINC000586916537 GI Annotated Anodyne O=c1ccc2cc(-c3nc4cnc(C(F)(F)C(F)(F)F)cc4[nH]3)ccc2o1 ZINC000586916582 GI Annotated Anodyne O=c1ccc2cc(-c3nc4c([N+](=O)[O-])cc(Br)cc4[nH]3)ccc2o1 ZINC000586916641 GI Annotated Bother COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000586916867 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000586916868 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000586916869 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000586916870 GI Annotated Anodyne COC(=O)c1cc2nc(C3CC4(COC4)C3)[nH]c2c(F)c1Nc1ccccc1 ZINC000586916995 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000586917243 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000586917245 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000586917247 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000586917250 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c([C@@H]3C[C@@]34CCOc3ccc(OC)cc34)nc2c1 ZINC000586917262 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c([C@@H]3C[C@]34CCOc3ccc(OC)cc34)nc2c1 ZINC000586917263 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c([C@H]3C[C@@]34CCOc3ccc(OC)cc34)nc2c1 ZINC000586917264 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c([C@H]3C[C@]34CCOc3ccc(OC)cc34)nc2c1 ZINC000586917267 GI Annotated Anodyne COc1ccc2c(C)c(CCc3nc4ccc(F)c(F)c4[nH]3)c(=O)oc2c1C ZINC000586917382 GI Annotated Anodyne COc1ccc2c(C)c(CCc3nc4c(C)nc(C)cc4[nH]3)c(=O)oc2c1C ZINC000586917396 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000586917517 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000586917521 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000586917526 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000586917529 GI Annotated Anodyne COc1ccc2c(C)c(CCc3nc4c(C)cnc(Cl)c4[nH]3)c(=O)oc2c1C ZINC000586918052 GI Annotated Anodyne COc1ccc2c(C)c(CCc3nc4ccc(Cl)nc4[nH]3)c(=O)oc2c1C ZINC000586918192 GI Annotated Anodyne COc1ccc2c(C)c(CCc3nc4cc(F)cc(F)c4[nH]3)c(=O)oc2c1C ZINC000586918240 GI Annotated Anodyne O=C1c2ccccc2C(=O)c2c1ccc1[nH]c(-c3ccc4oc(=O)ccc4c3)nc21 ZINC000586918243 GI Annotated Clean COc1ccc2c(C)c(CCc3nc4cncc(Cl)c4[nH]3)c(=O)oc2c1C ZINC000586918280 GI Annotated Anodyne FC(F)(F)Oc1cc(Br)c2[nH]c(C3CC4(COC4)C3)nc2c1 ZINC000586918371 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@@H]1c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000586918436 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)C[C@H]1c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000586918438 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@H]1c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000586918439 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)C[C@@H]1c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000586918440 GI Annotated Anodyne CCCCc1cc(=O)oc2cc(OCc3nc4cc5cn[nH]c5cc4[nH]3)ccc12 ZINC000586918493 GI Annotated Anodyne COc1ccc2c(C)c(CCc3nc4cc(F)c(F)cc4[nH]3)c(=O)oc2c1C ZINC000586918531 GI Annotated Anodyne COc1ccc2c(C)c(CCc3nc4cc(Cl)ncc4[nH]3)c(=O)oc2c1C ZINC000586918532 GI Annotated Anodyne COc1ccc2c(C)c(CCc3nc4ccnc(Cl)c4[nH]3)c(=O)oc2c1C ZINC000586918621 GI Annotated Anodyne CC(C)=CCOc1ccc2c(C)c(Cc3nc4cncnc4[nH]3)c(=O)oc2c1C ZINC000586918758 GI Annotated Anodyne COc1ccc2c(C)c(CCc3nc4c(Cl)ccnc4[nH]3)c(=O)oc2c1C ZINC000586918788 GI Annotated Anodyne COc1cc2nc(CCc3c(C)c4ccc(OC)c(C)c4oc3=O)[nH]c2cc1C ZINC000586918924 GI Annotated Anodyne O=c1ccc2cc(-c3nc4c(F)c(F)c(Br)cc4[nH]3)ccc2o1 ZINC000586918957 GI Annotated Anodyne CC(C)=CCOc1ccc2c(C)c(Cc3nc4cnncc4[nH]3)c(=O)oc2c1C ZINC000586919047 GI Annotated Anodyne COc1ccc2c(C)c(CCc3nc4cccc(OC)c4[nH]3)c(=O)oc2c1C ZINC000586919228 GI Annotated Anodyne COc1ccc2c(C)c(CCc3nc4ccc(C(C)=O)cc4[nH]3)c(=O)oc2c1C ZINC000586919262 GI Annotated Anodyne COc1cc2nc(CCc3c(C)c4ccc(OC)c(C)c4oc3=O)[nH]c2cc1F ZINC000586919264 GI Annotated Anodyne CSc1sc(-c2nc3cnccc3[nH]2)c(Cl)c1S(=O)(=O)C(C)C ZINC000586919563 GI Annotated Anodyne O=S(=O)(CCc1nc2ccc(C(F)(F)F)cc2[nH]1)c1ccc2c(c1)CCC2 ZINC000586920299 GI Annotated Anodyne CSc1sc(-c2nc3cccnc3[nH]2)c(Cl)c1S(=O)(=O)C(C)C ZINC000586920798 GI Annotated Anodyne O=S(=O)(CCc1nc2cc(Cl)cc(Cl)c2[nH]1)c1ccc2c(c1)CCC2 ZINC000586920838 GI Annotated Anodyne O=S(=O)(Cc1ccccc1-c1nc2c(Cl)ccnc2[nH]1)c1ccccc1 ZINC000586921009 GI Annotated Anodyne O=S(=O)(CCc1nc2cc(Cl)c(Cl)cc2[nH]1)c1ccc2c(c1)CCC2 ZINC000586921028 GI Annotated Anodyne O=S(=O)(Cc1ccccc1-c1nc2ccc(Cl)nc2[nH]1)c1ccccc1 ZINC000586921178 GI Annotated Anodyne Cc1cc2[nH]c(-c3ccccc3CS(=O)(=O)c3ccccc3)nc2c(C)n1 ZINC000586921521 GI Annotated Anodyne O=S(=O)(Cc1ccccc1-c1nc2cc(F)cc(F)c2[nH]1)c1ccccc1 ZINC000586921527 GI Annotated Anodyne CCS(=O)(=O)c1cccc(Cc2nc3cc(C)cc(Br)c3[nH]2)c1 ZINC000586921564 GI Annotated Anodyne CCS(=O)(=O)c1ccccc1-c1nc2cc(Cl)cc(Br)c2[nH]1 ZINC000586921565 GI Annotated Anodyne CCS(=O)(=O)c1ccccc1-c1nc2cc(C)cc(Br)c2[nH]1 ZINC000586921579 GI Annotated Anodyne CC(C)(C)c1cccc2nc(CCS(=O)(=O)c3ccc4c(c3)CCC4)[nH]c12 ZINC000586921778 GI Annotated Anodyne CCS(=O)(=O)c1ccccc1-c1nc2ccc(Br)c(C)c2[nH]1 ZINC000586921785 GI Annotated Anodyne O=S(=O)(Cc1ccccc1-c1nc2cc(Cl)ncc2[nH]1)c1ccccc1 ZINC000586921853 GI Annotated Anodyne CCS(=O)(=O)c1cccc(Cc2nc3ccc(Br)c(C)c3[nH]2)c1 ZINC000586921985 GI Annotated Anodyne COc1cccc2nc(-c3ccccc3CS(=O)(=O)c3ccccc3)[nH]c12 ZINC000586922064 GI Annotated Anodyne O=S(=O)(Cc1ccccc1-c1nc2cncc(Cl)c2[nH]1)c1ccccc1 ZINC000586922070 GI Annotated Anodyne O=S(=O)(Cc1ccccc1-c1nc2cc(Cl)cnc2[nH]1)c1ccccc1 ZINC000586922400 GI Annotated Anodyne CCS(=O)(=O)c1cccc(Cc2nc3cc(F)cc(C(F)(F)F)c3[nH]2)c1 ZINC000586922493 GI Annotated Anodyne O=S(=O)(Cc1ccccc1-c1nc2ccnc(Cl)c2[nH]1)c1ccccc1 ZINC000586922643 GI Annotated Anodyne O=S(=O)(Cc1ccccc1-c1nc2ccc(F)c(F)c2[nH]1)c1ccccc1 ZINC000586922683 GI Annotated Anodyne CC(C)(C)c1ccc2nc(CCS(=O)(=O)c3ccc4c(c3)CCC4)[nH]c2c1 ZINC000586923057 GI Annotated Anodyne CCS(=O)(=O)c1ccccc1-c1nc2cc(Br)c(C)c(C)c2[nH]1 ZINC000586923060 GI Annotated Anodyne CCS(=O)(=O)c1cccc(Cc2nc3cc(Br)cc(C)c3[nH]2)c1 ZINC000586923119 GI Annotated Anodyne Nc1ccc(Oc2ccc3nc(/C=C/S(=O)(=O)c4ccccc4)[nH]c3c2)cc1 ZINC000586923924 GI Annotated Clean Nc1ccc(Oc2ccc3nc(/C=C\S(=O)(=O)c4ccccc4)[nH]c3c2)cc1 ZINC000586923925 GI Annotated Clean O=S(=O)(/C=C\c1nc2cc3nc4ccccc4nc3cc2[nH]1)c1ccccc1 ZINC000586923961 GI Annotated Bother O=S(=O)(/C=C/c1nc2cc3nc4ccccc4nc3cc2[nH]1)c1ccccc1 ZINC000586923962 GI Annotated Bother O=S(=O)(/C=C\c1nc2cc(Br)c(F)c(F)c2[nH]1)c1ccccc1 ZINC000586924159 GI Annotated Anodyne O=S(=O)(/C=C/c1nc2cc(Br)c(F)c(F)c2[nH]1)c1ccccc1 ZINC000586924160 GI Annotated Anodyne O=C(c1ccccc1)c1ccc2nc(/C=C/S(=O)(=O)c3ccccc3)[nH]c2c1 ZINC000586924289 GI Annotated Anodyne O=C(c1ccccc1)c1ccc2nc(/C=C\S(=O)(=O)c3ccccc3)[nH]c2c1 ZINC000586924290 GI Annotated Anodyne COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cc(C)c(F)cc2[nH]1 ZINC000586924399 GI Annotated Unstable O=S(=O)(/C=C/c1nc2c3cccnc3c3ncccc3c2[nH]1)c1ccccc1 ZINC000586924738 GI Annotated Bother O=S(=O)(/C=C\c1nc2c3cccnc3c3ncccc3c2[nH]1)c1ccccc1 ZINC000586924739 GI Annotated Bother Cc1c(Br)ccc2nc(/C=C\S(=O)(=O)c3ccccc3)[nH]c12 ZINC000586924817 GI Annotated Anodyne Cc1c(Br)ccc2nc(/C=C/S(=O)(=O)c3ccccc3)[nH]c12 ZINC000586924820 GI Annotated Anodyne COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2ccc(F)c(F)c2[nH]1 ZINC000586924872 GI Annotated Unstable Cc1cc(Br)cc2nc(/C=C/S(=O)(=O)c3ccccc3)[nH]c12 ZINC000586924984 GI Annotated Anodyne Cc1cc(Br)cc2nc(/C=C\S(=O)(=O)c3ccccc3)[nH]c12 ZINC000586924985 GI Annotated Anodyne Cc1c(Br)cc2nc(/C=C/S(=O)(=O)c3ccccc3)[nH]c2c1C ZINC000586925063 GI Annotated Anodyne Cc1c(Br)cc2nc(/C=C\S(=O)(=O)c3ccccc3)[nH]c2c1C ZINC000586925067 GI Annotated Anodyne Cc1cc2nc(/C=C/S(=O)(=O)c3ccccc3)[nH]c2cc1Br ZINC000586925112 GI Annotated Anodyne Cc1cc2nc(/C=C\S(=O)(=O)c3ccccc3)[nH]c2cc1Br ZINC000586925115 GI Annotated Anodyne COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cc(C)cc(C)c2[nH]1 ZINC000586925322 GI Annotated Unstable COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cccc(Cl)c2[nH]1 ZINC000586925367 GI Annotated Unstable COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2c(C)ccc(C)c2[nH]1 ZINC000586925452 GI Annotated Unstable CCc1ccc2nc(-c3cc(Cl)c(S(=O)(=O)Cl)cc3OC)[nH]c2c1 ZINC000586925473 GI Annotated Unstable COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cc(F)c(F)cc2[nH]1 ZINC000586925502 GI Annotated Unstable COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2ccc(C)c(C)c2[nH]1 ZINC000586925529 GI Annotated Unstable COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cc(F)cc(F)c2[nH]1 ZINC000586925586 GI Annotated Unstable O=S(=O)(/C=C\c1nc2cc(Cl)cc(Br)c2[nH]1)c1ccccc1 ZINC000586925618 GI Annotated Anodyne COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cc(C)c(C)cc2[nH]1 ZINC000586925619 GI Annotated Unstable O=S(=O)(/C=C/c1nc2cc(Cl)cc(Br)c2[nH]1)c1ccccc1 ZINC000586925620 GI Annotated Anodyne Cc1ccc2nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c2n1 ZINC000586925632 GI Annotated Unstable COc1cc(S(=O)(=O)Cl)c(Cl)cc1-c1nc2cc(C)cc(F)c2[nH]1 ZINC000586925908 GI Annotated Unstable Cc1cncc2nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c12 ZINC000586926052 GI Annotated Unstable Cc1ccnc2[nH]c(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)nc12 ZINC000586926056 GI Annotated Unstable Cc1cc(S(=O)(=O)Cl)cc(-c2nc3c(F)cnc(Cl)c3[nH]2)c1Cl ZINC000586926169 GI Annotated Unstable Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cncc(Cl)c3[nH]2)c1Cl ZINC000586926185 GI Annotated Unstable O=S(=O)(Cl)c1ccc(Cl)c(-c2nc3cccc(O)c3[nH]2)c1Cl ZINC000586926241 GI Annotated Unstable CC(C)(C)c1cccc2nc(CCC(=O)c3ccc(S(C)(=O)=O)cc3)[nH]c12 ZINC000586926251 GI Annotated Anodyne Cc1cc(S(=O)(=O)Cl)cc(-c2nc3c(C)cnc(Cl)c3[nH]2)c1Cl ZINC000586926309 GI Annotated Unstable O=S(=O)(Cl)c1cc(-c2nc3ccc4ncccc4c3[nH]2)ccc1Cl ZINC000586926332 GI Annotated Unstable COc1cc2nc(-c3cc(S(=O)(=O)Cl)cc(C)c3Cl)[nH]c2cc1C ZINC000586926356 GI Annotated Unstable Cc1cc(Br)c2[nH]c(/C=C/S(=O)(=O)c3ccccc3)nc2c1 ZINC000586926361 GI Annotated Anodyne Cc1cc(Br)c2[nH]c(/C=C\S(=O)(=O)c3ccccc3)nc2c1 ZINC000586926362 GI Annotated Anodyne Cc1cc2[nH]c(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)nc2cc1[N+](=O)[O-] ZINC000586926437 GI Annotated Unstable N#Cc1ccc2nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c2c1 ZINC000586926445 GI Annotated Unstable CCc1ccc(-c2nc3c(Cl)c(Cl)cnc3[nH]2)cc1S(=O)(=O)Cl ZINC000586926493 GI Annotated Unstable Cc1cc(S(=O)(=O)Cl)cc(-c2nc3ccnc(Cl)c3[nH]2)c1Cl ZINC000586926531 GI Annotated Unstable CCc1ccc(-c2nc3c(F)c(F)c(F)c(F)c3[nH]2)cc1S(=O)(=O)Cl ZINC000586926625 GI Annotated Unstable CCc1ccc(-c2nc3cc(C#N)cc(Cl)c3[nH]2)cc1S(=O)(=O)Cl ZINC000586926639 GI Annotated Unstable CCc1ccc(-c2nc3cc(C(F)(F)F)cnc3[nH]2)cc1S(=O)(=O)Cl ZINC000586926652 GI Annotated Unstable Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(Cl)ncc3[nH]2)c1Cl ZINC000586926688 GI Annotated Unstable O=S(=O)(Cl)c1cc(-c2nc3c(F)c(F)c(F)c(F)c3[nH]2)ccc1Cl ZINC000586926691 GI Annotated Unstable O=S(=O)(Cl)c1cc(-c2nc3cc(C(F)(F)F)cnc3[nH]2)ccc1Cl ZINC000586926777 GI Annotated Unstable Cc1cc(S(=O)(=O)Cl)cc(-c2nc3ccc(Cl)nc3[nH]2)c1Cl ZINC000586926789 GI Annotated Unstable COc1cc2nc(-c3cc(S(=O)(=O)Cl)cc(C)c3Cl)[nH]c2cc1F ZINC000586926813 GI Annotated Unstable O=S(=O)(Cl)c1ccc(-c2nc3c(F)c(F)c(F)c(F)c3[nH]2)cc1Cl ZINC000586926826 GI Annotated Unstable CCc1ccc(-c2nc3cc(Cl)nc(Cl)c3[nH]2)cc1S(=O)(=O)Cl ZINC000586926901 GI Annotated Unstable Cc1cc2[nH]c(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)nc2cc1[N+](=O)[O-] ZINC000586927013 GI Annotated Unstable O=S(=O)(/C=C\c1nc2cc(Br)cc(Cl)c2[nH]1)c1ccccc1 ZINC000586927060 GI Annotated Anodyne O=S(=O)(/C=C/c1nc2cc(Br)cc(Cl)c2[nH]1)c1ccccc1 ZINC000586927062 GI Annotated Anodyne Cc1cc(S(=O)(=O)Cl)cc(-c2nc3ccc(F)c(F)c3[nH]2)c1Cl ZINC000586927130 GI Annotated Unstable Cc1cc(-c2nc3c(F)c(F)c(F)c(F)c3[nH]2)ccc1S(=O)(=O)Cl ZINC000586927247 GI Annotated Unstable Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(Cl)cnc3[nH]2)c1Cl ZINC000586927268 GI Annotated Unstable Cc1cnc2[nH]c(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)nc2c1 ZINC000586927275 GI Annotated Unstable Cc1cc2[nH]c(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)nc2c(C)n1 ZINC000586927284 GI Annotated Unstable COc1cccc2nc(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)[nH]c12 ZINC000586927300 GI Annotated Unstable Cc1cc(S(=O)(=O)Cl)cc(-c2nc3c(Cl)ccnc3[nH]2)c1Cl ZINC000586927317 GI Annotated Unstable Cc1cnc(Cl)c2[nH]c(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)nc12 ZINC000586927412 GI Annotated Unstable Cc1nccc2[nH]c(-c3c(Cl)ccc(S(=O)(=O)Cl)c3Cl)nc12 ZINC000586927489 GI Annotated Unstable Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cc(F)cc(F)c3[nH]2)c1Cl ZINC000586927505 GI Annotated Unstable Cc1cc(-c2nc3nc(Cl)c(Cl)cc3[nH]2)ccc1S(=O)(=O)Cl ZINC000586927534 GI Annotated Unstable O=S(=O)(Cl)c1ccc(-c2nc3cc(C(F)(F)F)cnc3[nH]2)cc1Cl ZINC000586927659 GI Annotated Unstable Cc1cc(-c2nc3ncc(Cl)c(Cl)c3[nH]2)ccc1S(=O)(=O)Cl ZINC000586927756 GI Annotated Unstable CCc1ccc(-c2nc3cc(C(F)(F)F)ncc3[nH]2)cc1S(=O)(=O)Cl ZINC000586927784 GI Annotated Unstable CCc1ccc(-c2nc3ccc(C(C)(C)C)nc3[nH]2)cc1S(=O)(=O)Cl ZINC000586927875 GI Annotated Unstable Cc1cc(-c2nc3c(Cl)nc(Cl)cc3[nH]2)ccc1S(=O)(=O)Cl ZINC000586927945 GI Annotated Unstable Cc1cnc(Cl)c2[nH]c(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)nc12 ZINC000586927949 GI Annotated Unstable O=S(=O)(Cl)c1ccc(-c2nc3cc(F)c(F)c(F)c3[nH]2)cc1Cl ZINC000586927957 GI Annotated Unstable N#Cc1cc(Cl)c2[nH]c(-c3ccc(S(=O)(=O)Cl)c(Cl)c3)nc2c1 ZINC000586927997 GI Annotated Unstable Cc1cc(-c2nc3c(OC(F)(F)F)cccc3[nH]2)ccc1S(=O)(=O)Cl ZINC000586928018 GI Annotated Unstable CCc1ccc(-c2nc3cccc(Br)c3[nH]2)cc1S(=O)(=O)Cl ZINC000586928060 GI Annotated Unstable Cc1cc(-c2nc3c(F)c(F)c(Cl)cc3[nH]2)ccc1S(=O)(=O)Cl ZINC000586928064 GI Annotated Unstable O=S(=O)(Cl)c1ccc(-c2nc3ccc4ncccc4c3[nH]2)cc1Cl ZINC000586928071 GI Annotated Unstable CCc1ccc(-c2nc3cc(Cl)c(Cl)nc3[nH]2)cc1S(=O)(=O)Cl ZINC000586928078 GI Annotated Unstable CCc1ccc(-c2nc3c(Cl)cnc(Cl)c3[nH]2)cc1S(=O)(=O)Cl ZINC000586928088 GI Annotated Unstable N#Cc1cc(Cl)c2[nH]c(-c3ccc(Cl)c(S(=O)(=O)Cl)c3)nc2c1 ZINC000586928094 GI Annotated Unstable O=S(=O)(Cl)c1cc(-c2nc3cc(F)c(F)c(F)c3[nH]2)ccc1Cl ZINC000586928127 GI Annotated Unstable Cc1cc(-c2nc3c(Br)cccc3[nH]2)ccc1S(=O)(=O)Cl ZINC000586928189 GI Annotated Unstable Cc1cc(-c2nc3c(Cl)ncc(Cl)c3[nH]2)ccc1S(=O)(=O)Cl ZINC000586928332 GI Annotated Unstable Cc1cc(-c2nc3cc(Cl)c([N+](=O)[O-])cc3[nH]2)ccc1S(=O)(=O)Cl ZINC000586928368 GI Annotated Unstable Cc1cc(-c2nc3cc(C(F)(F)F)c(C#N)cc3[nH]2)ccc1S(=O)(=O)Cl ZINC000586928397 GI Annotated Unstable CN(Cc1nc2ccc(C(C)(C)C)cc2[nH]1)S(=O)(=O)c1ccc(Cl)cc1 ZINC000586928990 GI Annotated Anodyne Cc1cc(S(=O)(=O)Cl)cc(-c2nc3cccc([N+](=O)[O-])c3[nH]2)c1Cl ZINC000586929731 GI Annotated Unstable CCN(CC)S(=O)(=O)c1cccc(-c2nc3ccc4c(c3[nH]2)CCCC4)c1 ZINC000586931065 GI Annotated Anodyne Cc1ccc(N(C)S(=O)(=O)c2cccc(-c3nc4cncc(C)c4[nH]3)c2)cc1 ZINC000586931238 GI Annotated Anodyne Cc1ccc(N(C)S(=O)(=O)c2cccc(-c3nc4c(C)ccnc4[nH]3)c2)cc1 ZINC000586931579 GI Annotated Anodyne CN(C)S(=O)(=O)c1ccc(-c2nc3cc(Sc4ccccc4)ccc3[nH]2)o1 ZINC000586931606 GI Annotated Anodyne CCCCS(=O)(=O)N[C@H](c1nc2cc(C(F)(F)F)c(F)cc2[nH]1)C(C)C ZINC000586932683 GI Annotated Anodyne CCCCS(=O)(=O)N[C@@H](c1nc2cc(C(F)(F)F)c(F)cc2[nH]1)C(C)C ZINC000586932685 GI Annotated Anodyne CCCCS(=O)(=O)N[C@H](c1nc2cc(Cl)c(Cl)cc2[nH]1)C(C)C ZINC000586933018 GI Annotated Anodyne CCCCS(=O)(=O)N[C@@H](c1nc2cc(Cl)c(Cl)cc2[nH]1)C(C)C ZINC000586933022 GI Annotated Anodyne CCCCS(=O)(=O)N[C@@H](c1nc2cc(F)cc(C(F)(F)F)c2[nH]1)C(C)C ZINC000586933269 GI Annotated Anodyne CCCCS(=O)(=O)N[C@H](c1nc2cc(F)cc(C(F)(F)F)c2[nH]1)C(C)C ZINC000586933270 GI Annotated Anodyne CCCCS(=O)(=O)N[C@@H](c1nc2cc(Cl)cc(Cl)c2[nH]1)C(C)C ZINC000586933271 GI Annotated Anodyne CCCCS(=O)(=O)N[C@H](c1nc2cc(Cl)cc(Cl)c2[nH]1)C(C)C ZINC000586933272 GI Annotated Anodyne CC[C@@H](C)NS(=O)(=O)c1ccc(-c2nc3c(Cl)nc(Cl)cc3[nH]2)cc1 ZINC000586935064 GI Annotated Anodyne CC[C@H](C)NS(=O)(=O)c1ccc(-c2nc3c(Cl)nc(Cl)cc3[nH]2)cc1 ZINC000586935065 GI Annotated Anodyne CC(C)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nc2cc(F)cc(F)c2[nH]1 ZINC000586935102 GI Annotated Anodyne CC(C)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nc2cc(F)cc(F)c2[nH]1 ZINC000586935104 GI Annotated Anodyne CC(C)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nc2cccc(F)c2[nH]1 ZINC000586935308 GI Annotated Anodyne CC(C)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nc2cccc(F)c2[nH]1 ZINC000586935310 GI Annotated Anodyne Cc1ccc2nc([C@@H](NS(=O)(=O)c3ccc(Cl)cc3)C(C)C)[nH]c2c1 ZINC000586935636 GI Annotated Anodyne Cc1ccc2nc([C@H](NS(=O)(=O)c3ccc(Cl)cc3)C(C)C)[nH]c2c1 ZINC000586935637 GI Annotated Anodyne Cc1c(F)ccc2nc([C@@H](NS(=O)(=O)c3ccc(Cl)cc3)C(C)C)[nH]c12 ZINC000586935711 GI Annotated Anodyne Cc1c(F)ccc2nc([C@H](NS(=O)(=O)c3ccc(Cl)cc3)C(C)C)[nH]c12 ZINC000586935718 GI Annotated Anodyne CC(C)[C@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nc2ccc(F)c(F)c2[nH]1 ZINC000586936571 GI Annotated Anodyne CC(C)[C@@H](NS(=O)(=O)c1ccc(Cl)cc1)c1nc2ccc(F)c(F)c2[nH]1 ZINC000586936573 GI Annotated Anodyne Cc1cccc2nc([C@@H](NS(=O)(=O)c3ccc(Cl)cc3)C(C)C)[nH]c12 ZINC000586938641 GI Annotated Anodyne Cc1cccc2nc([C@H](NS(=O)(=O)c3ccc(Cl)cc3)C(C)C)[nH]c12 ZINC000586938643 GI Annotated Anodyne CCc1ccc2nc([C@H](NS(=O)(=O)c3ccc(Cl)cc3)C(C)C)[nH]c2c1 ZINC000586939513 GI Annotated Anodyne CCc1ccc2nc([C@@H](NS(=O)(=O)c3ccc(Cl)cc3)C(C)C)[nH]c2c1 ZINC000586939514 GI Annotated Anodyne CC[C@H](C)NS(=O)(=O)c1ccc(-c2nc3c4c(ccc3[nH]2)CCCC4)cc1 ZINC000586939638 GI Annotated Anodyne CC[C@@H](C)NS(=O)(=O)c1ccc(-c2nc3c4c(ccc3[nH]2)CCCC4)cc1 ZINC000586939641 GI Annotated Anodyne CC[C@@H](C)NS(=O)(=O)c1ccc(-c2nc3c(ccc4nc(C)ccc43)[nH]2)cc1 ZINC000586940328 GI Annotated Anodyne CC[C@H](C)NS(=O)(=O)c1ccc(-c2nc3c(ccc4nc(C)ccc43)[nH]2)cc1 ZINC000586940330 GI Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3cc(Cl)cc(Cl)c3[nH]2)cc1 ZINC000586940566 GI Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3cc(Cl)cc(Cl)c3[nH]2)cc1 ZINC000586940569 GI Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3cc4ccccc4cc3[nH]2)cc1 ZINC000586940745 GI Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3cc4ccccc4cc3[nH]2)cc1 ZINC000586940746 GI Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3cccc(C(C)(C)C)c3[nH]2)cc1 ZINC000586940850 GI Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3cccc(C(C)(C)C)c3[nH]2)cc1 ZINC000586940851 GI Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3cc(Cl)c(Cl)cc3[nH]2)cc1 ZINC000586941000 GI Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3cc(Cl)c(Cl)cc3[nH]2)cc1 ZINC000586941002 GI Annotated Anodyne Cc1ccc(/C=C\S(=O)(=O)NCc2nc3ccc(C(C)(C)C)cc3[nH]2)cc1 ZINC000586941360 GI Annotated Anodyne Cc1ccc(/C=C/S(=O)(=O)NCc2nc3ccc(C(C)(C)C)cc3[nH]2)cc1 ZINC000586941362 GI Annotated Anodyne Cc1ccc(C)c2[nH]c(CCNS(=O)(=O)c3c(Cl)cccc3Cl)nc12 ZINC000586942406 GI Annotated Anodyne CCS(=O)(=O)NCCCc1nc2ccc(S(F)(F)(F)(F)F)cc2[nH]1 ZINC000586942895 GI Annotated Reactive Cc1ccc2nc(CCNS(=O)(=O)c3c(Cl)cccc3Cl)[nH]c2c1C ZINC000586943322 GI Annotated Anodyne Cc1cc(C)c2[nH]c(CCNS(=O)(=O)c3c(Cl)cccc3Cl)nc2c1 ZINC000586943391 GI Annotated Anodyne O=S(=O)(NCc1ccco1)c1ccsc1-c1nc2ccc(Cl)cc2[nH]1 ZINC000586945155 GI Annotated Anodyne C=CCc1cccc2nc(-c3sccc3S(=O)(=O)NCc3ccco3)[nH]c12 ZINC000586945195 GI Annotated Mild O=S(=O)(NCc1ccco1)c1ccsc1-c1nc2cccc(Cl)c2[nH]1 ZINC000586945308 GI Annotated Anodyne Cc1cccc2nc(-c3sccc3S(=O)(=O)NCc3cccs3)[nH]c12 ZINC000586946904 GI Annotated Anodyne Cc1cccc(NS(=O)(=O)c2ccc(-c3nc4nccc(C)c4[nH]3)cc2)c1C ZINC000586947356 GI Annotated Anodyne CC(C)S(=O)(=O)Nc1ccc(-c2nc3c(Cl)ncc(Cl)c3[nH]2)cc1 ZINC000586948384 GI Annotated Anodyne Cc1ccc(S(=O)(=O)Nc2ccccc2-c2nc3c(C)nc(C)cc3[nH]2)cc1 ZINC000586948413 GI Annotated Anodyne CC(C)S(=O)(=O)Nc1ccc(-c2nc3ncc(Cl)c(Cl)c3[nH]2)cc1 ZINC000586948721 GI Annotated Anodyne Cc1ccc(S(=O)(=O)Nc2ccccc2-c2nc3c(C)nccc3[nH]2)cc1 ZINC000586948730 GI Annotated Anodyne Cc1ccc(S(=O)(=O)Nc2ccccc2-c2nc3cccc(C#N)c3[nH]2)cc1 ZINC000586949403 GI Annotated Mild Cc1ccc(S(=O)(=O)Nc2ccccc2-c2nc3cncc(Cl)c3[nH]2)cc1 ZINC000586949428 GI Annotated Anodyne Cc1ccc(S(=O)(=O)Nc2ccccc2-c2nc3c(C)ccnc3[nH]2)cc1 ZINC000586950074 GI Annotated Anodyne Cc1ccc(S(=O)(=O)Nc2ccccc2-c2nc3ccc(C)nc3[nH]2)cc1 ZINC000586950144 GI Annotated Anodyne Cc1ccc(S(=O)(=O)Nc2ccccc2-c2nc3cncc(C)c3[nH]2)cc1 ZINC000586950462 GI Annotated Anodyne Cc1ccc(C)c2[nH]c(CS(=O)(=O)Nc3ccc(N4CCCCC4)cc3)nc12 ZINC000586950520 GI Annotated Anodyne Cc1ccc2c(ccc3[nH]c(-c4ccc(NS(=O)(=O)C(C)C)cc4)nc32)n1 ZINC000586951028 GI Annotated Anodyne Cc1cc(C)c2[nH]c(CS(=O)(=O)Nc3ccc(N4CCCCC4)cc3)nc2c1 ZINC000586951230 GI Annotated Anodyne CCc1ccc2nc(CS(=O)(=O)Nc3ccc(N4CCCCC4)cc3)[nH]c2c1 ZINC000586951258 GI Annotated Anodyne Cc1ccc2nc(CS(=O)(=O)Nc3ccc(N4CCCCC4)cc3)[nH]c2c1C ZINC000586951309 GI Annotated Anodyne C=CCc1cccc2nc(-c3sccc3S(=O)(=O)Nc3cccnc3)[nH]c12 ZINC000586952289 GI Annotated Mild CCc1ccc2nc(-c3sccc3S(=O)(=O)Nc3cccnc3)[nH]c2c1 ZINC000586952395 GI Annotated Anodyne CC1CCC(NS(=O)(=O)Cc2nc3ccc(Oc4ccccc4)cc3[nH]2)CC1 ZINC000586952543 GI Annotated Anodyne O=S(=O)(Nc1cccnc1)c1ccsc1-c1nc2cccc(Cl)c2[nH]1 ZINC000586952584 GI Annotated Anodyne O=S(=O)(Nc1cccnc1)c1ccsc1-c1nc2ccc(Cl)cc2[nH]1 ZINC000586952744 GI Annotated Anodyne Cc1ccc2nc(-c3sccc3S(=O)(=O)Nc3cccnc3)[nH]c2c1C ZINC000586952835 GI Annotated Anodyne Cc1ccc(C)c2[nH]c(-c3sccc3S(=O)(=O)Nc3cccnc3)nc12 ZINC000586954059 GI Annotated Anodyne C=CCc1cccc2nc(-c3cc(S(=O)(=O)N4CCC4)ccc3Cl)[nH]c12 ZINC000586954593 GI Annotated Mild Cc1cc(Cl)cc2nc(-c3cc(S(=O)(=O)N4CCC4)ccc3Cl)[nH]c12 ZINC000586955406 GI Annotated Anodyne Cc1c(Cl)ccc2nc(-c3cc(S(=O)(=O)N4CCC4)ccc3Cl)[nH]c12 ZINC000586955668 GI Annotated Anodyne O=[S@](Cc1nc2c(Cl)ncnc2[nH]1)C(c1ccccc1)c1ccccc1 ZINC000586957720 GI Annotated Anodyne O=[S@@](Cc1nc2c(Cl)ncnc2[nH]1)C(c1ccccc1)c1ccccc1 ZINC000586957724 GI Annotated Anodyne O=[S@](CCCc1nc2cc(Cl)ncc2[nH]1)c1ccc(Br)cc1 ZINC000586957752 GI Annotated Anodyne O=[S@@](CCCc1nc2cc(Cl)ncc2[nH]1)c1ccc(Br)cc1 ZINC000586957756 GI Annotated Anodyne CC(C)(SCc1nc2cc(C(F)(F)F)c(Br)cc2[nH]1)C(=O)O ZINC000586957963 GI Annotated Anodyne O=[S@](CCCc1nc2ccc(F)cc2[nH]1)c1ccc(Br)cc1 ZINC000586958002 GI Annotated Anodyne O=[S@@](CCCc1nc2ccc(F)cc2[nH]1)c1ccc(Br)cc1 ZINC000586958004 GI Annotated Anodyne CC(C)(SCc1nc2cc(Br)cc(C(F)(F)F)c2[nH]1)C(=O)O ZINC000586958085 GI Annotated Anodyne CC(C)(SCC(=O)O)c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000586958495 GI Annotated Anodyne Cc1cccc2nc(CCC[S@@](=O)c3ccc(Br)cc3)[nH]c12 ZINC000586958522 GI Annotated Anodyne Cc1cccc2nc(CCC[S@](=O)c3ccc(Br)cc3)[nH]c12 ZINC000586958524 GI Annotated Anodyne O=[S@](CCCc1nc2cncc(Cl)c2[nH]1)c1ccc(Br)cc1 ZINC000586958536 GI Annotated Anodyne O=[S@@](CCCc1nc2cncc(Cl)c2[nH]1)c1ccc(Br)cc1 ZINC000586958537 GI Annotated Anodyne COc1cncc2nc(C[S@@](=O)C(c3ccccc3)c3ccccc3)[nH]c12 ZINC000586958605 GI Annotated Anodyne COc1cncc2nc(C[S@](=O)C(c3ccccc3)c3ccccc3)[nH]c12 ZINC000586958608 GI Annotated Anodyne COc1cccc2nc(CCC[S@@](=O)c3ccc(Br)cc3)[nH]c12 ZINC000586958691 GI Annotated Anodyne COc1cccc2nc(CCC[S@](=O)c3ccc(Br)cc3)[nH]c12 ZINC000586958693 GI Annotated Anodyne Cc1ccc2nc(CCC[S@@](=O)c3ccc(Br)cc3)[nH]c2c1 ZINC000586958755 GI Annotated Anodyne Cc1ccc2nc(CCC[S@](=O)c3ccc(Br)cc3)[nH]c2c1 ZINC000586958760 GI Annotated Anodyne COc1nccc2nc(C[S@@](=O)C(c3ccccc3)c3ccccc3)[nH]c12 ZINC000586959134 GI Annotated Anodyne COc1nccc2nc(C[S@](=O)C(c3ccccc3)c3ccccc3)[nH]c12 ZINC000586959137 GI Annotated Anodyne O=[S@](CCCc1nc2ccnc(Cl)c2[nH]1)c1ccc(Br)cc1 ZINC000586959146 GI Annotated Anodyne O=[S@@](CCCc1nc2ccnc(Cl)c2[nH]1)c1ccc(Br)cc1 ZINC000586959148 GI Annotated Anodyne CC(C)(SCc1nc2ccc(Br)c(C(F)(F)F)c2[nH]1)C(=O)O ZINC000586959160 GI Annotated Anodyne O=[S@](Cc1nc2ccc(CO)cc2[nH]1)C(c1ccccc1)c1ccccc1 ZINC000586959184 GI Annotated Anodyne O=[S@@](Cc1nc2ccc(CO)cc2[nH]1)C(c1ccccc1)c1ccccc1 ZINC000586959185 GI Annotated Anodyne O=[S@](CCCc1nc2ccc(Cl)nc2[nH]1)c1ccc(Br)cc1 ZINC000586959189 GI Annotated Anodyne O=[S@@](CCCc1nc2ccc(Cl)nc2[nH]1)c1ccc(Br)cc1 ZINC000586959190 GI Annotated Anodyne CC(C)(SCc1nc2cc(C(F)(F)F)cc(Br)c2[nH]1)C(=O)O ZINC000586959200 GI Annotated Anodyne O=C(O)c1ccc2nc(C[S@@](=O)C(c3ccccc3)c3ccccc3)[nH]c2c1 ZINC000586959203 GI Annotated Anodyne O=C(O)c1ccc2nc(C[S@](=O)C(c3ccccc3)c3ccccc3)[nH]c2c1 ZINC000586959204 GI Annotated Anodyne O=[S@](Cc1nc2ccc(Br)c(C(F)(F)F)c2[nH]1)CC1CC1 ZINC000586959313 GI Annotated Anodyne O=[S@@](Cc1nc2ccc(Br)c(C(F)(F)F)c2[nH]1)CC1CC1 ZINC000586959319 GI Annotated Anodyne O=[S@](CCCc1nc2c(Cl)ccnc2[nH]1)c1ccc(Br)cc1 ZINC000586959581 GI Annotated Anodyne O=[S@@](CCCc1nc2c(Cl)ccnc2[nH]1)c1ccc(Br)cc1 ZINC000586959583 GI Annotated Anodyne CCCCOc1cc2nc(C[S@](=O)CC3CC3)[nH]c2cc1Br ZINC000586959683 GI Annotated Anodyne CCCCOc1cc2nc(C[S@@](=O)CC3CC3)[nH]c2cc1Br ZINC000586959690 GI Annotated Anodyne CCCOc1cc2nc(C(C)(C)SCC(=O)O)[nH]c2cc1Br ZINC000586959695 GI Annotated Anodyne O=[S@](Cc1nc2cc(Br)cc(C(F)(F)F)c2[nH]1)CC1CC1 ZINC000586959696 GI Annotated Anodyne O=[S@@](Cc1nc2cc(Br)cc(C(F)(F)F)c2[nH]1)CC1CC1 ZINC000586959697 GI Annotated Anodyne COc1cc2nc(C[S@@](=O)C(c3ccccc3)c3ccccc3)[nH]c2cn1 ZINC000586959724 GI Annotated Anodyne COc1cc2nc(C[S@](=O)C(c3ccccc3)c3ccccc3)[nH]c2cn1 ZINC000586959725 GI Annotated Anodyne CC(C)Oc1cc2nc(C(C)(C)SCC(=O)O)[nH]c2cc1Br ZINC000586959734 GI Annotated Anodyne O=[S@](Cc1nc2cc(C(F)(F)F)cc(Br)c2[nH]1)CC1CC1 ZINC000586959776 GI Annotated Anodyne O=[S@@](Cc1nc2cc(C(F)(F)F)cc(Br)c2[nH]1)CC1CC1 ZINC000586959778 GI Annotated Anodyne CCCOc1cc2nc(CSC(C)(C)C(=O)O)[nH]c2cc1Br ZINC000586959790 GI Annotated Anodyne O=[S@](Cc1nc2cc3c(cc2[nH]1)OCO3)C(c1ccccc1)c1ccccc1 ZINC000586959809 GI Annotated Anodyne O=[S@@](Cc1nc2cc3c(cc2[nH]1)OCO3)C(c1ccccc1)c1ccccc1 ZINC000586959810 GI Annotated Anodyne N#Cc1cc2nc(C[S@@](=O)C(c3ccccc3)c3ccccc3)[nH]c2cc1C#N ZINC000586959811 GI Annotated Mild N#Cc1cc2nc(C[S@](=O)C(c3ccccc3)c3ccccc3)[nH]c2cc1C#N ZINC000586959816 GI Annotated Mild CC(C)COc1cc2nc(C[S@](=O)CC3CC3)[nH]c2cc1Br ZINC000586960115 GI Annotated Anodyne CC(C)COc1cc2nc(C[S@@](=O)CC3CC3)[nH]c2cc1Br ZINC000586960116 GI Annotated Anodyne O=[S@](Cc1nc2cc(C(F)(F)F)c(Br)cc2[nH]1)CC1CC1 ZINC000586960161 GI Annotated Anodyne O=[S@@](Cc1nc2cc(C(F)(F)F)c(Br)cc2[nH]1)CC1CC1 ZINC000586960162 GI Annotated Anodyne CC(C)(SCC(=O)O)c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000586960207 GI Annotated Anodyne O=[S@](CCCc1nc2cccc(F)c2[nH]1)c1ccc(Br)cc1 ZINC000586960239 GI Annotated Anodyne O=[S@@](CCCc1nc2cccc(F)c2[nH]1)c1ccc(Br)cc1 ZINC000586960240 GI Annotated Anodyne COc1ccc2nc(C[S@@](=O)C(c3ccccc3)c3ccccc3)[nH]c2n1 ZINC000586960242 GI Annotated Anodyne COc1ccc2nc(C[S@](=O)C(c3ccccc3)c3ccccc3)[nH]c2n1 ZINC000586960244 GI Annotated Anodyne CC(C)Oc1cc2nc(CSC(C)(C)C(=O)O)[nH]c2cc1Br ZINC000586960537 GI Annotated Anodyne CC(C)CCOc1cc2nc(C[S@](=O)CC3CC3)[nH]c2cc1Br ZINC000586960694 GI Annotated Anodyne CC(C)CCOc1cc2nc(C[S@@](=O)CC3CC3)[nH]c2cc1Br ZINC000586960697 GI Annotated Anodyne CC(C)(SCC(=O)O)c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000586960750 GI Annotated Anodyne O=[S@](CCCc1nc2cc(F)c(F)cc2[nH]1)c1ccc(Br)cc1 ZINC000586960855 GI Annotated Anodyne O=[S@@](CCCc1nc2cc(F)c(F)cc2[nH]1)c1ccc(Br)cc1 ZINC000586960862 GI Annotated Anodyne O=[S@](Cc1nc2cc3cn[nH]c3cc2[nH]1)C(c1ccccc1)c1ccccc1 ZINC000586960890 GI Annotated Anodyne O=[S@@](Cc1nc2cc3cn[nH]c3cc2[nH]1)C(c1ccccc1)c1ccccc1 ZINC000586960892 GI Annotated Anodyne CC(C)(SCC(=O)O)c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000586961037 GI Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2cc(C(F)(F)F)cc(Cl)c2[nH]1 ZINC000586961134 GI Annotated Anodyne C[C@H](Sc1nc(N)cc(O)n1)c1nc2cc(C(F)(F)F)cc(Cl)c2[nH]1 ZINC000586961138 GI Annotated Anodyne CC1=C(c2ccc3nc([C@H](C)SCc4ccccc4)[nH]c3c2)NNC(=O)C1 ZINC000586961183 GI Annotated Anodyne CC1=C(c2ccc3nc([C@@H](C)SCc4ccccc4)[nH]c3c2)NNC(=O)C1 ZINC000586961196 GI Annotated Anodyne O=S(=O)(c1ccccc1)N1[C@H](c2nc3cccc(F)c3[nH]2)C[C@H]2CCCC[C@@H]21 ZINC000586961233 GI Annotated Anodyne O=S(=O)(c1ccccc1)N1[C@H](c2nc3cccc(F)c3[nH]2)C[C@@H]2CCCC[C@@H]21 ZINC000586961238 GI Annotated Anodyne O=S(=O)(c1ccccc1)N1[C@H](c2nc3cccc(F)c3[nH]2)C[C@@H]2CCCC[C@H]21 ZINC000586961241 GI Annotated Anodyne O=S(=O)(c1ccccc1)N1[C@H](c2nc3cccc(F)c3[nH]2)C[C@H]2CCCC[C@H]21 ZINC000586961245 GI Annotated Anodyne C[C@H](Sc1nc(N)cc(O)n1)c1nc2ccc(SC(F)(F)F)cc2[nH]1 ZINC000586961376 GI Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2ccc(SC(F)(F)F)cc2[nH]1 ZINC000586961377 GI Annotated Anodyne O=[S@](Cc1nc2ccc(CCO)cc2[nH]1)C(c1ccccc1)c1ccccc1 ZINC000586961502 GI Annotated Anodyne O=[S@@](Cc1nc2ccc(CCO)cc2[nH]1)C(c1ccccc1)c1ccccc1 ZINC000586961506 GI Annotated Anodyne O=[S@](CCCc1nc2cc(Cl)cnc2[nH]1)c1ccc(Br)cc1 ZINC000586961776 GI Annotated Anodyne O=[S@@](CCCc1nc2cc(Cl)cnc2[nH]1)c1ccc(Br)cc1 ZINC000586961777 GI Annotated Anodyne O=C(O)c1cccc2nc(C[S@@](=O)C(c3ccccc3)c3ccccc3)[nH]c12 ZINC000586961778 GI Annotated Anodyne O=C(O)c1cccc2nc(C[S@](=O)C(c3ccccc3)c3ccccc3)[nH]c12 ZINC000586961779 GI Annotated Anodyne O=[S@](CCCc1nc2ccc(F)c(F)c2[nH]1)c1ccc(Br)cc1 ZINC000586961855 GI Annotated Anodyne O=[S@@](CCCc1nc2ccc(F)c(F)c2[nH]1)c1ccc(Br)cc1 ZINC000586961856 GI Annotated Anodyne Cc1cc2[nH]c(CCC[S@@](=O)c3ccc(Br)cc3)nc2c(C)n1 ZINC000586961934 GI Annotated Anodyne Cc1cc2[nH]c(CCC[S@](=O)c3ccc(Br)cc3)nc2c(C)n1 ZINC000586961941 GI Annotated Anodyne O=[S@](CCCc1nc2cc(F)cc(F)c2[nH]1)c1ccc(Br)cc1 ZINC000586961966 GI Annotated Anodyne O=[S@@](CCCc1nc2cc(F)cc(F)c2[nH]1)c1ccc(Br)cc1 ZINC000586961967 GI Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2cccc(OCc3ccccc3)c2[nH]1 ZINC000586962123 GI Annotated Anodyne C[C@H](Sc1nc(N)cc(O)n1)c1nc2cccc(OCc3ccccc3)c2[nH]1 ZINC000586962125 GI Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2ccc(Br)c(O)c2[nH]1 ZINC000586962207 GI Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2ccc(Br)c(O)c2[nH]1 ZINC000586962209 GI Annotated Anodyne O=S(=O)(c1ccccc1)N1[C@H](c2nc3ccc(F)cc3[nH]2)C[C@@H]2CCCC[C@@H]21 ZINC000586962232 GI Annotated Anodyne O=S(=O)(c1ccccc1)N1[C@H](c2nc3ccc(F)cc3[nH]2)C[C@@H]2CCCC[C@H]21 ZINC000586962234 GI Annotated Anodyne O=S(=O)(c1ccccc1)N1[C@H](c2nc3ccc(F)cc3[nH]2)C[C@H]2CCCC[C@@H]21 ZINC000586962235 GI Annotated Anodyne O=S(=O)(c1ccccc1)N1[C@H](c2nc3ccc(F)cc3[nH]2)C[C@H]2CCCC[C@H]21 ZINC000586962237 GI Annotated Anodyne C[C@@H](Sc1ncccn1)c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000586962455 GI Annotated Anodyne C[C@H](Sc1ncccn1)c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000586962461 GI Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2cccc(Br)c2[nH]1 ZINC000586962552 GI Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2cccc(Br)c2[nH]1 ZINC000586962555 GI Annotated Anodyne C[C@@H](Sc1nc(N)cc(O)n1)c1nc2cc(C(F)(F)F)c(Cl)cc2[nH]1 ZINC000586963236 GI Annotated Anodyne C[C@H](Sc1nc(N)cc(O)n1)c1nc2cc(C(F)(F)F)c(Cl)cc2[nH]1 ZINC000586963237 GI Annotated Anodyne Cc1ccc(SCc2nc3cc(I)cnc3[nH]2)c(C)c1 ZINC000586963348 GI Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2c(C)c(Br)cnc2[nH]1 ZINC000586963387 GI Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2c(C)c(Br)cnc2[nH]1 ZINC000586963388 GI Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2ccc(Br)cc2[nH]1 ZINC000586963922 GI Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2ccc(Br)cc2[nH]1 ZINC000586963923 GI Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2cc(C(=O)OC)cc(Cl)c2[nH]1 ZINC000586964044 GI Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2cc(C(=O)OC)cc(Cl)c2[nH]1 ZINC000586964045 GI Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2cc(Br)c(C)nc2[nH]1 ZINC000586964113 GI Annotated Anodyne CC[C@H](Sc1nc(C)cc(O)n1)c1nc2cc(Br)c(C)nc2[nH]1 ZINC000586964114 GI Annotated Anodyne CC[C@@H](Sc1nc(C)cc(O)n1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000586964313 GI Annotated Bother CC[C@H](Sc1nc(C)cc(O)n1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000586964314 GI Annotated Bother CC1=C(c2ccc3nc(CSc4ccc(C)cc4C)[nH]c3c2)NNC(=O)C1 ZINC000586964335 GI Annotated Anodyne N#Cc1ccccc1SCc1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000586964465 GI Annotated Mild N#Cc1ccccc1SCc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000586964654 GI Annotated Mild Cc1ccc(-c2nnc(SCc3nc4c(C)cnc(Cl)c4[nH]3)n2C)cc1 ZINC000586964791 GI Annotated Anodyne N#Cc1ccccc1SCc1nc2cccc(I)c2[nH]1 ZINC000586964835 GI Annotated Mild Clc1ccnc2[nH]c(CSc3nnc(C4CC4)n3Cc3ccccc3)nc12 ZINC000586964898 GI Annotated Anodyne Cc1ccc(-c2nnc(SCc3nc4cc([N+](=O)[O-])c(F)cc4[nH]3)n2C)cc1 ZINC000586964932 GI Annotated Bother Clc1cnc2[nH]c(CSc3nnc(C4CC4)n3Cc3ccccc3)nc2c1 ZINC000586964944 GI Annotated Anodyne Cc1ccc(-c2nnc(SCc3nc4c(F)cnc(Cl)c4[nH]3)n2C)cc1 ZINC000586964962 GI Annotated Anodyne COc1cc2nc(CSc3nnc(-c4ccc(C)cc4)n3C)[nH]c2cc1F ZINC000586964992 GI Annotated Anodyne Cc1ccc(-c2nnc(SCc3nc4cc(C#N)cc(Cl)c4[nH]3)n2C)cc1 ZINC000586964998 GI Annotated Mild Cc1ccc(-c2nnc(SCc3nc4cc(F)c(F)c(F)c4[nH]3)n2C)cc1 ZINC000586965018 GI Annotated Anodyne Cc1ccc(-c2nnc(SCc3nc4cc([N+](=O)[O-])c(C)cc4[nH]3)n2C)cc1 ZINC000586965021 GI Annotated Bother Clc1nccc2nc(CSc3nnc(C4CC4)n3Cc3ccccc3)[nH]c12 ZINC000586965061 GI Annotated Anodyne N#Cc1ccccc1SCc1nc2ccc(S(=O)(=O)C(F)(F)F)cc2[nH]1 ZINC000586965161 GI Annotated Mild N#Cc1ccccc1SCc1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000586965240 GI Annotated Mild N#Cc1ccccc1SCc1nc2ccc(I)cc2[nH]1 ZINC000586965250 GI Annotated Mild Clc1cncc2nc(CSc3nnc(C4CC4)n3Cc3ccccc3)[nH]c12 ZINC000586965387 GI Annotated Anodyne Clc1ccc2nc(CSc3nnc(C4CC4)n3Cc3ccccc3)[nH]c2n1 ZINC000586965563 GI Annotated Anodyne COc1cc2nc(CSc3nnc(-c4ccc(C)cc4)n3C)[nH]c2cc1C ZINC000586965572 GI Annotated Anodyne CC(=O)c1ccc2nc(CSc3nnc(-c4ccc(C)cc4)n3C)[nH]c2c1 ZINC000586965908 GI Annotated Anodyne Clc1cc2nc(CSc3nnc(C4CC4)n3Cc3ccccc3)[nH]c2cn1 ZINC000586965928 GI Annotated Anodyne Cc1nccc2[nH]c(CSc3nnc(C4CC4)n3Cc3ccccc3)nc12 ZINC000586966038 GI Annotated Anodyne Cc1ccnc2[nH]c(CSc3nnc(C4CC4)n3Cc3ccccc3)nc12 ZINC000586966083 GI Annotated Anodyne Cc1ccc(-n2ccnc2SCc2nc3cc4c(cc3[nH]2)OCCO4)c(C)c1 ZINC000586966092 GI Annotated Anodyne COC(=O)c1cccc2nc(CSc3nccn3-c3ccc(C)cc3C)[nH]c12 ZINC000586966099 GI Annotated Anodyne COc1cccc2nc(CSc3nnc(C4CC4)n3Cc3ccccc3)[nH]c12 ZINC000586966133 GI Annotated Anodyne Cc1ccc(-n2ccnc2SCc2nc3cc(C(=O)O)c(F)cc3[nH]2)c(C)c1 ZINC000586966144 GI Annotated Anodyne Cc1ccc2nc(CSc3nnc(C4CC4)n3Cc3ccccc3)[nH]c2n1 ZINC000586966169 GI Annotated Anodyne Cc1ccc(-n2ccnc2SCc2nc3ccc(CCO)cc3[nH]2)c(C)c1 ZINC000586966180 GI Annotated Anodyne Cc1cc2[nH]c(CSc3nnc(C4CC4)n3Cc3ccccc3)nc2c(C)n1 ZINC000586966185 GI Annotated Anodyne Cc1ccc(-n2ccnc2SCc2nc3cccc(C(=O)O)c3[nH]2)c(C)c1 ZINC000586966213 GI Annotated Anodyne Fc1cc(C(F)(F)F)c2[nH]c(CSc3nc(-c4cccnc4)no3)nc2c1 ZINC000586966300 GI Annotated Anodyne CCc1cc(O)nc(SCc2nc3cc4nc5ccccc5nc4cc3[nH]2)n1 ZINC000586966313 GI Annotated Bother Cc1cc2nc(CSc3ncccc3C(=O)O)[nH]c2cc1Br ZINC000586966331 GI Annotated Anodyne Clc1cc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2c(Cl)n1 ZINC000586966332 GI Annotated Anodyne FC(F)(F)Oc1cccc2nc(CSc3nc(-c4cccnc4)no3)[nH]c12 ZINC000586966336 GI Annotated Anodyne N#Cc1cccc2nc(CSc3nnc(C4CC4)n3Cc3ccccc3)[nH]c12 ZINC000586966345 GI Annotated Mild N#Cc1ccc2nc(CSc3nnc(C4CC4)n3Cc3ccccc3)[nH]c2c1 ZINC000586966362 GI Annotated Mild Brc1ccc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2c1 ZINC000586966374 GI Annotated Anodyne Cc1c(Br)cc2nc(CSc3ncccc3C(=O)O)[nH]c2c1C ZINC000586966395 GI Annotated Anodyne Cc1ccc(-n2ccnc2SCc2nc3ccc([C@@H](N)N=O)cc3[nH]2)c(C)c1 ZINC000586966408 GI Annotated Anodyne Cc1ccc(-n2ccnc2SCc2nc3ccc([C@H](N)N=O)cc3[nH]2)c(C)c1 ZINC000586966409 GI Annotated Anodyne Fc1c(Cl)cc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2c1F ZINC000586966459 GI Annotated Anodyne Cc1c(Br)ccc2nc(CSc3ncccc3C(=O)O)[nH]c12 ZINC000586966615 GI Annotated Anodyne Clc1cnc2[nH]c(CSc3nc(-c4cccnc4)no3)nc2c1Cl ZINC000586966648 GI Annotated Anodyne Cc1ccc(-n2ccnc2SCc2nc3cc4nc(O)[nH]c4cc3[nH]2)c(C)c1 ZINC000586966687 GI Annotated Anodyne FC(F)(F)Oc1ccc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2c1 ZINC000586966689 GI Annotated Anodyne CCc1cc(O)nc(SCc2nc3ccc(Oc4ccc(N)cc4)cc3[nH]2)n1 ZINC000586966701 GI Annotated Clean Oc1cccc2nc(CSc3nnc(C4CC4)n3Cc3ccccc3)[nH]c12 ZINC000586966745 GI Annotated Anodyne Cc1ccc(-n2ccnc2SCc2nc3cc(C#N)c(C#N)cc3[nH]2)c(C)c1 ZINC000586966796 GI Annotated Mild Cc1ccc(-n2ccnc2SCc2nc3ccc(C(=O)O)cc3[nH]2)c(C)c1 ZINC000586966851 GI Annotated Anodyne COC(=O)c1ccc2nc(CSc3nccn3-c3ccc(C)cc3C)[nH]c2c1 ZINC000586966873 GI Annotated Anodyne FC(F)(F)c1cccc2nc(CSc3nc(-c4cccnc4)no3)[nH]c12 ZINC000586966935 GI Annotated Anodyne O=C(O)CSc1ncccc1-c1nc2cc(Cl)c(C(F)(F)F)cc2[nH]1 ZINC000586966943 GI Annotated Anodyne Cc1c(Br)cc2[nH]c(-c3cccnc3SCC(=O)O)nc2c1C ZINC000586966947 GI Annotated Anodyne O=C(O)c1cccnc1SCc1nc2cc(Br)cc(Cl)c2[nH]1 ZINC000586966953 GI Annotated Anodyne Cc1cc(Br)c2[nH]c(CSc3ncccc3C(=O)O)nc2c1 ZINC000586966982 GI Annotated Anodyne CCc1cc(O)nc(SCc2nc3c4cccnc4c4ncccc4c3[nH]2)n1 ZINC000586966990 GI Annotated Bother Brc1cccc2nc(CSc3nc(-c4cccnc4)no3)[nH]c12 ZINC000586966995 GI Annotated Anodyne FC(F)(F)c1ccc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2c1 ZINC000586967012 GI Annotated Anodyne CCc1cc(O)nc(SCc2nc3cccc(OCc4ccccc4)c3[nH]2)n1 ZINC000586967047 GI Annotated Anodyne Cc1ccc(-n2ccnc2SCc2nc3cc(F)cc(C(=O)O)c3[nH]2)c(C)c1 ZINC000586967095 GI Annotated Anodyne Cc1ccc(-n2ccnc2SCc2nc3cc4c(cc3[nH]2)OCO4)c(C)c1 ZINC000586967159 GI Annotated Anodyne Cc1cncc2nc(CSc3nnc(C4CC4)n3Cc3ccccc3)[nH]c12 ZINC000586967171 GI Annotated Anodyne Cc1cnc2[nH]c(CSc3nnc(C4CC4)n3Cc3ccccc3)nc2c1 ZINC000586967173 GI Annotated Anodyne O=C(O)CSc1ncccc1-c1nc2c(Cl)cc(C(F)(F)F)cc2[nH]1 ZINC000586967202 GI Annotated Anodyne Fc1cc2[nH]c(CSc3nc(-c4cccnc4)no3)nc2cc1C(F)(F)F ZINC000586967233 GI Annotated Anodyne Clc1cc2nc(CSc3nc(-c4cccnc4)no3)[nH]c2nc1Cl ZINC000586967235 GI Annotated Anodyne Clc1cnc(Cl)c2[nH]c(CSc3nc(-c4cccnc4)no3)nc12 ZINC000586967357 GI Annotated Anodyne CCc1cc(O)nc(SCc2nc3cc(Br)cc(Cl)c3[nH]2)n1 ZINC000586967361 GI Annotated Anodyne O=C(O)CSc1ncccc1-c1nc2c(Cl)cc(Br)cc2[nH]1 ZINC000586967398 GI Annotated Anodyne Oc1cc(O)nc(SCc2nc3ccc(Sc4ccccc4)cc3[nH]2)n1 ZINC000586967437 GI Annotated Anodyne O=C(O)c1cccnc1SCc1nc2cc(Cl)cc(Br)c2[nH]1 ZINC000586967439 GI Annotated Anodyne Cc1cc(Br)cc2nc(CSc3ncccc3C(=O)O)[nH]c12 ZINC000586967452 GI Annotated Anodyne O=C(O)CSc1ncccc1-c1nc2cc(SC(F)(F)F)ccc2[nH]1 ZINC000586967467 GI Annotated Anodyne O=C(O)CSc1ncccc1-c1nc2c(Br)cc(Cl)cc2[nH]1 ZINC000586967485 GI Annotated Anodyne Nc1ccc(Oc2ccc3nc(CSc4ncccc4C(=O)O)[nH]c3c2)cc1 ZINC000586967507 GI Annotated Clean Cc1ccc(-n2cnnc2SCc2nc3cc4cn[nH]c4cc3[nH]2)cc1Cl ZINC000586967539 GI Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3ccc(Cl)nc3[nH]2)cc1Cl ZINC000586967684 GI Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3cccc(C#N)c3[nH]2)cc1Cl ZINC000586967740 GI Annotated Mild Cc1nn(Cc2ccc(Cl)cc2)c(SCc2nc3cnccc3[nH]2)c1C=O ZINC000586967851 GI Annotated Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(SCc2nc3cccnc3[nH]2)c1C=O ZINC000586967904 GI Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3cc4c(cc3[nH]2)OCO4)cc1Cl ZINC000586967909 GI Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3ccc(C#N)cc3[nH]2)cc1Cl ZINC000586967922 GI Annotated Mild COc1cccc2nc(CSc3nncn3-c3ccc(C)c(Cl)c3)[nH]c12 ZINC000586967939 GI Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3cc(Cl)cnc3[nH]2)cc1Cl ZINC000586967948 GI Annotated Anodyne CCc1cc(O)nc(SCc2nc3cc(Cl)cc(Br)c3[nH]2)n1 ZINC000586968069 GI Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3cncc(Cl)c3[nH]2)cc1Cl ZINC000586968094 GI Annotated Anodyne CCc1cc(O)nc(SCc2nc3cc(Br)c(C)c(C)c3[nH]2)n1 ZINC000586968109 GI Annotated Anodyne CSCC(C)(C)c1nc2c(Br)cnc(Br)c2[nH]1 ZINC000586968374 GI Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3c(Cl)ccnc3[nH]2)cc1Cl ZINC000586968672 GI Annotated Anodyne Cc1cc2[nH]c(CSc3nncn3-c3ccc(C)c(Cl)c3)nc2c(C)n1 ZINC000586968710 GI Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3cccc(C(=O)O)c3[nH]2)cc1Cl ZINC000586968765 GI Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3ccnc(Cl)c3[nH]2)cc1Cl ZINC000586968833 GI Annotated Anodyne Cc1ccc(-n2cnnc2SCc2nc3cc(Cl)ncc3[nH]2)cc1Cl ZINC000586968941 GI Annotated Anodyne O=C(c1ccccc1)c1ccc2nc(CSc3ncccc3C(=O)O)[nH]c2c1 ZINC000586968974 GI Annotated Anodyne [O-][n+]1ccccc1SCc1nc2cc(OC(F)(F)F)c(Cl)cc2[nH]1 ZINC000586969150 GI Annotated Anodyne O=C(O)c1cccnc1SCc1nc2cc3nc4ccccc4nc3cc2[nH]1 ZINC000586969326 GI Annotated Bother O=C(O)c1cccnc1SCc1nc2c3cccnc3c3ncccc3c2[nH]1 ZINC000586969397 GI Annotated Bother CCCOc1cc2nc(CSc3cccc[n+]3[O-])[nH]c2cc1Br ZINC000586969526 GI Annotated Anodyne CC(C)Oc1cc2nc(CSc3cccc[n+]3[O-])[nH]c2cc1Br ZINC000586969756 GI Annotated Anodyne CCCC(Br)(CCC)c1nc2ccc(S(=O)(=O)O)cc2[nH]1 ZINC000586970126 GI Annotated Anodyne COC(C)(C)[C@H](Br)c1nc2cc(C)cc(Br)c2[nH]1 ZINC000586970222 GI Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2cc(C)cc(Br)c2[nH]1 ZINC000586970226 GI Annotated Reactive COC(C)(C)[C@H](Br)c1nc2cc(C#N)cc(Br)c2[nH]1 ZINC000586970274 GI Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2cc(C#N)cc(Br)c2[nH]1 ZINC000586970276 GI Annotated Reactive CC1=C(c2ccc3nc(CCSCc4ccc(C)cc4)[nH]c3c2)NNC(=O)C1 ZINC000586970535 GI Annotated Anodyne COC(C)(C)[C@H](Br)c1nc2cc(Br)cc(C)c2[nH]1 ZINC000586970689 GI Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2cc(Br)cc(C)c2[nH]1 ZINC000586970790 GI Annotated Reactive COC(C)(C)[C@H](Br)c1nc2ccc(Br)c(C)c2[nH]1 ZINC000586970875 GI Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2ccc(Br)c(C)c2[nH]1 ZINC000586970876 GI Annotated Reactive COC(C)(C)[C@H](Br)c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000586970877 GI Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000586970881 GI Annotated Reactive COC(C)(C)[C@H](Br)c1nc2cc(C)c(Br)cc2[nH]1 ZINC000586970892 GI Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2cc(C)c(Br)cc2[nH]1 ZINC000586970893 GI Annotated Reactive COC(C)(C)[C@H](Br)c1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1 ZINC000586970949 GI Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1 ZINC000586970953 GI Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000586970974 GI Annotated Reactive COC(C)(C)[C@H](Br)c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000586970977 GI Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2cc(Br)c(F)cc2[nH]1 ZINC000586971045 GI Annotated Reactive COC(C)(C)[C@H](Br)c1nc2cc(Br)c(F)cc2[nH]1 ZINC000586971046 GI Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2ccc(Br)c(F)c2[nH]1 ZINC000586971057 GI Annotated Reactive COC(C)(C)[C@H](Br)c1nc2ccc(Br)c(F)c2[nH]1 ZINC000586971058 GI Annotated Reactive Cc1ccc(CSCCc2nc3ccc(CN4CCOCC4)cc3[nH]2)cc1 ZINC000586971509 GI Annotated Anodyne COC(C)(C)[C@@H](Br)c1nc2ccc(F)c(Br)c2[nH]1 ZINC000586971513 GI Annotated Reactive COC(C)(C)[C@H](Br)c1nc2ccc(F)c(Br)c2[nH]1 ZINC000586971570 GI Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2cc(Br)cc(F)c2[nH]1 ZINC000586971588 GI Annotated Reactive COC(C)(C)[C@H](Br)c1nc2cc(Br)cc(F)c2[nH]1 ZINC000586971589 GI Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2cc(F)cc(Br)c2[nH]1 ZINC000586971680 GI Annotated Reactive COC(C)(C)[C@H](Br)c1nc2cc(F)cc(Br)c2[nH]1 ZINC000586971681 GI Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1 ZINC000586971792 GI Annotated Reactive COC(C)(C)[C@H](Br)c1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1 ZINC000586971796 GI Annotated Reactive COC(C)(C)[C@H](Br)c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000586971824 GI Annotated Reactive COC(C)(C)[C@@H](Br)c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000586971825 GI Annotated Reactive CCCC(Br)(CCC)c1nc2nc(Br)c[nH]c-2n1 ZINC000586971873 GI Annotated Anodyne CC(=O)N[C@H](CSCc1ccccc1)c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000586971885 GI Annotated Anodyne CC(=O)N[C@@H](CSCc1ccccc1)c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000586971887 GI Annotated Anodyne CC(C)CSc1ccc([N+](=O)[O-])cc1-c1nc2cc3c(cc2[nH]1)OCC(=O)N3 ZINC000586971938 GI Annotated Bother CC(=O)N[C@H](CSCc1ccccc1)c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000586971959 GI Annotated Anodyne CC(=O)N[C@@H](CSCc1ccccc1)c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000586971960 GI Annotated Anodyne COc1cc2nc([C@H](CSCc3ccccc3)NC(C)=O)[nH]c2cc1Cl ZINC000586971987 GI Annotated Anodyne COc1cc2nc([C@@H](CSCc3ccccc3)NC(C)=O)[nH]c2cc1Cl ZINC000586971989 GI Annotated Anodyne CC(=O)N[C@H](CSCc1ccccc1)c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000586971993 GI Annotated Anodyne CC(=O)N[C@@H](CSCc1ccccc1)c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000586971994 GI Annotated Anodyne BrC/C=C/c1nc2cc(Br)c(Br)cc2[nH]1 ZINC000586972152 GI Annotated Reactive BrC/C=C\c1nc2cc(Br)c(Br)cc2[nH]1 ZINC000586972153 GI Annotated Reactive CC(=O)N[C@@H](CSCc1ccccc1)c1nc2cnc3ccccc3c2[nH]1 ZINC000586972241 GI Annotated Anodyne CC(=O)N[C@H](CSCc1ccccc1)c1nc2cnc3ccccc3c2[nH]1 ZINC000586972243 GI Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3cc([N+](=O)[O-])ccc3SCC(C)C)nc12 ZINC000586972316 GI Annotated Bother COC(=O)c1cc2nc(CBr)[nH]c2c(F)c1Nc1ccccc1 ZINC000586972348 GI Annotated Reactive O=C1c2ccccc2C(=O)c2c1ccc1nc(CCCCBr)[nH]c21 ZINC000586972640 GI Annotated Reactive BrC/C=C/c1nc2c(Br)ccc(Br)c2[nH]1 ZINC000586972650 GI Annotated Reactive BrC/C=C\c1nc2c(Br)ccc(Br)c2[nH]1 ZINC000586972659 GI Annotated Reactive CC(=O)N[C@@H](CSCc1ccccc1)c1nc2cc(Cl)cc(F)c2[nH]1 ZINC000586973019 GI Annotated Anodyne CC(=O)N[C@H](CSCc1ccccc1)c1nc2cc(Cl)cc(F)c2[nH]1 ZINC000586973021 GI Annotated Anodyne C[C@H](c1ccc(CBr)cc1)c1nc2cc(C(=O)O)c(F)cc2[nH]1 ZINC000586973215 GI Annotated Reactive C[C@@H](c1ccc(CBr)cc1)c1nc2cc(C(=O)O)c(F)cc2[nH]1 ZINC000586973217 GI Annotated Reactive C[C@H](c1ccc(CBr)cc1)c1nc2cc(F)cc(C(=O)O)c2[nH]1 ZINC000586973337 GI Annotated Reactive C[C@@H](c1ccc(CBr)cc1)c1nc2cc(F)cc(C(=O)O)c2[nH]1 ZINC000586973338 GI Annotated Reactive C[C@H](c1ccc(CBr)cc1)c1nc2ccc(C(=O)N(C)C)cc2[nH]1 ZINC000586973387 GI Annotated Reactive C[C@@H](c1ccc(CBr)cc1)c1nc2ccc(C(=O)N(C)C)cc2[nH]1 ZINC000586973388 GI Annotated Reactive CC(=O)N[C@@H](CSCc1ccccc1)c1nc2ccc3ncccc3c2[nH]1 ZINC000586973890 GI Annotated Anodyne CC(=O)N[C@H](CSCc1ccccc1)c1nc2ccc3ncccc3c2[nH]1 ZINC000586973891 GI Annotated Anodyne CC(=O)N[C@@H](CSCc1ccccc1)c1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000586973956 GI Annotated Anodyne CC(=O)N[C@H](CSCc1ccccc1)c1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000586973957 GI Annotated Anodyne CC(C)CSc1ccc([N+](=O)[O-])cc1-c1nc2c(S)nc(S)nc2[nH]1 ZINC000586974020 GI Annotated Bother CC(=O)N[C@@H](CSCc1ccccc1)c1nc2ccc(C(C)(C)C)nc2[nH]1 ZINC000586974050 GI Annotated Anodyne CC(=O)N[C@H](CSCc1ccccc1)c1nc2ccc(C(C)(C)C)nc2[nH]1 ZINC000586974051 GI Annotated Anodyne COc1cc(Br)c([C@H](N)c2nc3ccc(Cl)cc3[nH]2)cc1OC ZINC000586974098 GI Annotated Anodyne COc1cc(Br)c([C@@H](N)c2nc3ccc(Cl)cc3[nH]2)cc1OC ZINC000586974102 GI Annotated Anodyne C[C@H](c1ccc(CBr)cc1)c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000586974161 GI Annotated Reactive C[C@@H](c1ccc(CBr)cc1)c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000586974162 GI Annotated Reactive N=c1[nH]c2nc(-c3cc(Cl)cc(Cl)c3Br)nc-2c(Cl)[nH]1 ZINC000586974209 GI Annotated Anodyne C[C@H](c1ccc(CBr)cc1)c1nc2nc(Br)c[nH]c-2n1 ZINC000586974280 GI Annotated Reactive C[C@@H](c1ccc(CBr)cc1)c1nc2nc(Br)c[nH]c-2n1 ZINC000586974281 GI Annotated Reactive C[C@H](c1ccc(CBr)cc1)c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000586974513 GI Annotated Reactive C[C@@H](c1ccc(CBr)cc1)c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000586974514 GI Annotated Reactive CC(=O)N[C@@H](CSCc1ccccc1)c1nc2cc(F)c(F)c(F)c2[nH]1 ZINC000586974709 GI Annotated Anodyne CC(=O)N[C@H](CSCc1ccccc1)c1nc2cc(F)c(F)c(F)c2[nH]1 ZINC000586974710 GI Annotated Anodyne COc1cc(Br)c([C@H](N)c2nc3c(C)ccc(C)c3[nH]2)cc1OC ZINC000586974736 GI Annotated Anodyne COc1cc(Br)c([C@@H](N)c2nc3c(C)ccc(C)c3[nH]2)cc1OC ZINC000586974739 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cc([N+](=O)[O-])ccc3SCC(C)C)[nH]c2n1 ZINC000586974935 GI Annotated Bother COc1cc(Br)c([C@H](N)c2nc3cccc(Cl)c3[nH]2)cc1OC ZINC000586975308 GI Annotated Anodyne COc1cc(Br)c([C@@H](N)c2nc3cccc(Cl)c3[nH]2)cc1OC ZINC000586975309 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(Cc3ccc(Br)c(C)c3)[nH]c2c1 ZINC000586975424 GI Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3cc(Cl)cc(Cl)c3Br)nc12 ZINC000586975445 GI Annotated Anodyne Cc1cc(Cc2nc3cncc(Br)c3[nH]2)ccc1Br ZINC000586975528 GI Annotated Anodyne Clc1ccc(OCc2nc3cc4cn[nH]c4cc3[nH]2)c(Br)c1 ZINC000586975762 GI Annotated Anodyne Cc1cc(Cc2nc3ccnc(Br)c3[nH]2)ccc1Br ZINC000586975831 GI Annotated Anodyne COc1cc(/C=C/c2nc3ccc([C@@H](N)N=O)cc3[nH]2)ccc1Br ZINC000586975922 GI Annotated Anodyne COc1cc(/C=C\c2nc3ccc([C@@H](N)N=O)cc3[nH]2)ccc1Br ZINC000586975924 GI Annotated Anodyne COc1cc(/C=C/c2nc3ccc([C@H](N)N=O)cc3[nH]2)ccc1Br ZINC000586975925 GI Annotated Anodyne COc1cc(/C=C\c2nc3ccc([C@H](N)N=O)cc3[nH]2)ccc1Br ZINC000586975926 GI Annotated Anodyne N[C@@H](N=O)c1ccc2nc(COc3ccc(Cl)cc3Br)[nH]c2c1 ZINC000586976036 GI Annotated Anodyne N[C@H](N=O)c1ccc2nc(COc3ccc(Cl)cc3Br)[nH]c2c1 ZINC000586976037 GI Annotated Anodyne CCc1ccc(-c2nc3ccc(C(=O)OC)c(OC)c3[nH]2)cc1Br ZINC000586976062 GI Annotated Anodyne Cc1cc(Cc2nc3ccc(OCCN(C)C)cc3[nH]2)ccc1Br ZINC000586976371 GI Annotated Anodyne COc1cc(/C=C/c2nc3cc4c(cc3[nH]2)OCCO4)ccc1Br ZINC000586976424 GI Annotated Anodyne COc1cc(/C=C\c2nc3cc4c(cc3[nH]2)OCCO4)ccc1Br ZINC000586976425 GI Annotated Anodyne COC(=O)c1cc2[nH]c(Cc3ccc(Br)c(C)c3)nc2cc1OC ZINC000586976442 GI Annotated Anodyne OCCc1ccc2nc(COc3ccc(Cl)cc3Br)[nH]c2c1 ZINC000586976529 GI Annotated Anodyne COc1cc(Br)c([C@H](N)c2nc3cc(C)cc(C)c3[nH]2)cc1OC ZINC000586976590 GI Annotated Anodyne COc1cc(Br)c([C@@H](N)c2nc3cc(C)cc(C)c3[nH]2)cc1OC ZINC000586976593 GI Annotated Anodyne COC(=O)c1cccc2nc(COc3ccc(Cl)cc3Br)[nH]c12 ZINC000586976612 GI Annotated Anodyne COc1cc(Br)c([C@H](N)c2nc3cc(C)c(C)cc3[nH]2)cc1OC ZINC000586976616 GI Annotated Anodyne COc1cc(Br)c([C@@H](N)c2nc3cc(C)c(C)cc3[nH]2)cc1OC ZINC000586976620 GI Annotated Anodyne N#Cc1cc2nc(COc3ccc(Cl)cc3Br)[nH]c2cc1C#N ZINC000586976908 GI Annotated Mild Oc1nc2cc3nc(COc4ccc(Cl)cc4Br)[nH]c3cc2[nH]1 ZINC000586977036 GI Annotated Anodyne Cc1cc(Cc2nc3cc(Br)cnc3[nH]2)ccc1Br ZINC000586977041 GI Annotated Anodyne COc1cc(Br)c([C@H](N)c2nc3ccc(C)c(C)c3[nH]2)cc1OC ZINC000586977086 GI Annotated Anodyne COc1cc(Br)c([C@@H](N)c2nc3ccc(C)c(C)c3[nH]2)cc1OC ZINC000586977088 GI Annotated Anodyne N#Cc1nc(Cl)cc2nc(COc3ccc(Cl)cc3Br)[nH]c12 ZINC000586977244 GI Annotated Mild CCc1ccc(-c2nc3nc(Br)c[nH]c-3n2)cc1Br ZINC000586977393 GI Annotated Anodyne Cc1cc(Cc2nc3c(Br)ccnc3[nH]2)ccc1Br ZINC000586977449 GI Annotated Anodyne COc1cc(/C=C/c2nc3cc(C#N)c(C#N)cc3[nH]2)ccc1Br ZINC000586977510 GI Annotated Mild COc1cc(/C=C\c2nc3cc(C#N)c(C#N)cc3[nH]2)ccc1Br ZINC000586977516 GI Annotated Mild COc1cc(/C=C/c2nc3cnc(C(F)(F)F)[nH]c-3n2)ccc1Br ZINC000586977550 GI Annotated Anodyne COc1cc(/C=C\c2nc3cnc(C(F)(F)F)[nH]c-3n2)ccc1Br ZINC000586977553 GI Annotated Anodyne COc1cc(/C=C/c2nc3cc(Cl)nc(C#N)c3[nH]2)ccc1Br ZINC000586977566 GI Annotated Mild COc1cc(/C=C\c2nc3cc(Cl)nc(C#N)c3[nH]2)ccc1Br ZINC000586977570 GI Annotated Mild COc1cc(/C=C\c2nc3cc4c(cc3[nH]2)NC(=O)CC4)ccc1Br ZINC000586977674 GI Annotated Anodyne COc1cc(/C=C/c2nc3cc4c(cc3[nH]2)NC(=O)CC4)ccc1Br ZINC000586977675 GI Annotated Anodyne Cc1cc(Cc2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)ccc1Br ZINC000586977819 GI Annotated Bother COC(=O)c1ccc2nc(Cc3ccc(Br)c(C)c3)[nH]c2c1OC ZINC000586977827 GI Annotated Anodyne Cc1cc(Cc2nc3cc(Br)ncc3[nH]2)ccc1Br ZINC000586977918 GI Annotated Anodyne COc1cc(/C=C/c2nc3cc4nc(O)[nH]c4cc3[nH]2)ccc1Br ZINC000586978001 GI Annotated Anodyne COc1cc(/C=C\c2nc3cc4nc(O)[nH]c4cc3[nH]2)ccc1Br ZINC000586978002 GI Annotated Anodyne Cc1cc(Cc2nc3ccc(Br)nc3[nH]2)ccc1Br ZINC000586978078 GI Annotated Anodyne CCOc1cc(/C=C\c2nc3cc(F)cnc3[nH]2)cc(Br)c1OC ZINC000586978116 GI Annotated Anodyne CCOc1cc(/C=C/c2nc3cc(F)cnc3[nH]2)cc(Br)c1OC ZINC000586978117 GI Annotated Anodyne COC(=O)c1cccc2nc(/C=C\c3ccc(Br)c(OC)c3)[nH]c12 ZINC000586978130 GI Annotated Anodyne COC(=O)c1cccc2nc(/C=C/c3ccc(Br)c(OC)c3)[nH]c12 ZINC000586978131 GI Annotated Anodyne CCOc1cc(/C=C\c2nc3ccnc(O)c3[nH]2)cc(Br)c1OC ZINC000586978447 GI Annotated Anodyne CCOc1cc(/C=C/c2nc3ccnc(O)c3[nH]2)cc(Br)c1OC ZINC000586978448 GI Annotated Anodyne Cc1nn(Cc2nc3cc(Br)cc(C)c3[nH]2)c(C)c1Br ZINC000586978669 GI Annotated Anodyne Cc1ncc(-c2nc3cncc(Br)c3[nH]2)c(C)c1Br ZINC000586978727 GI Annotated Anodyne Cc1ncc(-c2nc3c(Br)ccnc3[nH]2)c(C)c1Br ZINC000586978752 GI Annotated Anodyne Cc1nn(Cc2nc3ccc(Br)c(C)c3[nH]2)c(C)c1Br ZINC000586978813 GI Annotated Anodyne Cc1nn(Cc2nc3cc(C(F)(F)F)c(F)cc3[nH]2)c(C)c1Br ZINC000586978824 GI Annotated Anodyne Cc1ncc(-c2nc3cc(Br)ncc3[nH]2)c(C)c1Br ZINC000586978826 GI Annotated Anodyne Cc1nn(Cc2nc3cccc(OC(F)(F)F)c3[nH]2)c(C)c1Br ZINC000586978834 GI Annotated Anodyne Cc1nn(Cc2nc3cc(Cl)c(F)c(F)c3[nH]2)c(C)c1Br ZINC000586978837 GI Annotated Anodyne Cc1nn(Cc2nc3cc(F)cc(C(F)(F)F)c3[nH]2)c(C)c1Br ZINC000586978842 GI Annotated Anodyne Clc1nccc(-c2nc3cc(Br)ncc3[nH]2)c1Br ZINC000586978859 GI Annotated Anodyne CCOc1n[nH]c(-c2nc3cccc(C(F)(F)F)c3[nH]2)c1Br ZINC000586978866 GI Annotated Anodyne CCOc1n[nH]c(-c2nc3cccc(OC(F)(F)F)c3[nH]2)c1Br ZINC000586978881 GI Annotated Anodyne CCOc1n[nH]c(-c2nc3ccc(OC(F)(F)F)cc3[nH]2)c1Br ZINC000586978890 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3ccnc(Cl)c3Br)[nH]c2c1 ZINC000586978894 GI Annotated Anodyne FC(F)(F)c1cnc2[nH]c(-c3ccnc(Cl)c3Br)nc2c1 ZINC000586978903 GI Annotated Anodyne Fc1cc2[nH]c(-c3ccnc(Cl)c3Br)nc2cc1-n1cccn1 ZINC000586978908 GI Annotated Anodyne Cc1cc2nc(Cn3nc(C)c(Br)c3C)[nH]c2cc1Br ZINC000586978927 GI Annotated Anodyne Cc1cc(Br)c2[nH]c(Cn3nc(C)c(Br)c3C)nc2c1 ZINC000586979021 GI Annotated Anodyne Cc1ncc(-c2nc3cc4c(cc3[nH]2)OC(F)(F)O4)c(C)c1Br ZINC000586979023 GI Annotated Anodyne Clc1nccc(-c2nc3cc4c(cc3[nH]2)OCCCO4)c1Br ZINC000586979058 GI Annotated Anodyne Cc1nc2[nH]c(-c3cnc(C)c(Br)c3C)nc2cc1Br ZINC000586979063 GI Annotated Anodyne Clc1nccc(-c2nc3cc(Br)cnc3[nH]2)c1Br ZINC000586979073 GI Annotated Anodyne Clc1nccc(-c2nc3c(Br)ccnc3[nH]2)c1Br ZINC000586979124 GI Annotated Anodyne CCOc1n[nH]c(-c2nc3cc(F)cc(C(F)(F)F)c3[nH]2)c1Br ZINC000586979157 GI Annotated Anodyne Cc1ncc(-c2nc3cc(Br)cnc3[nH]2)c(C)c1Br ZINC000586979191 GI Annotated Anodyne Cc1ncc(-c2nc3ccc(Br)c(O)c3[nH]2)c(C)c1Br ZINC000586979193 GI Annotated Anodyne FC(F)(F)c1cc2nc(-c3ccnc(Cl)c3Br)[nH]c2cn1 ZINC000586979200 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(-c3cnc(C)c(Br)c3C)nc2c1 ZINC000586979272 GI Annotated Anodyne COc1cc(OC)c2[nH]c(-c3cc(Br)cc([N+](=O)[O-])c3C)nc2c1 ZINC000586979302 GI Annotated Bother Cc1ncc(-c2nc3cc(-n4cccn4)c(F)cc3[nH]2)c(C)c1Br ZINC000586979305 GI Annotated Anodyne Cc1ncc(-c2nc3ccc(Br)nc3[nH]2)c(C)c1Br ZINC000586979336 GI Annotated Anodyne Cc1ncc(-c2nc3ccnc(Br)c3[nH]2)c(C)c1Br ZINC000586979341 GI Annotated Anodyne CCOc1n[nH]c(-c2nc3cc(Cl)c(Cl)cc3[nH]2)c1Br ZINC000586979352 GI Annotated Anodyne Cc1nn(Cc2nc3ccc(OC(F)(F)F)cc3[nH]2)c(C)c1Br ZINC000586979382 GI Annotated Anodyne Clc1nccc(-c2nc3ccnc(Br)c3[nH]2)c1Br ZINC000586979391 GI Annotated Anodyne Cc1nn(Cc2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)c(C)c1Br ZINC000586979408 GI Annotated Mild Cc1c(-c2nc3cc(C(=O)O)c(F)cc3[nH]2)cc(Br)cc1[N+](=O)[O-] ZINC000586979432 GI Annotated Bother Clc1nccc(-c2nc3cncc(Br)c3[nH]2)c1Br ZINC000586979475 GI Annotated Anodyne Clc1nccc(-c2nc3ccc(Br)nc3[nH]2)c1Br ZINC000586979477 GI Annotated Anodyne CCOc1n[nH]c(-c2nc3cc(Cl)cc(Cl)c3[nH]2)c1Br ZINC000586979537 GI Annotated Anodyne CCOc1n[nH]c(-c2nc3cc(C(F)(F)F)c(F)cc3[nH]2)c1Br ZINC000586979571 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3cnc(C)c(Br)c3C)[nH]c2c1 ZINC000586979576 GI Annotated Anodyne Cc1c(-c2nc3cc(Cl)nc(C#N)c3[nH]2)cc(Br)cc1[N+](=O)[O-] ZINC000586979646 GI Annotated Mild COc1cc2nc(-c3cc(Br)cc([N+](=O)[O-])c3C)[nH]c2cc1F ZINC000586979715 GI Annotated Bother COc1cc2nc(-c3cc(Br)cc([N+](=O)[O-])c3C)[nH]c2cc1OC ZINC000586979746 GI Annotated Bother CCOc1n[nH]c(-c2nc3cc(Cl)c(F)c(F)c3[nH]2)c1Br ZINC000586979799 GI Annotated Anodyne COc1cc(Br)cc(C=O)c1OCc1nc2cc(C)c(F)cc2[nH]1 ZINC000586979812 GI Annotated Anodyne COc1cc(Br)cc(C=O)c1OCc1nc2ccc(C)cc2[nH]1 ZINC000586979837 GI Annotated Anodyne CCOc1n[nH]c(-c2nc3ccc(C(F)(F)F)cc3[nH]2)c1Br ZINC000586979910 GI Annotated Anodyne Cc1cc2[nH]c(-c3cc(Br)cc([N+](=O)[O-])c3C)nc2cc1[N+](=O)[O-] ZINC000586979926 GI Annotated Bother Cc1c(-c2nc3ccc([N+](=O)[O-])cc3[nH]2)cc(Br)cc1[N+](=O)[O-] ZINC000586980041 GI Annotated Bother Cc1c(-c2nc3cc(F)cc(C(=O)O)c3[nH]2)cc(Br)cc1[N+](=O)[O-] ZINC000586980047 GI Annotated Bother COc1cc(Br)cc(C=O)c1OCc1nc2cc(C)cc(F)c2[nH]1 ZINC000586980059 GI Annotated Anodyne COc1cc(Br)cc(C=O)c1OCc1nc2ccc(F)c(C)c2[nH]1 ZINC000586980086 GI Annotated Anodyne COc1cc(Br)cc(C=O)c1OCc1nc2cc(C)c(C)cc2[nH]1 ZINC000586980103 GI Annotated Anodyne COc1cc(Br)cc(C=O)c1OCc1nc2ccc(C)c(C)c2[nH]1 ZINC000586980111 GI Annotated Anodyne COc1cc(Br)cc(C=O)c1OCc1nc2ccc(Cl)cc2[nH]1 ZINC000586980173 GI Annotated Anodyne CCc1ccc2nc(COc3c(C=O)cc(Br)cc3OC)[nH]c2c1 ZINC000586980287 GI Annotated Anodyne COc1cc(Br)cc(C=O)c1OCc1nc2ccc(F)c(F)c2[nH]1 ZINC000586980296 GI Annotated Anodyne COc1cc(Br)cc(C=O)c1OCc1nc2cccc(Cl)c2[nH]1 ZINC000586980324 GI Annotated Anodyne Cc1c(-c2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)cc(Br)cc1[N+](=O)[O-] ZINC000586980340 GI Annotated Bother COc1cc(Br)cc(C=O)c1OCc1nc2cc(C)cc(C)c2[nH]1 ZINC000586980343 GI Annotated Anodyne Cc1c(-c2nc3c(F)cnc(Cl)c3[nH]2)cc(Br)cc1[N+](=O)[O-] ZINC000586980347 GI Annotated Bother COc1cc(Br)cc(C=O)c1OCc1nc2cc(F)c(F)cc2[nH]1 ZINC000586980395 GI Annotated Anodyne Cc1c(-c2nc3cccc([N+](=O)[O-])c3[nH]2)cc(Br)cc1[N+](=O)[O-] ZINC000586980447 GI Annotated Bother COc1cc(Br)cc(C=O)c1OCc1nc2c(C)ccc(C)c2[nH]1 ZINC000586980517 GI Annotated Anodyne Cc1cc(Br)ccc1-n1cccc1-c1nc2nc(Cl)c[nH]c-2n1 ZINC000586980530 GI Annotated Anodyne FC(F)(F)c1ncc2nc(-c3cc(Br)ccc3Cl)nc-2[nH]1 ZINC000586980538 GI Annotated Anodyne COc1cc(Br)cc(C=O)c1OCc1nc2cc(F)cc(F)c2[nH]1 ZINC000586980539 GI Annotated Anodyne Clc1ccc(Br)cc1-c1nc2nc(Br)c[nH]c-2n1 ZINC000586980552 GI Annotated Anodyne Cc1cc(Br)ccc1-n1cccc1-c1nc2ncc([N+](=O)[O-])cc2[nH]1 ZINC000586980580 GI Annotated Bother CCOC(=O)c1ccc2nc(COc3ccc(Br)cc3C)[nH]c2c1 ZINC000586980586 GI Annotated Anodyne COc1cc(Br)cc(C=O)c1OCc1nc2cccc(C)c2[nH]1 ZINC000586980597 GI Annotated Anodyne Cc1cc(Br)ccc1OCc1nc2ccc(Br)nc2[nH]1 ZINC000586980599 GI Annotated Anodyne Cc1cc(Br)ccc1OCc1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 ZINC000586980655 GI Annotated Bother COc1cncc2[nH]c(-c3cccn3-c3ccc(Br)cc3C)nc12 ZINC000586980689 GI Annotated Anodyne Cc1cc(Br)ccc1OCc1nc2cc([N+](=O)[O-])c(C)cc2[nH]1 ZINC000586980701 GI Annotated Bother COc1cc2nc(COc3ccc(Br)cc3C)[nH]c2cc1OC ZINC000586981017 GI Annotated Anodyne Cc1cc(Br)ccc1OCc1nc2c(Br)ccnc2[nH]1 ZINC000586981042 GI Annotated Anodyne Cc1cc(Br)ccc1OCc1nc2cc(Cl)nc(C#N)c2[nH]1 ZINC000586981134 GI Annotated Mild Cc1cc(Br)ccc1-n1cccc1-c1nc2c([N+](=O)[O-])cncc2[nH]1 ZINC000586981146 GI Annotated Bother COc1nccc2[nH]c(-c3cccn3-c3ccc(Br)cc3C)nc12 ZINC000586981191 GI Annotated Anodyne Cc1cc(Br)ccc1OCc1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000586981201 GI Annotated Anodyne O=Cc1cc(Br)cc(-c2nc3ccc(Br)c(O)c3[nH]2)c1 ZINC000586981264 GI Annotated Anodyne COc1cc2[nH]c(-c3cccn3-c3ccc(Br)cc3C)nc2cn1 ZINC000586981268 GI Annotated Anodyne Cc1cc(Br)ccc1OCc1nc2cc(Br)ncc2[nH]1 ZINC000586981270 GI Annotated Anodyne Cc1cc(Br)ccc1-n1cccc1-c1nc2cc(N)c(N)cc2[nH]1 ZINC000586981283 GI Annotated Anodyne Cc1cc(Br)ccc1OCc1nc2cc(F)cc(C(=O)O)c2[nH]1 ZINC000586981299 GI Annotated Anodyne CCCCCCOc1ccc(Br)cc1-c1nc2c(O)ncnc2[nH]1 ZINC000586981385 GI Annotated Anodyne Cc1nc2[nH]c(-c3cc(Br)cc(C=O)c3)nc2cc1Br ZINC000586981450 GI Annotated Anodyne Cc1cc(Br)ccc1OCc1nc2ccnc(Br)c2[nH]1 ZINC000586981452 GI Annotated Anodyne COc1ccc2[nH]c(-c3cccn3-c3ccc(Br)cc3C)nc2n1 ZINC000586981473 GI Annotated Anodyne Cc1cc(Br)ccc1OCc1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000586981501 GI Annotated Anodyne Cc1cc(Br)ccc1OCc1nc2cncc(Br)c2[nH]1 ZINC000586981678 GI Annotated Anodyne COc1cc(OC)c2[nH]c(COc3ccc(Br)cc3C)nc2c1 ZINC000586981700 GI Annotated Anodyne CC(C)CCOc1ccc(Br)cc1-c1nc2cc(=N)[nH]cc2[nH]1 ZINC000586981762 GI Annotated Anodyne CC(C)CCOc1ccc(Br)cc1-c1nc2cc[nH]c(=N)c2[nH]1 ZINC000586982094 GI Annotated Anodyne CCCCCCOc1ccc(Br)cc1-c1nc2cnnc(O)c2[nH]1 ZINC000586982112 GI Annotated Anodyne CCCCCCOc1ccc(Br)cc1-c1nc2c(N)ncnc2[nH]1 ZINC000586982153 GI Annotated Anodyne O=Cc1cc(Br)cc(-c2nc3cc(-n4cccn4)c(F)cc3[nH]2)c1 ZINC000586982179 GI Annotated Anodyne O=Cc1cc(Br)cc(-c2nc3c(F)cnc(Br)c3[nH]2)c1 ZINC000586982223 GI Annotated Anodyne CC(C)CCOc1ccc(Br)cc1-c1nc2c(N)ccnc2[nH]1 ZINC000586982406 GI Annotated Anodyne CCCCCCOc1ccc(Br)cc1-c1nc2c[nH]c(=N)[nH]c-2n1 ZINC000586982415 GI Annotated Anodyne O=Cc1cc(Br)cc(-c2nc3cc4c(cc3[nH]2)OC(F)(F)O4)c1 ZINC000586983026 GI Annotated Anodyne CC(C)C[C@H](Cc1cccc(Br)c1)c1nc2cnnc(O)c2[nH]1 ZINC000586983069 GI Annotated Anodyne CC(C)C[C@@H](Cc1cccc(Br)c1)c1nc2cnnc(O)c2[nH]1 ZINC000586983070 GI Annotated Anodyne CC(C)C[C@H](Cc1cccc(Br)c1)c1nc2c(O)ncnc2[nH]1 ZINC000586983094 GI Annotated Anodyne CC(C)C[C@@H](Cc1cccc(Br)c1)c1nc2c(O)ncnc2[nH]1 ZINC000586983095 GI Annotated Anodyne O=Cc1cc(Br)cc(-c2nc3cc([N+](=O)[O-])c(Cl)cc3[nH]2)c1 ZINC000586983263 GI Annotated Bother Cc1ccc2c(ccc3nc([C@@H](N)Cc4cccc(Br)c4)[nH]c32)n1 ZINC000586983327 GI Annotated Anodyne Cc1ccc2c(ccc3nc([C@H](N)Cc4cccc(Br)c4)[nH]c32)n1 ZINC000586983330 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(-c3cc(Br)cc(C=O)c3)nc2c1 ZINC000586983361 GI Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000586983453 GI Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000586983544 GI Annotated Anodyne COc1cc2nc([C@H](N)Cc3cccc(Br)c3)[nH]c2cc1Cl ZINC000586983545 GI Annotated Anodyne COc1cc2nc([C@@H](N)Cc3cccc(Br)c3)[nH]c2cc1Cl ZINC000586983546 GI Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2cccc(Br)c2[nH]1 ZINC000586983584 GI Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2cccc(Br)c2[nH]1 ZINC000586983585 GI Annotated Anodyne N#Cc1cc(Cl)c2[nH]c([C@H](N)Cc3cccc(Br)c3)nc2c1 ZINC000586983587 GI Annotated Mild N#Cc1cc(Cl)c2[nH]c([C@@H](N)Cc3cccc(Br)c3)nc2c1 ZINC000586983588 GI Annotated Mild N[C@H](Cc1cccc(Br)c1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000586983723 GI Annotated Bother N[C@@H](Cc1cccc(Br)c1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000586983724 GI Annotated Bother CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2cc(C)cc(C)c2[nH]1 ZINC000586983773 GI Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000586983798 GI Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000586983799 GI Annotated Anodyne CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2cc(C)cc(F)c2[nH]1 ZINC000586983835 GI Annotated Anodyne CCc1ccc2nc(C[C@H](NC(C)=O)c3ccc(Br)cc3)[nH]c2c1 ZINC000586983874 GI Annotated Anodyne CCc1ccc2nc(C[C@@H](NC(C)=O)c3ccc(Br)cc3)[nH]c2c1 ZINC000586983878 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2ccc(C)c(C)c2[nH]1)c1ccc(Br)cc1 ZINC000586983960 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccc(C)c(C)c2[nH]1)c1ccc(Br)cc1 ZINC000586983962 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2ccc(Cl)cc2[nH]1)c1ccc(Br)cc1 ZINC000586984079 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccc(Cl)cc2[nH]1)c1ccc(Br)cc1 ZINC000586984080 GI Annotated Anodyne CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2ccc(F)c(C)c2[nH]1 ZINC000586984082 GI Annotated Anodyne CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2c(C)ccc(C)c2[nH]1 ZINC000586984086 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc(F)c(F)cc2[nH]1)c1ccc(Br)cc1 ZINC000586984259 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(F)c(F)cc2[nH]1)c1ccc(Br)cc1 ZINC000586984260 GI Annotated Anodyne CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2cc(F)cc(F)c2[nH]1 ZINC000586984376 GI Annotated Anodyne C=CCc1cccc2nc([C@H](Cc3ccc(Br)cc3)NC(C)=O)[nH]c12 ZINC000586984399 GI Annotated Mild N[C@H](Cc1cccc(Br)c1)c1nc2ccc(Br)cc2[nH]1 ZINC000586984445 GI Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2ccc(Br)cc2[nH]1 ZINC000586984446 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc(C)cc(C)c2[nH]1)c1ccc(Br)cc1 ZINC000586984566 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(C)cc(C)c2[nH]1)c1ccc(Br)cc1 ZINC000586984567 GI Annotated Anodyne N#Cc1ccc2nc([C@@H](c3ccc(Br)cc3)N3CCCC3)[nH]c2c1 ZINC000586984573 GI Annotated Mild N#Cc1ccc2nc([C@H](c3ccc(Br)cc3)N3CCCC3)[nH]c2c1 ZINC000586984574 GI Annotated Mild CC(=O)[C@@H](Br)c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586984657 GI Annotated Reactive CC(=O)[C@H](Br)c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586984658 GI Annotated Reactive CC(=O)N[C@@H](Cc1nc2cc(F)cc(F)c2[nH]1)c1ccc(Br)cc1 ZINC000586984724 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(F)cc(F)c2[nH]1)c1ccc(Br)cc1 ZINC000586984725 GI Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000586984885 GI Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000586984886 GI Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000586984899 GI Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000586984900 GI Annotated Anodyne Brc1ccc([C@H](c2nc3cc4cn[nH]c4cc3[nH]2)N2CCCC2)cc1 ZINC000586984946 GI Annotated Anodyne Brc1ccc([C@@H](c2nc3cc4cn[nH]c4cc3[nH]2)N2CCCC2)cc1 ZINC000586984950 GI Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2cc(Cl)c(F)c(F)c2[nH]1 ZINC000586984992 GI Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2cc(Cl)c(F)c(F)c2[nH]1 ZINC000586984996 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2c(C)ccc(C)c2[nH]1)c1ccc(Br)cc1 ZINC000586985005 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2c(C)ccc(C)c2[nH]1)c1ccc(Br)cc1 ZINC000586985007 GI Annotated Anodyne N[C@@H](Cc1cccc(Br)c1)c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000586985096 GI Annotated Anodyne N[C@H](Cc1cccc(Br)c1)c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000586985097 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2ccc(F)c(C)c2[nH]1)c1ccc(Br)cc1 ZINC000586985125 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccc(F)c(C)c2[nH]1)c1ccc(Br)cc1 ZINC000586985126 GI Annotated Anodyne CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2ccc(C)c(C)c2[nH]1 ZINC000586985149 GI Annotated Anodyne CC(=O)N[C@@H](Cc1ccc(Br)cc1)c1nc2ccc(F)c(F)c2[nH]1 ZINC000586985251 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)[C@H](Br)C(=O)CC3 ZINC000586985366 GI Annotated Reactive O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)[C@@H](Br)C(=O)CC3 ZINC000586985370 GI Annotated Reactive CC(=O)N[C@@H](Cc1nc2cccc(Cl)c2[nH]1)c1ccc(Br)cc1 ZINC000586985534 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cccc(Cl)c2[nH]1)c1ccc(Br)cc1 ZINC000586985535 GI Annotated Anodyne N#Cc1cccc2nc([C@@H](c3ccc(Br)cc3)N3CCCC3)[nH]c12 ZINC000586985568 GI Annotated Mild N#Cc1cccc2nc([C@H](c3ccc(Br)cc3)N3CCCC3)[nH]c12 ZINC000586985569 GI Annotated Mild OCc1ccc2nc([C@@H](c3ccc(Br)cc3)N3CCCC3)[nH]c2c1 ZINC000586985612 GI Annotated Anodyne OCc1ccc2nc([C@H](c3ccc(Br)cc3)N3CCCC3)[nH]c2c1 ZINC000586985613 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc(C)c(F)cc2[nH]1)c1ccc(Br)cc1 ZINC000586985810 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(C)c(F)cc2[nH]1)c1ccc(Br)cc1 ZINC000586985811 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc(C)cc(F)c2[nH]1)c1ccc(Br)cc1 ZINC000586985831 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(C)cc(F)c2[nH]1)c1ccc(Br)cc1 ZINC000586985833 GI Annotated Anodyne O=C1c2ccccc2-c2cc(Cn3ccc(C(F)(F)F)n3)nc3ccc(O)c1c23 ZINC000586985924 GI Annotated Anodyne Fc1cnc2[nH]c([C@H](c3ccc(Br)cc3)N3CCCC3)nc2c1 ZINC000586986038 GI Annotated Anodyne Fc1cnc2[nH]c([C@@H](c3ccc(Br)cc3)N3CCCC3)nc2c1 ZINC000586986039 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)CC[C@H](Br)C3 ZINC000586986225 GI Annotated Reactive O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)CC[C@@H](Br)C3 ZINC000586986229 GI Annotated Reactive O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)[C@H](C(=O)C(F)(F)F)CC3 ZINC000586986257 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)[C@@H](C(=O)C(F)(F)F)CC3 ZINC000586986266 GI Annotated Anodyne COc1ccc(N)c(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c1OC ZINC000586986297 GI Annotated Anodyne O=C1c2ccccc2-c2cc(Cn3nc(Cl)nc3Cl)nc3ccc(O)c1c23 ZINC000586986365 GI Annotated Anodyne C=CCc1cccc2nc(C[C@@H](NC(C)=O)c3ccc(Br)cc3)[nH]c12 ZINC000586986393 GI Annotated Mild C=CCc1cccc2nc(C[C@H](NC(C)=O)c3ccc(Br)cc3)[nH]c12 ZINC000586986394 GI Annotated Mild O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)[C@H](Cn1cncn1)CCCC3 ZINC000586986425 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)[C@@H](Cn1cncn1)CCCC3 ZINC000586986431 GI Annotated Anodyne Nc1cc2c(cc1-c1cc3c4c(c(O)ccc4n1)C(=O)c1ccccc1-3)OCCO2 ZINC000586986573 GI Annotated Anodyne Cn1cc([C@H]2c3c(nc4ccc(O)c5c4c3-c3ccccc3C5=O)C2(C)C)cn1 ZINC000586986575 GI Annotated Anodyne Cn1cc([C@@H]2c3c(nc4ccc(O)c5c4c3-c3ccccc3C5=O)C2(C)C)cn1 ZINC000586986576 GI Annotated Anodyne N=c1[nH]c2cc(-c3cc4c5c(c(O)ccc5n3)C(=O)c3ccccc3-4)ccc2o1 ZINC000586986641 GI Annotated Anodyne Nc1ccc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)cc1[N+](=O)[O-] ZINC000586986659 GI Annotated Bother CC(=O)N[C@@H](Cc1nc2ccc(F)c(F)c2[nH]1)c1ccc(Br)cc1 ZINC000586986677 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccc(F)c(F)c2[nH]1)c1ccc(Br)cc1 ZINC000586986679 GI Annotated Anodyne CC(C)[C@H](NC(=O)CCl)c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586986721 GI Annotated Reactive CC(C)[C@@H](NC(=O)CCl)c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586986724 GI Annotated Reactive O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)C(=O)[C@H](Br)CC3 ZINC000586986742 GI Annotated Reactive O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)C(=O)[C@@H](Br)CC3 ZINC000586986743 GI Annotated Reactive CCOC(=O)[C@H](Cl)c1nc2ccc(O)c3c2c(c1C)-c1ccccc1C3=O ZINC000586986754 GI Annotated Reactive CCOC(=O)[C@@H](Cl)c1nc2ccc(O)c3c2c(c1C)-c1ccccc1C3=O ZINC000586986755 GI Annotated Reactive O=C(Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2)Nc1ccccc1 ZINC000586986936 GI Annotated Anodyne N=c1[nH]c2c(-c3cc4c5c(c(O)ccc5n3)C(=O)c3ccccc3-4)cccc2o1 ZINC000586986965 GI Annotated Anodyne COC1=C(Br)c2nc3ccc(O)c4c3c(c2C1)-c1ccccc1C4=O ZINC000586987008 GI Annotated Anodyne Cc1cccc(NC(=O)Cc2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)n1 ZINC000586987055 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H]1Cc2c1nc1ccc(O)c3c1c2-c1ccccc1C3=O ZINC000586987068 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1Cc2c1nc1ccc(O)c3c1c2-c1ccccc1C3=O ZINC000586987137 GI Annotated Anodyne O=C1c2ccccc2-c2cc(-c3cccc([N+](=O)[O-])c3O)nc3ccc(O)c1c23 ZINC000586987142 GI Annotated Bother Cn1cnc2cc(-c3cc4c5c(c(O)ccc5n3)C(=O)c3ccccc3-4)cnc21 ZINC000586987162 GI Annotated Anodyne Cc1c(CNC(=O)OC(C)(C)C)nc2ccc(O)c3c2c1-c1ccccc1C3=O ZINC000586987191 GI Annotated Anodyne N=c1[nH]c2cccc(-c3cc4c5c(c(O)ccc5n3)C(=O)c3ccccc3-4)c2o1 ZINC000586987282 GI Annotated Anodyne COC(=O)c1cc(-c2nc3ccc(O)c4c3c(c2C)-c2ccccc2C4=O)cn1C ZINC000586987290 GI Annotated Anodyne Cn1ccnc1[C@H]1CCCc2nc3ccc(O)c4c3c(c21)-c1ccccc1C4=O ZINC000586987380 GI Annotated Anodyne Cn1ccnc1[C@@H]1CCCc2nc3ccc(O)c4c3c(c21)-c1ccccc1C4=O ZINC000586987381 GI Annotated Anodyne Nc1ccc(-c2nc3ccc(O)c4c3c(c2CC(=O)O)-c2ccccc2C4=O)cc1 ZINC000586987383 GI Annotated Anodyne Nc1cccc(-c2nc3ccc(O)c4c3c(c2CC(=O)O)-c2ccccc2C4=O)c1 ZINC000586987389 GI Annotated Anodyne C[C@H]1CCCCN1C(=O)Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586987408 GI Annotated Anodyne C[C@@H]1CCCCN1C(=O)Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586987409 GI Annotated Anodyne COc1ccc(Cc2cnc3ccc(O)c4c3c2-c2ccccc2C4=O)c(C)n1 ZINC000586987421 GI Annotated Anodyne O=C1c2ccccc2-c2cc(-c3ccccc3-n3ccnn3)nc3ccc(O)c1c23 ZINC000586987436 GI Annotated Anodyne CCOC(=O)c1cccc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)n1 ZINC000586987463 GI Annotated Anodyne O=C1c2ccccc2-c2cc(CC(=O)N3CCCCCC3)nc3ccc(O)c1c23 ZINC000586987504 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)[C@H](C(=O)C(F)F)CCC3 ZINC000586987519 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)[C@@H](C(=O)C(F)F)CCC3 ZINC000586987520 GI Annotated Anodyne COc1ccc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c(OC)n1 ZINC000586987579 GI Annotated Anodyne CC(C)(C)n1cc(O)c(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)n1 ZINC000586987592 GI Annotated Anodyne COCCn1nc(C)c(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c1C ZINC000586987617 GI Annotated Anodyne Cc1ccnc(NC(=O)Cc2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c1 ZINC000586987649 GI Annotated Anodyne COc1cc(N)c(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c(OC)c1 ZINC000586987682 GI Annotated Anodyne Cc1cnc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c([N+](=O)[O-])c1 ZINC000586987687 GI Annotated Bother COc1cc(C)c(Cc2cnc3ccc(O)c4c3c2-c2ccccc2C4=O)cn1 ZINC000586987748 GI Annotated Anodyne O=C1c2ccccc2-c2cc(-c3cn(-c4ccccc4)nn3)nc3ccc(O)c1c23 ZINC000586987814 GI Annotated Anodyne Nc1cc2c(cc1-c1cc3c4c(c(O)ccc4n1)C(=O)c1ccccc1-3)OCO2 ZINC000586987831 GI Annotated Anodyne O=C1c2ccccc2-c2cc(-c3ccc(-n4cncn4)cc3)nc3ccc(O)c1c23 ZINC000586987843 GI Annotated Anodyne NC(=O)Nc1ccc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)cc1 ZINC000586987853 GI Annotated Anodyne Cc1cccnc1NC(=O)Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586987871 GI Annotated Anodyne COc1ccc2c(c1N)-c1nc3ccc(O)c4c3c(c1C2)-c1ccccc1C4=O ZINC000586987874 GI Annotated Anodyne N=C(N)Nc1ccc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)cc1 ZINC000586987898 GI Annotated Anodyne Cn1ccnc1[C@@H]1CCc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)C1 ZINC000586987935 GI Annotated Anodyne Cn1ccnc1[C@H]1CCc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)C1 ZINC000586987936 GI Annotated Anodyne Nc1ccccc1C(=O)OCc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586988047 GI Annotated Anodyne Cn1nccc1[C@@H]1CCc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)C1 ZINC000586988053 GI Annotated Anodyne Cn1nccc1[C@H]1CCc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)C1 ZINC000586988054 GI Annotated Anodyne COc1cc(N)c(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)cc1OC ZINC000586988060 GI Annotated Anodyne O=C(c1ccc([N+](=O)[O-])cc1)c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586988077 GI Annotated Bother Nc1ccc([N+](=O)[O-])cc1-c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586988081 GI Annotated Bother Nc1ccc([N+](=O)[O-])c(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c1 ZINC000586988084 GI Annotated Bother Cn1nccc1[C@@H]1CCCc2nc3ccc(O)c4c3c(c21)-c1ccccc1C4=O ZINC000586988085 GI Annotated Anodyne Cn1nccc1[C@H]1CCCc2nc3ccc(O)c4c3c(c21)-c1ccccc1C4=O ZINC000586988086 GI Annotated Anodyne O=C1c2ccccc2-c2cc(-c3ccc(O)c([N+](=O)[O-])c3)nc3ccc(O)c1c23 ZINC000586988115 GI Annotated Bother O=C1c2ccccc2-c2cc(-c3cccc(O)c3[N+](=O)[O-])nc3ccc(O)c1c23 ZINC000586988119 GI Annotated Bother O=C1Cc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)-c2cc(F)ccc2N1 ZINC000586988209 GI Annotated Anodyne O=C(Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2)Nc1ccccc1F ZINC000586988269 GI Annotated Anodyne O=C1c2ccccc2-c2cc(CN3Cc4ccccc4C3=O)nc3ccc(O)c1c23 ZINC000586988274 GI Annotated Anodyne O=C(Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2)Nc1cccc(F)c1 ZINC000586988279 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)[C@H](c1cncnc1)CCC3 ZINC000586988363 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)[C@@H](c1cncnc1)CCC3 ZINC000586988365 GI Annotated Anodyne COc1ccc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)nc1OC ZINC000586988476 GI Annotated Anodyne CCOC(=O)c1ccc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)cn1 ZINC000586988693 GI Annotated Anodyne COC(=O)c1ccnc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c1 ZINC000586988705 GI Annotated Anodyne O=C1c2ccccc2-c2c(CCNC(=O)C3CCCC3)cnc3ccc(O)c1c23 ZINC000586988757 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586988961 GI Annotated Anodyne CC(=O)Nc1ccc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c(O)c1 ZINC000586988977 GI Annotated Anodyne CC(C)(C)OC(=O)NCCc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586988999 GI Annotated Anodyne CC(=O)Nc1ccc(O)c(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c1 ZINC000586989011 GI Annotated Anodyne O=C1c2ccccc2-c2c(CCO)c(-c3ccc(F)cc3)nc3ccc(O)c1c23 ZINC000586989121 GI Annotated Anodyne O=C(Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2)Nc1ccc(F)cc1 ZINC000586989133 GI Annotated Anodyne CN(C(=O)Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2)c1ccccc1 ZINC000586989137 GI Annotated Anodyne CCOC(=O)[C@@H]1CCc2nc3ccc(O)c4c3c(c2[C@@H]1C)-c1ccccc1C4=O ZINC000586989216 GI Annotated Anodyne CCOC(=O)[C@H]1CCc2nc3ccc(O)c4c3c(c2[C@@H]1C)-c1ccccc1C4=O ZINC000586989217 GI Annotated Anodyne CCOC(=O)[C@@H]1CCc2nc3ccc(O)c4c3c(c2[C@H]1C)-c1ccccc1C4=O ZINC000586989218 GI Annotated Anodyne CCOC(=O)[C@H]1CCc2nc3ccc(O)c4c3c(c2[C@H]1C)-c1ccccc1C4=O ZINC000586989219 GI Annotated Anodyne Cc1c(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)cnc2ccnn12 ZINC000586989245 GI Annotated Anodyne C=C1NC(C)=Cn2nc(-c3cc4c5c(c(O)ccc5n3)C(=O)c3ccccc3-4)cc21 ZINC000586989308 GI Annotated Anodyne O=C1c2ccccc2-c2cc(-c3ccc4c(c3)CNCC4)nc3ccc(O)c1c23 ZINC000586989347 GI Annotated Anodyne CC(C)CCOC(=O)Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586989393 GI Annotated Anodyne CCCCOC(=O)CCc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586989414 GI Annotated Anodyne Cc1noc([C@@H]2CCc3nc4ccc(O)c5c4c(c3C2)-c2ccccc2C5=O)n1 ZINC000586989436 GI Annotated Anodyne Cc1noc([C@H]2CCc3nc4ccc(O)c5c4c(c3C2)-c2ccccc2C5=O)n1 ZINC000586989437 GI Annotated Anodyne CCc1noc([C@@H]2CCc3nc4ccc(O)c5c4c(c3C2)-c2ccccc2C5=O)n1 ZINC000586989457 GI Annotated Anodyne CCc1noc([C@H]2CCc3nc4ccc(O)c5c4c(c3C2)-c2ccccc2C5=O)n1 ZINC000586989458 GI Annotated Anodyne CCc1c(-c2c[nH]c(C(=O)O)c2)nc2ccc(O)c3c2c1-c1ccccc1C3=O ZINC000586989498 GI Annotated Anodyne Cc1cc2ncc(-c3cc4c5c(c(O)ccc5n3)C(=O)c3ccccc3-4)c(C)n2n1 ZINC000586989504 GI Annotated Anodyne CCCc1c(CC(=O)OCC)nc2ccc(O)c3c2c1-c1ccccc1C3=O ZINC000586989604 GI Annotated Anodyne CCOC(=O)Cc1nc2ccc(O)c3c2c(c1C(C)C)-c1ccccc1C3=O ZINC000586989626 GI Annotated Anodyne O=C1Cc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)-c2ccccc2N1 ZINC000586989632 GI Annotated Anodyne CCOC(=O)[C@H](C)c1nc2ccc(O)c3c2c(c1CC)-c1ccccc1C3=O ZINC000586989681 GI Annotated Anodyne CCOC(=O)[C@@H](C)c1nc2ccc(O)c3c2c(c1CC)-c1ccccc1C3=O ZINC000586989682 GI Annotated Anodyne CCOC(=O)[C@@]1(C)CCc2nc3ccc(O)c4c3c(c2C1)-c1ccccc1C4=O ZINC000586989704 GI Annotated Anodyne CCOC(=O)[C@]1(C)CCc2nc3ccc(O)c4c3c(c2C1)-c1ccccc1C4=O ZINC000586989705 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)-c1ccccc1[C@H]3C(=O)O ZINC000586989728 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)-c1ccccc1[C@@H]3C(=O)O ZINC000586989729 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C(=O)O)c1nc3ccc(O)c4c3c(c12)-c1ccccc1C4=O ZINC000586989746 GI Annotated Anodyne CC1(C)[C@H]2CC[C@@]1(C(=O)O)c1nc3ccc(O)c4c3c(c12)-c1ccccc1C4=O ZINC000586989752 GI Annotated Anodyne Cc1[nH]c(C(=O)O)c(C)c1-c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586989761 GI Annotated Anodyne CCOC(=O)Cc1nc2ccc(O)c3c2c(c1CC(C)C)-c1ccccc1C3=O ZINC000586989769 GI Annotated Anodyne CCC[C@@H](C)OC(=O)Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586989828 GI Annotated Anodyne CCC[C@H](C)OC(=O)Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586989830 GI Annotated Anodyne O=C(O)Cc1ccc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)cc1 ZINC000586990047 GI Annotated Anodyne O=C(O)c1ccc2c(c1)Cc1c-2nc2ccc(O)c3c2c1-c1ccccc1C3=O ZINC000586990081 GI Annotated Anodyne Cc1c(C(=O)O)[nH]c2c1-c1nc3ccc(O)c4c3c(c1CC2)-c1ccccc1C4=O ZINC000586990093 GI Annotated Anodyne O=C(Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2)c1ccccc1O ZINC000586990102 GI Annotated Anodyne O=C1c2ccccc2-c2cc(-c3ccc4nc(O)[nH]c4c3)nc3ccc(O)c1c23 ZINC000586990107 GI Annotated Anodyne O=C(O)COc1ccccc1-c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586990145 GI Annotated Anodyne CCOC(=O)[C@H]1Cc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)[C@H](C)C1 ZINC000586990149 GI Annotated Anodyne CCOC(=O)[C@@H]1Cc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)[C@H](C)C1 ZINC000586990152 GI Annotated Anodyne CCOC(=O)[C@H]1Cc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)[C@@H](C)C1 ZINC000586990155 GI Annotated Anodyne O=C1COc2cc(-c3cc4c5c(c(O)ccc5n3)C(=O)c3ccccc3-4)ccc2N1 ZINC000586990158 GI Annotated Anodyne CCOC(=O)[C@@H]1Cc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)[C@@H](C)C1 ZINC000586990160 GI Annotated Anodyne COc1cc(O)c2c(c1)Cc1c-2nc2ccc(O)c3c2c1-c1ccccc1C3=O ZINC000586990174 GI Annotated Anodyne Cc1[nH]c(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c(C)c1C(=O)O ZINC000586990199 GI Annotated Anodyne CCCCOC(=O)Cc1c(C)nc2ccc(O)c3c2c1-c1ccccc1C3=O ZINC000586990257 GI Annotated Anodyne CCCCCOC(=O)Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586990265 GI Annotated Anodyne COC(=O)[C@H](c1nc2ccc(O)c3c2c(c1C)-c1ccccc1C3=O)C(C)C ZINC000586990268 GI Annotated Anodyne COC(=O)[C@@H](c1nc2ccc(O)c3c2c(c1C)-c1ccccc1C3=O)C(C)C ZINC000586990269 GI Annotated Anodyne COC(=O)c1cc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)ccc1O ZINC000586990273 GI Annotated Anodyne CCOC(=O)[C@H]1Cc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)C[C@H]1C ZINC000586990441 GI Annotated Anodyne CCOC(=O)[C@@H]1Cc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)C[C@H]1C ZINC000586990442 GI Annotated Anodyne CCOC(=O)[C@@H]1Cc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)C[C@@H]1C ZINC000586990444 GI Annotated Anodyne CCOC(=O)[C@H]1Cc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)C[C@@H]1C ZINC000586990445 GI Annotated Anodyne CCc1c(-c2cc(O)c(O)cc2O)nc2ccc(O)c3c2c1-c1ccccc1C3=O ZINC000586990460 GI Annotated Clean CCOC(=O)C[C@@H]1CCc2nc3ccc(O)c4c3c(c2C1)-c1ccccc1C4=O ZINC000586990472 GI Annotated Anodyne CCOC(=O)C[C@H]1CCc2nc3ccc(O)c4c3c(c2C1)-c1ccccc1C4=O ZINC000586990475 GI Annotated Anodyne CCOC(=O)[C@H](c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2)C(C)C ZINC000586990547 GI Annotated Anodyne CCOC(=O)[C@@H](c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2)C(C)C ZINC000586990549 GI Annotated Anodyne Cc1[nH]c2c(c1C(=O)O)-c1nc3ccc(O)c4c3c(c1CC2)-c1ccccc1C4=O ZINC000586990604 GI Annotated Anodyne CC1(C)CC(=O)C(Cc2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)C(=O)C1 ZINC000586990686 GI Annotated Anodyne COc1ccc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)cc1CO ZINC000586990812 GI Annotated Anodyne CCOC(=O)[C@H]1Cc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)C=C1C ZINC000586990839 GI Annotated Anodyne CCOC(=O)[C@@H]1Cc2c(nc3ccc(O)c4c3c2-c2ccccc2C4=O)C=C1C ZINC000586990840 GI Annotated Anodyne COC(=O)c1cccc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c1O ZINC000586990872 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)-c1cc2c(cc1C3)OCCO2 ZINC000586990934 GI Annotated Anodyne O=C(O)Cc1c(-c2ccccc2)nc2ccc(O)c3c2c1-c1ccccc1C3=O ZINC000586990937 GI Annotated Anodyne O=C(O)c1nc2ccc(O)c3c2c(c1Cc1ccccc1)-c1ccccc1C3=O ZINC000586991012 GI Annotated Anodyne CC(=O)c1cc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c(O)cc1O ZINC000586991248 GI Annotated Anodyne O=C1Cc2nc3ccc(O)c4c3c(c2[C@H](c2ccco2)C1)-c1ccccc1C4=O ZINC000586991255 GI Annotated Anodyne O=C(O)c1ccc2c(c1)-c1nc3ccc(O)c4c3c(c1C2)-c1ccccc1C4=O ZINC000586991259 GI Annotated Anodyne O=C1Cc2nc3ccc(O)c4c3c(c2[C@@H](c2ccco2)C1)-c1ccccc1C4=O ZINC000586991260 GI Annotated Anodyne CCc1c([C@@H](CC)C(=O)OC)nc2ccc(O)c3c2c1-c1ccccc1C3=O ZINC000586991310 GI Annotated Anodyne CCc1c([C@H](CC)C(=O)OC)nc2ccc(O)c3c2c1-c1ccccc1C3=O ZINC000586991311 GI Annotated Anodyne O=C(O)c1coc2c1-c1nc3ccc(O)c4c3c(c1CC2)-c1ccccc1C4=O ZINC000586991394 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)-c1cc2c(cc1C3)OCO2 ZINC000586991406 GI Annotated Anodyne O=C1c2ccccc2-c2cc(C3C(=O)c4ccccc4C3=O)nc3ccc(O)c1c23 ZINC000586991566 GI Annotated Clean CC1(C)CC(=O)C(c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)C(=O)C1 ZINC000586991664 GI Annotated Anodyne O=C(O)c1cccc2c1Cc1c-2nc2ccc(O)c3c2c1-c1ccccc1C3=O ZINC000586991700 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4ccc(O)c1c24)CCC1(C3)CC(C(=O)O)C1 ZINC000586991844 GI Annotated Anodyne COC(=O)[C@H]1c2ccccc2-c2nc3ccc(O)c4c3c(c21)-c1ccccc1C4=O ZINC000586991924 GI Annotated Anodyne COC(=O)[C@@H]1c2ccccc2-c2nc3ccc(O)c4c3c(c21)-c1ccccc1C4=O ZINC000586991930 GI Annotated Anodyne O=C1c2ccccc2-c2cc(-c3cc4c(cc3O)OCO4)nc3ccc(O)c1c23 ZINC000586992044 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@@H](C)Cc2c1nc1ccc(O)c3c1c2-c1ccccc1C3=O ZINC000586992114 GI Annotated Anodyne CCOC(=O)[C@H]1C[C@@H](C)Cc2c1nc1ccc(O)c3c1c2-c1ccccc1C3=O ZINC000586992115 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C)Cc2c1nc1ccc(O)c3c1c2-c1ccccc1C3=O ZINC000586992117 GI Annotated Anodyne CCOC(=O)[C@H]1C[C@H](C)Cc2c1nc1ccc(O)c3c1c2-c1ccccc1C3=O ZINC000586992119 GI Annotated Anodyne O=C(Cc1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2)OCc1ccccc1 ZINC000586992133 GI Annotated Anodyne Cc1nc2ccc(O)c3c2c(c1Cc1ccc(O)c(O)c1)-c1ccccc1C3=O ZINC000586992258 GI Annotated Clean O=C1c2ccccc2-c2cc(CCc3ccc(O)c(O)c3)nc3ccc(O)c1c23 ZINC000586992313 GI Annotated Clean O=C(O)c1ccc(O)c(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c1 ZINC000586992367 GI Annotated Anodyne Cc1c(-c2c(O)cc(O)cc2O)nc2ccc(O)c3c2c1-c1ccccc1C3=O ZINC000586992417 GI Annotated Anodyne COC(=O)c1coc2c1-c1nc3ccc(O)c4c3c(c1CC2)-c1ccccc1C4=O ZINC000586992438 GI Annotated Anodyne Cc1ccc2c3c(c4c(nc13)[C@@H](Br)C(=O)C4)-c1ccccc1C2=O ZINC000586992611 GI Annotated Reactive Cc1ccc2c3c(c4c(nc13)[C@H](Br)C(=O)C4)-c1ccccc1C2=O ZINC000586992615 GI Annotated Reactive COC(=O)c1ccc(O)c(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c1 ZINC000586992688 GI Annotated Anodyne CCO/C=C(/C(=O)OCC)c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586992694 GI Annotated Anodyne CCO/C=C(\C(=O)OCC)c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586992697 GI Annotated Anodyne O=C(O)c1ccc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c(O)c1 ZINC000586992879 GI Annotated Anodyne CSc1ncc2c(n1)CCc1c-2nc2ccc(O)c3c2c1-c1ccccc1C3=O ZINC000586992907 GI Annotated Anodyne NC(=S)Nc1cccc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)c1 ZINC000586992967 GI Annotated Anodyne Cc1c(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)sc2ncnn12 ZINC000586993102 GI Annotated Anodyne NC(=S)Nc1ccc(-c2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)cc1 ZINC000586993410 GI Annotated Anodyne COc1cc(Cc2cc3c4c(c(O)ccc4n2)C(=O)c2ccccc2-3)ccc1O ZINC000586993533 GI Annotated Anodyne COc1cc(O)cc(O)c1-c1cc2c3c(c(O)ccc3n1)C(=O)c1ccccc1-2 ZINC000586993652 GI Annotated Anodyne CCOC(=O)C(=O)[C@H](Cl)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000586993756 GI Annotated Reactive CCOC(=O)C(=O)[C@@H](Cl)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000586993757 GI Annotated Reactive O=C1c2ccccc2-c2cc(CSc3nncs3)nc3ccc(O)c1c23 ZINC000586994577 GI Annotated Anodyne FC1(F)Oc2cc3nc(CCNc4ccc(Br)cc4)[nH]c3cc2O1 ZINC000586994741 GI Annotated Anodyne FC(F)(F)c1cc2nc(CCNc3ccc(Br)cc3)[nH]c2cn1 ZINC000586994745 GI Annotated Anodyne CC(C)(Oc1ccc(Br)cc1)c1nc2cc3c(cc2[nH]1)OCO3 ZINC000586994963 GI Annotated Anodyne CC(C)(Oc1ccc(Br)cc1)c1nc2ccc(C(=O)O)cc2[nH]1 ZINC000586994995 GI Annotated Anodyne Cc1ccc2c3c(cc(-c4ccc(OCC(N)=O)cc4)nc13)-c1ccccc1C2=O ZINC000586995007 GI Annotated Anodyne CC(C)(Oc1ccc(Br)cc1)c1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000586995117 GI Annotated Anodyne CC(C)(Oc1ccc(Br)cc1)c1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000586995118 GI Annotated Anodyne Brc1ccc(NCCc2nc3c(Br)ccnc3[nH]2)cc1 ZINC000586995194 GI Annotated Anodyne Brc1ccc(NCCc2nc3cc4c(cc3[nH]2)OCCCO4)cc1 ZINC000586995284 GI Annotated Anodyne Brc1ccc(NCCc2nc3ccc(Br)nc3[nH]2)cc1 ZINC000586995318 GI Annotated Anodyne CC(C)(Oc1ccc(Br)cc1)c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000586995587 GI Annotated Anodyne COC(=O)c1ccc2nc(C(C)(C)Oc3ccc(Br)cc3)[nH]c2c1 ZINC000586995594 GI Annotated Anodyne Brc1ccc(NCCc2nc3cncc(Br)c3[nH]2)cc1 ZINC000586995605 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(CCNc3ccc(Br)cc3)[nH]c2cc1F ZINC000586995657 GI Annotated Bother CC(C)(Oc1ccc(Br)cc1)c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000586995865 GI Annotated Anodyne Cc1cc2[nH]c(CCNc3ccc(Br)cc3)nc2cc1[N+](=O)[O-] ZINC000586995983 GI Annotated Bother Cc1ccc2c3c(cc(-c4ccc(O)c(C(N)=O)c4)nc13)-c1ccccc1C2=O ZINC000586996026 GI Annotated Anodyne FC(F)(F)c1cnc2[nH]c(CCNc3ccc(Br)cc3)nc2c1 ZINC000586996068 GI Annotated Anodyne Brc1ccc(NCCc2nc3ccnc(Br)c3[nH]2)cc1 ZINC000586996184 GI Annotated Anodyne Cc1cc(Br)cc2nc([C@H](O)c3ccc(Br)cc3)[nH]c12 ZINC000586996194 GI Annotated Anodyne O[C@H](c1ccc(Br)cc1)c1nc2cccc(OC(F)(F)F)c2[nH]1 ZINC000586996312 GI Annotated Anodyne COc1cc2nc(C[C@@H](N)c3ccc(Br)cc3)[nH]c2cc1Cl ZINC000586996316 GI Annotated Anodyne N#Cc1cc(Cl)c2[nH]c(C[C@@H](N)c3ccc(Br)cc3)nc2c1 ZINC000586996341 GI Annotated Mild N[C@H](Cc1nc2cc(Cl)c(Cl)nc2[nH]1)c1ccc(Br)cc1 ZINC000586996346 GI Annotated Anodyne N#Cc1cc2nc([C@H](O)c3ccc(Br)cc3)[nH]c2cc1C(F)(F)F ZINC000586996486 GI Annotated Mild Cc1cc(Br)c2[nH]c([C@H](O)c3ccc(Br)cc3)nc2c1 ZINC000586996505 GI Annotated Anodyne O[C@H](c1ccc(Br)cc1)c1nc2ccc(Br)cc2[nH]1 ZINC000586996534 GI Annotated Anodyne CCOC(=O)/C(=C/N(C)C)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000586996541 GI Annotated Anodyne N[C@H](Cc1nc2cccc(Br)c2[nH]1)c1ccc(Br)cc1 ZINC000586996543 GI Annotated Anodyne CCOC(=O)/C(=C\N(C)C)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000586996548 GI Annotated Anodyne O[C@H](c1ccc(Br)cc1)c1nc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000586996595 GI Annotated Anodyne CC(C)(Oc1ccc(Br)cc1)c1nc2cc(C#N)c(C#N)cc2[nH]1 ZINC000586996632 GI Annotated Mild Brc1ccc(NCCc2nc3cc(Br)cnc3[nH]2)cc1 ZINC000586996651 GI Annotated Anodyne Cc1ccc2c3c(cc(-c4ccccc4OCC(N)=O)nc13)-c1ccccc1C2=O ZINC000586996880 GI Annotated Anodyne N=c1[nH]ccc2nc(-c3ccccc3OCc3ccc(Br)cc3)[nH]c12 ZINC000586996960 GI Annotated Anodyne CC(=O)c1ccc2nc(/C=C/c3cc4c(cc3Br)OCO4)[nH]c2c1 ZINC000586997086 GI Annotated Anodyne CC(=O)c1ccc2nc(/C=C\c3cc4c(cc3Br)OCO4)[nH]c2c1 ZINC000586997092 GI Annotated Anodyne N[C@H](Cc1nc2c(Cl)cnc(Cl)c2[nH]1)c1ccc(Br)cc1 ZINC000586997191 GI Annotated Anodyne Clc1cc2nc(/C=C/c3cc4c(cc3Br)OCO4)[nH]c2cn1 ZINC000586997202 GI Annotated Anodyne Clc1cc2nc(/C=C\c3cc4c(cc3Br)OCO4)[nH]c2cn1 ZINC000586997210 GI Annotated Anodyne Brc1ccc(COc2ccccc2-c2nc3cncnc3[nH]2)cc1 ZINC000586997357 GI Annotated Anodyne CC(C)(Oc1ccc(Br)cc1)c1nc2c(S)nc(S)nc2[nH]1 ZINC000586997389 GI Annotated Anodyne COC(=O)c1cccc2nc(C(C)(C)Oc3ccc(Br)cc3)[nH]c12 ZINC000586997418 GI Annotated Anodyne Cc1ccc2c3c(cc(CC(=O)Nc4cccnc4)nc13)-c1ccccc1C2=O ZINC000586997593 GI Annotated Anodyne Cc1ccc2c3c(cc(CC(=O)NCc4ccco4)nc13)-c1ccccc1C2=O ZINC000586997636 GI Annotated Anodyne Cc1ccnc(NC(=O)Cc2cc3c4c(ccc(C)c4n2)C(=O)c2ccccc2-3)n1 ZINC000586997653 GI Annotated Anodyne Cc1cc2nc([C@H](O)c3ccc(Br)cc3)[nH]c2cc1Br ZINC000586997711 GI Annotated Anodyne N[C@H](Cc1nc2cc(Cl)c(F)c(F)c2[nH]1)c1ccc(Br)cc1 ZINC000586997755 GI Annotated Anodyne N[C@H](Cc1nc2c(F)c(F)c(F)c(F)c2[nH]1)c1ccc(Br)cc1 ZINC000586997762 GI Annotated Anodyne Cc1c(Br)ccc2nc([C@H](O)c3ccc(Br)cc3)[nH]c12 ZINC000586997775 GI Annotated Anodyne Clc1ccnc2[nH]c(/C=C/c3cc4c(cc3Br)OCO4)nc12 ZINC000586997866 GI Annotated Anodyne Clc1ccnc2[nH]c(/C=C\c3cc4c(cc3Br)OCO4)nc12 ZINC000586997867 GI Annotated Anodyne Oc1ncnc2[nH]c(-c3ccccc3OCc3ccc(Br)cc3)nc12 ZINC000586997913 GI Annotated Anodyne Fc1cnc(Cl)c2[nH]c(/C=C/c3cc4c(cc3Br)OCO4)nc12 ZINC000586997976 GI Annotated Anodyne Fc1cnc(Cl)c2[nH]c(/C=C\c3cc4c(cc3Br)OCO4)nc12 ZINC000586997982 GI Annotated Anodyne Brc1ccc(COc2ccccc2-c2nc3cnncc3[nH]2)cc1 ZINC000586998009 GI Annotated Anodyne O[C@H](c1ccc(Br)cc1)c1nc2cccc(Br)c2[nH]1 ZINC000586998049 GI Annotated Anodyne N[C@H](Cc1nc2ccc(Br)cc2[nH]1)c1ccc(Br)cc1 ZINC000586998129 GI Annotated Anodyne N[C@H](Cc1nc2cc(Cl)nc(Cl)c2[nH]1)c1ccc(Br)cc1 ZINC000586998132 GI Annotated Anodyne Cc1ccc2c(ccc3nc(C[C@@H](N)c4ccc(Br)cc4)[nH]c32)n1 ZINC000586998134 GI Annotated Anodyne N[C@H](Cc1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1)c1ccc(Br)cc1 ZINC000586998147 GI Annotated Bother N[C@H](Cc1nc2c(Cl)c(Cl)cnc2[nH]1)c1ccc(Br)cc1 ZINC000586998169 GI Annotated Anodyne Clc1cnc2[nH]c(/C=C/c3cc4c(cc3Br)OCO4)nc2c1 ZINC000586998413 GI Annotated Anodyne Clc1cnc2[nH]c(/C=C\c3cc4c(cc3Br)OCO4)nc2c1 ZINC000586998414 GI Annotated Anodyne Clc1nccc2nc(/C=C/c3cc4c(cc3Br)OCO4)[nH]c12 ZINC000586998423 GI Annotated Anodyne Clc1nccc2nc(/C=C\c3cc4c(cc3Br)OCO4)[nH]c12 ZINC000586998424 GI Annotated Anodyne Oc1ncnc2[nH]c(/C=C/c3ccc(-c4ccc(Br)cc4)o3)nc12 ZINC000586998558 GI Annotated Anodyne Oc1ncnc2[nH]c(/C=C\c3ccc(-c4ccc(Br)cc4)o3)nc12 ZINC000586998559 GI Annotated Anodyne COc1cc2nc(/C=C\c3cc4c(cc3Br)OCO4)[nH]c2cc1F ZINC000586998604 GI Annotated Anodyne COc1cc2nc(/C=C/c3cc4c(cc3Br)OCO4)[nH]c2cc1F ZINC000586998605 GI Annotated Anodyne Clc1cncc2nc(/C=C/c3cc4c(cc3Br)OCO4)[nH]c12 ZINC000586998640 GI Annotated Anodyne Clc1cncc2nc(/C=C\c3cc4c(cc3Br)OCO4)[nH]c12 ZINC000586998641 GI Annotated Anodyne Brc1cc2c(cc1/C=C/c1nc3cc4cn[nH]c4cc3[nH]1)OCO2 ZINC000586998678 GI Annotated Anodyne N=c1cc2nc(-c3ccccc3OCc3ccc(Br)cc3)[nH]c2c[nH]1 ZINC000586998680 GI Annotated Anodyne Brc1ccc(COc2ccccc2-c2nc3ncc[nH]c-3n2)cc1 ZINC000586998700 GI Annotated Anodyne Nc1ncnc2[nH]c(/C=C/c3ccc(-c4ccc(Br)cc4)o3)nc12 ZINC000586998704 GI Annotated Anodyne Nc1ncnc2[nH]c(/C=C\c3ccc(-c4ccc(Br)cc4)o3)nc12 ZINC000586998705 GI Annotated Anodyne Brc1cc2c(cc1/C=C\c1nc3cc4cn[nH]c4cc3[nH]1)OCO2 ZINC000586998779 GI Annotated Anodyne O=[N+]([O-])c1cccc2nc(/C=C\c3cc4c(cc3Br)OCO4)[nH]c12 ZINC000586998983 GI Annotated Bother O=[N+]([O-])c1cccc2nc(/C=C/c3cc4c(cc3Br)OCO4)[nH]c12 ZINC000586998984 GI Annotated Bother Clc1ccc2nc(/C=C/c3cc4c(cc3Br)OCO4)[nH]c2n1 ZINC000586999199 GI Annotated Anodyne Clc1ccc2nc(/C=C\c3cc4c(cc3Br)OCO4)[nH]c2n1 ZINC000586999200 GI Annotated Anodyne Oc1nncc2nc(/C=C/c3ccc(-c4ccc(Br)cc4)o3)[nH]c12 ZINC000586999334 GI Annotated Anodyne Oc1nncc2nc(/C=C\c3ccc(-c4ccc(Br)cc4)o3)[nH]c12 ZINC000586999335 GI Annotated Anodyne O=[N+]([O-])c1ccc2nc(/C=C/c3cc4c(cc3Br)OCO4)[nH]c2c1 ZINC000586999372 GI Annotated Bother O=[N+]([O-])c1ccc2nc(/C=C\c3cc4c(cc3Br)OCO4)[nH]c2c1 ZINC000586999373 GI Annotated Bother O=c1oc2cc(O)c(Br)cc2cc1-c1nc2c(F)cc(F)cc2[nH]1 ZINC000586999464 GI Annotated Anodyne Cc1ccc2[nH]c(-c3cc4cc(Br)c(O)cc4oc3=O)nc2c1C ZINC000586999468 GI Annotated Anodyne O=c1oc2cc(O)c(Br)cc2cc1-c1nc2cc(Cl)ccc2[nH]1 ZINC000586999474 GI Annotated Anodyne CCc1ccc2[nH]c(-c3cc4cc(Br)c(O)cc4oc3=O)nc2c1 ZINC000586999479 GI Annotated Anodyne O=c1oc2cc(O)c(Br)cc2cc1-c1nc2c(Cl)cccc2[nH]1 ZINC000586999494 GI Annotated Anodyne Cc1cc(F)c2nc(-c3cc4cc(Br)c(O)cc4oc3=O)[nH]c2c1 ZINC000586999519 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Br)ccc12)c1nc2cc(F)cc(F)c2[nH]1 ZINC000586999603 GI Annotated Anodyne Cc1c(F)ccc2nc([C@@H](N)Cc3c[nH]c4cc(Br)ccc34)[nH]c12 ZINC000586999628 GI Annotated Anodyne Brc1cnc(NCc2ccccc2)c(-c2nc3cccnc3[nH]2)c1 ZINC000586999640 GI Annotated Anodyne CCn1cc(Br)c(Cc2nc3ccc(OC(F)(F)F)cc3[nH]2)n1 ZINC000586999649 GI Annotated Anodyne Clc1cncc2nc(/C=C/c3cc(Br)c4c(c3)OCCO4)[nH]c12 ZINC000586999664 GI Annotated Anodyne Clc1cncc2nc(/C=C\c3cc(Br)c4c(c3)OCCO4)[nH]c12 ZINC000586999668 GI Annotated Anodyne CCn1cc(Br)c(Cc2nc3cc(Br)cc(C)c3[nH]2)n1 ZINC000586999717 GI Annotated Anodyne Nc1cc2nc(COc3ccc4ccccc4c3Br)[nH]c2cc1N ZINC000586999811 GI Annotated Anodyne Cc1cc2nc([C@@H](N)Cc3c[nH]c4cc(Br)ccc34)[nH]c2cc1F ZINC000586999830 GI Annotated Anodyne Cc1cc2[nH]c(-c3cc4cc(Br)c(O)cc4oc3=O)nc2cc1F ZINC000586999852 GI Annotated Anodyne CCn1cc(Br)c(Cc2nc3cc(F)cc(C(F)(F)F)c3[nH]2)n1 ZINC000586999854 GI Annotated Anodyne Cc1c(F)ccc2[nH]c(-c3cc4cc(Br)c(O)cc4oc3=O)nc12 ZINC000586999858 GI Annotated Anodyne Clc1nccc2nc(/C=C/c3cc(Br)c4c(c3)OCCO4)[nH]c12 ZINC000586999859 GI Annotated Anodyne Clc1nccc2nc(/C=C\c3cc(Br)c4c(c3)OCCO4)[nH]c12 ZINC000586999861 GI Annotated Anodyne O=c1oc2cc(O)c(Br)cc2cc1-c1nc2c(F)c(F)ccc2[nH]1 ZINC000586999922 GI Annotated Anodyne Brc1cnc(NCc2ccccc2)c(-c2nc3cnccc3[nH]2)c1 ZINC000586999958 GI Annotated Anodyne CCn1cc(Br)c(Cc2nc3cc(Cl)c(F)c(F)c3[nH]2)n1 ZINC000587000014 GI Annotated Anodyne Oc1nccc2nc(-c3cc(Br)cnc3NCc3ccccc3)[nH]c12 ZINC000587000019 GI Annotated Anodyne Clc1c[nH]c2nc(COc3ccc4ccccc4c3Br)nc-2n1 ZINC000587000051 GI Annotated Anodyne COc1cncc2nc(COc3ccc4ccccc4c3Br)[nH]c12 ZINC000587000093 GI Annotated Anodyne O=c1oc2cc(O)c(Br)cc2cc1-c1nc2cc(F)c(F)cc2[nH]1 ZINC000587000134 GI Annotated Anodyne CC(=O)c1ccc2nc([C@@H](N)Cc3c[nH]c4cc(Br)ccc34)[nH]c2c1 ZINC000587000199 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Br)ccc12)c1nc2cc(F)c(F)cc2[nH]1 ZINC000587000253 GI Annotated Anodyne CCn1cc(Br)c(Cc2nc3cc(C)c(Br)cc3[nH]2)n1 ZINC000587000451 GI Annotated Anodyne COc1cc2nc(COc3ccc4ccccc4c3Br)[nH]c2cn1 ZINC000587000541 GI Annotated Anodyne Clc1ccc2nc(/C=C/c3cc(Br)c4c(c3)OCCO4)[nH]c2n1 ZINC000587000553 GI Annotated Anodyne Clc1ccc2nc(/C=C\c3cc(Br)c4c(c3)OCCO4)[nH]c2n1 ZINC000587000555 GI Annotated Anodyne Cc1cc(C)c2nc(-c3cc4cc(Br)c(O)cc4oc3=O)[nH]c2c1 ZINC000587000562 GI Annotated Anodyne Clc1cnc2[nH]c(/C=C/c3cc(Br)c4c(c3)OCCO4)nc2c1 ZINC000587000614 GI Annotated Anodyne Clc1cnc2[nH]c(/C=C\c3cc(Br)c4c(c3)OCCO4)nc2c1 ZINC000587000616 GI Annotated Anodyne Brc1cc(/C=C/c2nc3cc4cn[nH]c4cc3[nH]2)cc2c1OCCO2 ZINC000587000623 GI Annotated Anodyne Brc1cc(/C=C\c2nc3cc4cn[nH]c4cc3[nH]2)cc2c1OCCO2 ZINC000587000625 GI Annotated Anodyne COc1ccc2nc(/C=C\c3cc(Br)c4c(c3)OCCO4)[nH]c2c1 ZINC000587000638 GI Annotated Anodyne COc1ccc2nc(/C=C/c3cc(Br)c4c(c3)OCCO4)[nH]c2c1 ZINC000587000640 GI Annotated Anodyne Fc1ccc2nc(/C=C/c3cc(Br)c4c(c3)OCCO4)[nH]c2c1 ZINC000587000683 GI Annotated Anodyne Fc1ccc2nc(/C=C\c3cc(Br)c4c(c3)OCCO4)[nH]c2c1 ZINC000587000685 GI Annotated Anodyne Cc1ccc(C)c2[nH]c(-c3cc4cc(Br)c(O)cc4oc3=O)nc12 ZINC000587000703 GI Annotated Anodyne CCOc1cc2oc(=O)c(-c3nc4ccccc4[nH]3)cc2cc1Br ZINC000587000726 GI Annotated Anodyne Cc1cc2[nH]c([C@@H](N)Cc3c[nH]c4cc(Br)ccc34)nc2c(C)n1 ZINC000587000886 GI Annotated Anodyne Cc1cc(F)c2[nH]c([C@@H](N)Cc3c[nH]c4cc(Br)ccc34)nc2c1 ZINC000587000973 GI Annotated Anodyne O=[N+]([O-])c1cncc2nc(COc3ccc4ccccc4c3Br)[nH]c12 ZINC000587001049 GI Annotated Bother CC(=O)c1ccc2nc(CCn3ncc4cc(Br)ccc43)[nH]c2c1 ZINC000587001144 GI Annotated Anodyne CCn1cc(Br)c(Cc2nc3cc(C(F)(F)F)c(F)cc3[nH]2)n1 ZINC000587001373 GI Annotated Anodyne Cc1cc2nc(-c3cc4cc(Br)c(O)cc4oc3=O)[nH]c2cc1C ZINC000587001383 GI Annotated Anodyne CCn1cc(Br)c(Cc2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)n1 ZINC000587001387 GI Annotated Mild Clc1ccnc2[nH]c(/C=C/c3cc(Br)c4c(c3)OCCO4)nc12 ZINC000587001415 GI Annotated Anodyne Clc1ccnc2[nH]c(/C=C\c3cc(Br)c4c(c3)OCCO4)nc12 ZINC000587001419 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Br)ccc12)c1nc2ccc(F)c(F)c2[nH]1 ZINC000587001451 GI Annotated Anodyne CCn1cc(Br)c(Cc2nc3cccc(OC(F)(F)F)c3[nH]2)n1 ZINC000587001488 GI Annotated Anodyne Fc1cc(F)c2[nH]c(CCn3ncc4cc(Br)ccc43)nc2c1 ZINC000587001577 GI Annotated Anodyne Clc1cc2nc(/C=C/c3cc(Br)c4c(c3)OCCO4)[nH]c2cn1 ZINC000587001639 GI Annotated Anodyne Clc1cc2nc(/C=C\c3cc(Br)c4c(c3)OCCO4)[nH]c2cn1 ZINC000587001641 GI Annotated Anodyne COc1cccc2nc([C@@H](N)Cc3c[nH]c4cc(Br)ccc34)[nH]c12 ZINC000587001663 GI Annotated Anodyne Brc1ccc2c(cnn2CCc2nc3ccc4ncccc4c3[nH]2)c1 ZINC000587001686 GI Annotated Anodyne Cc1cc2[nH]c(/C=C\c3cc(Br)c4c(c3)OCCO4)nc2c(C)n1 ZINC000587001688 GI Annotated Anodyne Cc1cc2[nH]c(/C=C/c3cc(Br)c4c(c3)OCCO4)nc2c(C)n1 ZINC000587001691 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Br)ccc12)c1nc2ccc(Cl)nc2[nH]1 ZINC000587001738 GI Annotated Anodyne COc1cc2nc(CCn3ncc4cc(Br)ccc43)[nH]c2cc1C ZINC000587001742 GI Annotated Anodyne Fc1cc2nc(CCn3ncc4cc(Br)ccc43)[nH]c2c(F)c1F ZINC000587001779 GI Annotated Anodyne O=C1C[C@@H](Cc2nc3cc(Cl)cnc3[nH]2)c2c(Br)cccc2O1 ZINC000587001914 GI Annotated Anodyne O=C1C[C@H](Cc2nc3cc(Cl)cnc3[nH]2)c2c(Br)cccc2O1 ZINC000587001915 GI Annotated Anodyne O=C1C[C@@H](Cc2nc3ccnc(Cl)c3[nH]2)c2c(Br)cccc2O1 ZINC000587001919 GI Annotated Anodyne O=C1C[C@H](Cc2nc3ccnc(Cl)c3[nH]2)c2c(Br)cccc2O1 ZINC000587001920 GI Annotated Anodyne FC(F)(F)c1cnc2[nH]c(-c3ccnc4[nH]cc(Br)c34)nc2c1 ZINC000587001944 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3ccnc4[nH]cc(Br)c34)[nH]c2cc1Cl ZINC000587001961 GI Annotated Bother COc1ccc2nc(COc3ccc4ccccc4c3Br)[nH]c2n1 ZINC000587002051 GI Annotated Anodyne Clc1ncc2nc(COc3ccc4ccccc4c3Br)nc-2[nH]1 ZINC000587002061 GI Annotated Anodyne CCn1cc(Br)c(Cc2nc3ccc(Br)c(C)c3[nH]2)n1 ZINC000587002143 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Br)ccc12)c1nc2ccnc(Cl)c2[nH]1 ZINC000587002146 GI Annotated Anodyne O=[N+]([O-])c1cnc2[nH]c(COc3ccc4ccccc4c3Br)nc2c1 ZINC000587002183 GI Annotated Bother COc1nccc2nc(COc3ccc4ccccc4c3Br)[nH]c12 ZINC000587002192 GI Annotated Anodyne COc1cccc2nc(/C=C/c3cc(Br)c4c(c3)OCCO4)[nH]c12 ZINC000587002202 GI Annotated Anodyne COc1cccc2nc(/C=C\c3cc(Br)c4c(c3)OCCO4)[nH]c12 ZINC000587002204 GI Annotated Anodyne CCn1cc(Br)c(Cc2nc3cc(C)cc(Br)c3[nH]2)n1 ZINC000587002227 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Br)ccc12)c1nc2cncc(Cl)c2[nH]1 ZINC000587002316 GI Annotated Anodyne COc1cc2nc([C@@H](N)Cc3c[nH]c4cc(Br)ccc34)[nH]c2cc1C ZINC000587002342 GI Annotated Anodyne COc1cc2nc(CCn3ncc4cc(Br)ccc43)[nH]c2cc1F ZINC000587002353 GI Annotated Anodyne Brc1ccc2c(cnn2CCc2nc3cnc4ccccc4c3[nH]2)c1 ZINC000587002382 GI Annotated Anodyne Brc1cnc2[nH]c(-c3ccnc4[nH]cc(Br)c34)nc2c1 ZINC000587002451 GI Annotated Anodyne O=C1C[C@@H](Cc2nc3c(Cl)ccnc3[nH]2)c2c(Br)cccc2O1 ZINC000587002468 GI Annotated Anodyne O=C1C[C@H](Cc2nc3c(Cl)ccnc3[nH]2)c2c(Br)cccc2O1 ZINC000587002469 GI Annotated Anodyne Brc1ccc2nc(-c3ccnc4[nH]cc(Br)c34)[nH]c2n1 ZINC000587002473 GI Annotated Anodyne N#Cc1ccc2nc(/C=C/c3cc(Br)c4c(c3)OCCO4)[nH]c2c1 ZINC000587002543 GI Annotated Mild N#Cc1ccc2nc(/C=C\c3cc(Br)c4c(c3)OCCO4)[nH]c2c1 ZINC000587002544 GI Annotated Mild N#Cc1cccc2nc(/C=C\c3cc(Br)c4c(c3)OCCO4)[nH]c12 ZINC000587002549 GI Annotated Mild N#Cc1cccc2nc(/C=C/c3cc(Br)c4c(c3)OCCO4)[nH]c12 ZINC000587002550 GI Annotated Mild Fc1cnc(Cl)c2[nH]c(CCn3ncc4cc(Br)ccc43)nc12 ZINC000587002703 GI Annotated Anodyne CC(=O)c1ccc2nc(/C=C\c3cc(Br)c4c(c3)OCCO4)[nH]c2c1 ZINC000587002715 GI Annotated Anodyne CC(=O)c1ccc2nc(/C=C/c3cc(Br)c4c(c3)OCCO4)[nH]c2c1 ZINC000587002717 GI Annotated Anodyne Cc1cnc(Cl)c2[nH]c(CCn3ncc4cc(Br)ccc43)nc12 ZINC000587002722 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Br)ccc12)c1nc2cc(Cl)ncc2[nH]1 ZINC000587002746 GI Annotated Anodyne Fc1ccc2nc(CCn3ncc4cc(Br)ccc43)[nH]c2c1F ZINC000587002817 GI Annotated Anodyne Brc1cncc2nc(-c3ccnc4[nH]cc(Br)c34)[nH]c12 ZINC000587002952 GI Annotated Anodyne O=C1C[C@@H](Cc2nc3cc(Cl)ncc3[nH]2)c2c(Br)cccc2O1 ZINC000587002978 GI Annotated Anodyne O=C1C[C@H](Cc2nc3cc(Cl)ncc3[nH]2)c2c(Br)cccc2O1 ZINC000587002982 GI Annotated Anodyne Fc1cccc2nc(/C=C\c3cc(Br)c4c(c3)OCCO4)[nH]c12 ZINC000587002996 GI Annotated Anodyne Fc1cccc2nc(/C=C/c3cc(Br)c4c(c3)OCCO4)[nH]c12 ZINC000587002999 GI Annotated Anodyne CCCn1cnc2cc(-c3nc4cc(OC)ncc4[nH]3)cc(Br)c21 ZINC000587003166 GI Annotated Anodyne Fc1cc2nc(CCn3ncc4cc(Br)ccc43)[nH]c2cc1F ZINC000587003226 GI Annotated Anodyne CCCn1cnc2cc(-c3nc4nc(Cl)c[nH]c-4n3)cc(Br)c21 ZINC000587003263 GI Annotated Anodyne CCCn1cnc2cc(-c3nc4ccc(CCO)cc4[nH]3)cc(Br)c21 ZINC000587003267 GI Annotated Anodyne Cc1cc(F)c2[nH]c(C[C@H]3CC(=O)Oc4cccc(Br)c43)nc2c1 ZINC000587003380 GI Annotated Anodyne Cc1cc(F)c2[nH]c(C[C@@H]3CC(=O)Oc4cccc(Br)c43)nc2c1 ZINC000587003383 GI Annotated Anodyne Cc1cc2nc(C[C@H]3CC(=O)Oc4cccc(Br)c43)[nH]c2cc1F ZINC000587003449 GI Annotated Anodyne Cc1cc2nc(C[C@@H]3CC(=O)Oc4cccc(Br)c43)[nH]c2cc1F ZINC000587003451 GI Annotated Anodyne Fc1c(F)c(F)c2[nH]c(-c3ccnc4[nH]cc(Br)c34)nc2c1F ZINC000587003454 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3ccc(Br)c4cc(C)oc34)[nH]c2n1 ZINC000587003493 GI Annotated Anodyne Brc1nccc2nc(-c3ccnc4[nH]cc(Br)c34)[nH]c12 ZINC000587003531 GI Annotated Anodyne O=C1C[C@@H](Cc2nc3ccc(F)c(F)c3[nH]2)c2c(Br)cccc2O1 ZINC000587003554 GI Annotated Anodyne O=C1C[C@H](Cc2nc3ccc(F)c(F)c3[nH]2)c2c(Br)cccc2O1 ZINC000587003555 GI Annotated Anodyne FC(F)(F)c1cc2nc(-c3ccnc4[nH]cc(Br)c34)[nH]c2cn1 ZINC000587003585 GI Annotated Anodyne CCCn1cnc2cc(-c3nc4ccc(OC)nc4[nH]3)cc(Br)c21 ZINC000587003674 GI Annotated Anodyne O=C1C[C@@H](Cc2nc3cc(F)c(F)cc3[nH]2)c2c(Br)cccc2O1 ZINC000587003723 GI Annotated Anodyne O=C1C[C@H](Cc2nc3cc(F)c(F)cc3[nH]2)c2c(Br)cccc2O1 ZINC000587003727 GI Annotated Anodyne CCCn1cnc2cc(-c3nc4cncc(OC)c4[nH]3)cc(Br)c21 ZINC000587003976 GI Annotated Anodyne Brc1cc2nc(-c3ccnc4[nH]cc(Br)c34)[nH]c2cn1 ZINC000587003980 GI Annotated Anodyne O=C1C[C@@H](Cc2nc3cncc(Cl)c3[nH]2)c2c(Br)cccc2O1 ZINC000587003998 GI Annotated Anodyne O=C1C[C@H](Cc2nc3cncc(Cl)c3[nH]2)c2c(Br)cccc2O1 ZINC000587004002 GI Annotated Anodyne Cc1cc2c(Br)ccc(-c3nc4ccc(-n5cnnn5)cc4[nH]3)c2o1 ZINC000587004038 GI Annotated Anodyne Brc1c[nH]c2nccc(-c3nc4cc5c(cc4[nH]3)OCCCO5)c12 ZINC000587004067 GI Annotated Anodyne O=C1C[C@@H](Cc2nc3cc(F)cc(F)c3[nH]2)c2c(Br)cccc2O1 ZINC000587004272 GI Annotated Anodyne O=C1C[C@H](Cc2nc3cc(F)cc(F)c3[nH]2)c2c(Br)cccc2O1 ZINC000587004274 GI Annotated Anodyne CCCn1cnc2cc(-c3nc4cc5c(cc4[nH]3)OCO5)cc(Br)c21 ZINC000587004288 GI Annotated Anodyne CCCn1cnc2cc(-c3nc4ccnc(OC)c4[nH]3)cc(Br)c21 ZINC000587004336 GI Annotated Anodyne CCCn1cnc2cc(-c3nc4ccc(CO)cc4[nH]3)cc(Br)c21 ZINC000587004438 GI Annotated Anodyne Cc1cc2c(Br)ccc(-c3nc4cc5c(cc4[nH]3)OCC(=O)N5)c2o1 ZINC000587004456 GI Annotated Anodyne O=C1C[C@@H](Cc2nc3ccc(Cl)nc3[nH]2)c2c(Br)cccc2O1 ZINC000587004542 GI Annotated Anodyne O=C1C[C@H](Cc2nc3ccc(Cl)nc3[nH]2)c2c(Br)cccc2O1 ZINC000587004543 GI Annotated Anodyne O=C1C[C@@H](Cc2nc3ccc(F)cc3[nH]2)c2c(Br)cccc2O1 ZINC000587004544 GI Annotated Anodyne O=C1C[C@H](Cc2nc3ccc(F)cc3[nH]2)c2c(Br)cccc2O1 ZINC000587004545 GI Annotated Anodyne O=C1C[C@@H](Cc2nc3cccc(F)c3[nH]2)c2c(Br)cccc2O1 ZINC000587004551 GI Annotated Anodyne O=C1C[C@H](Cc2nc3cccc(F)c3[nH]2)c2c(Br)cccc2O1 ZINC000587004552 GI Annotated Anodyne Cc1c(F)ccc2nc(C[C@H]3CC(=O)Oc4cccc(Br)c43)[nH]c12 ZINC000587004554 GI Annotated Anodyne Cc1c(F)ccc2nc(C[C@@H]3CC(=O)Oc4cccc(Br)c43)[nH]c12 ZINC000587004555 GI Annotated Anodyne CC(=O)c1ccc2nc(C[C@@H]3CC(=O)Oc4cccc(Br)c43)[nH]c2c1 ZINC000587004558 GI Annotated Anodyne CC(=O)c1ccc2nc(C[C@H]3CC(=O)Oc4cccc(Br)c43)[nH]c2c1 ZINC000587004559 GI Annotated Anodyne CCCn1cnc2cc(-c3nc4c(Cl)ncnc4[nH]3)cc(Br)c21 ZINC000587004574 GI Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3ccc(Br)c4cc(C)oc34)nc12 ZINC000587004606 GI Annotated Anodyne Cc1cc2c(Br)ccc(-c3nc4c(S)nc(S)nc4[nH]3)c2o1 ZINC000587004663 GI Annotated Anodyne COC(=O)c1cc2nc(-c3ccc(Br)c4cc(C)oc34)[nH]c2cn1 ZINC000587004685 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Br)ccc12)c1nc2c(Cl)ccnc2[nH]1 ZINC000587004727 GI Annotated Anodyne CCCn1cnc2cc(-c3nc4cccc(C(=O)O)c4[nH]3)cc(Br)c21 ZINC000587004737 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Br)ccc12)c1nc2cc(Cl)cnc2[nH]1 ZINC000587004752 GI Annotated Anodyne Brc1ccnc2[nH]c(-c3ccnc4[nH]cc(Br)c34)nc12 ZINC000587004803 GI Annotated Anodyne Fc1cc2[nH]c(-c3ccnc4[nH]cc(Br)c34)nc2cc1-n1cccn1 ZINC000587004846 GI Annotated Anodyne FC(F)(F)c1cc2nc(-c3nc(Br)ccc3Cl)[nH]c2cn1 ZINC000587004968 GI Annotated Anodyne CCOC(=O)c1ccc2nc(-c3nc(Br)ccc3Cl)[nH]c2c1 ZINC000587004971 GI Annotated Anodyne Clc1ccc(Br)nc1-c1nc2cc(Br)cnc2[nH]1 ZINC000587004972 GI Annotated Anodyne FC1(F)Oc2cc3nc(-c4nc(Br)ccc4Cl)[nH]c3cc2O1 ZINC000587004973 GI Annotated Anodyne Clc1ccc(Br)nc1-c1nc2c(Br)ccnc2[nH]1 ZINC000587004988 GI Annotated Anodyne Clc1ccc(Br)nc1-c1nc2ccnc(Br)c2[nH]1 ZINC000587004993 GI Annotated Anodyne Clc1ccc(Br)nc1-c1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587005001 GI Annotated Anodyne Clc1ccc(Br)nc1-c1nc2cncc(Br)c2[nH]1 ZINC000587005047 GI Annotated Anodyne CC(C)n1c(-c2nc3nccc(N)c3[nH]2)cc(Br)c1Br ZINC000587005079 GI Annotated Anodyne Fc1cc2[nH]c(-c3nc(Br)ccc3Cl)nc2cc1-n1cccn1 ZINC000587005094 GI Annotated Anodyne Clc1ccc(Br)nc1-c1nc2cc(Br)ncc2[nH]1 ZINC000587005095 GI Annotated Anodyne Clc1c(-c2nc3cc(Br)cnc3[nH]2)ccnc1Br ZINC000587005168 GI Annotated Anodyne Clc1cnc(Br)c(-c2nc3ccc(Br)cc3[nH]2)n1 ZINC000587005175 GI Annotated Anodyne FC(F)(F)c1ccc2nc(-c3nc(Cl)cnc3Br)[nH]c2c1 ZINC000587005221 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3nc(Br)ccc3Cl)[nH]c2c1 ZINC000587005268 GI Annotated Anodyne FC(F)(F)c1cnc2[nH]c(-c3nc(Br)ccc3Cl)nc2c1 ZINC000587005352 GI Annotated Anodyne FC(F)(F)Oc1ccc2nc(-c3nc(Cl)cnc3Br)[nH]c2c1 ZINC000587005371 GI Annotated Anodyne Clc1c(-c2nc3ccnc(Br)c3[nH]2)ccnc1Br ZINC000587005397 GI Annotated Anodyne Clc1ccc(Br)nc1-c1nc2ccc(Br)nc2[nH]1 ZINC000587005441 GI Annotated Anodyne FC(F)(F)c1cnc2[nH]c(-c3ccnc(Br)c3Cl)nc2c1 ZINC000587005470 GI Annotated Anodyne FC(F)(F)c1cc2nc(-c3ccnc(Br)c3Cl)[nH]c2cn1 ZINC000587005478 GI Annotated Anodyne Clc1cnc(Br)c(-c2nc3c(Cl)c(Cl)cnc3[nH]2)n1 ZINC000587005563 GI Annotated Anodyne Clc1cnc(Br)c(-c2nc3cccc(Br)c3[nH]2)n1 ZINC000587005603 GI Annotated Anodyne Clc1c(-c2nc3cc(Br)ncc3[nH]2)ccnc1Br ZINC000587005624 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3ccnc(Br)c3Cl)[nH]c2c1 ZINC000587005632 GI Annotated Anodyne FC(F)(F)Oc1cccc2nc(-c3nc(Cl)cnc3Br)[nH]c12 ZINC000587005644 GI Annotated Anodyne Fc1c(Cl)cc2nc(-c3nc(Cl)cnc3Br)[nH]c2c1F ZINC000587005770 GI Annotated Anodyne Clc1c(-c2nc3c(Br)ccnc3[nH]2)ccnc1Br ZINC000587005824 GI Annotated Anodyne FC(F)(F)c1cccc2nc(-c3nc(Cl)cnc3Br)[nH]c12 ZINC000587005838 GI Annotated Anodyne Clc1cnc(Br)c(-c2nc3cc(Cl)nc(Cl)c3[nH]2)n1 ZINC000587005851 GI Annotated Anodyne Clc1c(-c2nc3ccc(Br)nc3[nH]2)ccnc1Br ZINC000587005861 GI Annotated Anodyne Clc1cnc(Br)c(-c2nc3cc(Cl)c(Cl)nc3[nH]2)n1 ZINC000587005871 GI Annotated Anodyne Clc1c(-c2nc3cncc(Br)c3[nH]2)ccnc1Br ZINC000587005898 GI Annotated Anodyne Clc1cnc(Br)c(-c2nc3c(Cl)cnc(Cl)c3[nH]2)n1 ZINC000587005904 GI Annotated Anodyne Fc1cc2[nH]c(-c3ccnc(Br)c3Cl)nc2cc1-n1cccn1 ZINC000587005910 GI Annotated Anodyne Brc1cnc2[nH]c(-c3cc4ccc(Br)cn4c3)nc2c1 ZINC000587005949 GI Annotated Anodyne Brc1ccc2cc(-c3nc4cc(Br)ncc4[nH]3)cn2c1 ZINC000587005954 GI Annotated Anodyne Brc1ccc2cc(-c3nc4ccnc(Br)c4[nH]3)cn2c1 ZINC000587006011 GI Annotated Anodyne O=C1CCc2cc3nc(-c4cc5ccc(Br)cn5c4)[nH]c3cc2N1 ZINC000587006018 GI Annotated Anodyne Fc1c(F)c(F)c2[nH]c(-c3cnn4cccc(Br)c34)nc2c1F ZINC000587006040 GI Annotated Anodyne Clc1cc2nc(-c3cnn4cc(Br)cnc34)[nH]c2cc1Cl ZINC000587006096 GI Annotated Anodyne Brc1ccc2cc(-c3nc4ccc(Br)nc4[nH]3)cn2c1 ZINC000587006122 GI Annotated Anodyne Clc1c(-c2nc3cc4c(cc3[nH]2)OCCCO4)ccnc1Br ZINC000587006240 GI Annotated Anodyne Clc1cc(Cl)c2[nH]c(-c3cnn4cc(Br)cnc34)nc2c1 ZINC000587006245 GI Annotated Anodyne Clc1cc2[nH]c(-c3cccn4c(Br)cnc34)nc2c(Cl)n1 ZINC000587006275 GI Annotated Anodyne Fc1c(F)c(F)c2[nH]c(-c3ccc4[nH]nc(Br)c4c3)nc2c1F ZINC000587006308 GI Annotated Anodyne Brc1cccc2nc(-c3cnn4cccc(Br)c34)[nH]c12 ZINC000587006337 GI Annotated Anodyne CN(C)CCOc1ccc2nc(-c3cc4ccc(Br)cn4c3)[nH]c2c1 ZINC000587006398 GI Annotated Anodyne FC(F)(F)c1cc2nc(-c3cnn4cccc(Br)c34)[nH]c2cn1 ZINC000587006405 GI Annotated Anodyne O=C1c2ccccc2C(=O)c2c1ccc1[nH]c(-c3ccc(Br)o3)nc21 ZINC000587006431 GI Annotated Clean Brc1ccc2cc(-c3nc4cncc(Br)c4[nH]3)cn2c1 ZINC000587006527 GI Annotated Anodyne Brc1ccc2nc(-c3ccc4[nH]nc(Br)c4c3)[nH]c2n1 ZINC000587006568 GI Annotated Anodyne Brc1n[nH]c2ccc(-c3nc4cc5c(cc4[nH]3)OCCCO5)cc12 ZINC000587006574 GI Annotated Anodyne Brc1n[nH]c2ccc(-c3nc4ccnc(Br)c4[nH]3)cc12 ZINC000587006575 GI Annotated Anodyne Clc1cnc2nc(-c3cccn4c(Br)cnc34)[nH]c2c1Cl ZINC000587006577 GI Annotated Anodyne Brc1ccc2nc(-c3cnn4cccc(Br)c34)[nH]c2c1 ZINC000587006684 GI Annotated Anodyne Brc1ccc(-c2nc3c(I)cccc3[nH]2)o1 ZINC000587006693 GI Annotated Anodyne Clc1cc2nc(-c3cnn4cccc(Br)c34)[nH]c2nc1Cl ZINC000587006748 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3cc4ccc(Br)cn4c3)[nH]c2cc1F ZINC000587006757 GI Annotated Bother O=c1c(-c2nc3c(F)cccc3[nH]2)cc(Br)cn1Cc1ccccc1 ZINC000587006776 GI Annotated Anodyne FC(F)(F)c1cnc2[nH]c(-c3cnn4cccc(Br)c34)nc2c1 ZINC000587006788 GI Annotated Anodyne Clc1cnc(Cl)c2[nH]c(-c3cnn4cccc(Br)c34)nc12 ZINC000587006847 GI Annotated Anodyne FC(F)(F)c1ncc2nc(-c3cc4ccc(Br)cn4c3)nc-2[nH]1 ZINC000587006891 GI Annotated Anodyne Brc1ccc2cc(-c3nc4cc5c(cc4[nH]3)OCCCO5)cn2c1 ZINC000587006959 GI Annotated Anodyne Cc1ccc2c(ccc3nc(-c4cnn5cccc(Br)c45)[nH]c32)n1 ZINC000587006976 GI Annotated Anodyne FC(F)(F)c1ccc2nc(-c3cnn4cc(Br)cnc34)[nH]c2c1 ZINC000587006979 GI Annotated Anodyne Clc1cnc2[nH]c(-c3cnn4cccc(Br)c34)nc2c1Cl ZINC000587007009 GI Annotated Anodyne FC(F)(F)c1cccc2nc(-c3cnn4cc(Br)cnc34)[nH]c12 ZINC000587007014 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3cc4ccc(Br)cn4c3)[nH]c2c1 ZINC000587007023 GI Annotated Anodyne COc1cc2[nH]c(-c3cccn4c(Br)cnc34)nc2cc1Cl ZINC000587007042 GI Annotated Anodyne COc1cc2nc(-c3cnn4cccc(Br)c34)[nH]c2cc1Cl ZINC000587007057 GI Annotated Anodyne Brc1cccc2[nH]c(-c3cccn4c(Br)cnc34)nc12 ZINC000587007152 GI Annotated Anodyne Clc1cc2nc(-c3cnn4cccc(Br)c34)[nH]c2c(Cl)n1 ZINC000587007172 GI Annotated Anodyne Brc1cnc2[nH]c(-c3ccc4[nH]nc(Br)c4c3)nc2c1 ZINC000587007177 GI Annotated Anodyne FC(F)(F)c1cnc2[nH]c(-c3ccc4[nH]nc(Br)c4c3)nc2c1 ZINC000587007179 GI Annotated Anodyne Clc1ncc(Cl)c2[nH]c(-c3cccn4c(Br)cnc34)nc12 ZINC000587007194 GI Annotated Anodyne FC(F)(F)c1cc2nc(-c3ccc4[nH]nc(Br)c4c3)[nH]c2cn1 ZINC000587007197 GI Annotated Anodyne Clc1cc2[nH]c(-c3cccn4c(Br)cnc34)nc2nc1Cl ZINC000587007240 GI Annotated Anodyne FC(F)(F)c1cc2[nH]c(-c3cccn4c(Br)cnc34)nc2cn1 ZINC000587007254 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3cnn4cccc(Br)c34)[nH]c2cc1Cl ZINC000587007269 GI Annotated Bother Brc1ccc2cc(-c3nc4c(Br)ccnc4[nH]3)cn2c1 ZINC000587007318 GI Annotated Anodyne O=[N+]([O-])c1cc(Br)cc2[nH]c(-c3ccc(Br)o3)nc12 ZINC000587007338 GI Annotated Bother Cc1ccc2c(ccc3[nH]c(-c4cccn5c(Br)cnc45)nc32)n1 ZINC000587007397 GI Annotated Anodyne O=[N+]([O-])c1c(Br)ccc2[nH]c(-c3ccc(Br)o3)nc12 ZINC000587007693 GI Annotated Bother O=C(Nc1ccc(Cc2nc3cccnc3[nH]2)cc1)c1ccc(Br)o1 ZINC000587007939 GI Annotated Anodyne Clc1c(Br)cnc2nc(-c3ccc(Br)o3)[nH]c12 ZINC000587007941 GI Annotated Anodyne Clc1ncc(Br)c2[nH]c(-c3ccc(Br)o3)nc12 ZINC000587008193 GI Annotated Anodyne Brc1ccc(-c2nc3cc(I)ccc3[nH]2)o1 ZINC000587008392 GI Annotated Anodyne O=[N+]([O-])c1cc2[nH]c(-c3cccn4c(Br)cnc34)nc2cc1Cl ZINC000587008406 GI Annotated Bother Fc1c(F)c(F)c2[nH]c(-c3cccn4c(Br)cnc34)nc2c1F ZINC000587008456 GI Annotated Anodyne Brc1n[nH]c2ccc(-c3nc4cncc(Br)c4[nH]3)cc12 ZINC000587008466 GI Annotated Anodyne FC(F)(F)c1cnc2nc(-c3cccn4c(Br)cnc34)[nH]c2c1 ZINC000587008619 GI Annotated Anodyne Fc1cc2[nH]c(-c3ccc4[nH]nc(Br)c4c3)nc2cc1-n1cccn1 ZINC000587008629 GI Annotated Anodyne CC(C)(NC(=O)CCl)c1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1 ZINC000587009523 GI Annotated Reactive CC(C)(NC(=O)CCl)c1nc2ccc(-c3nc4ccccc4s3)cc2[nH]1 ZINC000587009606 GI Annotated Reactive COC(=O)c1cc(Cl)c2[nH]c(-c3sc(Br)nc3C)nc2c1 ZINC000587010567 GI Annotated Anodyne Cc1nc(Br)sc1-c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587010771 GI Annotated Anodyne N=c1nc(O)c2nc(-c3oc4ccccc4c3CSc3cccs3)[nH]c2[nH]1 ZINC000587010961 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(-c3sc(C4CC4)nc3C)nc2c1 ZINC000587011056 GI Annotated Anodyne Cc1nc(C2CC2)sc1-c1nc2cccc(I)c2[nH]1 ZINC000587011184 GI Annotated Anodyne Cc1nc(Br)sc1-c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587011265 GI Annotated Anodyne COC(=O)c1cc2[nH]c(Cc3sc(-c4ccccc4)nc3C)nc2cc1OC ZINC000587011333 GI Annotated Anodyne N=c1[nH]cc2nc(-c3oc4ccccc4c3CSc3cccs3)nc-2[nH]1 ZINC000587011360 GI Annotated Anodyne Cc1nc(C2CC2)sc1-c1nc2ccc(I)cc2[nH]1 ZINC000587011503 GI Annotated Anodyne Cc1nc(-c2ccc(Cl)cc2)sc1-c1nc2ccc(-n3cnnn3)cc2[nH]1 ZINC000587011576 GI Annotated Anodyne CN(C)C(=O)c1ccc2nc(-c3nc(Br)sc3C3CC3)[nH]c2c1 ZINC000587011602 GI Annotated Anodyne Cc1nc(-c2ccccc2)sc1Cc1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000587011634 GI Annotated Anodyne Brc1nc(-c2nc3cc4c(cc3[nH]2)OCCO4)c(C2CC2)s1 ZINC000587011670 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3sc(-c4ccc(Cl)cc4)nc3C)[nH]c2n1 ZINC000587011677 GI Annotated Anodyne Cc1nc2[nH]c(-c3sc(Br)nc3C)nc2cc1Br ZINC000587011732 GI Annotated Anodyne N#Cc1nc(Cl)cc2nc(-c3nc(Br)sc3C3CC3)[nH]c12 ZINC000587011756 GI Annotated Mild Cc1nc(Br)sc1-c1nc2cc(C#N)cc(Br)c2[nH]1 ZINC000587011759 GI Annotated Mild Cc1nc(Br)sc1-c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587011768 GI Annotated Anodyne COC(=O)c1cccc2nc(-c3nc(Br)sc3C3CC3)[nH]c12 ZINC000587011833 GI Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3sc(-c4ccc(Cl)cc4)nc3C)nc12 ZINC000587012052 GI Annotated Anodyne Cc1nc(-c2ccc(Cl)cc2)sc1-c1nc2c(O)nc(S)nc2[nH]1 ZINC000587012083 GI Annotated Anodyne COc1cc2nc(-c3nc(Br)sc3C3CC3)[nH]c2cc1OC ZINC000587012190 GI Annotated Anodyne Cc1nc(-c2ccccc2)sc1Cc1nc2nc(Br)c[nH]c-2n1 ZINC000587012227 GI Annotated Anodyne Cc1nc(Br)sc1-c1nc2ccc(Br)c(O)c2[nH]1 ZINC000587012353 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3nc(Br)sc3C3CC3)[nH]c2cc1F ZINC000587012377 GI Annotated Bother N[C@H](CCl)c1nc2cc(OCc3ccccc3)c(Br)cc2[nH]1 ZINC000587012391 GI Annotated Reactive O=C1CCc2cc3nc(-c4nc(Br)sc4C4CC4)[nH]c3cc2N1 ZINC000587012446 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(Cc3sc(C)nc3C)nc2c1 ZINC000587012745 GI Annotated Anodyne Brc1nc(-c2nc3cc4c(cc3[nH]2)OCCCO4)c(C2CC2)s1 ZINC000587012835 GI Annotated Anodyne N[C@H](N=O)c1ccc2nc(-c3nc(Br)sc3C3CC3)[nH]c2c1 ZINC000587012847 GI Annotated Anodyne N[C@@H](N=O)c1ccc2nc(-c3nc(Br)sc3C3CC3)[nH]c2c1 ZINC000587012848 GI Annotated Anodyne COC(=O)c1ccc2nc(Cc3sc(-c4ccccc4)nc3C)[nH]c2c1OC ZINC000587012948 GI Annotated Anodyne COc1cc(OC)c2[nH]c(-c3nc(Br)sc3C3CC3)nc2c1 ZINC000587012959 GI Annotated Anodyne Cc1nc(-c2ccccc2)sc1Cc1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587013033 GI Annotated Bother Cc1nc(-c2ccccc2)sc1Cc1nc2ccc(C(=O)N(C)C)cc2[nH]1 ZINC000587013088 GI Annotated Anodyne Cc1nc(C2CC2)sc1-c1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587013130 GI Annotated Anodyne O=C(O)c1cc2nc(-c3nc(Br)sc3C3CC3)[nH]c2cc1F ZINC000587013275 GI Annotated Anodyne FC(F)(F)c1ncc2nc(-c3nc(Br)sc3C3CC3)nc-2[nH]1 ZINC000587013285 GI Annotated Anodyne O=C(O)c1cc(F)cc2nc(-c3nc(Br)sc3C3CC3)[nH]c12 ZINC000587013446 GI Annotated Anodyne Cc1ccc(-c2nc(-c3nc4cc5c(cc4[nH]3)OCC(=O)N5)c(C)s2)cc1 ZINC000587013450 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3nc(Br)sc3C3CC3)[nH]c2c1 ZINC000587013492 GI Annotated Anodyne CCO[C@H](C)c1nc(C)c(-c2nc3c(F)cnc(Br)c3[nH]2)s1 ZINC000587013673 GI Annotated Anodyne CCO[C@@H](C)c1nc(C)c(-c2nc3c(F)cnc(Br)c3[nH]2)s1 ZINC000587013674 GI Annotated Anodyne CCCc1sc(=N)[nH]c1-c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587013705 GI Annotated Anodyne Cc1ccc(-c2nc(-c3nc4nc(Br)c[nH]c-4n3)c(C)s2)cc1 ZINC000587013801 GI Annotated Anodyne CSc1ccc2nc(-c3csc(CNC(=O)OC(C)(C)C)n3)[nH]c2c1 ZINC000587013902 GI Annotated Anodyne COc1cc2nc(-c3csc(CNC(=O)OC(C)(C)C)n3)[nH]c2cc1Cl ZINC000587014066 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3cc(C(F)(F)F)ncc3[nH]2)cs1 ZINC000587014072 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3ccc4ncccc4c3[nH]2)cs1 ZINC000587014095 GI Annotated Anodyne Cc1cnc(Cl)c2[nH]c(-c3csc(CNC(=O)OC(C)(C)C)n3)nc12 ZINC000587014112 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3ccc(C(C)(C)C)nc3[nH]2)cs1 ZINC000587014125 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3cc(C(F)(F)F)cnc3[nH]2)cs1 ZINC000587014497 GI Annotated Anodyne CC(C)Oc1ccc2nc(-c3csc(CNC(=O)OC(C)(C)C)n3)[nH]c2c1 ZINC000587014559 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3cc(F)c(F)c(F)c3[nH]2)cs1 ZINC000587014608 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3cnc4ccccc4c3[nH]2)cs1 ZINC000587014778 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1nc(-c2nc3cc(C#N)cc(Cl)c3[nH]2)cs1 ZINC000587014779 GI Annotated Mild N=c1[nH]c2nc(-c3csc(-c4cccc(Cl)c4Cl)n3)nc-2c(Cl)[nH]1 ZINC000587014790 GI Annotated Anodyne COC(=O)c1cc2nc(-c3sc(-c4ccc(Cl)cc4)nc3C)[nH]c2cn1 ZINC000587014989 GI Annotated Anodyne N#Cc1nc2nc(-c3csc(-c4cc(Cl)cc(Cl)c4)n3)[nH]c2nc1C#N ZINC000587015094 GI Annotated Mild Cc1nc(-c2ccc(Cl)cc2)sc1-c1nc2[nH]c(=N)[nH]c(Cl)c-2n1 ZINC000587015164 GI Annotated Anodyne N#Cc1nc2nc(-c3csc(-c4cccc(Cl)c4Cl)n3)[nH]c2nc1C#N ZINC000587015199 GI Annotated Mild Oc1nc(S)nc2[nH]c(-c3csc(-c4cc(Cl)cc(Cl)c4)n3)nc12 ZINC000587015397 GI Annotated Anodyne Brc1cnc2[nH]c(-c3csc(-c4ccc5c(c4)CCO5)n3)nc2c1 ZINC000587015495 GI Annotated Anodyne N=c1[nH]c2nc(-c3csc(-c4cc(Cl)cc(Cl)c4)n3)nc-2c(Cl)[nH]1 ZINC000587015568 GI Annotated Anodyne CCc1ccc(-c2nc(-c3nc4cc5c(cc4[nH]3)OCC(=O)N5)cs2)cc1 ZINC000587015702 GI Annotated Anodyne O=C1COc2cc3[nH]c(-c4csc(-c5ccc(Cl)cc5)n4)nc3cc2N1 ZINC000587015712 GI Annotated Anodyne Cc1ccc(-c2nc(-c3nc4ccc(CN5CCOCC5)cc4[nH]3)cs2)o1 ZINC000587015727 GI Annotated Anodyne N#Cc1cc(Br)c2[nH]c(-c3csc([C@H]4CCCO4)n3)nc2c1 ZINC000587015805 GI Annotated Mild N#Cc1cc(Br)c2[nH]c(-c3csc([C@@H]4CCCO4)n3)nc2c1 ZINC000587015806 GI Annotated Mild CCc1ccc(-c2nc(-c3nc4nc(Br)c[nH]c-4n3)cs2)cc1 ZINC000587015921 GI Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3csc(-c4cccc(Cl)c4Cl)n3)nc12 ZINC000587015940 GI Annotated Anodyne Sc1nc(S)c2nc(-c3csc(-c4ccc(Cl)cc4)n3)[nH]c2n1 ZINC000587016076 GI Annotated Anodyne Brc1ccc2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)[nH]c2n1 ZINC000587016093 GI Annotated Anodyne O=[N+]([O-])c1c(Br)ccc2nc(-c3csc([C@@H]4CCCO4)n3)[nH]c12 ZINC000587016115 GI Annotated Bother O=[N+]([O-])c1c(Br)ccc2nc(-c3csc([C@H]4CCCO4)n3)[nH]c12 ZINC000587016116 GI Annotated Bother Brc1cc2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)[nH]c2cn1 ZINC000587016210 GI Annotated Anodyne Brc1cncc2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)[nH]c12 ZINC000587016266 GI Annotated Anodyne Brc1ccnc2[nH]c(-c3csc(-c4ccc5c(c4)CCO5)n3)nc12 ZINC000587016306 GI Annotated Anodyne Ic1cccc2nc(-c3csc([C@H]4CCCO4)n3)[nH]c12 ZINC000587016314 GI Annotated Anodyne Ic1cccc2nc(-c3csc([C@@H]4CCCO4)n3)[nH]c12 ZINC000587016315 GI Annotated Anodyne Ic1ccc2nc(-c3csc([C@H]4CCCO4)n3)[nH]c2c1 ZINC000587016337 GI Annotated Anodyne Ic1ccc2nc(-c3csc([C@@H]4CCCO4)n3)[nH]c2c1 ZINC000587016338 GI Annotated Anodyne Clc1c(Br)cnc2[nH]c(-c3csc([C@H]4CCCO4)n3)nc12 ZINC000587016422 GI Annotated Anodyne Clc1c(Br)cnc2[nH]c(-c3csc([C@@H]4CCCO4)n3)nc12 ZINC000587016426 GI Annotated Anodyne O=C(O)c1ccc2nc(-c3csc(=Nc4cccc5ncccc45)[nH]3)[nH]c2c1 ZINC000587016470 GI Annotated Anodyne O=[N+]([O-])c1cc(Br)cc2nc(-c3csc([C@H]4CCCO4)n3)[nH]c12 ZINC000587016523 GI Annotated Bother O=[N+]([O-])c1cc(Br)cc2nc(-c3csc([C@@H]4CCCO4)n3)[nH]c12 ZINC000587016524 GI Annotated Bother Clc1ccc2nc(-c3csc(=Nc4cccc5ncccc45)[nH]3)[nH]c2n1 ZINC000587016582 GI Annotated Anodyne Brc1nccc2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)[nH]c12 ZINC000587016598 GI Annotated Anodyne Cc1c(Br)cnc2[nH]c(Cc3csc(-c4ccco4)n3)nc12 ZINC000587016651 GI Annotated Anodyne O=C(O)c1cc2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)[nH]c2cc1F ZINC000587016714 GI Annotated Anodyne Cc1nc2[nH]c(Cc3csc(-c4ccco4)n3)nc2cc1Br ZINC000587016754 GI Annotated Anodyne Clc1cncc2nc(-c3csc(=Nc4cccc5ncccc45)[nH]3)[nH]c12 ZINC000587016948 GI Annotated Anodyne O=C(O)c1cccc2nc(-c3csc(=Nc4cccc5ncccc45)[nH]3)[nH]c12 ZINC000587016959 GI Annotated Anodyne N#Cc1cc2nc(-c3csc(=Nc4cccc5ncccc45)[nH]3)[nH]c2cc1C#N ZINC000587016964 GI Annotated Mild COc1ccc(-c2nnc(-c3ccc4nc(-c5csc(O)n5)[nH]c4c3)o2)cc1 ZINC000587016984 GI Annotated Anodyne Clc1cc2nc(-c3csc(=Nc4cccc5ncccc45)[nH]3)[nH]c2cn1 ZINC000587017069 GI Annotated Anodyne COc1cc2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)[nH]c2cc1OC ZINC000587017098 GI Annotated Anodyne Oc1nc(-c2nc3cc(OC(F)(F)F)cc(Br)c3[nH]2)cs1 ZINC000587017104 GI Annotated Anodyne O=C(O)c1cc(F)cc2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)[nH]c12 ZINC000587017187 GI Annotated Anodyne O=[N+]([O-])c1ccc2nc(-c3csc(=Nc4cccc5ncccc45)[nH]3)[nH]c2c1 ZINC000587017232 GI Annotated Bother Nc1ccc(-c2ccc3nc(-c4csc([C@H]5CCCO5)n4)[nH]c3c2)cc1N ZINC000587017254 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)[nH]c2cc1F ZINC000587017260 GI Annotated Bother Nc1ccc(-c2ccc3nc(-c4csc([C@@H]5CCCO5)n4)[nH]c3c2)cc1N ZINC000587017261 GI Annotated Anodyne FC(F)(F)c1ncc2nc(-c3csc(-c4ncccc4Cl)n3)nc-2[nH]1 ZINC000587017298 GI Annotated Anodyne Oc1nc(-c2nc3cc(Br)cc(OC(F)(F)F)c3[nH]2)cs1 ZINC000587017304 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)[nH]c2c1 ZINC000587017335 GI Annotated Anodyne CC1=C(c2ccc3nc(-c4csc(-c5ccc(C)o5)n4)[nH]c3c2)NNC(=O)C1 ZINC000587017379 GI Annotated Anodyne Clc1ncc(Br)c2nc(-c3csc([C@H]4CCCO4)n3)[nH]c12 ZINC000587017486 GI Annotated Anodyne Clc1ncc(Br)c2nc(-c3csc([C@@H]4CCCO4)n3)[nH]c12 ZINC000587017489 GI Annotated Anodyne Clc1cnc2[nH]c(-c3csc(=Nc4cccc5ncccc45)[nH]3)nc2c1 ZINC000587017580 GI Annotated Anodyne Oc1nc(-c2nc3cc(OC(F)(F)F)c(Br)cc3[nH]2)cs1 ZINC000587017654 GI Annotated Anodyne COc1cc(OC)c2[nH]c(-c3csc(-c4ccc5c(c4)CCO5)n3)nc2c1 ZINC000587017656 GI Annotated Anodyne Clc1nccc2nc(-c3csc(=Nc4cccc5ncccc45)[nH]3)[nH]c12 ZINC000587017657 GI Annotated Anodyne COC(=O)c1cc2nc(-c3csc(O)n3)[nH]c2c(F)c1Nc1ccccc1 ZINC000587017764 GI Annotated Anodyne O=C1CCc2cc3nc(-c4csc(-c5ncccc5Cl)n4)[nH]c3cc2N1 ZINC000587017811 GI Annotated Anodyne CN(C)C(=O)c1ccc2nc(-c3csc(-c4ncccc4Cl)n3)[nH]c2c1 ZINC000587017843 GI Annotated Anodyne N[C@@H](N=O)c1ccc2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)[nH]c2c1 ZINC000587017907 GI Annotated Anodyne N[C@H](N=O)c1ccc2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)[nH]c2c1 ZINC000587017910 GI Annotated Anodyne FC(F)(F)c1ncc2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)nc-2[nH]1 ZINC000587017927 GI Annotated Anodyne COC(=O)c1cccc2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)[nH]c12 ZINC000587017941 GI Annotated Anodyne N#Cc1nc(Cl)cc2nc(-c3csc(-c4ccc5c(c4)CCO5)n3)[nH]c12 ZINC000587018007 GI Annotated Mild O=[N+]([O-])c1cc2nc(-c3csc(-c4ncccc4Cl)n3)[nH]c2cc1F ZINC000587018031 GI Annotated Bother c1cc(N=c2[nH]c(-c3nc4cc5cn[nH]c5cc4[nH]3)cs2)c2cccnc2c1 ZINC000587018096 GI Annotated Anodyne c1cc2c(cc1-c1nc(-c3nc4cc5c(cc4[nH]3)OCCCO5)cs1)CCO2 ZINC000587018114 GI Annotated Anodyne CN(C)CCOc1ccc2nc(-c3csc(-c4ncccc4Cl)n3)[nH]c2c1 ZINC000587018126 GI Annotated Anodyne O=C1CCc2cc3nc(-c4csc(-c5ccc6c(c5)CCO6)n4)[nH]c3cc2N1 ZINC000587018146 GI Annotated Anodyne Fc1cnc(Br)c2[nH]c(Cc3csc(-c4ccco4)n3)nc12 ZINC000587018163 GI Annotated Anodyne c1cc2c(cc1-c1nc(-c3nc4cc5c(cc4[nH]3)OCCO5)cs1)CCO2 ZINC000587018232 GI Annotated Anodyne FC(F)(F)c1nc(Cl)[nH]c2nc(Cc3csc(-c4ccco4)n3)nc1-2 ZINC000587018288 GI Annotated Anodyne Oc1c(Br)ccc2nc(Cc3csc(-c4ccco4)n3)[nH]c12 ZINC000587018339 GI Annotated Anodyne c1cc(N=c2[nH]c(-c3nc4cc5c(cc4[nH]3)OCO5)cs2)c2cccnc2c1 ZINC000587018392 GI Annotated Anodyne O=[N+]([O-])c1cccc2nc(-c3csc(=Nc4cccc5ncccc45)[nH]3)[nH]c12 ZINC000587018415 GI Annotated Bother Clc1ccnc2[nH]c(-c3csc(=Nc4cccc5ncccc45)[nH]3)nc12 ZINC000587018421 GI Annotated Anodyne Clc1cnc2[nH]c(Cc3csc(-c4ccc5c(c4)OCCO5)n3)nc2c1 ZINC000587018453 GI Annotated Anodyne COc1cccc2nc(Cc3csc(-c4ccc5c(c4)OCCO5)n3)[nH]c12 ZINC000587018542 GI Annotated Anodyne Clc1nccc2nc(Cc3csc(-c4ccc5c(c4)OCCO5)n3)[nH]c12 ZINC000587018694 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1nc(Cc2nc3cc(C(F)(F)F)ncc3[nH]2)cs1 ZINC000587018814 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1nc(Cc2nc3cc(F)c(F)c(F)c3[nH]2)cs1 ZINC000587018841 GI Annotated Anodyne Nc1ccnc2[nH]c(Cc3csc(-c4ccc(Br)s4)n3)nc12 ZINC000587018872 GI Annotated Anodyne O=C(Nc1ccccc1)Nc1nc(Cc2nc3cncc(Cl)c3[nH]2)cs1 ZINC000587018873 GI Annotated Anodyne Clc1cncc2nc(Cc3csc(-c4ccc5c(c4)OCCO5)n3)[nH]c12 ZINC000587018887 GI Annotated Anodyne Cc1ccc(C)c2[nH]c(Cc3csc(NC(=O)c4cccc(O)c4)n3)nc12 ZINC000587018909 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1nc(Cc2nc3c(F)cnc(Cl)c3[nH]2)cs1 ZINC000587019007 GI Annotated Anodyne CSc1ccc2nc(Cc3csc(NC(=O)c4cccc(O)c4)n3)[nH]c2c1 ZINC000587019026 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1nc(Cc2nc3cc(C(F)(F)F)cnc3[nH]2)cs1 ZINC000587019028 GI Annotated Anodyne C=CCc1cccc2nc(Cc3csc(NC(=O)c4cccc(O)c4)n3)[nH]c12 ZINC000587019077 GI Annotated Mild Cc1cc2[nH]c(Cc3csc(NC(=O)Nc4ccccc4)n3)nc2c(C)n1 ZINC000587019116 GI Annotated Anodyne O=C(Nc1ccccc1)Nc1nc(Cc2nc3c(Cl)ccnc3[nH]2)cs1 ZINC000587019133 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1nc(Cc2nc3cc(C#N)cc(Cl)c3[nH]2)cs1 ZINC000587019136 GI Annotated Mild Cc1cc2[nH]c(Cc3csc(NC(=O)c4cccs4)n3)nc2cc1[N+](=O)[O-] ZINC000587019148 GI Annotated Bother CC(C)(C)OC(=O)Nc1nc(Cc2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)cs1 ZINC000587019161 GI Annotated Bother COc1cc2nc(Cc3csc(-c4ccc5c(c4)OCCO5)n3)[nH]c2cc1F ZINC000587019212 GI Annotated Anodyne CCc1ccc2nc(Cc3csc(NC(=O)c4cccc(O)c4)n3)[nH]c2c1 ZINC000587019245 GI Annotated Anodyne O=C(Nc1nc(Cc2nc3cc(F)cc(F)c3[nH]2)cs1)c1cccs1 ZINC000587019250 GI Annotated Anodyne Fc1cc(F)c2[nH]c(Cc3csc(-c4ccc5c(c4)OCCO5)n3)nc2c1 ZINC000587019321 GI Annotated Anodyne N#Cc1cc(Cl)c2[nH]c(Cc3csc(NC(=O)c4cccs4)n3)nc2c1 ZINC000587019341 GI Annotated Mild Cc1cc(C)c2[nH]c(Cc3csc(NC(=O)c4cccc(O)c4)n3)nc2c1 ZINC000587019347 GI Annotated Anodyne O=C(Nc1ccccc1)Nc1nc(Cc2nc3cc4cn[nH]c4cc3[nH]2)cs1 ZINC000587019394 GI Annotated Anodyne O=C(Nc1ccccc1)Nc1nc(Cc2nc3cccc([N+](=O)[O-])c3[nH]2)cs1 ZINC000587019415 GI Annotated Bother O=C(Nc1ccccc1)Nc1nc(Cc2nc3ccc(Cl)nc3[nH]2)cs1 ZINC000587019444 GI Annotated Anodyne Cc1cnc(Cl)c2[nH]c(Cc3csc(NC(=O)OC(C)(C)C)n3)nc12 ZINC000587019452 GI Annotated Anodyne CC(=O)c1ccc2nc(Cc3csc(NC(=O)Nc4ccccc4)n3)[nH]c2c1 ZINC000587019453 GI Annotated Anodyne O=C(Nc1nc(Cc2nc3ccc4ncccc4c3[nH]2)cs1)c1cccs1 ZINC000587019492 GI Annotated Anodyne Oc1nccc2nc(Cc3csc(-c4ccc(Br)s4)n3)[nH]c12 ZINC000587019498 GI Annotated Anodyne Cc1cnc(Cl)c2[nH]c(Cc3csc(NC(=O)c4cccs4)n3)nc12 ZINC000587019512 GI Annotated Anodyne Brc1ccc(-c2nc(Cc3nc4cnccc4[nH]3)cs2)s1 ZINC000587019521 GI Annotated Anodyne COc1cc2nc(Cc3csc(NC(=O)Nc4ccccc4)n3)[nH]c2cc1F ZINC000587019566 GI Annotated Anodyne COc1cc2nc(Cc3csc(NC(=O)c4cccs4)n3)[nH]c2cc1C ZINC000587019568 GI Annotated Anodyne O=C(Nc1ccccc1)Nc1nc(Cc2nc3cc(Cl)cnc3[nH]2)cs1 ZINC000587019626 GI Annotated Anodyne O=C(Nc1nc(Cc2nc3cnc4ccccc4c3[nH]2)cs1)c1cccs1 ZINC000587019653 GI Annotated Anodyne O=C(Nc1ccccc1)Nc1nc(Cc2nc3ccnc(Cl)c3[nH]2)cs1 ZINC000587019669 GI Annotated Anodyne Cc1cc2nc(Cc3csc(NC(=O)c4cccc(O)c4)n3)[nH]c2cc1F ZINC000587019814 GI Annotated Anodyne COc1cc2nc(Cc3csc(NC(=O)OC(C)(C)C)n3)[nH]c2cc1F ZINC000587019815 GI Annotated Anodyne Brc1ccc(-c2nc(Cc3nc4cccnc4[nH]3)cs2)s1 ZINC000587019839 GI Annotated Anodyne O=C(Nc1nc(Cc2nc3c(F)cnc(Cl)c3[nH]2)cs1)c1cccs1 ZINC000587019845 GI Annotated Anodyne O=C(Nc1nc(Cc2nc3cc(F)c(F)c(F)c3[nH]2)cs1)c1cccs1 ZINC000587019919 GI Annotated Anodyne Cc1ccc2nc(Cc3csc(NC(=O)c4cccc(O)c4)n3)[nH]c2c1C ZINC000587019925 GI Annotated Anodyne O=C(Nc1nc(Cc2nc3ccc(F)c(F)c3[nH]2)cs1)c1cccs1 ZINC000587019954 GI Annotated Anodyne Cc1cc(F)c2[nH]c(Cc3csc(NC(=O)c4cccc(O)c4)n3)nc2c1 ZINC000587019965 GI Annotated Anodyne Cc1nc(COc2cccc(-c3nc4cc(C(=O)O)c(F)cc4[nH]3)c2)cs1 ZINC000587020002 GI Annotated Anodyne Cc1csc(SCc2ccc(-c3nc4nc(=N)[nH]c(Cl)c4[nH]3)cc2)n1 ZINC000587020009 GI Annotated Anodyne O=C(Nc1nc(Cc2nc3cccc(Cl)c3[nH]2)cs1)c1cccc(O)c1 ZINC000587020106 GI Annotated Anodyne Cc1nc(COc2cccc(-c3nc4cc5c(cc4[nH]3)OCCO5)c2)cs1 ZINC000587020174 GI Annotated Anodyne Cc1nc(COc2cccc(-c3nc4cc(Cl)nc(C#N)c4[nH]3)c2)cs1 ZINC000587020258 GI Annotated Mild Cc1nc(COc2cccc(-c3nc4cnc(C(F)(F)F)[nH]c-4n3)c2)cs1 ZINC000587020285 GI Annotated Anodyne Cc1nc(COc2cccc(-c3nc4ccc([C@H](N)N=O)cc4[nH]3)c2)cs1 ZINC000587020309 GI Annotated Anodyne Cc1nc(COc2cccc(-c3nc4ccc([C@@H](N)N=O)cc4[nH]3)c2)cs1 ZINC000587020310 GI Annotated Anodyne Cc1nc(COc2cccc(-c3nc4cc(F)cc(C(=O)O)c4[nH]3)c2)cs1 ZINC000587020334 GI Annotated Anodyne Cc1nc(COc2cccc(-c3nc4ccc(C(=O)N(C)C)cc4[nH]3)c2)cs1 ZINC000587020377 GI Annotated Anodyne Cc1nc(COc2cccc(-c3nc4cc5c(cc4[nH]3)NC(=O)CC5)c2)cs1 ZINC000587020378 GI Annotated Anodyne Cc1nc(COc2cccc(-c3nc4cc5nc(O)[nH]c5cc4[nH]3)c2)cs1 ZINC000587020391 GI Annotated Anodyne N=c1[nH]c(-c2cccc(-c3nc4ccc(Br)c(O)c4[nH]3)c2)cs1 ZINC000587020464 GI Annotated Anodyne COC(=O)c1ccc2[nH]c(-c3ccc(CSc4nc(C)cs4)cc3)nc2n1 ZINC000587020530 GI Annotated Anodyne COC(=O)c1cccc2nc(-c3cccc(OCc4csc(C)n4)c3)[nH]c12 ZINC000587020532 GI Annotated Anodyne Cc1nc(-c2c[nH]cc2-c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)cs1 ZINC000587020734 GI Annotated Anodyne Cc1cc2[nH]c(Cc3csc(NC(=O)OC(C)(C)C)n3)nc2cc1[N+](=O)[O-] ZINC000587020803 GI Annotated Bother Cn1cc(-c2ncc(-c3nc4cc(Br)c(F)c(F)c4[nH]3)s2)cn1 ZINC000587020914 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(-c3cnc(Cl)s3)nc2c1 ZINC000587020948 GI Annotated Anodyne COC(=O)c1cc2[nH]c(-c3cnc(Cc4ccccc4)s3)nc2cc1OC ZINC000587020960 GI Annotated Anodyne Cc1nc(-c2c[nH]cc2-c2nc3c(F)cnc(Br)c3[nH]2)cs1 ZINC000587020977 GI Annotated Anodyne Cc1csc(SCc2ccc(-c3nc4c(O)nc(S)nc4[nH]3)cc2)n1 ZINC000587021078 GI Annotated Anodyne N=c1[nH]c(-c2cccc(-c3nc4[nH]c(Cl)nc(C(F)(F)F)c-4n3)c2)cs1 ZINC000587021233 GI Annotated Anodyne N#Cc1cc(Br)c2[nH]c(-c3cccc(-c4csc(=N)[nH]4)c3)nc2c1 ZINC000587021260 GI Annotated Mild Cc1nc2[nH]c(-c3cccc(-c4csc(=N)[nH]4)c3)nc2cc1Br ZINC000587021273 GI Annotated Anodyne CC(C)Oc1cc2nc(-c3cnc([C@@H](C)O)s3)[nH]c2cc1Br ZINC000587021318 GI Annotated Anodyne CC(C)Oc1cc2nc(-c3cnc([C@H](C)O)s3)[nH]c2cc1Br ZINC000587021321 GI Annotated Anodyne Cn1cc(-c2ncc(-c3nc4ccc(Oc5ccc(N)cc5)cc4[nH]3)s2)cn1 ZINC000587021331 GI Annotated Clean O=[N+]([O-])c1cc2nc(-c3cnc(Cc4ccccc4)s3)[nH]c2cc1[N+](=O)[O-] ZINC000587021332 GI Annotated Bother c1ccc(Cc2ncc(-c3nc4ccc(CN5CCOCC5)cc4[nH]3)s2)cc1 ZINC000587021338 GI Annotated Anodyne Fc1cnc2[nH]c(-c3cccc(N=c4[nH]c(-c5ccccn5)cs4)c3)nc2c1 ZINC000587021384 GI Annotated Anodyne OCc1ccc2nc(-c3cccc(N=c4[nH]c(-c5ccccn5)cs4)c3)[nH]c2c1 ZINC000587021390 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(-c3cccc(-c4csc(=N)[nH]4)c3)nc2c1 ZINC000587021419 GI Annotated Anodyne N#Cc1ncc(-c2nc3cc(OC(F)(F)F)cc(Br)c3[nH]2)s1 ZINC000587021447 GI Annotated Mild CCOC(=O)Cc1ccc2nc(-c3cnc(Cc4ccccc4)s3)[nH]c2c1 ZINC000587021497 GI Annotated Anodyne Cn1cc(-c2ncc(-c3nc4ccc(C(=O)c5ccccc5)cc4[nH]3)s2)cn1 ZINC000587021507 GI Annotated Anodyne N=c1[nH]c(-c2cccc(-c3nc4cc(-n5cccn5)c(F)cc4[nH]3)c2)cs1 ZINC000587021550 GI Annotated Anodyne N#Cc1ncc(-c2nc3cc(Br)c(Br)cc3[nH]2)s1 ZINC000587021789 GI Annotated Mild Cn1cc(-c2ncc(-c3nc4c5cccnc5c5ncccc5c4[nH]3)s2)cn1 ZINC000587021849 GI Annotated Bother N#Cc1ncc(-c2nc3c(Br)ccc(Br)c3[nH]2)s1 ZINC000587021859 GI Annotated Mild Cc1nc(-c2c[nH]cc2-c2nc3ccc(Br)c(O)c3[nH]2)cs1 ZINC000587021883 GI Annotated Anodyne N=c1[nH]c(-c2cccc(-c3nc4c(F)cnc(Br)c4[nH]3)c2)cs1 ZINC000587022010 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cnc(Cc4ccccc4)s3)[nH]c2c1OC ZINC000587022112 GI Annotated Anodyne CC(C)COc1cc2nc(-c3cnc(C#N)s3)[nH]c2cc1Br ZINC000587022243 GI Annotated Mild N#Cc1ncc(-c2nc3cc(Br)cc(OC(F)(F)F)c3[nH]2)s1 ZINC000587022261 GI Annotated Mild CCCCOc1cc2nc(-c3cnc(C#N)s3)[nH]c2cc1Br ZINC000587022271 GI Annotated Mild Oc1nccc2nc(-c3cccc(N=c4[nH]c(-c5ccccn5)cs4)c3)[nH]c12 ZINC000587022327 GI Annotated Anodyne Cc1c(Br)cc2nc(-c3cnc(-c4cnn(C)c4)s3)[nH]c2c1C ZINC000587022411 GI Annotated Anodyne Cn1cc(-c2ncc(-c3nc4cc5nc6ccccc6nc5cc4[nH]3)s2)cn1 ZINC000587022506 GI Annotated Bother CCCOc1cc2nc(-c3cnc([C@@H](C)O)s3)[nH]c2cc1Br ZINC000587022662 GI Annotated Anodyne CCCOc1cc2nc(-c3cnc([C@H](C)O)s3)[nH]c2cc1Br ZINC000587022663 GI Annotated Anodyne N#Cc1ncc(-c2nc3cc(OC(F)(F)F)c(Br)cc3[nH]2)s1 ZINC000587022709 GI Annotated Mild COC(=O)c1cc2nc(-c3cnc(C#N)s3)[nH]c2c(F)c1Nc1ccccc1 ZINC000587022812 GI Annotated Mild CC(C)(C)OC(=O)Nc1cnc(-c2nc3cnc(Br)cc3[nH]2)s1 ZINC000587022856 GI Annotated Anodyne COc1cc(OC)c2nc(-c3ncc(NC(=O)OC(C)(C)C)s3)[nH]c2c1 ZINC000587022863 GI Annotated Anodyne Cc1cc2nc(-c3ncc(NC(=O)OC(C)(C)C)s3)[nH]c2cc1[N+](=O)[O-] ZINC000587022877 GI Annotated Bother CC(C)(C)OC(=O)Nc1cnc(-c2nc3ncc(C(F)(F)F)cc3[nH]2)s1 ZINC000587022881 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cnc(-c2nc3cc4c(cc3[nH]2)OCCCO4)s1 ZINC000587023063 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cnc(-c2nc3nc(Br)ccc3[nH]2)s1 ZINC000587023067 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cnc(-c2nc3ncc(Br)cc3[nH]2)s1 ZINC000587023270 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cnc(-c2nc3nccc(Br)c3[nH]2)s1 ZINC000587023367 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cnc(-c2nc3cnc(C(F)(F)F)cc3[nH]2)s1 ZINC000587023435 GI Annotated Anodyne CC(C)(C)OC(=O)N=c1[nH]nc(Cc2nc3ccc(C(C)(C)C)cc3[nH]2)s1 ZINC000587023459 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cnc(-c2nc3c(Br)cncc3[nH]2)s1 ZINC000587023594 GI Annotated Anodyne COc1cc2nc(-c3ncc(NC(=O)OC(C)(C)C)s3)[nH]c2cc1OC ZINC000587023620 GI Annotated Anodyne Clc1ncc(-c2nc3c(Br)cnc(Br)c3[nH]2)s1 ZINC000587023864 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cnc(-c2nc3c(Br)nccc3[nH]2)s1 ZINC000587023883 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cnc(-c2nc3cc(F)c([N+](=O)[O-])cc3[nH]2)s1 ZINC000587023897 GI Annotated Bother Cc1c(Cl)ccc2nc(CCC(=O)Nc3nnc(-c4ccncc4)s3)[nH]c12 ZINC000587024120 GI Annotated Anodyne CC1=C(c2ccc3[nH]c(-c4ccc(-c5nccs5)s4)nc3c2)NNC(=O)C1 ZINC000587024165 GI Annotated Anodyne Cc1cc2nc(CCC(=O)Nc3nnc(-c4ccncc4)s3)[nH]c2cc1Cl ZINC000587024250 GI Annotated Anodyne CC(C)(C)OC(=O)N=c1[nH]nc(Cc2nc3cccc(C(C)(C)C)c3[nH]2)s1 ZINC000587024288 GI Annotated Anodyne Cc1cc(Cl)cc2nc(CCC(=O)Nc3nnc(-c4ccncc4)s3)[nH]c12 ZINC000587024402 GI Annotated Anodyne N[C@@H](c1ccsc1)c1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000587024639 GI Annotated Anodyne N[C@H](c1ccsc1)c1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000587024640 GI Annotated Anodyne N[C@H](c1ccsc1)c1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000587024657 GI Annotated Anodyne N[C@@H](c1ccsc1)c1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000587024658 GI Annotated Anodyne Sc1nnc(SCc2nc3c4cccnc4c4ncccc4c3[nH]2)s1 ZINC000587024880 GI Annotated Bother Fc1c(Br)cc2nc(CSc3nnc(S)s3)[nH]c2c1F ZINC000587024966 GI Annotated Anodyne N[C@@H](c1ccsc1)c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587024988 GI Annotated Anodyne N[C@H](c1ccsc1)c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587024991 GI Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc([C@H](N)c4ccsc4)[nH]c3c2)cc1 ZINC000587025019 GI Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc([C@@H](N)c4ccsc4)[nH]c3c2)cc1 ZINC000587025020 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cccc(O)c3[nH]2)C[C@H]2CCCC[C@H]21 ZINC000587025152 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cccc(O)c3[nH]2)C[C@H]2CCCC[C@@H]21 ZINC000587025153 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cccc(O)c3[nH]2)C[C@@H]2CCCC[C@H]21 ZINC000587025154 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cccc(O)c3[nH]2)C[C@@H]2CCCC[C@@H]21 ZINC000587025155 GI Annotated Anodyne N[C@@H](c1ccsc1)c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587025212 GI Annotated Anodyne N[C@H](c1ccsc1)c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587025214 GI Annotated Anodyne Sc1nnc(SCc2nc3cc(Cl)cc(Br)c3[nH]2)s1 ZINC000587025228 GI Annotated Anodyne N[C@@H](c1ccsc1)c1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000587025230 GI Annotated Anodyne N[C@H](c1ccsc1)c1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000587025232 GI Annotated Anodyne Cc1c(Br)cc2nc(CSc3nnc(S)s3)[nH]c2c1C ZINC000587025289 GI Annotated Anodyne Nc1ccc(Oc2ccc3nc(CSc4nnc(S)s4)[nH]c3c2)cc1 ZINC000587025459 GI Annotated Clean O=C(c1ccccc1)c1ccc2nc(CSc3nnc(S)s3)[nH]c2c1 ZINC000587025536 GI Annotated Anodyne CC(C)COc1cc2nc([C@@H](N)c3ccsc3)[nH]c2cc1Br ZINC000587025634 GI Annotated Anodyne CC(C)COc1cc2nc([C@H](N)c3ccsc3)[nH]c2cc1Br ZINC000587025636 GI Annotated Anodyne COC(=O)c1cc2nc([C@@H](N)c3ccsc3)[nH]c2c(F)c1Nc1ccccc1 ZINC000587025644 GI Annotated Anodyne COC(=O)c1cc2nc([C@H](N)c3ccsc3)[nH]c2c(F)c1Nc1ccccc1 ZINC000587025649 GI Annotated Anodyne N[C@H](c1ccsc1)c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587025744 GI Annotated Anodyne N[C@@H](c1ccsc1)c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587025745 GI Annotated Anodyne N[C@@H](c1ccsc1)c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587025774 GI Annotated Anodyne N[C@H](c1ccsc1)c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587025776 GI Annotated Anodyne Sc1nnc(SCc2nc3cc(Br)cc(Cl)c3[nH]2)s1 ZINC000587025808 GI Annotated Anodyne Clc1ncc(I)c2nc(/C=C/c3ccsc3)[nH]c12 ZINC000587025839 GI Annotated Anodyne Clc1ncc(I)c2nc(/C=C\c3ccsc3)[nH]c12 ZINC000587025840 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3ccc(O)cc3[nH]2)C[C@H]2CCCC[C@@H]21 ZINC000587025851 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3ccc(O)cc3[nH]2)C[C@@H]2CCCC[C@@H]21 ZINC000587025852 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3ccc(O)cc3[nH]2)C[C@@H]2CCCC[C@H]21 ZINC000587025854 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3ccc(O)cc3[nH]2)C[C@H]2CCCC[C@H]21 ZINC000587025857 GI Annotated Anodyne N[C@H](c1ccsc1)c1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587025928 GI Annotated Anodyne N[C@@H](c1ccsc1)c1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587025929 GI Annotated Anodyne COc1cncc2nc([C@@H]3C[C@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)[nH]c12 ZINC000587025959 GI Annotated Anodyne COc1cncc2nc([C@@H]3C[C@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)[nH]c12 ZINC000587025960 GI Annotated Anodyne COc1cncc2nc([C@@H]3C[C@@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)[nH]c12 ZINC000587025961 GI Annotated Anodyne COc1cncc2nc([C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)[nH]c12 ZINC000587025962 GI Annotated Anodyne Cc1oc(-c2ccsc2)nc1Cc1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587026116 GI Annotated Anodyne COc1cc2nc([C@@H]3C[C@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)[nH]c2cn1 ZINC000587026165 GI Annotated Anodyne COc1cc2nc([C@@H]3C[C@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)[nH]c2cn1 ZINC000587026167 GI Annotated Anodyne COc1cc2nc([C@@H]3C[C@@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)[nH]c2cn1 ZINC000587026169 GI Annotated Anodyne COc1cc2nc([C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)[nH]c2cn1 ZINC000587026170 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc(CSCc3ccsc3)nc-2[nH]1 ZINC000587026319 GI Annotated Anodyne FC(F)(F)C(F)(F)c1cc2nc(CSc3nnc(S)s3)[nH]c2cn1 ZINC000587026437 GI Annotated Anodyne N[C@H](c1ccsc1)c1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587026458 GI Annotated Anodyne N[C@@H](c1ccsc1)c1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587026459 GI Annotated Anodyne Sc1nnc(SCc2nc3cc4nc5ccccc5nc4cc3[nH]2)s1 ZINC000587026473 GI Annotated Bother Ic1cnc2[nH]c(CSCc3ccsc3)nc2c1 ZINC000587026651 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3ccc(CO)cc3[nH]2)C[C@H]2CCCC[C@H]21 ZINC000587026731 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3ccc(CO)cc3[nH]2)C[C@@H]2CCCC[C@H]21 ZINC000587026733 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3ccc(CO)cc3[nH]2)C[C@H]2CCCC[C@@H]21 ZINC000587026734 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3ccc(CO)cc3[nH]2)C[C@@H]2CCCC[C@@H]21 ZINC000587026735 GI Annotated Anodyne Cc1oc(-c2ccsc2)nc1Cc1nc2cc(Br)ncc2[nH]1 ZINC000587026776 GI Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(-c3cccc(-c4ccsc4)c3)[nH]c12 ZINC000587026777 GI Annotated Anodyne Cc1oc(-c2ccsc2)nc1Cc1nc2cncc(Br)c2[nH]1 ZINC000587026782 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(CCc3scnc3C)nc2c1 ZINC000587026806 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cc(F)cnc3[nH]2)C[C@H]2CCCC[C@@H]21 ZINC000587026893 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cc(F)cnc3[nH]2)C[C@@H]2CCCC[C@@H]21 ZINC000587026894 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cc(F)cnc3[nH]2)C[C@@H]2CCCC[C@H]21 ZINC000587026895 GI Annotated Anodyne O=C(Cc1ccsc1)N1[C@H](c2nc3cc(F)cnc3[nH]2)C[C@H]2CCCC[C@H]21 ZINC000587026896 GI Annotated Anodyne O=S(=O)(c1ccc2nc(CSCc3ccsc3)[nH]c2c1)C(F)(F)F ZINC000587026897 GI Annotated Anodyne Cc1oc(-c2ccsc2)nc1Cc1nc2ccc(Br)nc2[nH]1 ZINC000587026921 GI Annotated Anodyne Cc1cncc2nc([C@@H]3C[C@@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)[nH]c12 ZINC000587026930 GI Annotated Anodyne Cc1oc(-c2ccsc2)nc1Cc1nc2c(F)cnc(Br)c2[nH]1 ZINC000587026932 GI Annotated Anodyne Cc1cncc2nc([C@@H]3C[C@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)[nH]c12 ZINC000587026938 GI Annotated Anodyne Cc1cncc2nc([C@@H]3C[C@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)[nH]c12 ZINC000587026939 GI Annotated Anodyne Cc1cncc2nc([C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)[nH]c12 ZINC000587026940 GI Annotated Anodyne Cc1cnc2[nH]c([C@@H]3C[C@@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)nc2c1 ZINC000587026942 GI Annotated Anodyne Cc1cnc2[nH]c([C@@H]3C[C@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)nc2c1 ZINC000587026943 GI Annotated Anodyne Cc1cnc2[nH]c([C@@H]3C[C@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)nc2c1 ZINC000587026944 GI Annotated Anodyne Cc1cnc2[nH]c([C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)nc2c1 ZINC000587026946 GI Annotated Anodyne Cc1oc(-c2ccsc2)nc1Cc1nc2c(Br)ccnc2[nH]1 ZINC000587027180 GI Annotated Anodyne Cc1oc(-c2ccsc2)nc1Cc1nc2ccnc(Br)c2[nH]1 ZINC000587027190 GI Annotated Anodyne Cc1oc(-c2ccsc2)nc1Cc1nc2cc(Br)cnc2[nH]1 ZINC000587027216 GI Annotated Anodyne CC(C)COc1cc2nc([C@H](N)Cc3cscn3)[nH]c2cc1Br ZINC000587027381 GI Annotated Anodyne Cc1ccnc2[nH]c([C@@H]3C[C@@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)nc12 ZINC000587027538 GI Annotated Anodyne Cc1ccnc2[nH]c([C@@H]3C[C@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)nc12 ZINC000587027539 GI Annotated Anodyne Cc1ccnc2[nH]c([C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)nc12 ZINC000587027541 GI Annotated Anodyne Cc1ccnc2[nH]c([C@@H]3C[C@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)nc12 ZINC000587027543 GI Annotated Anodyne Cc1ncsc1-c1c[nH]cc1-c1nc2ccc(Br)c(O)c2[nH]1 ZINC000587027708 GI Annotated Anodyne CCCCOc1cc2nc([C@H](N)Cc3cscn3)[nH]c2cc1Br ZINC000587027840 GI Annotated Anodyne COc1nccc2nc([C@@H]3C[C@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)[nH]c12 ZINC000587027859 GI Annotated Anodyne COc1nccc2nc([C@@H]3C[C@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)[nH]c12 ZINC000587027861 GI Annotated Anodyne COc1nccc2nc([C@@H]3C[C@@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)[nH]c12 ZINC000587027863 GI Annotated Anodyne COc1nccc2nc([C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)[nH]c12 ZINC000587027865 GI Annotated Anodyne Cc1ccc2nc([C@@H]3C[C@@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)[nH]c2n1 ZINC000587027929 GI Annotated Anodyne Cc1ccc2nc([C@@H]3C[C@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)[nH]c2n1 ZINC000587027930 GI Annotated Anodyne Cc1ccc2nc([C@@H]3C[C@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)[nH]c2n1 ZINC000587027931 GI Annotated Anodyne Cc1ccc2nc([C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)[nH]c2n1 ZINC000587027932 GI Annotated Anodyne Cc1nccc2[nH]c([C@@H]3C[C@@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)nc12 ZINC000587028207 GI Annotated Anodyne Cc1nccc2[nH]c([C@@H]3C[C@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)nc12 ZINC000587028208 GI Annotated Anodyne Cc1nccc2[nH]c([C@@H]3C[C@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)nc12 ZINC000587028209 GI Annotated Anodyne Cc1nccc2[nH]c([C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)nc12 ZINC000587028212 GI Annotated Anodyne O=C(NCc1nc2ccc(-c3nc4ccccc4s3)cc2[nH]1)c1cscn1 ZINC000587028265 GI Annotated Anodyne Cc1ncsc1-c1c[nH]cc1-c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587028309 GI Annotated Anodyne CC1=C(c2ccc3nc(-c4ncsc4-c4ccccc4)[nH]c3c2)NNC(=O)C1 ZINC000587028320 GI Annotated Anodyne c1ccc(-c2scnc2-c2nc3ccc(CN4CCOCC4)cc3[nH]2)cc1 ZINC000587028338 GI Annotated Anodyne COc1ccc2nc([C@@H]3C[C@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)[nH]c2n1 ZINC000587028389 GI Annotated Anodyne COc1ccc2nc([C@@H]3C[C@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)[nH]c2n1 ZINC000587028390 GI Annotated Anodyne COc1ccc2nc([C@@H]3C[C@@H]4CCCC[C@H]4N3C(=O)Cc3ccsc3)[nH]c2n1 ZINC000587028391 GI Annotated Anodyne COc1ccc2nc([C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)Cc3ccsc3)[nH]c2n1 ZINC000587028392 GI Annotated Anodyne Cc1ncsc1-c1c[nH]cc1-c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587028785 GI Annotated Anodyne N[C@H](Cc1cscn1)c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587028872 GI Annotated Anodyne N[C@H](Cc1cscn1)c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587028941 GI Annotated Anodyne COc1cc2[nH]c(-c3sc4c(c3C)C(=O)N3CCC=C3N4)nc2cc1Cl ZINC000587028988 GI Annotated Anodyne CN(C)CCOc1ccc2nc(-c3ccccc3OCc3cscn3)[nH]c2c1 ZINC000587029046 GI Annotated Anodyne Cc1c(-c2nc3nc(C(C)(C)C)ccc3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029070 GI Annotated Anodyne Cc1c(-c2nc3c(Cl)ncc(Cl)c3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029075 GI Annotated Anodyne FC(F)(F)c1ncc2nc(-c3ccccc3OCc3cscn3)nc-2[nH]1 ZINC000587029115 GI Annotated Anodyne Brc1ccc2nc(-c3ccccc3OCc3cscn3)[nH]c2n1 ZINC000587029166 GI Annotated Anodyne Cc1c(-c2nc3ncc(C(F)(F)F)cc3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029220 GI Annotated Anodyne c1ccc(-c2nc3cc4c(cc3[nH]2)OCCCO4)c(OCc2cscn2)c1 ZINC000587029221 GI Annotated Anodyne Cc1c(-c2nc3c(Cl)nc(Cl)cc3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029264 GI Annotated Anodyne Brc1ccnc2[nH]c(-c3ccccc3OCc3cscn3)nc12 ZINC000587029281 GI Annotated Anodyne Brc1nccc2nc(-c3ccccc3OCc3cscn3)[nH]c12 ZINC000587029311 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3ccccc3OCc3cscn3)[nH]c2cc1[N+](=O)[O-] ZINC000587029313 GI Annotated Bother N[C@H](Cc1cscn1)c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587029323 GI Annotated Anodyne N[C@H](Cc1cscn1)c1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1 ZINC000587029330 GI Annotated Anodyne Cc1c(-c2nc3c(F)c(F)c(F)cc3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029331 GI Annotated Anodyne Brc1cncc2nc(-c3ccccc3OCc3cscn3)[nH]c12 ZINC000587029334 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3ccccc3OCc3cscn3)[nH]c2c1 ZINC000587029381 GI Annotated Anodyne Cc1c(-c2nc3ncc(Cl)c(Cl)c3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029397 GI Annotated Anodyne Cc1c(-c2nc3cc(OC(C)C)ccc3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029449 GI Annotated Anodyne Cc1c(-c2nc3cnc(C(F)(F)F)cc3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029485 GI Annotated Anodyne O=C1CCc2cc3nc(-c4ccccc4OCc4cscn4)[nH]c3cc2N1 ZINC000587029555 GI Annotated Anodyne Brc1cc2nc(-c3ccccc3OCc3cscn3)[nH]c2cn1 ZINC000587029564 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3ccccc3OCc3cscn3)[nH]c2c1OC ZINC000587029648 GI Annotated Anodyne Cc1c(-c2nc3c(Cl)cc(C#N)cc3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029674 GI Annotated Mild Cc1c(-c2nc3c(F)c(F)c(F)c(F)c3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029748 GI Annotated Anodyne COC(=O)c1cc2[nH]c(-c3ccccc3OCc3cscn3)nc2cc1OC ZINC000587029809 GI Annotated Anodyne Cc1c(-c2nc3nc(Cl)c(Cl)cc3[nH]2)sc2c1C(=O)N1CCC=C1N2 ZINC000587029901 GI Annotated Anodyne N[C@H](Cc1cscn1)c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587029997 GI Annotated Anodyne Brc1cnc2[nH]c(-c3ccccc3OCc3cscn3)nc2c1 ZINC000587030068 GI Annotated Anodyne Cc1cnc2[nH]c([C@H](C)S/C=C3\NC(=O)c4c(sc(C)c4C)N3)nc2c1 ZINC000587030431 GI Annotated Anodyne Cc1cnc2[nH]c([C@H](C)S/C=C3/NC(=O)c4c(sc(C)c4C)N3)nc2c1 ZINC000587030432 GI Annotated Anodyne Cc1cnc2[nH]c([C@@H](C)S/C=C3/NC(=O)c4c(sc(C)c4C)N3)nc2c1 ZINC000587030433 GI Annotated Anodyne Cc1cnc2[nH]c([C@@H](C)S/C=C3\NC(=O)c4c(sc(C)c4C)N3)nc2c1 ZINC000587030434 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@H](C)c1nc3c(C)ccnc3[nH]1)N2 ZINC000587030574 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@H](C)c1nc3c(C)ccnc3[nH]1)N2 ZINC000587030575 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@@H](C)c1nc3c(C)ccnc3[nH]1)N2 ZINC000587030576 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@@H](C)c1nc3c(C)ccnc3[nH]1)N2 ZINC000587030577 GI Annotated Anodyne COc1nccc2nc(-c3sc4cc(Br)ccc4c3N)[nH]c12 ZINC000587030578 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@@H](C)c1nc3cccc(O)c3[nH]1)N2 ZINC000587030608 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@@H](C)c1nc3cccc(O)c3[nH]1)N2 ZINC000587030609 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@H](C)c1nc3cccc(O)c3[nH]1)N2 ZINC000587030610 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@H](C)c1nc3cccc(O)c3[nH]1)N2 ZINC000587030611 GI Annotated Anodyne Nc1c(-c2nc3cncc([N+](=O)[O-])c3[nH]2)sc2cc(Br)ccc12 ZINC000587030627 GI Annotated Bother COc1cc2nc(-c3sc4cc(Br)ccc4c3N)[nH]c2cn1 ZINC000587030628 GI Annotated Anodyne Nc1c(-c2nc3cc([N+](=O)[O-])cnc3[nH]2)sc2cc(Br)ccc12 ZINC000587030821 GI Annotated Bother C[C@@H]1CCCc2sc(-n3cccc3)c(-c3nc4nc(C#N)c(C#N)nc4[nH]3)c21 ZINC000587030879 GI Annotated Mild C[C@H]1CCCc2sc(-n3cccc3)c(-c3nc4nc(C#N)c(C#N)nc4[nH]3)c21 ZINC000587030880 GI Annotated Mild Cc1ccc2nc([C@H](C)S/C=C3\NC(=O)c4c(sc(C)c4C)N3)[nH]c2n1 ZINC000587030940 GI Annotated Anodyne Cc1ccc2nc([C@H](C)S/C=C3/NC(=O)c4c(sc(C)c4C)N3)[nH]c2n1 ZINC000587030941 GI Annotated Anodyne Cc1ccc2nc([C@@H](C)S/C=C3/NC(=O)c4c(sc(C)c4C)N3)[nH]c2n1 ZINC000587030942 GI Annotated Anodyne Cc1ccc2nc([C@@H](C)S/C=C3\NC(=O)c4c(sc(C)c4C)N3)[nH]c2n1 ZINC000587030944 GI Annotated Anodyne COc1cncc2nc(-c3sc4cc(Br)ccc4c3N)[nH]c12 ZINC000587031010 GI Annotated Anodyne CC(C)(C)OC(=O)N1CCc2scc(-c3nc4cccc(C#N)c4[nH]3)c2C1 ZINC000587031059 GI Annotated Mild C[C@@H]1CCCc2sc(-n3cccc3)c(-c3nc4[nH]c(=N)[nH]c(Cl)c-4n3)c21 ZINC000587031132 GI Annotated Anodyne C[C@H]1CCCc2sc(-n3cccc3)c(-c3nc4[nH]c(=N)[nH]c(Cl)c-4n3)c21 ZINC000587031135 GI Annotated Anodyne O=[N+]([O-])c1cc(Br)cc2nc(-c3csc4c3CCOC4)[nH]c12 ZINC000587031730 GI Annotated Bother Nc1c(-c2nc3ccc(CCO)cc3[nH]2)sc2cc(Br)ccc12 ZINC000587031766 GI Annotated Anodyne C[C@@H]1CCCc2sc(-n3cccc3)c(-c3nc4c(O)nc(S)nc4[nH]3)c21 ZINC000587031773 GI Annotated Anodyne C[C@H]1CCCc2sc(-n3cccc3)c(-c3nc4c(O)nc(S)nc4[nH]3)c21 ZINC000587031776 GI Annotated Anodyne COC(=O)c1ccc2[nH]c(-c3c(-n4cccc4)sc4c3CCC4)nc2c1OC ZINC000587031873 GI Annotated Anodyne Nc1c(-c2nc3c(Cl)ncnc3[nH]2)sc2cc(Br)ccc12 ZINC000587031885 GI Annotated Anodyne CC(C)(C)OC(=O)N1CCc2scc(-c3nc4ccc(C(=O)O)cc4[nH]3)c2C1 ZINC000587031977 GI Annotated Anodyne CC(C)(C)OC(=O)N1CCc2scc(-c3nc4ccc(CCO)cc4[nH]3)c2C1 ZINC000587032264 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@@H](C)c1nc3c(C)nccc3[nH]1)N2 ZINC000587032302 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@@H](C)c1nc3c(C)nccc3[nH]1)N2 ZINC000587032305 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@H](C)c1nc3c(C)nccc3[nH]1)N2 ZINC000587032308 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@H](C)c1nc3c(C)nccc3[nH]1)N2 ZINC000587032309 GI Annotated Anodyne CC(C)(C)OC(=O)N1CCc2scc(-c3nc4cccc(C(=O)O)c4[nH]3)c2C1 ZINC000587032315 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3c(-n4cccc4)sc4c3CCC4)[nH]c2cc1[N+](=O)[O-] ZINC000587032369 GI Annotated Bother CC(C)(C)OC(=O)N1CCc2scc(-c3nc4ccc(CO)cc4[nH]3)c2C1 ZINC000587032443 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@@H](C)c1nc3cc(F)cnc3[nH]1)N2 ZINC000587032448 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@H](C)c1nc3cc(F)cnc3[nH]1)N2 ZINC000587032451 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@@H](C)c1nc3cc(F)cnc3[nH]1)N2 ZINC000587032452 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@H](C)c1nc3cc(F)cnc3[nH]1)N2 ZINC000587032453 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@H](C)c1nc3ccc(O)cc3[nH]1)N2 ZINC000587032454 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@@H](C)c1nc3ccc(O)cc3[nH]1)N2 ZINC000587032455 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@H](C)c1nc3ccc(O)cc3[nH]1)N2 ZINC000587032456 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@@H](C)c1nc3ccc(O)cc3[nH]1)N2 ZINC000587032457 GI Annotated Anodyne O=[N+]([O-])c1c(Br)ccc2nc(-c3csc4c3CCOC4)[nH]c12 ZINC000587032494 GI Annotated Bother Nc1c(-c2nc3nc(Cl)c[nH]c-3n2)sc2cc(Br)ccc12 ZINC000587032498 GI Annotated Anodyne CC(C)(C)OC(=O)N1CCc2scc(-c3nc4c(Cl)ncnc4[nH]3)c2C1 ZINC000587032504 GI Annotated Anodyne Nc1c(-c2nc3cnc(Cl)[nH]c-3n2)sc2cc(Br)ccc12 ZINC000587032513 GI Annotated Anodyne FC(F)(F)C(F)(F)c1cc2nc(-c3csc4c3CCOC4)[nH]c2cn1 ZINC000587032544 GI Annotated Anodyne CC(C)(C)OC(=O)N1CCc2scc(-c3nc4ccc(C#N)cc4[nH]3)c2C1 ZINC000587032563 GI Annotated Mild O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3csc4c3CCOC4)[nH]c21 ZINC000587032576 GI Annotated Clean FC(F)(F)c1ncc2nc(-c3c(-n4cccc4)sc4c3CCC4)nc-2[nH]1 ZINC000587032715 GI Annotated Anodyne Nc1c(-c2nc3cccc(C(=O)O)c3[nH]2)sc2cc(Br)ccc12 ZINC000587032887 GI Annotated Anodyne COc1ccc2nc(-c3sc4cc(Br)ccc4c3N)[nH]c2n1 ZINC000587032902 GI Annotated Anodyne Oc1ccc2scc(-c3nc4[nH]c(O)nc(NCc5ccccc5)c-4n3)c2c1 ZINC000587032995 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@@H](C)c1nc3cncc(C)c3[nH]1)N2 ZINC000587032998 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@@H](C)c1nc3cncc(C)c3[nH]1)N2 ZINC000587032999 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C/S[C@H](C)c1nc3cncc(C)c3[nH]1)N2 ZINC000587033001 GI Annotated Anodyne Cc1sc2c(c1C)C(=O)N/C(=C\S[C@H](C)c1nc3cncc(C)c3[nH]1)N2 ZINC000587033003 GI Annotated Anodyne Nc1c(-c2nc3ccc(C(=O)O)cc3[nH]2)sc2cc(Br)ccc12 ZINC000587033065 GI Annotated Anodyne Oc1ccc2scc(-c3nc4cc(I)cnc4[nH]3)c2c1 ZINC000587033100 GI Annotated Anodyne C[C@@H]1CCc2sc(-c3nc4[nH]c(O)nc(NCc5ccccc5)c-4n3)cc2C1 ZINC000587033338 GI Annotated Anodyne C[C@H]1CCc2sc(-c3nc4[nH]c(O)nc(NCc5ccccc5)c-4n3)cc2C1 ZINC000587033339 GI Annotated Anodyne COC(=O)c1cc(Br)c2nc(-c3cc4c(s3)CCC4)[nH]c2c1 ZINC000587033439 GI Annotated Anodyne CC1=C(c2ccc3[nH]c(-c4cc5c(s4)CC[C@@H](C)C5)nc3c2)NNC(=O)C1 ZINC000587033520 GI Annotated Anodyne CC1=C(c2ccc3[nH]c(-c4cc5c(s4)CC[C@H](C)C5)nc3c2)NNC(=O)C1 ZINC000587033534 GI Annotated Anodyne COC(=O)c1cc2nc(-c3c(-n4cccc4)sc4c3CCC4)[nH]c2cc1OC ZINC000587033549 GI Annotated Anodyne Brc1c[nH]c2nc(-c3c(-n4cccc4)sc4c3CCC4)nc-2n1 ZINC000587033680 GI Annotated Anodyne CCC[C@@H](NC(=O)c1cc2ccccc2s1)c1nc2nc(Cl)c[nH]c-2n1 ZINC000587033888 GI Annotated Anodyne CCC[C@H](NC(=O)c1cc2ccccc2s1)c1nc2nc(Cl)c[nH]c-2n1 ZINC000587033891 GI Annotated Anodyne Cc1cc(Br)cc2nc(CNC(=O)c3cc4c(s3)CCC4)[nH]c12 ZINC000587033897 GI Annotated Anodyne Cc1c(Br)ccc2nc(CNC(=O)c3cc4c(s3)CCC4)[nH]c12 ZINC000587033933 GI Annotated Anodyne CC(C)(C)OC(=O)N1CCc2scc(-c3nc4cc5cn[nH]c5cc4[nH]3)c2C1 ZINC000587033945 GI Annotated Anodyne CCC[C@@H](NC(=O)c1cc2ccccc2s1)c1nc2cnc(Cl)[nH]c-2n1 ZINC000587034091 GI Annotated Anodyne CCC[C@H](NC(=O)c1cc2ccccc2s1)c1nc2cnc(Cl)[nH]c-2n1 ZINC000587034092 GI Annotated Anodyne O=C(NCc1nc2cc3nc4ccccc4nc3cc2[nH]1)c1cc2c(s1)CCC2 ZINC000587034253 GI Annotated Bother CCC[C@@H](NC(=O)c1cc2ccccc2s1)c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000587034282 GI Annotated Bother CCC[C@H](NC(=O)c1cc2ccccc2s1)c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000587034283 GI Annotated Bother C[C@@H]1CCc2sc(-c3nc4ncc(I)cc4[nH]3)cc2C1 ZINC000587034359 GI Annotated Anodyne C[C@H]1CCc2sc(-c3nc4ncc(I)cc4[nH]3)cc2C1 ZINC000587034363 GI Annotated Anodyne CC(C)(C)OC(=O)N1CCc2scc(-c3nc4cc5c(cc4[nH]3)OCO5)c2C1 ZINC000587035016 GI Annotated Anodyne O=C(NCc1nc2cc(C(F)(F)F)c(F)cc2[nH]1)c1cc2c(s1)CCC2 ZINC000587035033 GI Annotated Anodyne Cc1cc2nc(CNC(=O)c3cc4c(s3)CCC4)[nH]c2cc1Br ZINC000587035146 GI Annotated Anodyne O=C(NCc1nc2cc(F)cc(C(F)(F)F)c2[nH]1)c1cc2c(s1)CCC2 ZINC000587035310 GI Annotated Anodyne CCC[C@@H](NC(=O)c1cc2ccccc2s1)c1nc2c(Cl)ncnc2[nH]1 ZINC000587035313 GI Annotated Anodyne CCC[C@H](NC(=O)c1cc2ccccc2s1)c1nc2c(Cl)ncnc2[nH]1 ZINC000587035314 GI Annotated Anodyne Cc1cc(Br)c2[nH]c(CNC(=O)c3cc4c(s3)CCC4)nc2c1 ZINC000587035471 GI Annotated Anodyne O=C(NCc1nc2c3cccnc3c3ncccc3c2[nH]1)c1cc2c(s1)CCC2 ZINC000587035623 GI Annotated Bother CCC[C@H](NC(=O)c1cc2ccccc2s1)c1nc2ccnc(OC)c2[nH]1 ZINC000587035664 GI Annotated Anodyne CCC[C@@H](NC(=O)c1cc2ccccc2s1)c1nc2ccnc(OC)c2[nH]1 ZINC000587035666 GI Annotated Anodyne CCC[C@@H](NC(=O)c1cc2ccccc2s1)c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000587035692 GI Annotated Bother CCC[C@H](NC(=O)c1cc2ccccc2s1)c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000587035693 GI Annotated Bother Ic1cccc2nc(C[C@H]3OCCc4ccsc43)[nH]c12 ZINC000587035812 GI Annotated Anodyne Ic1cccc2nc(C[C@@H]3OCCc4ccsc43)[nH]c12 ZINC000587035815 GI Annotated Anodyne Nc1ccc(-c2ccc3nc(C[C@@H]4OCCc5ccsc54)[nH]c3c2)cc1N ZINC000587035856 GI Annotated Anodyne Nc1ccc(-c2ccc3nc(C[C@H]4OCCc5ccsc54)[nH]c3c2)cc1N ZINC000587035858 GI Annotated Anodyne Ic1ccc2nc(C[C@H]3OCCc4ccsc43)[nH]c2c1 ZINC000587035913 GI Annotated Anodyne Ic1ccc2nc(C[C@@H]3OCCc4ccsc43)[nH]c2c1 ZINC000587035920 GI Annotated Anodyne Ic1cnc2[nH]c([C@@H]3SCCc4sccc43)nc2c1 ZINC000587036540 GI Annotated Anodyne Ic1cnc2[nH]c([C@H]3SCCc4sccc43)nc2c1 ZINC000587036541 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@@H]3SCCc4sccc43)[nH]c12 ZINC000587036646 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@H]3SCCc4sccc43)[nH]c12 ZINC000587036647 GI Annotated Anodyne O=[N+]([O-])c1c(Br)ccc2nc(C[C@H]3OCCc4ccsc43)[nH]c12 ZINC000587036721 GI Annotated Bother O=[N+]([O-])c1c(Br)ccc2nc(C[C@@H]3OCCc4ccsc43)[nH]c12 ZINC000587036722 GI Annotated Bother FC(F)(F)c1nc(Cl)[nH]c2nc([C@@H]3SCCc4sccc43)nc1-2 ZINC000587036790 GI Annotated Anodyne FC(F)(F)c1nc(Cl)[nH]c2nc([C@H]3SCCc4sccc43)nc1-2 ZINC000587036791 GI Annotated Anodyne Clc1c(Br)cnc2[nH]c(C[C@H]3OCCc4ccsc43)nc12 ZINC000587036851 GI Annotated Anodyne Clc1c(Br)cnc2[nH]c(C[C@@H]3OCCc4ccsc43)nc12 ZINC000587036852 GI Annotated Anodyne Clc1ncc(Br)c2nc(C[C@H]3OCCc4ccsc43)[nH]c12 ZINC000587036853 GI Annotated Anodyne Clc1ncc(Br)c2nc(C[C@@H]3OCCc4ccsc43)[nH]c12 ZINC000587036854 GI Annotated Anodyne C=CCc1cccc2nc([C@@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)[nH]c12 ZINC000587036987 GI Annotated Mild C=CCc1cccc2nc([C@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)[nH]c12 ZINC000587036988 GI Annotated Mild CC(C)(C)OC(=O)Nc1snnc1-c1nc2c(Br)cccc2[nH]1 ZINC000587037026 GI Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4ccc(Cl)c(C)c4[nH]3)cc12 ZINC000587037521 GI Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4ccc(Cl)c(C)c4[nH]3)cc12 ZINC000587037525 GI Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4ccc5c(c4[nH]3)CCCC5)cc12 ZINC000587037579 GI Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4ccc5c(c4[nH]3)CCCC5)cc12 ZINC000587037605 GI Annotated Anodyne O=[N+]([O-])c1cc(Br)cc2nc(C[C@H]3OCCc4ccsc43)[nH]c12 ZINC000587037679 GI Annotated Bother O=[N+]([O-])c1cc(Br)cc2nc(C[C@@H]3OCCc4ccsc43)[nH]c12 ZINC000587037680 GI Annotated Bother Oc1nc(NCc2ccccc2)c2nc([C@H]3SCCc4sccc43)nc-2[nH]1 ZINC000587037735 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@@H]3SCCc4sccc43)nc-2[nH]1 ZINC000587037736 GI Annotated Anodyne C=CCN1C(=O)S[C@@H](Cc2nc3ccc(Oc4ccccc4)cc3[nH]2)C1=O ZINC000587037946 GI Annotated Mild C=CCN1C(=O)S[C@H](Cc2nc3ccc(Oc4ccccc4)cc3[nH]2)C1=O ZINC000587037947 GI Annotated Mild COc1cc2[nH]c(-c3nnsc3NC(=O)OC(C)(C)C)nc2cc1Cl ZINC000587037954 GI Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4ccc(C(C)(C)C)nc4[nH]3)cc12 ZINC000587038016 GI Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4ccc(C(C)(C)C)nc4[nH]3)cc12 ZINC000587038017 GI Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4cc(Cl)cc(F)c4[nH]3)cc12 ZINC000587038091 GI Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4cc(Cl)cc(F)c4[nH]3)cc12 ZINC000587038094 GI Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4ccc(OC(C)C)cc4[nH]3)cc12 ZINC000587038096 GI Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4ccc(OC(C)C)cc4[nH]3)cc12 ZINC000587038097 GI Annotated Anodyne C=CCN1C(=O)S[C@H](Cc2nc3cc(C(F)(F)F)c(Cl)cc3[nH]2)C1=O ZINC000587038223 GI Annotated Mild C=CCN1C(=O)S[C@@H](Cc2nc3cc(C(F)(F)F)c(Cl)cc3[nH]2)C1=O ZINC000587038227 GI Annotated Mild CC(C)(C)OC(=O)Nc1snnc1-c1nc2c(F)c(F)c(Cl)cc2[nH]1 ZINC000587038265 GI Annotated Anodyne CSc1ccc2nc([C@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)[nH]c2c1 ZINC000587038347 GI Annotated Anodyne CSc1ccc2nc([C@@H](C)NC(=O)c3cc4c(C)nn(C)c4s3)[nH]c2c1 ZINC000587038348 GI Annotated Anodyne Cc1ccc2c(ccc3[nH]c(-c4nnsc4NC(=O)OC(C)(C)C)nc32)n1 ZINC000587038475 GI Annotated Anodyne COC(=O)c1ccc2nc(COc3ccccc3C3SCCS3)[nH]c2c1 ZINC000587038734 GI Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4cc(Cl)cc(C)c4[nH]3)cc12 ZINC000587038889 GI Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4cc(Cl)cc(C)c4[nH]3)cc12 ZINC000587038890 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1snnc1-c1nc2c(Cl)ncc(Cl)c2[nH]1 ZINC000587038907 GI Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@H](C)c3nc4cc(Cl)c(F)cc4[nH]3)cc12 ZINC000587038970 GI Annotated Anodyne Cc1nn(C)c2sc(C(=O)N[C@@H](C)c3nc4cc(Cl)c(F)cc4[nH]3)cc12 ZINC000587038971 GI Annotated Anodyne CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2ccc(Br)cc2[nH]1 ZINC000587039013 GI Annotated Anodyne Fc1ccc2nc([C@@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c2c1Br ZINC000587039049 GI Annotated Anodyne Fc1ccc2nc([C@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c2c1Br ZINC000587039051 GI Annotated Anodyne Fc1ccc2nc([C@@H]3CS[C@H](Cc4ccccc4)N3)[nH]c2c1Br ZINC000587039053 GI Annotated Anodyne Fc1ccc2nc([C@H]3CS[C@H](Cc4ccccc4)N3)[nH]c2c1Br ZINC000587039055 GI Annotated Anodyne CCCOc1cc2nc(Cc3csc4nccn34)[nH]c2cc1Br ZINC000587039088 GI Annotated Anodyne FC(F)(F)Oc1cccc2nc([C@@H]3CS[C@H](Cc4ccccc4)N3)[nH]c12 ZINC000587039104 GI Annotated Anodyne FC(F)(F)Oc1cccc2nc([C@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c12 ZINC000587039110 GI Annotated Anodyne FC(F)(F)Oc1cccc2nc([C@H]3CS[C@H](Cc4ccccc4)N3)[nH]c12 ZINC000587039111 GI Annotated Anodyne FC(F)(F)Oc1cccc2nc([C@@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c12 ZINC000587039113 GI Annotated Anodyne Fc1cc(Br)cc2nc([C@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c12 ZINC000587039151 GI Annotated Anodyne Fc1cc(Br)cc2nc([C@@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c12 ZINC000587039153 GI Annotated Anodyne Fc1cc(Br)cc2nc([C@H]3CS[C@H](Cc4ccccc4)N3)[nH]c12 ZINC000587039156 GI Annotated Anodyne Fc1cc(Br)cc2nc([C@@H]3CS[C@H](Cc4ccccc4)N3)[nH]c12 ZINC000587039158 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1snnc1-c1nc2ncc(Cl)c(Cl)c2[nH]1 ZINC000587039163 GI Annotated Anodyne N=c1[nH]c2nc(CCN3c4ccccc4Sc4ccccc43)nc-2c(Cl)[nH]1 ZINC000587039368 GI Annotated Anodyne CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000587039401 GI Annotated Anodyne C=CCN1C(=O)S[C@@H](Cc2nc3cc(C(F)(F)F)cc(Cl)c3[nH]2)C1=O ZINC000587039519 GI Annotated Mild C=CCN1C(=O)S[C@H](Cc2nc3cc(C(F)(F)F)cc(Cl)c3[nH]2)C1=O ZINC000587039521 GI Annotated Mild CC(C)(C)OC(=O)Nc1snnc1-c1nc2c(Cl)nc(Cl)cc2[nH]1 ZINC000587039650 GI Annotated Anodyne CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2cccc(Br)c2[nH]1 ZINC000587039679 GI Annotated Anodyne O=C(O)c1cc2nc(COc3ccccc3C3SCCS3)[nH]c2cc1F ZINC000587039725 GI Annotated Anodyne CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000587039739 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1snnc1-c1nc2cc(C(F)(F)F)ccc2[nH]1 ZINC000587039879 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1snnc1-c1nc2nc(Cl)c(Cl)cc2[nH]1 ZINC000587040015 GI Annotated Anodyne CC(C)Oc1ccc2[nH]c(-c3nnsc3NC(=O)OC(C)(C)C)nc2c1 ZINC000587040024 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1snnc1-c1nc2cc(Br)ccc2[nH]1 ZINC000587040102 GI Annotated Anodyne Fc1c(Br)ccc2nc([C@@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c12 ZINC000587040268 GI Annotated Anodyne Fc1c(Br)ccc2nc([C@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c12 ZINC000587040270 GI Annotated Anodyne Fc1c(Br)ccc2nc([C@@H]3CS[C@H](Cc4ccccc4)N3)[nH]c12 ZINC000587040271 GI Annotated Anodyne Fc1c(Br)ccc2nc([C@H]3CS[C@H](Cc4ccccc4)N3)[nH]c12 ZINC000587040273 GI Annotated Anodyne FC(F)(F)Oc1ccc2nc([C@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587040311 GI Annotated Anodyne FC(F)(F)Oc1ccc2nc([C@@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587040312 GI Annotated Anodyne FC(F)(F)Oc1ccc2nc([C@H]3CS[C@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587040313 GI Annotated Anodyne FC(F)(F)Oc1ccc2nc([C@@H]3CS[C@H](Cc4ccccc4)N3)[nH]c2c1 ZINC000587040314 GI Annotated Anodyne N#Cc1cc(Br)c2[nH]c([C@H]3CS[C@@H](Cc4ccccc4)N3)nc2c1 ZINC000587040334 GI Annotated Mild N#Cc1cc(Br)c2[nH]c([C@@H]3CS[C@@H](Cc4ccccc4)N3)nc2c1 ZINC000587040337 GI Annotated Mild N#Cc1cc(Br)c2[nH]c([C@H]3CS[C@H](Cc4ccccc4)N3)nc2c1 ZINC000587040339 GI Annotated Mild N#Cc1cc(Br)c2[nH]c([C@@H]3CS[C@H](Cc4ccccc4)N3)nc2c1 ZINC000587040341 GI Annotated Mild CC(C)Oc1cc2nc(Cc3csc4nccn34)[nH]c2cc1Br ZINC000587040437 GI Annotated Anodyne Oc1nc(S)nc2[nH]c(CCN3c4ccccc4Sc4ccccc43)nc12 ZINC000587040474 GI Annotated Anodyne COC(=O)c1cccc2nc(COc3ccccc3C3SCCS3)[nH]c12 ZINC000587040512 GI Annotated Anodyne CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000587040528 GI Annotated Anodyne CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587040555 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3cc(F)cc(F)c3[nH]2)cc1 ZINC000587040714 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3cc(F)cc(F)c3[nH]2)cc1 ZINC000587040715 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2ccc(Br)c(F)c2[nH]1 ZINC000587040752 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2ccc(Br)c(F)c2[nH]1 ZINC000587040753 GI Annotated Anodyne N#Cc1cc2nc(COc3ccccc3C3SCCS3)[nH]c2cc1C#N ZINC000587040985 GI Annotated Mild CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000587041006 GI Annotated Anodyne CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2cccc(OC(F)(F)F)c2[nH]1 ZINC000587041035 GI Annotated Anodyne Cc1nc2[nH]c([C@@H]3CSCN3C(=O)OC(C)(C)C)nc2cc1Br ZINC000587041037 GI Annotated Anodyne Cc1c(Br)cnc2[nH]c([C@@H]3CSCN3C(=O)OC(C)(C)C)nc12 ZINC000587041075 GI Annotated Anodyne c1ccc(C2SCCS2)c(OCc2nc3cc4c(cc3[nH]2)OCCO4)c1 ZINC000587041362 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cc(Br)c(F)cc2[nH]1 ZINC000587041363 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cc(Br)c(F)cc2[nH]1 ZINC000587041365 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3cc(OC)c(C)cc3[nH]2)cc1 ZINC000587041454 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3cc(OC)c(C)cc3[nH]2)cc1 ZINC000587041455 GI Annotated Anodyne CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000587041570 GI Annotated Anodyne CC(C)(C)OC(=O)N1CSC[C@H]1c1nc2cc(Cl)c(F)c(F)c2[nH]1 ZINC000587041596 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3ccc(CC)cc3[nH]2)cc1 ZINC000587041603 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3ccc(CC)cc3[nH]2)cc1 ZINC000587041604 GI Annotated Anodyne COc1cc2nc(C[C@@H]3Sc4ccc(Cl)cc4NC3=O)[nH]c2cc1F ZINC000587041697 GI Annotated Anodyne COc1cc2nc(C[C@H]3Sc4ccc(Cl)cc4NC3=O)[nH]c2cc1F ZINC000587041700 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1 ZINC000587041758 GI Annotated Mild CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1 ZINC000587041771 GI Annotated Mild CC(C)(C)C(=O)N1CSC[C@H]1c1nc2c3cccnc3c3ncccc3c2[nH]1 ZINC000587041823 GI Annotated Bother CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2c3cccnc3c3ncccc3c2[nH]1 ZINC000587041824 GI Annotated Bother N[C@@H](N=O)c1ccc2nc(COc3ccccc3C3SCCS3)[nH]c2c1 ZINC000587041951 GI Annotated Anodyne N[C@H](N=O)c1ccc2nc(COc3ccccc3C3SCCS3)[nH]c2c1 ZINC000587041952 GI Annotated Anodyne Cc1cc(Br)c2[nH]c([C@H]3CSCN3C(=O)C(C)(C)C)nc2c1 ZINC000587042177 GI Annotated Anodyne Cc1cc(Br)c2[nH]c([C@@H]3CSCN3C(=O)C(C)(C)C)nc2c1 ZINC000587042182 GI Annotated Anodyne O=C1CSc2ccc(-c3nc4c5cccnc5c5ncccc5c4[nH]3)cc2N1 ZINC000587042203 GI Annotated Bother CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cc(F)cc(Br)c2[nH]1 ZINC000587042219 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cc(F)cc(Br)c2[nH]1 ZINC000587042221 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3cc(C)cc(C)c3[nH]2)cc1 ZINC000587042236 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3cc(C)cc(C)c3[nH]2)cc1 ZINC000587042238 GI Annotated Anodyne O=C1CSc2ccc(-c3nc4cc(F)cc(Br)c4[nH]3)cc2N1 ZINC000587042266 GI Annotated Anodyne FC(F)(F)c1ncc2nc(COc3ccccc3C3SCCS3)nc-2[nH]1 ZINC000587042324 GI Annotated Anodyne N#Cc1cc2nc([C@@H]3CS[C@H](Cc4ccccc4)N3)[nH]c2cc1C(F)(F)F ZINC000587042404 GI Annotated Mild N#Cc1cc2nc([C@H]3CS[C@H](Cc4ccccc4)N3)[nH]c2cc1C(F)(F)F ZINC000587042407 GI Annotated Mild N#Cc1cc2nc([C@@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c2cc1C(F)(F)F ZINC000587042408 GI Annotated Mild N#Cc1cc2nc([C@H]3CS[C@@H](Cc4ccccc4)N3)[nH]c2cc1C(F)(F)F ZINC000587042409 GI Annotated Mild CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3ccc(F)c(C)c3[nH]2)cc1 ZINC000587042534 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3ccc(F)c(C)c3[nH]2)cc1 ZINC000587042535 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cc3nc4ccccc4nc3cc2[nH]1 ZINC000587042568 GI Annotated Bother CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cc3nc4ccccc4nc3cc2[nH]1 ZINC000587042569 GI Annotated Bother CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3cc(F)c(F)cc3[nH]2)cc1 ZINC000587042578 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3cc(F)c(F)cc3[nH]2)cc1 ZINC000587042579 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3cc(C)c(F)cc3[nH]2)cc1 ZINC000587042586 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3cc(C)c(F)cc3[nH]2)cc1 ZINC000587042587 GI Annotated Anodyne Fc1cc(Br)c2[nH]c([C@H]3CS[C@@H](Cc4ccccc4)N3)nc2c1 ZINC000587042656 GI Annotated Anodyne Fc1cc(Br)c2[nH]c([C@@H]3CS[C@@H](Cc4ccccc4)N3)nc2c1 ZINC000587042657 GI Annotated Anodyne Fc1cc(Br)c2[nH]c([C@H]3CS[C@H](Cc4ccccc4)N3)nc2c1 ZINC000587042658 GI Annotated Anodyne Fc1cc(Br)c2[nH]c([C@@H]3CS[C@H](Cc4ccccc4)N3)nc2c1 ZINC000587042659 GI Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@H]1Cc1nc2cnc3ccccc3c2[nH]1 ZINC000587042788 GI Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@@H]1Cc1nc2cnc3ccccc3c2[nH]1 ZINC000587042789 GI Annotated Anodyne Nc1ccc(-c2ccc3nc(-c4ccc5c(c4)NC(=O)CS5)[nH]c3c2)cc1N ZINC000587042893 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3cc(C)cc(F)c3[nH]2)cc1 ZINC000587042922 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3cc(C)cc(F)c3[nH]2)cc1 ZINC000587042923 GI Annotated Anodyne Cc1c(Br)ccc2nc([C@H]3CSCN3C(=O)C(C)(C)C)[nH]c12 ZINC000587042957 GI Annotated Anodyne Cc1c(Br)ccc2nc([C@@H]3CSCN3C(=O)C(C)(C)C)[nH]c12 ZINC000587042959 GI Annotated Anodyne CN(C)C(=O)c1ccc2nc(COc3ccccc3C3SCCS3)[nH]c2c1 ZINC000587042990 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1 ZINC000587043015 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1 ZINC000587043016 GI Annotated Anodyne O=C(O)c1cc(F)cc2nc(COc3ccccc3C3SCCS3)[nH]c12 ZINC000587043073 GI Annotated Anodyne Cc1cnc(Cl)c2[nH]c(C[C@H]3Sc4ccc(Cl)cc4NC3=O)nc12 ZINC000587043162 GI Annotated Anodyne Cc1cnc(Cl)c2[nH]c(C[C@@H]3Sc4ccc(Cl)cc4NC3=O)nc12 ZINC000587043163 GI Annotated Anodyne N#Cc1cc(Cl)c2[nH]c(C[C@@H]3Sc4ccc(Cl)cc4NC3=O)nc2c1 ZINC000587043202 GI Annotated Mild N#Cc1cc(Cl)c2[nH]c(C[C@H]3Sc4ccc(Cl)cc4NC3=O)nc2c1 ZINC000587043203 GI Annotated Mild Fc1cc2[nH]c([C@H]3CS[C@@H](Cc4ccccc4)N3)nc2cc1Br ZINC000587043284 GI Annotated Anodyne Fc1cc2[nH]c([C@@H]3CS[C@@H](Cc4ccccc4)N3)nc2cc1Br ZINC000587043285 GI Annotated Anodyne Fc1cc2[nH]c([C@H]3CS[C@H](Cc4ccccc4)N3)nc2cc1Br ZINC000587043286 GI Annotated Anodyne Fc1cc2[nH]c([C@@H]3CS[C@H](Cc4ccccc4)N3)nc2cc1Br ZINC000587043287 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cc(F)cc(C(F)(F)F)c2[nH]1 ZINC000587043356 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cc(F)cc(C(F)(F)F)c2[nH]1 ZINC000587043358 GI Annotated Anodyne O=C1CSc2ccc(-c3nc4ccc(Br)c(F)c4[nH]3)cc2N1 ZINC000587043407 GI Annotated Anodyne Cc1cc2nc([C@H]3CSCN3C(=O)C(C)(C)C)[nH]c2cc1Br ZINC000587043474 GI Annotated Anodyne Cc1cc2nc([C@@H]3CSCN3C(=O)C(C)(C)C)[nH]c2cc1Br ZINC000587043475 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2ccc(F)c(Br)c2[nH]1 ZINC000587043486 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2ccc(F)c(Br)c2[nH]1 ZINC000587043487 GI Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@H]1Cc1nc2c(F)cnc(Cl)c2[nH]1 ZINC000587043506 GI Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@@H]1Cc1nc2c(F)cnc(Cl)c2[nH]1 ZINC000587043507 GI Annotated Anodyne O=S(=O)(c1ccc2nc([C@@H]3Cc4ccccc4S3)[nH]c2c1)C(F)(F)F ZINC000587043514 GI Annotated Anodyne O=S(=O)(c1ccc2nc([C@H]3Cc4ccccc4S3)[nH]c2c1)C(F)(F)F ZINC000587043522 GI Annotated Anodyne Cc1cc2[nH]c(C[C@@H]3Sc4ccc(Cl)cc4NC3=O)nc2cc1[N+](=O)[O-] ZINC000587043545 GI Annotated Bother Cc1cc2[nH]c(C[C@H]3Sc4ccc(Cl)cc4NC3=O)nc2cc1[N+](=O)[O-] ZINC000587043549 GI Annotated Bother Cc1cc(Br)cc2nc([C@H]3CSCN3C(=O)C(C)(C)C)[nH]c12 ZINC000587043644 GI Annotated Anodyne Cc1cc(Br)cc2nc([C@@H]3CSCN3C(=O)C(C)(C)C)[nH]c12 ZINC000587043645 GI Annotated Anodyne O=C1CSc2ccc(-c3nc4cc(Br)c(F)c(F)c4[nH]3)cc2N1 ZINC000587043827 GI Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@H]1Cc1nc2ccc3ncccc3c2[nH]1 ZINC000587043836 GI Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@@H]1Cc1nc2ccc3ncccc3c2[nH]1 ZINC000587043837 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@@H]3Cc4ccccc4S3)nc-2[nH]1 ZINC000587043874 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@H]3Cc4ccccc4S3)nc-2[nH]1 ZINC000587043875 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cc(C(F)(F)F)c(F)cc2[nH]1 ZINC000587043934 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cc(C(F)(F)F)c(F)cc2[nH]1 ZINC000587043935 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2ccc(C(=O)c3ccccc3)cc2[nH]1 ZINC000587043968 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2ccc(C(=O)c3ccccc3)cc2[nH]1 ZINC000587043969 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3c(C)ccc(C)c3[nH]2)cc1 ZINC000587044004 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3c(C)ccc(C)c3[nH]2)cc1 ZINC000587044005 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3ccc(C)c(C)c3[nH]2)cc1 ZINC000587044006 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3ccc(C)c(C)c3[nH]2)cc1 ZINC000587044007 GI Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@@H]1Cc1nc2cc(F)c(F)c(F)c2[nH]1 ZINC000587044032 GI Annotated Anodyne O=C1Nc2cc(Cl)ccc2S[C@H]1Cc1nc2cc(F)c(F)c(F)c2[nH]1 ZINC000587044033 GI Annotated Anodyne O=C1CSc2ccc(-c3nc4ccc(F)c(Br)c4[nH]3)cc2N1 ZINC000587044223 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3ccc(F)c(F)c3[nH]2)cc1 ZINC000587044242 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3ccc(F)c(F)c3[nH]2)cc1 ZINC000587044243 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@H]2c2nc3ccc(C(C)=O)cc3[nH]2)cc1 ZINC000587044294 GI Annotated Anodyne CCOc1ccc(C(=O)N2CSC[C@@H]2c2nc3ccc(C(C)=O)cc3[nH]2)cc1 ZINC000587044295 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@@H]1c1nc2cc(Br)cc(F)c2[nH]1 ZINC000587044310 GI Annotated Anodyne CC(C)(C)C(=O)N1CSC[C@H]1c1nc2cc(Br)cc(F)c2[nH]1 ZINC000587044311 GI Annotated Anodyne O=C1CSc2ccc(-c3nc4c(Br)cnc(Cl)c4[nH]3)cc2N1 ZINC000587044368 GI Annotated Anodyne COc1c(Cl)cc(Cl)c(OC)c1-c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000587044406 GI Annotated Anodyne Oc1nc2cc3nc(COc4ccccc4C4SCCS4)[nH]c3cc2[nH]1 ZINC000587044408 GI Annotated Anodyne O=C1CSc2ccc(-c3nc4cc5nc6ccccc6nc5cc4[nH]3)cc2N1 ZINC000587044438 GI Annotated Bother COc1c(Cl)cc(Cl)c(OC)c1-c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000587044442 GI Annotated Anodyne O=C1CSc2ccc(-c3nc4cc(Br)cc(F)c4[nH]3)cc2N1 ZINC000587044553 GI Annotated Anodyne O=C1CSc2ccc(-c3nc4cc(Br)c(F)cc4[nH]3)cc2N1 ZINC000587044592 GI Annotated Anodyne COc1c(Cl)cc(Cl)c(OC)c1-c1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000587044646 GI Annotated Anodyne COc1c(Cl)cc(Cl)c(OC)c1-c1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000587044647 GI Annotated Anodyne COc1c(Cl)cc(Cl)c(OC)c1-c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000587044651 GI Annotated Anodyne COc1c(Cl)cc(Cl)c(OC)c1-c1nc2cc(Cl)nc(C#N)c2[nH]1 ZINC000587044654 GI Annotated Mild COc1c(Cl)cc(Cl)c(OC)c1-c1nc2cc(C(=O)O)c(F)cc2[nH]1 ZINC000587044667 GI Annotated Anodyne COc1c(Cl)cc(Cl)c(OC)c1-c1nc2cc(F)cc(C(=O)O)c2[nH]1 ZINC000587044699 GI Annotated Anodyne COc1c(Cl)cc(Cl)c(OC)c1-c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000587044748 GI Annotated Anodyne COc1cc(-c2nc3cc(C#N)cc(Br)c3[nH]2)cc(Cl)c1O ZINC000587045689 GI Annotated Mild COc1cc(-c2nc3cncc([N+](=O)[O-])c3[nH]2)cc(Cl)c1OCC(C)C ZINC000587045851 GI Annotated Bother COC(=O)c1ccc2nc(-c3cc(Cl)c(OCC(C)C)c(OC)c3)[nH]c2n1 ZINC000587045920 GI Annotated Anodyne COc1cc(-c2nc3c(Br)cnc(Cl)c3[nH]2)cc(Cl)c1O ZINC000587046129 GI Annotated Anodyne COc1cc(-c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)cc(Cl)c1O ZINC000587046182 GI Annotated Bother COc1cc(-c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)cc(Cl)c1O ZINC000587046219 GI Annotated Bother COc1cc(-c2nc3cc([N+](=O)[O-])cnc3[nH]2)cc(Cl)c1OCC(C)C ZINC000587046374 GI Annotated Bother COc1cc(-c2nc3ccc(-c4ccc(N)c(N)c4)cc3[nH]2)cc(Cl)c1O ZINC000587046399 GI Annotated Anodyne COc1cc(-c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)cc(Cl)c1O ZINC000587046405 GI Annotated Anodyne COC(=O)c1cc2nc(-c3cc(Cl)c(OCC(C)C)c(OC)c3)[nH]c2cn1 ZINC000587046410 GI Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3cc(Cl)c(OCC(C)C)c(OC)c3)nc12 ZINC000587046415 GI Annotated Anodyne COc1cc(-c2nc3c(S)nc(S)nc3[nH]2)cc(Cl)c1OCC(C)C ZINC000587046425 GI Annotated Anodyne O=[N+]([O-])c1cc(/C=C/c2nc3cc(Br)ncc3[nH]2)ccc1Cl ZINC000587047184 GI Annotated Bother O=[N+]([O-])c1cc(/C=C\c2nc3cc(Br)ncc3[nH]2)ccc1Cl ZINC000587047186 GI Annotated Bother COC(=O)c1cc2[nH]c(/C=C/c3ccc(Cl)c([N+](=O)[O-])c3)nc2cc1OC ZINC000587047482 GI Annotated Bother COC(=O)c1cc2[nH]c(/C=C\c3ccc(Cl)c([N+](=O)[O-])c3)nc2cc1OC ZINC000587047483 GI Annotated Bother O=[N+]([O-])c1cc(/C=C/c2nc3c(Br)ccnc3[nH]2)ccc1Cl ZINC000587047499 GI Annotated Bother O=[N+]([O-])c1cc(/C=C\c2nc3c(Br)ccnc3[nH]2)ccc1Cl ZINC000587047500 GI Annotated Bother CCOC(=O)Cc1ccc2nc(/C=C/c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2c1 ZINC000587047525 GI Annotated Bother CCOC(=O)Cc1ccc2nc(/C=C\c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2c1 ZINC000587047526 GI Annotated Bother O=S(=O)(O)c1ccc2nc([C@@H]3C[C@H]3c3c(Cl)cccc3Cl)[nH]c2c1 ZINC000587047764 GI Annotated Anodyne O=S(=O)(O)c1ccc2nc([C@H]3C[C@@H]3c3c(Cl)cccc3Cl)[nH]c2c1 ZINC000587047765 GI Annotated Anodyne O=S(=O)(O)c1ccc2nc([C@@H]3C[C@@H]3c3c(Cl)cccc3Cl)[nH]c2c1 ZINC000587047766 GI Annotated Anodyne O=S(=O)(O)c1ccc2nc([C@H]3C[C@H]3c3c(Cl)cccc3Cl)[nH]c2c1 ZINC000587047767 GI Annotated Anodyne O=[N+]([O-])c1cc(/C=C/c2nc3cc(Br)cnc3[nH]2)ccc1Cl ZINC000587047819 GI Annotated Bother O=[N+]([O-])c1cc(/C=C\c2nc3cc(Br)cnc3[nH]2)ccc1Cl ZINC000587047820 GI Annotated Bother CCCC(=O)Nc1ccc(Cl)c(NC(=O)CCc2nc3c(C)nccc3[nH]2)c1 ZINC000587047945 GI Annotated Anodyne O=[N+]([O-])c1cc(/C=C\c2nc3ccc(Br)nc3[nH]2)ccc1Cl ZINC000587048361 GI Annotated Bother O=[N+]([O-])c1cc(/C=C/c2nc3ccc(Br)nc3[nH]2)ccc1Cl ZINC000587048362 GI Annotated Bother O=Cc1cccc(-c2ccc(Cl)c(-c3nc4c(O)nc(S)nc4[nH]3)c2)c1 ZINC000587048466 GI Annotated Anodyne O=[N+]([O-])c1cc(/C=C/c2nc3cncc(Br)c3[nH]2)ccc1Cl ZINC000587048539 GI Annotated Bother O=[N+]([O-])c1cc(/C=C\c2nc3cncc(Br)c3[nH]2)ccc1Cl ZINC000587048541 GI Annotated Bother CN(C)CCOc1ccc2nc(/C=C/c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2c1 ZINC000587048556 GI Annotated Bother CN(C)CCOc1ccc2nc(/C=C\c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2c1 ZINC000587048558 GI Annotated Bother COC(=O)c1ccc2nc(/C=C/c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2c1OC ZINC000587048561 GI Annotated Bother COC(=O)c1ccc2nc(/C=C\c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2c1OC ZINC000587048563 GI Annotated Bother CN1CCN(c2ccc3nc(/C=C\c4ccc(Cl)c([N+](=O)[O-])c4)[nH]c3c2)CC1 ZINC000587048722 GI Annotated Bother CN1CCN(c2ccc3nc(/C=C/c4ccc(Cl)c([N+](=O)[O-])c4)[nH]c3c2)CC1 ZINC000587048725 GI Annotated Bother O=[N+]([O-])c1cc(/C=C/c2nc3ccnc(Br)c3[nH]2)ccc1Cl ZINC000587048802 GI Annotated Bother O=[N+]([O-])c1cc(/C=C\c2nc3ccnc(Br)c3[nH]2)ccc1Cl ZINC000587048804 GI Annotated Bother N=c1[nH]c2nc(-c3cc(-c4cccc(C=O)c4)ccc3Cl)nc-2c(Cl)[nH]1 ZINC000587049206 GI Annotated Anodyne O=[N+]([O-])c1cc(/C=C/c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)ccc1Cl ZINC000587049855 GI Annotated Bother O=[N+]([O-])c1cc(/C=C\c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)ccc1Cl ZINC000587049860 GI Annotated Bother CCCC(=O)Nc1ccc(Cl)c(NC(=O)/C=C/c2nc3cc(C)cnc3[nH]2)c1 ZINC000587049946 GI Annotated Anodyne CCCC(=O)Nc1ccc(Cl)c(NC(=O)/C=C\c2nc3cc(C)cnc3[nH]2)c1 ZINC000587049947 GI Annotated Anodyne CCCC(=O)Nc1ccc(Cl)c(NC(=O)/C=C\c2nc3cnccc3[nH]2)c1 ZINC000587049963 GI Annotated Anodyne CCCC(=O)Nc1ccc(Cl)c(NC(=O)/C=C/c2nc3cnccc3[nH]2)c1 ZINC000587049964 GI Annotated Anodyne CCCC(=O)Nc1ccc(Cl)c(NC(=O)/C=C/c2nc3cccnc3[nH]2)c1 ZINC000587050002 GI Annotated Anodyne CCCC(=O)Nc1ccc(Cl)c(NC(=O)/C=C\c2nc3cccnc3[nH]2)c1 ZINC000587050003 GI Annotated Anodyne CCCC(=O)Nc1ccc(Cl)c(NC(=O)CCc2nc3ccc(C)nc3[nH]2)c1 ZINC000587050205 GI Annotated Anodyne CCCC(=O)Nc1ccc(Cl)c(NC(=O)CCc2nc3cc(C)cnc3[nH]2)c1 ZINC000587050209 GI Annotated Anodyne CCCC(=O)Nc1ccc(Cl)c(NC(=O)CCc2nc3cncc(C)c3[nH]2)c1 ZINC000587050315 GI Annotated Anodyne CCS(=O)(=O)c1ccc2nc(/C=C/c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2c1 ZINC000587050553 GI Annotated Bother CCS(=O)(=O)c1ccc2nc(/C=C\c3ccc(Cl)c([N+](=O)[O-])c3)[nH]c2c1 ZINC000587050558 GI Annotated Bother CCCC(=O)Nc1ccc(Cl)c(NC(=O)/C=C/c2nc3cncc(C)c3[nH]2)c1 ZINC000587050810 GI Annotated Anodyne CCCC(=O)Nc1ccc(Cl)c(NC(=O)/C=C\c2nc3cncc(C)c3[nH]2)c1 ZINC000587050811 GI Annotated Anodyne O=[N+]([O-])c1cc(/C=C\c2nc3ccc(CN4CCOCC4)cc3[nH]2)ccc1Cl ZINC000587050988 GI Annotated Bother O=[N+]([O-])c1cc(/C=C/c2nc3ccc(CN4CCOCC4)cc3[nH]2)ccc1Cl ZINC000587050990 GI Annotated Bother CCCC(=O)Nc1ccc(Cl)c(NC(=O)/C=C/c2nc3c(C)nccc3[nH]2)c1 ZINC000587051146 GI Annotated Anodyne CCCC(=O)Nc1ccc(Cl)c(NC(=O)/C=C\c2nc3c(C)nccc3[nH]2)c1 ZINC000587051308 GI Annotated Anodyne CCCC(=O)Nc1ccc(Cl)c(NC(=O)/C=C\c2nc3cccc(O)c3[nH]2)c1 ZINC000587051385 GI Annotated Anodyne CCCC(=O)Nc1ccc(Cl)c(NC(=O)/C=C/c2nc3cccc(O)c3[nH]2)c1 ZINC000587051389 GI Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2c3cccnc3c3ncccc3c2[nH]1 ZINC000587051554 GI Annotated Bother N#Cc1nc2nc(-c3ccc(-c4cc(Cl)ccc4Cl)o3)nc-2[nH]c1C#N ZINC000587051600 GI Annotated Mild N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2cc3nc4ccccc4nc3cc2[nH]1 ZINC000587051868 GI Annotated Bother COc1cccc(-c2ccc(-c3nc4[nH]c(=N)[nH]c(Cl)c-4n3)c(Cl)c2)c1 ZINC000587052019 GI Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2cc(Br)c(F)cc2[nH]1 ZINC000587052194 GI Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2ccc(C(=O)c3ccccc3)cc2[nH]1 ZINC000587052419 GI Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2cc(F)cc(Br)c2[nH]1 ZINC000587052423 GI Annotated Anodyne COc1cccc(-c2ccc(-c3nc4c(O)nc(S)nc4[nH]3)c(Cl)c2)c1 ZINC000587052432 GI Annotated Anodyne Cc1cc(Br)cc2nc([C@H](N)Cc3ccc(O)c(Cl)c3)[nH]c12 ZINC000587052473 GI Annotated Anodyne Cc1cc2nc([C@H](N)Cc3ccc(O)c(Cl)c3)[nH]c2cc1Br ZINC000587052502 GI Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2ccc(F)c(Br)c2[nH]1 ZINC000587052537 GI Annotated Anodyne COc1cccc(-c2ccc(-c3nc4nc(C#N)c(C#N)nc4[nH]3)c(Cl)c2)c1 ZINC000587052556 GI Annotated Mild N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2ccc(Br)c(F)c2[nH]1 ZINC000587052593 GI Annotated Anodyne Cc1cc(Br)c2[nH]c([C@H](N)Cc3ccc(O)c(Cl)c3)nc2c1 ZINC000587052674 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3cc(-n4cccc4)ccc3Cl)[nH]c2cc1[N+](=O)[O-] ZINC000587052685 GI Annotated Bother CCc1cc(OCc2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)ccc1Cl ZINC000587052709 GI Annotated Bother CCc1cc(OCc2nc3ccc(C4=C(C)CC(=O)NN4)cc3[nH]2)ccc1Cl ZINC000587052872 GI Annotated Anodyne N[C@H](Cc1ccc(O)c(Cl)c1)c1nc2cc(Br)cc(F)c2[nH]1 ZINC000587052892 GI Annotated Anodyne CCc1cc(OCc2nc3ccc(N4CCN(C)CC4)cc3[nH]2)ccc1Cl ZINC000587052955 GI Annotated Anodyne Cc1c(Br)ccc2nc([C@H](N)Cc3ccc(O)c(Cl)c3)[nH]c12 ZINC000587052963 GI Annotated Anodyne N#Cc1cc2nc([C@H](N)Cc3ccc(O)c(Cl)c3)[nH]c2cc1C(F)(F)F ZINC000587052995 GI Annotated Mild CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2cccc(F)c2[nH]1 ZINC000587053044 GI Annotated Bother CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2cccc(F)c2[nH]1 ZINC000587053045 GI Annotated Bother COC(=O)c1cc(Br)c2[nH]c(-c3ccc(O)cc3Cl)nc2c1 ZINC000587053346 GI Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(/C=C\c3cccc(Cl)c3Cl)[nH]c12 ZINC000587053586 GI Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(/C=C/c3cccc(Cl)c3Cl)[nH]c12 ZINC000587053587 GI Annotated Anodyne CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2cccc(C#N)c2[nH]1 ZINC000587053931 GI Annotated Mild CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2cccc(C#N)c2[nH]1 ZINC000587053937 GI Annotated Mild CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2ccc(C#N)cc2[nH]1 ZINC000587054267 GI Annotated Mild CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2ccc(C#N)cc2[nH]1 ZINC000587054269 GI Annotated Mild O=c1ccc(-c2nc3cc(F)cnc3[nH]2)cn1Cc1ccc(Cl)cc1Cl ZINC000587054540 GI Annotated Anodyne Oc1nncc2[nH]c(-c3ccc(COc4cccc(Cl)c4Cl)o3)nc12 ZINC000587054846 GI Annotated Anodyne N[C@H](Cc1nc2cccc(I)c2[nH]1)c1ccccc1Cl ZINC000587055269 GI Annotated Anodyne N[C@@H](Cc1nc2cccc(I)c2[nH]1)c1ccccc1Cl ZINC000587055271 GI Annotated Anodyne Nc1ncnc2nc(-c3ccc(COc4cccc(Cl)c4Cl)o3)[nH]c12 ZINC000587055534 GI Annotated Anodyne Cc1cnc2[nH]c(-c3ccc(=O)n(Cc4ccc(Cl)cc4Cl)c3)nc2c1 ZINC000587055537 GI Annotated Anodyne O=c1ccc(-c2nc3ccc(O)cc3[nH]2)cn1Cc1ccc(Cl)cc1Cl ZINC000587055796 GI Annotated Anodyne Cc1ccc2nc(-c3ccc(=O)n(Cc4ccc(Cl)cc4Cl)c3)[nH]c2n1 ZINC000587055798 GI Annotated Anodyne CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2ccc(F)cc2[nH]1 ZINC000587055990 GI Annotated Bother CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1nc2ccc(F)cc2[nH]1 ZINC000587055993 GI Annotated Bother N[C@@H](Cc1nc2cc(Br)c(F)c(F)c2[nH]1)c1ccccc1Cl ZINC000587056487 GI Annotated Anodyne N[C@H](Cc1nc2cc(Br)c(F)c(F)c2[nH]1)c1ccccc1Cl ZINC000587056489 GI Annotated Anodyne N[C@H](Cc1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1)c1ccccc1Cl ZINC000587056542 GI Annotated Bother N[C@@H](Cc1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1)c1ccccc1Cl ZINC000587056543 GI Annotated Bother N#Cc1cc(Br)c2[nH]c(C[C@@H](N)c3ccccc3Cl)nc2c1 ZINC000587057021 GI Annotated Mild N#Cc1cc(Br)c2[nH]c(C[C@H](N)c3ccccc3Cl)nc2c1 ZINC000587057022 GI Annotated Mild N[C@H](Cc1nc2ccc(I)cc2[nH]1)c1ccccc1Cl ZINC000587057024 GI Annotated Anodyne N[C@@H](Cc1nc2ccc(I)cc2[nH]1)c1ccccc1Cl ZINC000587057025 GI Annotated Anodyne N[C@@H](Cc1nc2c(Br)cnc(Cl)c2[nH]1)c1ccccc1Cl ZINC000587057563 GI Annotated Anodyne N[C@H](Cc1nc2c(Br)cnc(Cl)c2[nH]1)c1ccccc1Cl ZINC000587057567 GI Annotated Anodyne N[C@@H](Cc1nc2c(Cl)c(Br)cnc2[nH]1)c1ccccc1Cl ZINC000587057858 GI Annotated Anodyne N[C@H](Cc1nc2c(Cl)c(Br)cnc2[nH]1)c1ccccc1Cl ZINC000587057860 GI Annotated Anodyne Oc1ncnc2[nH]c(-c3ccc(COc4cccc(Cl)c4Cl)o3)nc12 ZINC000587057885 GI Annotated Anodyne Nc1ccc(-c2ccc3nc([C@@H](N)Cc4ccccc4Cl)[nH]c3c2)cc1N ZINC000587057953 GI Annotated Anodyne O[C@@H](c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1)c1ccccc1Cl ZINC000587058365 GI Annotated Anodyne O[C@H](c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1)c1ccccc1Cl ZINC000587058376 GI Annotated Anodyne Nc1ccc(-c2ccc3nc(C[C@H](N)c4ccccc4Cl)[nH]c3c2)cc1N ZINC000587058436 GI Annotated Anodyne Nc1ccc(-c2ccc3nc(C[C@@H](N)c4ccccc4Cl)[nH]c3c2)cc1N ZINC000587058438 GI Annotated Anodyne N[C@H](Cc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1)c1ccccc1Cl ZINC000587058591 GI Annotated Bother N[C@@H](Cc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1)c1ccccc1Cl ZINC000587058593 GI Annotated Bother Oc1nc(NCc2ccccc2)c2nc(CCc3ccccc3Cl)nc-2[nH]1 ZINC000587058637 GI Annotated Anodyne N[C@@H](Cc1ccccc1Cl)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587058784 GI Annotated Bother Cc1cncc2nc(-c3ccc(=O)n(Cc4ccc(Cl)cc4Cl)c3)[nH]c12 ZINC000587058935 GI Annotated Anodyne N[C@@H](Cc1ccccc1Cl)c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587059026 GI Annotated Anodyne N[C@@H](Cc1ccccc1Cl)c1nc2cccc(I)c2[nH]1 ZINC000587059044 GI Annotated Anodyne N[C@@H](Cc1ccccc1Cl)c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587059075 GI Annotated Anodyne O=c1ccc(-c2nc3cccc(O)c3[nH]2)cn1Cc1ccc(Cl)cc1Cl ZINC000587059158 GI Annotated Anodyne N#Cc1cc(Br)c2[nH]c([C@@H](N)Cc3ccccc3Cl)nc2c1 ZINC000587059352 GI Annotated Mild N[C@@H](Cc1ccccc1Cl)c1nc2ccc(I)cc2[nH]1 ZINC000587059358 GI Annotated Anodyne Clc1ccccc1CCc1nc2cc(I)cnc2[nH]1 ZINC000587059442 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc(CCc3ccccc3Cl)[nH]c12 ZINC000587059443 GI Annotated Anodyne N[C@@H](Cc1ccccc1Cl)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587059569 GI Annotated Bother Cc1nccc2[nH]c(-c3ccc(=O)n(Cc4ccc(Cl)cc4Cl)c3)nc12 ZINC000587059620 GI Annotated Anodyne N[C@@H](Cc1ccccc1Cl)c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587059806 GI Annotated Anodyne Cc1ccnc2[nH]c(-c3ccc(=O)n(Cc4ccc(Cl)cc4Cl)c3)nc12 ZINC000587059917 GI Annotated Anodyne O=C1c2ccccc2C(=O)c2c1ccc1nc([C@@H](O)c3ccccc3Cl)[nH]c21 ZINC000587059985 GI Annotated Clean O=C1c2ccccc2C(=O)c2c1ccc1nc([C@H](O)c3ccccc3Cl)[nH]c21 ZINC000587059986 GI Annotated Clean O=[N+]([O-])c1c(Br)ccc2nc(CNc3ccccc3Cl)[nH]c12 ZINC000587060168 GI Annotated Bother O=C(O)c1cc(Br)cc2nc(CNc3ccccc3Cl)[nH]c12 ZINC000587060173 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(CNc3ccccc3Cl)nc2c1 ZINC000587060252 GI Annotated Anodyne O=[N+]([O-])c1cc(Br)cc2nc(CNc3ccccc3Cl)[nH]c12 ZINC000587060304 GI Annotated Bother N=c1nc(-c2ccccc2Cl)c(-c2nc3c(Cl)c(Cl)cnc3[nH]2)c[nH]1 ZINC000587060320 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3coc(-c4ccccc4Cl)n3)[nH]c2c1OC ZINC000587060553 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3cc(C#N)c(C#N)cc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587060609 GI Annotated Mild Cc1cc(-c2nc3ncc[nH]c-3n2)c2c(C)nn(Cc3ccccc3Cl)c2n1 ZINC000587060616 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3ccc(C(C)=O)cc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587060621 GI Annotated Anodyne N=c1nc(-c2ccccc2Cl)c(-c2nc3cc(Cl)c(Cl)nc3[nH]2)c[nH]1 ZINC000587060629 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3cc(OC)c(OC)cc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587060660 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3ccc(C(=O)OC)cc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587060723 GI Annotated Anodyne N#Cc1cc(Cl)c2[nH]c(-c3c[nH]c(=N)nc3-c3ccccc3Cl)nc2c1 ZINC000587060831 GI Annotated Mild CC(C)(C)c1ccc2nc(-c3c[nH]c(=N)nc3-c3ccccc3Cl)[nH]c2n1 ZINC000587060873 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3cc(OC)cc(OC)c3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587060997 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3cc(Cl)ncc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587061048 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3cccc(C(=O)OC)c3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587061063 GI Annotated Anodyne Cc1cc(-c2nc3cnncc3[nH]2)c2c(C)nn(Cc3ccccc3Cl)c2n1 ZINC000587061083 GI Annotated Anodyne Cc1cc(-c2nc3ncncc3[nH]2)c2c(C)nn(Cc3ccccc3Cl)c2n1 ZINC000587061094 GI Annotated Anodyne O=S(=O)(c1ccc2nc(CNc3ccccc3Cl)[nH]c2c1)C(F)(F)F ZINC000587061133 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3cccc([N+](=O)[O-])c3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587061134 GI Annotated Bother CCN1C(=O)C[C@@H](c2nc3cncc(Cl)c3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587061198 GI Annotated Anodyne N=c1nc(-c2ccccc2Cl)c(-c2nc3cc(C(F)(F)F)cnc3[nH]2)c[nH]1 ZINC000587061277 GI Annotated Anodyne N=c1nc(-c2ccccc2Cl)c(-c2nc3cc(Cl)nc(Cl)c3[nH]2)c[nH]1 ZINC000587061322 GI Annotated Anodyne N=c1nc(-c2ccccc2Cl)c(-c2nc3cc(C(F)(F)F)ncc3[nH]2)c[nH]1 ZINC000587061340 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3ccc(Cl)nc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587061418 GI Annotated Anodyne N=c1nc(-c2ccccc2Cl)c(-c2nc3cc(F)c(F)c(F)c3[nH]2)c[nH]1 ZINC000587061632 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3ccnc(Cl)c3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587061650 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3cc4cn[nH]c4cc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587061651 GI Annotated Anodyne CN(C)CCOc1ccc2nc(-c3coc(-c4ccccc4Cl)n3)[nH]c2c1 ZINC000587061809 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3cc(OC)c(F)cc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587061985 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3c(F)cnc(Cl)c3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587062098 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3ccc([C@@H](N)N=O)cc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587062118 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3ccc([C@H](N)N=O)cc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587062119 GI Annotated Anodyne COCCN1C(=O)CC[C@H](c2nc3cc(C)cnc3[nH]2)[C@H]1c1ccccc1Cl ZINC000587062130 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3c(Cl)ccnc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587062149 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3ccc([N+](=O)[O-])cc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587062177 GI Annotated Bother COCCN1C(=O)CC[C@H](c2nc3cncc(C)c3[nH]2)[C@H]1c1ccccc1Cl ZINC000587062211 GI Annotated Anodyne Clc1ccccc1NCc1nc2cccc(I)c2[nH]1 ZINC000587062467 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3cc(Cl)cnc3[nH]2)[C@@H]1c1ccccc1Cl ZINC000587062479 GI Annotated Anodyne CC[C@H](Oc1ccccc1Cl)c1nc2ccc(N3CCN(C)CC3)cc2[nH]1 ZINC000587062507 GI Annotated Anodyne CC[C@@H](Oc1ccccc1Cl)c1nc2ccc(N3CCN(C)CC3)cc2[nH]1 ZINC000587062508 GI Annotated Anodyne COCCN1C(=O)CC[C@H](c2nc3c(C)nccc3[nH]2)[C@H]1c1ccccc1Cl ZINC000587062593 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3cc4c(cc3[nH]2)OCO4)[C@@H]1c1ccccc1Cl ZINC000587062621 GI Annotated Anodyne CCN1C(=O)C[C@@H](c2nc3cc4c(cc3[nH]2)OCCO4)[C@@H]1c1ccccc1Cl ZINC000587062656 GI Annotated Anodyne NS(=O)(=O)c1cccc2nc(Cc3ccc(-c4ccccc4Cl)cc3)[nH]c12 ZINC000587062712 GI Annotated Anodyne COCCN1C(=O)CC[C@H](c2nc3ccc(O)cc3[nH]2)[C@H]1c1ccccc1Cl ZINC000587062755 GI Annotated Anodyne Cc1onc(-c2nc3cc([C@H](N)N=O)ccc3[nH]2)c1COc1ccccc1Cl ZINC000587062780 GI Annotated Anodyne Cc1onc(-c2nc3cc([C@@H](N)N=O)ccc3[nH]2)c1COc1ccccc1Cl ZINC000587062782 GI Annotated Anodyne Clc1ccccc1NCc1nc2ccc(I)cc2[nH]1 ZINC000587063008 GI Annotated Anodyne COCCN1C(=O)CC[C@H](c2nc3c(C)ccnc3[nH]2)[C@H]1c1ccccc1Cl ZINC000587063115 GI Annotated Anodyne Cc1onc(-c2nc3ncc([N+](=O)[O-])cc3[nH]2)c1COc1ccccc1Cl ZINC000587063135 GI Annotated Bother Cc1onc(-c2nc3nc(Cl)c[nH]c-3n2)c1COc1ccccc1Cl ZINC000587063148 GI Annotated Anodyne Cc1onc(-c2nc3nc(Cl)ncc3[nH]2)c1COc1ccccc1Cl ZINC000587063191 GI Annotated Anodyne Cc1onc(-c2nc3cc(CCO)ccc3[nH]2)c1COc1ccccc1Cl ZINC000587063203 GI Annotated Anodyne COCCN1C(=O)CC[C@H](c2nc3ccc(C)nc3[nH]2)[C@H]1c1ccccc1Cl ZINC000587063239 GI Annotated Anodyne COCCN1C(=O)CC[C@H](c2nc3cccc(O)c3[nH]2)[C@H]1c1ccccc1Cl ZINC000587063275 GI Annotated Anodyne Cc1onc(-c2nc3ncnc(Cl)c3[nH]2)c1COc1ccccc1Cl ZINC000587063567 GI Annotated Anodyne COCCN1C(=O)CC[C@H](c2nc3ccccc3[nH]2)[C@H]1c1ccccc1Cl ZINC000587063576 GI Annotated Anodyne Cc1onc(-c2nc3cc4c(cc3[nH]2)OCO4)c1COc1ccccc1Cl ZINC000587063611 GI Annotated Anodyne N=c1nc2nc(-c3ccc(COc4ccccc4Cl)cc3)[nH]c2c(Cl)[nH]1 ZINC000587063706 GI Annotated Anodyne Clc1ccccc1-c1ccc(Cc2nc3ccc(-n4cnnn4)cc3[nH]2)cc1 ZINC000587063709 GI Annotated Anodyne Clc1ccccc1-c1nc(-c2nc3nc(Br)c[nH]c-3n2)co1 ZINC000587063718 GI Annotated Anodyne Cc1onc(-c2nc3c([N+](=O)[O-])cncc3[nH]2)c1COc1ccccc1Cl ZINC000587063764 GI Annotated Bother O=c1cccc(-c2nc3c(F)cccc3[nH]2)n1CCOc1ccccc1Cl ZINC000587063983 GI Annotated Anodyne Cc1cc2nc(-c3cccc(=O)n3CCOc3ccccc3Cl)[nH]c2c(C)n1 ZINC000587064094 GI Annotated Anodyne COc1cccc2[nH]c(-c3cccc(=O)n3CCOc3ccccc3Cl)nc12 ZINC000587064149 GI Annotated Anodyne COC(=O)c1cc2[nH]c(-c3ccc(COc4ccccc4Cl)o3)nc2cn1 ZINC000587064246 GI Annotated Anodyne Cc1cccc2[nH]c(-c3cccc(=O)n3CCOc3ccccc3Cl)nc12 ZINC000587064318 GI Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2cc(C#N)cc(Cl)c2[nH]1 ZINC000587064391 GI Annotated Mild COc1cc(Cl)cc(C=O)c1OCc1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000587064418 GI Annotated Anodyne Clc1cccnc1-c1nc2c(Br)cnc(Br)c2[nH]1 ZINC000587064479 GI Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587064549 GI Annotated Anodyne Cc1nn(-c2cccc(-c3nc4ccc(C(=O)N(C)C)cc4[nH]3)c2)c(C)c1Cl ZINC000587064555 GI Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000587064622 GI Annotated Anodyne COc1cnc(-c2nc3cnc(C(F)(F)C(F)(F)F)cc3[nH]2)cc1Cl ZINC000587064678 GI Annotated Anodyne COC(=O)c1ccc2[nH]c(-c3ccc(COc4ccccc4Cl)o3)nc2n1 ZINC000587064690 GI Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3ccc(COc4ccccc4Cl)cc3)nc12 ZINC000587064717 GI Annotated Anodyne COc1cc2nc(COc3c(C=O)cc(Cl)cc3OC)[nH]c2cc1Cl ZINC000587064808 GI Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000587064809 GI Annotated Anodyne CCOc1n[nH]c(-c2nc3cc(Cl)cc(Br)c3[nH]2)c1Cl ZINC000587064866 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(-c3ncccc3Cl)nc2c1 ZINC000587064884 GI Annotated Anodyne COC(=O)c1ccnc2nc(-c3ccc(COc4ccccc4Cl)o3)[nH]c12 ZINC000587064912 GI Annotated Anodyne Clc1ccccc1OCc1ccc(-c2nc3cc(-n4cnnn4)ccc3[nH]2)o1 ZINC000587064940 GI Annotated Anodyne Cc1nn(-c2cccc(-c3nc4cc5c(cc4[nH]3)OCCO5)c2)c(C)c1Cl ZINC000587064944 GI Annotated Anodyne COc1cnc(-c2nc3c4c(ccc3[nH]2)C(=O)c2ccccc2C4=O)cc1Cl ZINC000587065032 GI Annotated Clean CCOc1n[nH]c(-c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c1Cl ZINC000587065162 GI Annotated Anodyne COC(=O)c1cccc2nc(-c3cccc(-n4nc(C)c(Cl)c4C)c3)[nH]c12 ZINC000587065181 GI Annotated Anodyne O=C1COc2cc3nc(-c4ccc(COc5ccccc5Cl)o4)[nH]c3cc2N1 ZINC000587065195 GI Annotated Anodyne Sc1nc(S)c2nc(-c3ccc(COc4ccccc4Cl)o3)[nH]c2n1 ZINC000587065268 GI Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000587065292 GI Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000587065294 GI Annotated Anodyne CCOc1n[nH]c(-c2nc3cc(Br)cc(Cl)c3[nH]2)c1Cl ZINC000587065373 GI Annotated Anodyne CCOc1n[nH]c(-c2nc3cc(Br)c(F)c(F)c3[nH]2)c1Cl ZINC000587065418 GI Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2ccc(Br)cc2[nH]1 ZINC000587065484 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cccc(-n4nc(C)c(Cl)c4C)c3)[nH]c2c1 ZINC000587065492 GI Annotated Anodyne Cc1nn(-c2cccc(-c3nc4cc5nc(O)[nH]c5cc4[nH]3)c2)c(C)c1Cl ZINC000587065501 GI Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2cccc(Br)c2[nH]1 ZINC000587065519 GI Annotated Anodyne Cc1nn(-c2cccc(-c3nc4c(S)nc(S)nc4[nH]3)c2)c(C)c1Cl ZINC000587065521 GI Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000587065549 GI Annotated Bother Cc1nn(-c2cccc(-c3nc4ccc([C@H](N)N=O)cc4[nH]3)c2)c(C)c1Cl ZINC000587065582 GI Annotated Anodyne Cc1nn(-c2cccc(-c3nc4ccc([C@@H](N)N=O)cc4[nH]3)c2)c(C)c1Cl ZINC000587065583 GI Annotated Anodyne COc1cc(Cl)cc(C=O)c1OCc1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000587065685 GI Annotated Anodyne Cc1nn(-c2cccc(-c3nc4cnc(C(F)(F)F)[nH]c-4n3)c2)c(C)c1Cl ZINC000587065812 GI Annotated Anodyne Cc1cc(Cl)ccc1OCCCc1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587066091 GI Annotated Anodyne Cc1cc(Cl)ccc1OCCCc1nc2nc(Br)c[nH]c-2n1 ZINC000587066103 GI Annotated Anodyne Cc1cc(Cl)ccc1-n1cccc1-c1nc2nc(Br)c[nH]c-2n1 ZINC000587066183 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(-c3ccc(Cl)cc3OC)nc2c1 ZINC000587066261 GI Annotated Anodyne CNc1cc(Cl)ccc1-c1nc2cc(C(=O)OC)cc(Br)c2[nH]1 ZINC000587066317 GI Annotated Anodyne COc1cc(Cl)ccc1-c1nc2cccc(I)c2[nH]1 ZINC000587066539 GI Annotated Anodyne Cc1cc(Cl)ccc1-n1cccc1-c1nc2cc3c(cc2[nH]1)NC(=O)CO3 ZINC000587066737 GI Annotated Anodyne COc1cc(Cl)ccc1-c1nc2ccc(I)cc2[nH]1 ZINC000587066778 GI Annotated Anodyne Cc1cc(Cl)ccc1C#Cc1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587067362 GI Annotated Mild COc1cc(Cl)cc(C=O)c1OCc1nc2ccc3nc(C)ccc3c2[nH]1 ZINC000587067382 GI Annotated Anodyne CC1=C(c2ccc3nc([C@@H](C)Oc4ccc(Cl)cc4C)[nH]c3c2)NNC(=O)C1 ZINC000587067480 GI Annotated Anodyne Cc1cc(Cl)ccc1O[C@H](C)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587067705 GI Annotated Bother N=c1[nH]c2nc(-c3cncc(-c4cc(Cl)cc(Cl)c4)c3)nc-2c(Cl)[nH]1 ZINC000587067714 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cc(Cl)cc(-c4ccc(CO)cc4)c3)[nH]c2n1 ZINC000587067763 GI Annotated Anodyne O=[N+]([O-])c1cncc2nc(-c3cc(Cl)cc(-c4ccc(CO)cc4)c3)[nH]c12 ZINC000587067768 GI Annotated Bother Nc1ccnc2[nH]c(-c3cc(-c4ccco4)n(-c4cccc(Cl)c4)n3)nc12 ZINC000587067873 GI Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3cc(Cl)cc(-c4ccc(CO)cc4)c3)nc12 ZINC000587067912 GI Annotated Anodyne N=c1cc2nc(-c3cc(-c4ccco4)n(-c4cccc(Cl)c4)n3)[nH]c2c[nH]1 ZINC000587068093 GI Annotated Anodyne CN(C)CCOc1ccc2[nH]c(-c3cc(-c4cccc(Cl)c4)[nH]n3)nc2c1 ZINC000587068185 GI Annotated Anodyne N=c1[nH]ccc2nc(-c3cc(-c4ccco4)n(-c4cccc(Cl)c4)n3)[nH]c12 ZINC000587068199 GI Annotated Anodyne Nc1cc2nc(-c3cc(-c4ccco4)n(-c4cccc(Cl)c4)n3)[nH]c2cc1N ZINC000587068265 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3cc(-c4cccc(Cl)c4)[nH]n3)[nH]c2cc1[N+](=O)[O-] ZINC000587068293 GI Annotated Bother Oc1nccc2nc(-c3cc(-c4ccco4)n(-c4cccc(Cl)c4)n3)[nH]c12 ZINC000587068347 GI Annotated Anodyne NC[C@H](Cc1ccc(Cl)cc1)c1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1 ZINC000587069226 GI Annotated Anodyne NC[C@@H](Cc1ccc(Cl)cc1)c1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1 ZINC000587069227 GI Annotated Anodyne NC[C@H](Cc1ccc(Cl)cc1)c1nc2ccc(F)c(Br)c2[nH]1 ZINC000587069229 GI Annotated Anodyne NC[C@@H](Cc1ccc(Cl)cc1)c1nc2ccc(F)c(Br)c2[nH]1 ZINC000587069233 GI Annotated Anodyne C[C@H](CC(=O)c1ccc(Cl)cc1)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587069311 GI Annotated Bother C[C@@H](CC(=O)c1ccc(Cl)cc1)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587069313 GI Annotated Bother NC[C@H](Cc1ccc(Cl)cc1)c1nc2cc(F)cc(Br)c2[nH]1 ZINC000587069321 GI Annotated Anodyne NC[C@@H](Cc1ccc(Cl)cc1)c1nc2cc(F)cc(Br)c2[nH]1 ZINC000587069322 GI Annotated Anodyne COC(=O)c1ccc2nc([C@H](C)CC(=O)c3ccc(Cl)cc3)[nH]c2c1OC ZINC000587069416 GI Annotated Anodyne COC(=O)c1ccc2nc([C@@H](C)CC(=O)c3ccc(Cl)cc3)[nH]c2c1OC ZINC000587069417 GI Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3cncc(-c4cc(Cl)cc(Cl)c4)c3)nc12 ZINC000587069466 GI Annotated Anodyne Oc1nncc2nc(/C=C/c3ccc(OCc4cccc(Cl)c4)cc3)[nH]c12 ZINC000587069472 GI Annotated Anodyne Oc1nncc2nc(/C=C\c3ccc(OCc4cccc(Cl)c4)cc3)[nH]c12 ZINC000587069474 GI Annotated Anodyne NC[C@H](Cc1ccc(Cl)cc1)c1nc2cc(Br)cc(F)c2[nH]1 ZINC000587069804 GI Annotated Anodyne NC[C@@H](Cc1ccc(Cl)cc1)c1nc2cc(Br)cc(F)c2[nH]1 ZINC000587069805 GI Annotated Anodyne C[C@H](CC(=O)c1ccc(Cl)cc1)c1nc2nc(Br)c[nH]c-2n1 ZINC000587070003 GI Annotated Anodyne C[C@@H](CC(=O)c1ccc(Cl)cc1)c1nc2nc(Br)c[nH]c-2n1 ZINC000587070005 GI Annotated Anodyne C[C@@H](CC(=O)c1ccc(Cl)cc1)c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587070112 GI Annotated Anodyne C[C@H](CC(=O)c1ccc(Cl)cc1)c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587070114 GI Annotated Anodyne N#Cc1cc2nc([C@@H](CN)Cc3ccc(Cl)cc3)[nH]c2cc1C(F)(F)F ZINC000587070501 GI Annotated Mild N#Cc1cc2nc([C@H](CN)Cc3ccc(Cl)cc3)[nH]c2cc1C(F)(F)F ZINC000587070507 GI Annotated Mild N#Cc1cc(Br)c2[nH]c([C@@H](CN)Cc3ccc(Cl)cc3)nc2c1 ZINC000587070573 GI Annotated Mild N#Cc1cc(Br)c2[nH]c([C@H](CN)Cc3ccc(Cl)cc3)nc2c1 ZINC000587070574 GI Annotated Mild NC[C@H](Cc1ccc(Cl)cc1)c1nc2ccc(Br)c(F)c2[nH]1 ZINC000587070595 GI Annotated Anodyne NC[C@@H](Cc1ccc(Cl)cc1)c1nc2ccc(Br)c(F)c2[nH]1 ZINC000587070596 GI Annotated Anodyne COC(=O)c1cc2[nH]c([C@H](C)CC(=O)c3ccc(Cl)cc3)nc2cc1OC ZINC000587070705 GI Annotated Anodyne COC(=O)c1cc2[nH]c([C@@H](C)CC(=O)c3ccc(Cl)cc3)nc2cc1OC ZINC000587070706 GI Annotated Anodyne O=C(Cc1ccc(Cl)cc1)c1nc2cc(I)ccc2[nH]1 ZINC000587070774 GI Annotated Anodyne O=C(Cc1ccc(Cl)cc1)c1nc2c(C(=O)O)cc(Br)cc2[nH]1 ZINC000587070951 GI Annotated Anodyne NC[C@H](Cc1ccc(Cl)cc1)c1nc2cc(Br)c(F)cc2[nH]1 ZINC000587071279 GI Annotated Anodyne NC[C@@H](Cc1ccc(Cl)cc1)c1nc2cc(Br)c(F)cc2[nH]1 ZINC000587071280 GI Annotated Anodyne N#Cc1nc2nc(-c3cncc(-c4cc(Cl)cc(Cl)c4)c3)[nH]c2nc1C#N ZINC000587071497 GI Annotated Mild CC1(C)[C@H](/C=C(/Cl)c2ccc(Cl)cc2)[C@@H]1c1nc2c(O)nc(=N)[nH]c2[nH]1 ZINC000587071673 GI Annotated Anodyne CC1(C)[C@H](/C=C(\Cl)c2ccc(Cl)cc2)[C@H]1c1nc2c(O)nc(=N)[nH]c2[nH]1 ZINC000587071690 GI Annotated Anodyne CC1(C)[C@H](/C=C(\Cl)c2ccc(Cl)cc2)[C@@H]1c1nc2c(O)nc(=N)[nH]c2[nH]1 ZINC000587071692 GI Annotated Anodyne CC1(C)[C@H](/C=C(/Cl)c2ccc(Cl)cc2)[C@H]1c1nc2c(O)nc(=N)[nH]c2[nH]1 ZINC000587071694 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](Cc1nc2ccnc(O)c2[nH]1)c1cccc(Cl)c1 ZINC000587071847 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](Cc1nc2ccnc(O)c2[nH]1)c1cccc(Cl)c1 ZINC000587071849 GI Annotated Anodyne O=C(Cc1ccc(Cl)cc1)c1nc2c(Cl)ncc(Br)c2[nH]1 ZINC000587072023 GI Annotated Anodyne N=c1[nH]cc2nc(/C=C/c3ccc(OCc4cccc(Cl)c4)cc3)nc-2[nH]1 ZINC000587072109 GI Annotated Anodyne N=c1[nH]cc2nc(/C=C\c3ccc(OCc4cccc(Cl)c4)cc3)nc-2[nH]1 ZINC000587072111 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](Cc1nc2c(N)ccnc2[nH]1)c1cccc(Cl)c1 ZINC000587072122 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](Cc1nc2c(N)ccnc2[nH]1)c1cccc(Cl)c1 ZINC000587072123 GI Annotated Anodyne O=C(Cc1ccc(Cl)cc1)c1nc2c([N+](=O)[O-])cc(Br)cc2[nH]1 ZINC000587072257 GI Annotated Bother O=C(Cc1ccc(Cl)cc1)c1nc2c(I)cccc2[nH]1 ZINC000587072645 GI Annotated Anodyne O=C(Cc1ccc(Cl)cc1)c1nc2ncc(Br)c(Cl)c2[nH]1 ZINC000587072732 GI Annotated Anodyne O=C(Cc1ccc(Cl)cc1)c1nc2c([N+](=O)[O-])c(Br)ccc2[nH]1 ZINC000587072740 GI Annotated Bother CC1(C)[C@H](/C=C(/Cl)c2ccc(Cl)cc2)[C@@H]1c1nc2c(O)nc(O)nc2[nH]1 ZINC000587072745 GI Annotated Anodyne CC1(C)[C@H](/C=C(\Cl)c2ccc(Cl)cc2)[C@H]1c1nc2c(O)nc(O)nc2[nH]1 ZINC000587072746 GI Annotated Anodyne CC1(C)[C@H](/C=C(\Cl)c2ccc(Cl)cc2)[C@@H]1c1nc2c(O)nc(O)nc2[nH]1 ZINC000587072747 GI Annotated Anodyne CC1(C)[C@H](/C=C(/Cl)c2ccc(Cl)cc2)[C@H]1c1nc2c(O)nc(O)nc2[nH]1 ZINC000587072748 GI Annotated Anodyne O=C(Cc1ccc(Cl)cc1)c1nc2nc(Cl)nc(C(F)(F)F)c2[nH]1 ZINC000587072829 GI Annotated Anodyne CC1=C(c2ccc3nc(C4(Cc5ccc(Cl)cc5)CC4)[nH]c3c2)NNC(=O)C1 ZINC000587073075 GI Annotated Anodyne Clc1ccc(CN2CCC[C@@H]2c2nc3nc(Br)c[nH]c-3n2)cc1 ZINC000587073268 GI Annotated Anodyne Clc1ccc(CN2CCC[C@H]2c2nc3nc(Br)c[nH]c-3n2)cc1 ZINC000587073269 GI Annotated Anodyne Clc1ccc(-c2cnccc2-c2nc3nc(Br)c[nH]c-3n2)cc1 ZINC000587073354 GI Annotated Anodyne Cc1c(-c2nc3cc(F)c(F)c(F)c3[nH]2)nnn1Cc1ccc(Cl)cc1 ZINC000587073357 GI Annotated Anodyne Cc1c(-c2nc3cc(C(F)(F)F)cnc3[nH]2)nnn1Cc1ccc(Cl)cc1 ZINC000587073588 GI Annotated Anodyne Cc1c(-c2nc3c(F)c(F)c(F)c(F)c3[nH]2)nnn1Cc1ccc(Cl)cc1 ZINC000587073696 GI Annotated Anodyne CC1=C(c2ccc3nc(C4(c5ccc(Cl)cc5)CCC4)[nH]c3c2)NNC(=O)C1 ZINC000587073874 GI Annotated Anodyne N=c1nc(O)c2nc(/C=C(\CCc3ccc(Cl)cc3)c3ccccc3)[nH]c2[nH]1 ZINC000587073952 GI Annotated Anodyne N=c1nc(O)c2nc(/C=C(/CCc3ccc(Cl)cc3)c3ccccc3)[nH]c2[nH]1 ZINC000587073959 GI Annotated Anodyne Cc1c(-c2nc3c(F)cnc(Cl)c3[nH]2)nnn1Cc1ccc(Cl)cc1 ZINC000587074083 GI Annotated Anodyne FC(F)(F)c1ncc2nc([C@H]3CCCN3Cc3ccc(Cl)cc3)nc-2[nH]1 ZINC000587074254 GI Annotated Anodyne FC(F)(F)c1ncc2nc([C@@H]3CCCN3Cc3ccc(Cl)cc3)nc-2[nH]1 ZINC000587074256 GI Annotated Anodyne Clc1ccc(CC2(c3nc4ccc(CN5CCOCC5)cc4[nH]3)CC2)cc1 ZINC000587074309 GI Annotated Anodyne Cc1cc2[nH]c(-c3nnn(Cc4ccc(Cl)cc4)c3C)nc2cc1[N+](=O)[O-] ZINC000587074380 GI Annotated Bother Cc1c(-c2nc3cc(C#N)cc(Cl)c3[nH]2)nnn1Cc1ccc(Cl)cc1 ZINC000587074383 GI Annotated Mild COC(=O)c1ccc2nc([C@@H]3CCCN3Cc3ccc(Cl)cc3)[nH]c2c1OC ZINC000587074687 GI Annotated Anodyne COc1cc2nc(-c3nnn(Cc4ccc(Cl)cc4)c3C)[nH]c2cc1Cl ZINC000587074688 GI Annotated Anodyne COC(=O)c1ccc2nc([C@H]3CCCN3Cc3ccc(Cl)cc3)[nH]c2c1OC ZINC000587074689 GI Annotated Anodyne Cc1c(-c2nc3cc(C(F)(F)F)ncc3[nH]2)nnn1Cc1ccc(Cl)cc1 ZINC000587074743 GI Annotated Anodyne Fc1cc2[nH]c(-c3cn(-c4ccc(Cl)cc4)nn3)nc2cc1Br ZINC000587074901 GI Annotated Anodyne Fc1cc(Br)cc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c12 ZINC000587074941 GI Annotated Anodyne FC(F)(F)Oc1ccc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c2c1 ZINC000587074960 GI Annotated Anodyne N#Cc1cc(Br)c2[nH]c(-c3cn(-c4ccc(Cl)cc4)nn3)nc2c1 ZINC000587075033 GI Annotated Mild Oc1c(Br)ccc2nc([C@H]3C=C(c4ccc(Cl)cc4)NO3)[nH]c12 ZINC000587075047 GI Annotated Anodyne Oc1c(Br)ccc2nc([C@@H]3C=C(c4ccc(Cl)cc4)NO3)[nH]c12 ZINC000587075049 GI Annotated Anodyne FC(F)(F)Oc1cccc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c12 ZINC000587075076 GI Annotated Anodyne Cc1c(-c2nc3ccc(C(=O)N(C)C)cc3[nH]2)cnn1-c1ccc(Cl)cc1 ZINC000587075200 GI Annotated Anodyne Cc1onc(-c2nc3nc(Cl)ncc3[nH]2)c1COc1ccc(Cl)cc1 ZINC000587075272 GI Annotated Anodyne Cc1c(-c2nc3cnc(C(F)(F)F)[nH]c-3n2)cnn1-c1ccc(Cl)cc1 ZINC000587075496 GI Annotated Anodyne Fc1c(Br)ccc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c12 ZINC000587075500 GI Annotated Anodyne Fc1cc2[nH]c([C@H]3C=C(c4ccc(Cl)cc4)NO3)nc2cc1-n1cccn1 ZINC000587075519 GI Annotated Anodyne Fc1cc2[nH]c([C@@H]3C=C(c4ccc(Cl)cc4)NO3)nc2cc1-n1cccn1 ZINC000587075520 GI Annotated Anodyne Cc1c(-c2nc3cc4c(cc3[nH]2)NC(=O)CC4)cnn1-c1ccc(Cl)cc1 ZINC000587075565 GI Annotated Anodyne COC(=O)c1cc2[nH]c(-c3cnn(-c4ccc(Cl)cc4)c3C)nc2cc1OC ZINC000587075598 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cnn(-c4ccc(Cl)cc4)c3C)[nH]c2c1OC ZINC000587075630 GI Annotated Anodyne Cc1c(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)cnn1-c1ccc(Cl)cc1 ZINC000587075808 GI Annotated Bother CCOC(=O)Cc1ccc2nc(-c3cn(-c4ccc(Cl)cc4)nc3C)[nH]c2c1 ZINC000587075820 GI Annotated Anodyne Cc1nn(-c2ccc(Cl)cc2)cc1-c1nc2ccc(C(=O)N(C)C)cc2[nH]1 ZINC000587075843 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c2cc1Cl ZINC000587075885 GI Annotated Bother Cc1onc(-c2nc3ncnc(Cl)c3[nH]2)c1COc1ccc(Cl)cc1 ZINC000587075894 GI Annotated Anodyne Cc1c(-c2nc3ccc(OCCN(C)C)cc3[nH]2)cnn1-c1ccc(Cl)cc1 ZINC000587075982 GI Annotated Anodyne Fc1ccc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c2c1Br ZINC000587076021 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3cnn(-c4ccc(Cl)cc4)c3C)[nH]c2c1 ZINC000587076268 GI Annotated Anodyne Cc1nn(-c2ccc(Cl)cc2)cc1-c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587076274 GI Annotated Bother Cc1nn(-c2ccc(Cl)cc2)cc1-c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000587076304 GI Annotated Anodyne Cc1onc(-c2nc3nc(Cl)c[nH]c-3n2)c1COc1ccc(Cl)cc1 ZINC000587076319 GI Annotated Anodyne Cc1onc(-c2nc3cc4c(cc3[nH]2)OCO4)c1COc1ccc(Cl)cc1 ZINC000587076354 GI Annotated Anodyne Cc1onc(-c2nc3ncc([N+](=O)[O-])cc3[nH]2)c1COc1ccc(Cl)cc1 ZINC000587076360 GI Annotated Bother Cc1onc(-c2nc3c([N+](=O)[O-])cncc3[nH]2)c1COc1ccc(Cl)cc1 ZINC000587076415 GI Annotated Bother N#Cc1cc2nc(-c3cn(-c4ccc(Cl)cc4)nn3)[nH]c2cc1C(F)(F)F ZINC000587076455 GI Annotated Mild Oc1nc2cc3[nH]c(-c4ccc(-c5ccc(Cl)cc5)nc4O)nc3cc2[nH]1 ZINC000587076534 GI Annotated Anodyne Cc1nn(-c2ccc(Cl)cc2)cc1-c1nc2ccc(OCCN(C)C)cc2[nH]1 ZINC000587076554 GI Annotated Anodyne Cc1nn(-c2ccc(Cl)cc2)cc1-c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000587076588 GI Annotated Anodyne COC(=O)c1cc2[nH]c(-c3cn(-c4ccc(Cl)cc4)nc3C)nc2cc1OC ZINC000587076631 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cn(-c4ccc(Cl)cc4)nc3C)[nH]c2c1OC ZINC000587076681 GI Annotated Anodyne Oc1nc(-c2ccc(Cl)cc2)ccc1-c1nc2nc(C(F)(F)F)ncc2[nH]1 ZINC000587076767 GI Annotated Anodyne Oc1nc(-c2ccc(Cl)cc2)ccc1-c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000587076773 GI Annotated Anodyne Fc1cc(Br)c2[nH]c(-c3cn(-c4ccc(Cl)cc4)nn3)nc2c1 ZINC000587076851 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c([C@@H]3C=C(c4ccc(Cl)cc4)NO3)nc2c1 ZINC000587076947 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c([C@H]3C=C(c4ccc(Cl)cc4)NO3)nc2c1 ZINC000587076948 GI Annotated Anodyne FC1(F)Oc2cc3nc([C@@H]4C=C(c5ccc(Cl)cc5)NO4)[nH]c3cc2O1 ZINC000587076978 GI Annotated Anodyne FC1(F)Oc2cc3nc([C@H]4C=C(c5ccc(Cl)cc5)NO4)[nH]c3cc2O1 ZINC000587076979 GI Annotated Anodyne O=[N+]([O-])c1cc2nc([C@@H]3C=C(c4ccc(Cl)cc4)NO3)[nH]c2cc1Cl ZINC000587077005 GI Annotated Bother O=[N+]([O-])c1cc2nc([C@H]3C=C(c4ccc(Cl)cc4)NO3)[nH]c2cc1Cl ZINC000587077006 GI Annotated Bother Fc1cnc(Cl)c2[nH]c(CCc3nnc(-c4ccc(Cl)cc4)o3)nc12 ZINC000587077019 GI Annotated Anodyne O=C1COc2cc3nc(-c4ccncc4-c4ccc(Cl)cc4)[nH]c3cc2N1 ZINC000587077119 GI Annotated Anodyne Cc1c(Br)cnc2[nH]c([C@H]3C=C(c4ccc(Cl)cc4)NO3)nc12 ZINC000587077215 GI Annotated Anodyne Cc1c(Br)cnc2[nH]c([C@@H]3C=C(c4ccc(Cl)cc4)NO3)nc12 ZINC000587077216 GI Annotated Anodyne Cc1cc2[nH]c(CCc3nnc(-c4ccc(Cl)cc4)o3)nc2cc1[N+](=O)[O-] ZINC000587077267 GI Annotated Bother Cc1nc2[nH]c([C@@H]3C=C(c4ccc(Cl)cc4)NO3)nc2cc1Br ZINC000587077298 GI Annotated Anodyne Cc1nc2[nH]c([C@H]3C=C(c4ccc(Cl)cc4)NO3)nc2cc1Br ZINC000587077299 GI Annotated Anodyne Oc1nc(-c2ccc(Cl)cc2)ccc1-c1nc2c(S)nc(S)nc2[nH]1 ZINC000587077336 GI Annotated Anodyne Fc1cnc(Br)c2[nH]c([C@H]3C=C(c4ccc(Cl)cc4)NO3)nc12 ZINC000587077517 GI Annotated Anodyne Fc1cnc(Br)c2[nH]c([C@@H]3C=C(c4ccc(Cl)cc4)NO3)nc12 ZINC000587077518 GI Annotated Anodyne FC(F)(F)c1cnc2[nH]c(CCc3nnc(-c4ccc(Cl)cc4)o3)nc2c1 ZINC000587077535 GI Annotated Anodyne FC(F)(F)c1cc2nc(CCc3nnc(-c4ccc(Cl)cc4)o3)[nH]c2cn1 ZINC000587077580 GI Annotated Anodyne Fc1cc2nc(CCc3nnc(-c4ccc(Cl)cc4)o3)[nH]c2c(F)c1F ZINC000587077752 GI Annotated Anodyne Clc1ccc(-c2nnc(CCc3nc4cc5c(cc4[nH]3)OCCCO5)o2)cc1 ZINC000587077761 GI Annotated Anodyne CCCc1cc(=O)oc2cc(O[C@@H](C)c3nc4cncnc4[nH]3)c(Cl)cc12 ZINC000587077790 GI Annotated Anodyne CCCc1cc(=O)oc2cc(O[C@H](C)c3nc4cncnc4[nH]3)c(Cl)cc12 ZINC000587077799 GI Annotated Anodyne COC(=O)c1cc2nc([C@H]3Nc4ccc(Cl)cc4[C@H]4C=CC[C@H]43)[nH]c2cn1 ZINC000587077962 GI Annotated Clean CCCc1cc(=O)oc2cc(O[C@@H](C)c3nc4c(N)ccnc4[nH]3)c(Cl)cc12 ZINC000587078079 GI Annotated Anodyne CCCc1cc(=O)oc2cc(O[C@H](C)c3nc4c(N)ccnc4[nH]3)c(Cl)cc12 ZINC000587078080 GI Annotated Anodyne CCCc1cc(=O)oc2cc(O[C@@H](C)c3nc4cc(=N)[nH]cc4[nH]3)c(Cl)cc12 ZINC000587078093 GI Annotated Anodyne CCCc1cc(=O)oc2cc(O[C@H](C)c3nc4cc(=N)[nH]cc4[nH]3)c(Cl)cc12 ZINC000587078094 GI Annotated Anodyne CCCc1cc(=O)oc2cc(O[C@@H](C)c3nc4cc[nH]c(=N)c4[nH]3)c(Cl)cc12 ZINC000587078178 GI Annotated Anodyne CCCc1cc(=O)oc2cc(O[C@H](C)c3nc4cc[nH]c(=N)c4[nH]3)c(Cl)cc12 ZINC000587078179 GI Annotated Anodyne CCCc1cc(=O)oc2cc(O[C@@H](C)c3nc4ncc[nH]c-4n3)c(Cl)cc12 ZINC000587078516 GI Annotated Anodyne CCCc1cc(=O)oc2cc(O[C@H](C)c3nc4ncc[nH]c-4n3)c(Cl)cc12 ZINC000587078517 GI Annotated Anodyne CCCc1cc(=O)oc2cc(O[C@@H](C)c3nc4cnncc4[nH]3)c(Cl)cc12 ZINC000587078579 GI Annotated Anodyne CCCc1cc(=O)oc2cc(O[C@H](C)c3nc4cnncc4[nH]3)c(Cl)cc12 ZINC000587078580 GI Annotated Anodyne COC(=O)c1ccc2nc([C@H]3Nc4ccc(Cl)cc4[C@H]4C=CC[C@H]43)[nH]c2n1 ZINC000587078650 GI Annotated Clean N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2ccnc(Br)c2[nH]1 ZINC000587078706 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2ccnc(Br)c2[nH]1 ZINC000587078707 GI Annotated Anodyne N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2ccc(Br)nc2[nH]1 ZINC000587078714 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2ccc(Br)nc2[nH]1 ZINC000587078715 GI Annotated Anodyne N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2c(Br)ccnc2[nH]1 ZINC000587078764 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2c(Br)ccnc2[nH]1 ZINC000587078766 GI Annotated Anodyne N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587078819 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587078823 GI Annotated Anodyne N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000587078831 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000587078836 GI Annotated Anodyne N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc(Br)cnc2[nH]1 ZINC000587079051 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc(Br)cnc2[nH]1 ZINC000587079053 GI Annotated Anodyne N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc3c(cc2[nH]1)OC(F)(F)O3 ZINC000587079122 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc3c(cc2[nH]1)OC(F)(F)O3 ZINC000587079123 GI Annotated Anodyne N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cncc(Br)c2[nH]1 ZINC000587079264 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cncc(Br)c2[nH]1 ZINC000587079265 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@H]3Cc4cc(Cl)ccc4O3)[nH]c12 ZINC000587079717 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@@H]3Cc4cc(Cl)ccc4O3)[nH]c12 ZINC000587079718 GI Annotated Anodyne C=CCc1cccc2[nH]c(-c3noc(C)c3Cn3cc(Cl)c([N+](=O)[O-])n3)nc12 ZINC000587079724 GI Annotated Mild Sc1nc(S)c2nc([C@H]3Nc4ccc(Cl)cc4[C@H]4C=CC[C@H]43)[nH]c2n1 ZINC000587079762 GI Annotated Clean CCOC(=O)c1ccc2nc([C@@H](N)Cc3c[nH]c4cc(Cl)ccc34)[nH]c2c1 ZINC000587079822 GI Annotated Anodyne CCOC(=O)c1ccc2nc([C@H](N)Cc3c[nH]c4cc(Cl)ccc34)[nH]c2c1 ZINC000587079823 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587080229 GI Annotated Anodyne N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587080230 GI Annotated Anodyne O=C1COc2cc3[nH]c([C@H]4Nc5ccc(Cl)cc5[C@H]5C=CC[C@H]54)nc3cc2N1 ZINC000587080242 GI Annotated Clean Clc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](c1nc3ccc(-n4cnnn4)cc3[nH]1)N2 ZINC000587080298 GI Annotated Clean Clc1ccc2c(c1)C[C@@H](c1nc3ccc(I)cc3[nH]1)O2 ZINC000587080302 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587080308 GI Annotated Anodyne Clc1ccc2c(c1)C[C@H](c1nc3ccc(I)cc3[nH]1)O2 ZINC000587080311 GI Annotated Anodyne N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587080328 GI Annotated Anodyne Clc1ccc2ccn(Cc3nc4ccc(CN5CCOCC5)cc4[nH]3)c2c1 ZINC000587080378 GI Annotated Anodyne FC(F)(F)c1nc(Cl)[nH]c2nc([C@H]3Cc4cc(Cl)ccc4O3)nc1-2 ZINC000587080601 GI Annotated Anodyne FC(F)(F)c1nc(Cl)[nH]c2nc([C@@H]3Cc4cc(Cl)ccc4O3)nc1-2 ZINC000587080604 GI Annotated Anodyne N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000587080631 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000587080632 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc([C@@H](N)Cc3c[nH]c4cc(Cl)ccc34)[nH]c2c1 ZINC000587080836 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc([C@H](N)Cc3c[nH]c4cc(Cl)ccc34)[nH]c2c1 ZINC000587080837 GI Annotated Anodyne Clc1ncc2[nH]c(-c3cc(-c4ccccc4)nc4c(Cl)cnn34)nc2n1 ZINC000587080841 GI Annotated Anodyne N#Cc1cc2nc(-c3cc(-c4ccccc4)nc4c(Cl)cnn34)[nH]c2cc1C#N ZINC000587080913 GI Annotated Mild CC[C@@H](C)n1cc(Cl)c(-c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)n1 ZINC000587081147 GI Annotated Anodyne CC[C@H](C)n1cc(Cl)c(-c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)n1 ZINC000587081149 GI Annotated Anodyne N[C@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc(Br)ncc2[nH]1 ZINC000587081226 GI Annotated Anodyne N[C@@H](Cc1c[nH]c2cc(Cl)ccc12)c1nc2cc(Br)ncc2[nH]1 ZINC000587081228 GI Annotated Anodyne Clc1cnn2c(-c3nc4cc5[nH]ncc5cc4[nH]3)cc(-c3ccccc3)nc12 ZINC000587081308 GI Annotated Anodyne Clc1cnn2c(-c3nc4cc5c(cc4[nH]3)OCO5)cc(-c3ccccc3)nc12 ZINC000587081317 GI Annotated Anodyne COC(=O)c1ccnc2[nH]c([C@H]3Nc4ccc(Cl)cc4[C@H]4C=CC[C@H]43)nc12 ZINC000587081393 GI Annotated Clean Clc1ccc2c(c1)C[C@H](c1nc3cccc(I)c3[nH]1)O2 ZINC000587081434 GI Annotated Anodyne Clc1ccc2c(c1)C[C@@H](c1nc3cccc(I)c3[nH]1)O2 ZINC000587081435 GI Annotated Anodyne O=C1CCc2cc3nc(-c4cccc(OCn5cc(Cl)cn5)c4)[nH]c3cc2N1 ZINC000587081529 GI Annotated Anodyne Fc1cnc(Cl)c2[nH]c(-c3cccc(OCn4cc(Cl)cn4)c3)nc12 ZINC000587081644 GI Annotated Anodyne O=C(CCCc1nc2c(F)cnc(Br)c2[nH]1)c1ccc(Cl)cn1 ZINC000587081660 GI Annotated Anodyne Clc1ncnc2nc(-c3cc(-c4ccccc4)nc4c(Cl)cnn34)[nH]c12 ZINC000587081715 GI Annotated Anodyne Cc1c(Br)cnc2[nH]c(CCCC(=O)c3ccc(Cl)cn3)nc12 ZINC000587081757 GI Annotated Anodyne COc1cc(OC)c2[nH]c(-c3cccc(OCn4cc(Cl)cn4)c3)nc2c1 ZINC000587081769 GI Annotated Anodyne COc1cc2nc(-c3cccc(OCn4cc(Cl)cn4)c3)[nH]c2cc1OC ZINC000587081812 GI Annotated Anodyne O=C(CCCc1nc2cc(-n3cccn3)c(F)cc2[nH]1)c1ccc(Cl)cn1 ZINC000587081909 GI Annotated Anodyne Clc1cnn(COc2cccc(-c3nc4cc5c(cc4[nH]3)OCCCO5)c2)c1 ZINC000587082099 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3cccc(OCn4cc(Cl)cn4)c3)[nH]c2cc1F ZINC000587082108 GI Annotated Bother Cc1nc2[nH]c(CCCC(=O)c3ccc(Cl)cn3)nc2cc1Br ZINC000587082123 GI Annotated Anodyne O=C(CCCc1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1)c1ccc(Cl)cn1 ZINC000587082136 GI Annotated Bother N=c1nc(O)c2nc(-c3cc(-c4ccccc4)nc4c(Cl)cccc34)[nH]c2[nH]1 ZINC000587082213 GI Annotated Anodyne O=C(CCCc1nc2ccc(Br)c(O)c2[nH]1)c1ccc(Cl)cn1 ZINC000587082262 GI Annotated Anodyne Oc1nc(O)c2nc(-c3cc(-c4ccccc4)nc4c(Cl)cccc34)[nH]c2n1 ZINC000587082341 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(CCCC(=O)c3ccc(Cl)cn3)nc2c1 ZINC000587082542 GI Annotated Anodyne N#Cc1nc(Cl)cc2nc(-c3cccc(OCn4cc(Cl)cn4)c3)[nH]c12 ZINC000587082554 GI Annotated Mild Cc1ccc(-c2cc(-c3nc4c(N)ncnc4[nH]3)c3cccc(Cl)c3n2)o1 ZINC000587082740 GI Annotated Anodyne O=C1COc2cc3nc(-c4ccc5ccc(Cl)c(Cl)c5n4)[nH]c3cc2N1 ZINC000587082755 GI Annotated Anodyne Cc1cc2[nH]c(-c3cccc(OCn4cc(Cl)cn4)c3)nc2cc1[N+](=O)[O-] ZINC000587083059 GI Annotated Bother Cc1ccc(-c2cc(-c3nc4c(O)nc(O)nc4[nH]3)c3cccc(Cl)c3n2)o1 ZINC000587083122 GI Annotated Anodyne Sc1nc(S)c2nc(-c3ccc4ccc(Cl)c(Cl)c4n3)[nH]c2n1 ZINC000587083252 GI Annotated Anodyne Cc1ccc(-c2cc(-c3nc4c(O)ncnc4[nH]3)c3cccc(Cl)c3n2)o1 ZINC000587083384 GI Annotated Anodyne Cc1ccc(-c2cc(-c3nc4c[nH]c(=N)[nH]c-4n3)c3cccc(Cl)c3n2)o1 ZINC000587083429 GI Annotated Anodyne Clc1ccc2ccc(-c3nc4cc(-n5cnnn5)ccc4[nH]3)nc2c1Cl ZINC000587083512 GI Annotated Anodyne Cc1ccc(-c2cc(-c3nc4cnnc(O)c4[nH]3)c3cccc(Cl)c3n2)o1 ZINC000587083524 GI Annotated Anodyne COc1ccc(-c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c(Cl)n1 ZINC000587083649 GI Annotated Anodyne Clc1cccc(C2(c3nc4ccc(I)cc4[nH]3)CC2)n1 ZINC000587083876 GI Annotated Anodyne Clc1nc(-c2nc3nc(Br)c[nH]c-3n2)ccc1-c1ccccc1 ZINC000587084073 GI Annotated Anodyne O=[N+]([O-])c1c(Br)ccc2nc(C3(c4cccc(Cl)n4)CC3)[nH]c12 ZINC000587084173 GI Annotated Bother O=C1COc2cc3nc(-c4ccc(-c5ccccc5)c(Cl)n4)[nH]c3cc2N1 ZINC000587084300 GI Annotated Anodyne COc1ccc(-c2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)c(Cl)n1 ZINC000587084333 GI Annotated Clean O=C1c2ccccc2C(=O)c2c1ccc1nc(C3(c4cccc(Cl)n4)CC3)[nH]c21 ZINC000587084416 GI Annotated Clean Clc1ccc(-c2ccc(-c3nc4c(Br)cncc4[nH]3)cc2)nn1 ZINC000587084551 GI Annotated Anodyne FC(F)(F)Oc1cccc2nc(C3CCN(c4nccnc4Cl)CC3)[nH]c12 ZINC000587084650 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc(C3(c4cccc(Cl)n4)CC3)[nH]c12 ZINC000587084665 GI Annotated Anodyne Fc1c(Cl)cc2nc(C3CCN(c4nccnc4Cl)CC3)[nH]c2c1F ZINC000587084717 GI Annotated Anodyne Clc1cccc(C2(c3nc4cccc(I)c4[nH]3)CC2)n1 ZINC000587084763 GI Annotated Anodyne Clc1ccc(-c2ccc(-c3nc4c(Br)nccc4[nH]3)cc2)nn1 ZINC000587084909 GI Annotated Anodyne O=[N+]([O-])c1cc(Br)cc2nc(C3(c4cccc(Cl)n4)CC3)[nH]c12 ZINC000587084972 GI Annotated Bother Clc1nccnc1N1CCC(c2nc3cccc(Br)c3[nH]2)CC1 ZINC000587084995 GI Annotated Anodyne Clc1nccnc1N1CCC(c2nc3c(Cl)cnc(Cl)c3[nH]2)CC1 ZINC000587085058 GI Annotated Anodyne Clc1ccc(-c2ccc(-c3nc4ncc(Br)cc4[nH]3)cc2)nn1 ZINC000587085108 GI Annotated Anodyne CC1=C(c2ccc3nc(-c4ccc5cc(Cl)ncc5c4)[nH]c3c2)NNC(=O)C1 ZINC000587085170 GI Annotated Anodyne FC(F)(F)c1ncc2[nH]c(-c3ccc(-c4ccc(Cl)nn4)cc3)nc2n1 ZINC000587085217 GI Annotated Anodyne Clc1cnc2[nH]c(C3CCN(c4nccnc4Cl)CC3)nc2c1Cl ZINC000587085355 GI Annotated Anodyne Clc1cc2nc(C3CCN(c4nccnc4Cl)CC3)[nH]c2nc1Cl ZINC000587085376 GI Annotated Anodyne Clc1ccc(-c2ccc(-c3nc4cnc(Br)cc4[nH]3)cc2)nn1 ZINC000587085416 GI Annotated Anodyne Clc1ccc(-c2ccc(-c3nc4nc(Br)ccc4[nH]3)cc2)nn1 ZINC000587085421 GI Annotated Anodyne Cc1ccc2c(ccc3nc(C4CCN(c5nccnc5Cl)CC4)[nH]c32)n1 ZINC000587085517 GI Annotated Anodyne Clc1cc2nc(C3CCN(c4nccnc4Cl)CC3)[nH]c2c(Cl)n1 ZINC000587085533 GI Annotated Anodyne CC1=C(c2ccc3nc(-c4cc(Cl)nc5ccccc45)[nH]c3c2)NNC(=O)C1 ZINC000587085629 GI Annotated Anodyne FC(F)(F)c1cc(Br)c2[nH]c(-c3cnc(Cl)nc3)nc2c1 ZINC000587085784 GI Annotated Anodyne CC(C)COc1cc2nc(-c3cnc(Cl)nc3)[nH]c2cc1Br ZINC000587085844 GI Annotated Anodyne Clc1ncc(-c2nc3cc(Br)c(Br)cc3[nH]2)cn1 ZINC000587085852 GI Annotated Anodyne FC(F)(F)Oc1cc2nc(-c3cnc(Cl)nc3)[nH]c2cc1Br ZINC000587085906 GI Annotated Anodyne CC1=C(c2ccc3nc(-c4cc5ccccc5c(Cl)n4)[nH]c3c2)NNC(=O)C1 ZINC000587085915 GI Annotated Anodyne Nc1ncc(Cl)nc1-c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587086000 GI Annotated Anodyne Clc1ncc(-c2nc3c(Br)ccc(Br)c3[nH]2)cn1 ZINC000587086058 GI Annotated Anodyne FC(F)(F)Oc1cc(Br)c2[nH]c(-c3cnc(Cl)nc3)nc2c1 ZINC000587086099 GI Annotated Anodyne FC(F)(F)c1cc2nc(-c3cnc(Cl)nc3)[nH]c2cc1Br ZINC000587086119 GI Annotated Anodyne FC(F)(F)c1c(Br)ccc2nc(-c3cnc(Cl)nc3)[nH]c12 ZINC000587086187 GI Annotated Anodyne FC(F)(F)c1cc(Br)cc2nc(-c3cnc(Cl)nc3)[nH]c12 ZINC000587086248 GI Annotated Anodyne FC(F)(F)Oc1cc(Br)cc2nc(-c3cnc(Cl)nc3)[nH]c12 ZINC000587086263 GI Annotated Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=C\c1nc2ncc[nH]c-2n1 ZINC000587086292 GI Annotated Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=C/c1nc2ncc[nH]c-2n1 ZINC000587086293 GI Annotated Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=C\c1nc2cc(=N)[nH]cc2[nH]1 ZINC000587086349 GI Annotated Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=C/c1nc2cc(=N)[nH]cc2[nH]1 ZINC000587086350 GI Annotated Anodyne CC(C)COc1cc2nc(-c3nc(Cl)cnc3N)[nH]c2cc1Br ZINC000587086732 GI Annotated Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=C\c1nc2cnncc2[nH]1 ZINC000587086808 GI Annotated Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=C/c1nc2cnncc2[nH]1 ZINC000587086810 GI Annotated Anodyne Nc1ncc(Cl)nc1-c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587086846 GI Annotated Anodyne Nc1ncc(Cl)nc1-c1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1 ZINC000587086889 GI Annotated Anodyne CC(C)(F)[C@@H](Br)c1nc2cc(C#N)cc(Br)c2[nH]1 ZINC000587086895 GI Annotated Reactive CC(C)(F)[C@H](Br)c1nc2cc(C#N)cc(Br)c2[nH]1 ZINC000587086897 GI Annotated Reactive CC(C)(F)[C@H](Br)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587086934 GI Annotated Reactive CC(C)(F)[C@@H](Br)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587086935 GI Annotated Reactive O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)c1nc2ccc(Cl)cc2[nH]1 ZINC000587087015 GI Annotated Mild Oc1nc(NCc2ccccc2)c2nc(-c3c(Cl)[nH]c4ccccc34)nc-2[nH]1 ZINC000587087048 GI Annotated Anodyne O=C(O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)c1nc2cccc(Cl)c2[nH]1 ZINC000587087157 GI Annotated Mild FC(F)=C(C[C@@H]1CCCN1)c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587087193 GI Annotated Anodyne FC(F)=C(C[C@H]1CCCN1)c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587087200 GI Annotated Anodyne FC(Br)(Br)c1nc2ccc(Br)cc2[nH]1 ZINC000587087203 GI Annotated Anodyne Nc1ncc(Cl)nc1-c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587087296 GI Annotated Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=C\c1nc2cncnc2[nH]1 ZINC000587087334 GI Annotated Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=C/c1nc2cncnc2[nH]1 ZINC000587087336 GI Annotated Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=C\c1nc2cc[nH]c(=N)c2[nH]1 ZINC000587087414 GI Annotated Anodyne Cc1nn(Cc2ccc(Cl)cc2)c(Cl)c1/C=C/c1nc2cc[nH]c(=N)c2[nH]1 ZINC000587087415 GI Annotated Anodyne Nc1ncc(Cl)nc1-c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587087440 GI Annotated Anodyne Fc1c(Cl)cc2nc(C(F)(Br)Br)[nH]c2c1F ZINC000587087531 GI Annotated Anodyne FC(Br)(Br)c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000587087558 GI Annotated Anodyne CC(C)(F)[C@H](Br)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587087775 GI Annotated Reactive CC(C)(F)[C@@H](Br)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587087776 GI Annotated Reactive CC(C)(F)[C@@H](Br)c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587087779 GI Annotated Reactive CC(C)(F)[C@H](Br)c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587087780 GI Annotated Reactive CC(C)(F)[C@H](Br)c1nc2ccc(I)cc2[nH]1 ZINC000587087823 GI Annotated Reactive CC(C)(F)[C@@H](Br)c1nc2ccc(I)cc2[nH]1 ZINC000587087824 GI Annotated Reactive CC(C)(F)[C@H](Br)c1nc2cccc(I)c2[nH]1 ZINC000587087912 GI Annotated Reactive CC(C)(F)[C@@H](Br)c1nc2cccc(I)c2[nH]1 ZINC000587087914 GI Annotated Reactive CC(C)(F)[C@H](Br)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587087933 GI Annotated Reactive CC(C)(F)[C@@H](Br)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587087935 GI Annotated Reactive FC(F)(F)Oc1ccc2nc(C(F)(Br)Br)[nH]c2c1 ZINC000587088074 GI Annotated Anodyne CCCCOc1cc2nc(-c3nc(Cl)cnc3N)[nH]c2cc1Br ZINC000587088133 GI Annotated Anodyne FC(F)=C(C[C@@H]1CCCN1)c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587088167 GI Annotated Anodyne FC(F)=C(C[C@H]1CCCN1)c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587088169 GI Annotated Anodyne FC(F)=C(C[C@H]1CCCN1)c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587088343 GI Annotated Mild FC(F)=C(C[C@@H]1CCCN1)c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587088344 GI Annotated Mild FC(F)(F)Oc1cccc2nc(C(F)(Br)Br)[nH]c12 ZINC000587088345 GI Annotated Anodyne Clc1[nH]c2ccccc2c1-c1nc2cc(I)cnc2[nH]1 ZINC000587088370 GI Annotated Anodyne FC(Br)(Br)c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000587088382 GI Annotated Anodyne FC(F)(F)c1cccc2nc(C(F)(Br)Br)[nH]c12 ZINC000587088566 GI Annotated Anodyne FC(Br)(Br)c1nc2cccc(Br)c2[nH]1 ZINC000587088570 GI Annotated Anodyne FC(F)=C(C[C@@H]1CCCN1)c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587088842 GI Annotated Anodyne FC(F)=C(C[C@H]1CCCN1)c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587088847 GI Annotated Anodyne CCc1ccc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(=O)O)[nH]c2c1 ZINC000587088867 GI Annotated Mild O=C1c2ccccc2C(=O)c2c1ccc1nc(C(C[C@H]3CCCN3)=C(F)F)[nH]c21 ZINC000587088880 GI Annotated Clean O=C1c2ccccc2C(=O)c2c1ccc1nc(C(C[C@@H]3CCCN3)=C(F)F)[nH]c21 ZINC000587088882 GI Annotated Clean FC(F)(F)c1ccc2nc(C(F)(Br)Br)[nH]c2c1 ZINC000587088983 GI Annotated Anodyne FC(Br)(Br)c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000587089034 GI Annotated Anodyne Cc1cc(C)c2[nH]c(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(=O)O)nc2c1 ZINC000587089047 GI Annotated Mild Cc1c(F)ccc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(=O)O)[nH]c12 ZINC000587089073 GI Annotated Mild FC(Br)(Br)c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000587089083 GI Annotated Anodyne Cc1cc(F)c2[nH]c(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(=O)O)nc2c1 ZINC000587089119 GI Annotated Mild CCOC(=O)c1cc(Br)c2[nH]c(C(F)(F)c3ccccn3)nc2c1 ZINC000587089132 GI Annotated Anodyne Cc1cc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(=O)O)[nH]c2cc1C ZINC000587089149 GI Annotated Mild FC(F)C(F)(F)c1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587089290 GI Annotated Anodyne FC(F)(F)[C@@](F)(Cl)c1nc2cccc(I)c2[nH]1 ZINC000587089366 GI Annotated Anodyne FC(F)(F)[C@](F)(Cl)c1nc2cccc(I)c2[nH]1 ZINC000587089367 GI Annotated Anodyne Cc1ccc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(=O)O)[nH]c2c1C ZINC000587089453 GI Annotated Mild Cc1ccc(C)c2[nH]c(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(=O)O)nc12 ZINC000587089510 GI Annotated Mild O=[N+]([O-])c1cccc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c12 ZINC000587089651 GI Annotated Mild O=C1c2ccccc2C(=O)c2c1ccc1nc([C@@](F)(Cl)C(F)(F)F)[nH]c21 ZINC000587089653 GI Annotated Clean O=C1c2ccccc2C(=O)c2c1ccc1nc([C@](F)(Cl)C(F)(F)F)[nH]c21 ZINC000587089654 GI Annotated Clean O=[N+]([O-])c1cc(Br)cc2nc([C@](F)(Cl)C(F)(F)F)[nH]c12 ZINC000587089674 GI Annotated Bother O=[N+]([O-])c1cc(Br)cc2nc([C@@](F)(Cl)C(F)(F)F)[nH]c12 ZINC000587089676 GI Annotated Bother Cc1cc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(=O)O)[nH]c2cc1F ZINC000587089766 GI Annotated Mild FC(F)C(F)(F)c1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587089843 GI Annotated Anodyne O=C(O)c1cc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c2cc1F ZINC000587089861 GI Annotated Mild O=C(O)c1cc(F)cc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c12 ZINC000587089980 GI Annotated Mild OCCc1ccc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c2c1 ZINC000587090036 GI Annotated Mild O=[N+]([O-])c1ccc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c2c1 ZINC000587090056 GI Annotated Mild FC(F)(F)C(F)(F)C(F)(F)C(F)(F)c1nc2cc3cn[nH]c3cc2[nH]1 ZINC000587090088 GI Annotated Mild N#Cc1cc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c2cc1C#N ZINC000587090162 GI Annotated Mild O=C(O)c1ccc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c2c1 ZINC000587090259 GI Annotated Mild Oc1nc2cc3nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c3cc2[nH]1 ZINC000587090280 GI Annotated Mild O=C(O)c1cccc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c12 ZINC000587090286 GI Annotated Mild N[C@H](N=O)c1ccc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c2c1 ZINC000587090399 GI Annotated Mild N[C@@H](N=O)c1ccc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c2c1 ZINC000587090400 GI Annotated Mild COC(=O)c1cc(Br)c2[nH]c([C@@](F)(Cl)C(F)(F)F)nc2c1 ZINC000587090459 GI Annotated Anodyne FC(F)(F)C(F)(F)C(F)(F)C(F)(F)c1nc2cc3c(cc2[nH]1)OCO3 ZINC000587090461 GI Annotated Mild COC(=O)c1cc(Br)c2[nH]c([C@](F)(Cl)C(F)(F)F)nc2c1 ZINC000587090465 GI Annotated Anodyne N#Cc1nc(Cl)cc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c12 ZINC000587090563 GI Annotated Mild COC(=O)c1cccc2nc(C(F)(F)C(F)(F)C(F)(F)C(F)(F)F)[nH]c12 ZINC000587090567 GI Annotated Mild FC(F)(F)C(F)(F)C(F)(F)C(F)(F)c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000587090651 GI Annotated Mild O=[N+]([O-])c1c(Br)ccc2nc([C@](F)(Cl)C(F)(F)F)[nH]c12 ZINC000587090668 GI Annotated Bother O=[N+]([O-])c1c(Br)ccc2nc([C@@](F)(Cl)C(F)(F)F)[nH]c12 ZINC000587090669 GI Annotated Bother FC(F)(F)[C@@](F)(Cl)c1nc2ccc(I)cc2[nH]1 ZINC000587090819 GI Annotated Anodyne FC(F)(F)[C@](F)(Cl)c1nc2ccc(I)cc2[nH]1 ZINC000587090820 GI Annotated Anodyne FC(F)(F)CSc1cc(-c2nc3cnc(C(F)(F)F)[nH]c-3n2)ccn1 ZINC000587090860 GI Annotated Anodyne FC(F)(F)CSc1cc(-c2nc3c(Br)ccnc3[nH]2)ccn1 ZINC000587090884 GI Annotated Anodyne Fc1ccc2nc(-c3ccnc(OCC(F)(F)F)c3)[nH]c2c1Br ZINC000587090916 GI Annotated Anodyne FC(F)(F)CSc1cc(-c2nc3cncc(Br)c3[nH]2)ccn1 ZINC000587090950 GI Annotated Anodyne CC(C)(C)OC(=O)N1CCC(OCC(F)(F)F)(c2nc3ccccc3[nH]2)CC1 ZINC000587090963 GI Annotated Anodyne Fc1cc(Br)c2[nH]c(-c3ccnc(OCC(F)(F)F)c3)nc2c1 ZINC000587090980 GI Annotated Anodyne OCc1ccc2[nH]c(-c3ccc(C(F)(F)F)nc3OCC(F)(F)F)nc2c1 ZINC000587091028 GI Annotated Anodyne Fc1cnc2nc(-c3ccc(C(F)(F)F)nc3OCC(F)(F)F)[nH]c2c1 ZINC000587091038 GI Annotated Mild FC(F)(F)CSc1cc(-c2nc3cc(Br)ncc3[nH]2)ccn1 ZINC000587091134 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3ccnc(SCC(F)(F)F)c3)[nH]c2c1 ZINC000587091151 GI Annotated Anodyne Fc1cc2[nH]c(-c3ccnc(OCC(F)(F)F)c3)nc2cc1Br ZINC000587091159 GI Annotated Anodyne FC(F)(F)COc1cc(-c2nc3ccc(OC(F)(F)F)cc3[nH]2)ccn1 ZINC000587091160 GI Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2cnc3ccccc3c2[nH]1)C(F)(F)F ZINC000587091209 GI Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2cnc3ccccc3c2[nH]1)C(F)(F)F ZINC000587091213 GI Annotated Anodyne Oc1c(Br)ccc2nc(-c3ccnc(OCC(F)(F)F)c3)[nH]c12 ZINC000587091227 GI Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2ccc(SC)cc2[nH]1)C(F)(F)F ZINC000587091233 GI Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2ccc(SC)cc2[nH]1)C(F)(F)F ZINC000587091236 GI Annotated Anodyne Fc1cnc(Br)c2[nH]c(-c3ncoc3CCC(F)(F)F)nc12 ZINC000587091263 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3ccnc(SCC(F)(F)F)c3)[nH]c2c1OC ZINC000587091334 GI Annotated Anodyne Cc1cnc2nc(-c3ccc(C(F)(F)F)nc3OCC(F)(F)F)[nH]c2c1 ZINC000587091346 GI Annotated Anodyne O=[N+]([O-])c1cc(-c2nc3cc(Cl)c(Cl)cc3[nH]2)nn1CC(F)(F)F ZINC000587091350 GI Annotated Bother N#Cc1ccc2[nH]c(-c3ccc(C(F)(F)F)nc3OCC(F)(F)F)nc2c1 ZINC000587091438 GI Annotated Mild Fc1cc(Br)cc2nc(-c3ccnc(OCC(F)(F)F)c3)[nH]c12 ZINC000587091553 GI Annotated Anodyne Fc1c(Br)ccc2nc(-c3ccnc(OCC(F)(F)F)c3)[nH]c12 ZINC000587091587 GI Annotated Anodyne N#Cc1cc(Br)c2[nH]c(-c3ncoc3CCC(F)(F)F)nc2c1 ZINC000587091618 GI Annotated Mild C=CCc1cccc2nc([C@@](N)(c3ccccc3OCC)C(F)(F)F)[nH]c12 ZINC000587091630 GI Annotated Mild C=CCc1cccc2nc([C@](N)(c3ccccc3OCC)C(F)(F)F)[nH]c12 ZINC000587091639 GI Annotated Mild COC(=O)c1cc2[nH]c(-c3ccnc(SCC(F)(F)F)c3)nc2cc1OC ZINC000587091697 GI Annotated Anodyne Oc1ccc2[nH]c(-c3ccc(C(F)(F)F)nc3OCC(F)(F)F)nc2c1 ZINC000587091744 GI Annotated Anodyne Nc1ccc(-c2ccc3nc(-c4ccnc(OCC(F)(F)F)c4)[nH]c3c2)cc1N ZINC000587091748 GI Annotated Anodyne N#Cc1cccc2[nH]c(-c3ccc(C(F)(F)F)nc3OCC(F)(F)F)nc12 ZINC000587091775 GI Annotated Mild Cc1ccnc2nc(-c3ccc(C(F)(F)F)nc3OCC(F)(F)F)[nH]c12 ZINC000587091817 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(-c3ccnc(OCC(F)(F)F)c3)nc2c1 ZINC000587091834 GI Annotated Anodyne FC(F)(F)COc1nc(C(F)(F)F)ccc1-c1nc2ncnc(Cl)c2[nH]1 ZINC000587092020 GI Annotated Anodyne Cc1ccc2[nH]c(-c3ccc(C(F)(F)F)nc3OCC(F)(F)F)nc2n1 ZINC000587092064 GI Annotated Anodyne Cc1nccc2nc(-c3ccc(C(F)(F)F)nc3OCC(F)(F)F)[nH]c12 ZINC000587092160 GI Annotated Anodyne O=[N+]([O-])c1cc(-c2nc3cc(Cl)cc(Cl)c3[nH]2)nn1CC(F)(F)F ZINC000587092182 GI Annotated Bother FC(F)(F)CSc1cc(-c2nc3ccc(Br)nc3[nH]2)ccn1 ZINC000587092216 GI Annotated Anodyne N#Cc1cc(Br)c2[nH]c(-c3ccnc(OCC(F)(F)F)c3)nc2c1 ZINC000587092248 GI Annotated Mild FC(F)(F)CSc1cc(-c2nc3cc4c(cc3[nH]2)OCCCO4)ccn1 ZINC000587092278 GI Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2cc(OC)c(Cl)cc2[nH]1)C(F)(F)F ZINC000587092398 GI Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2cc(OC)c(Cl)cc2[nH]1)C(F)(F)F ZINC000587092399 GI Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2cc(OC)c(C)cc2[nH]1)C(F)(F)F ZINC000587092473 GI Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2cc(OC)c(C)cc2[nH]1)C(F)(F)F ZINC000587092485 GI Annotated Anodyne FC(F)(F)CCc1ocnc1-c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587092521 GI Annotated Anodyne FC(F)(F)CSc1cc(-c2nc3ccnc(Br)c3[nH]2)ccn1 ZINC000587092536 GI Annotated Anodyne Cc1cncc2[nH]c(-c3ccc(C(F)(F)F)nc3OCC(F)(F)F)nc12 ZINC000587092568 GI Annotated Anodyne FC(F)(F)COc1cc(-c2nc3cccc(OC(F)(F)F)c3[nH]2)ccn1 ZINC000587092590 GI Annotated Anodyne N#Cc1cc2nc(-c3ccnc(OCC(F)(F)F)c3)[nH]c2cc1C(F)(F)F ZINC000587092635 GI Annotated Mild FC(F)(F)CSc1cc(-c2nc3cc(Br)cnc3[nH]2)ccn1 ZINC000587092636 GI Annotated Anodyne CN(C)CCOc1ccc2nc(-c3ccnc(SCC(F)(F)F)c3)[nH]c2c1 ZINC000587092640 GI Annotated Anodyne Cc1nc2[nH]c(-c3ccnc(OCC(F)(F)F)c3)nc2cc1Br ZINC000587092725 GI Annotated Anodyne C[C@@H](NC(=O)CC(F)(F)F)c1nc2cc(Cl)cc(Br)c2[nH]1 ZINC000587092759 GI Annotated Anodyne C[C@H](NC(=O)CC(F)(F)F)c1nc2cc(Cl)cc(Br)c2[nH]1 ZINC000587092764 GI Annotated Anodyne FC(F)(F)[C@H]1C[C@@H]1c1nc2c(Br)cnc(Br)c2[nH]1 ZINC000587092778 GI Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2cc(C#N)cc(Cl)c2[nH]1)C(F)(F)F ZINC000587092836 GI Annotated Mild CCOc1ccccc1[C@@](N)(c1nc2cc(C#N)cc(Cl)c2[nH]1)C(F)(F)F ZINC000587092838 GI Annotated Mild Cc1csc([C@@](O)(Cc2nc3cc(C)c(Cl)cc3[nH]2)C(F)(F)F)n1 ZINC000587092885 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cc(C)c(Cl)cc3[nH]2)C(F)(F)F)n1 ZINC000587092891 GI Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2ccc(C(C)(C)C)nc2[nH]1)C(F)(F)F ZINC000587092954 GI Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2ccc(C(C)(C)C)nc2[nH]1)C(F)(F)F ZINC000587092958 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cc(Cl)cc(C)c3[nH]2)C(F)(F)F)n1 ZINC000587092994 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cc(Cl)cc(C)c3[nH]2)C(F)(F)F)n1 ZINC000587092995 GI Annotated Anodyne O=[N+]([O-])c1cc(-c2nc3cc(F)cc(C(F)(F)F)c3[nH]2)nn1CC(F)(F)F ZINC000587093072 GI Annotated Mild Cc1c(Br)cnc2[nH]c(-c3ncoc3CCC(F)(F)F)nc12 ZINC000587093086 GI Annotated Anodyne O=[N+]([O-])c1cc(-c2nc3cc(C(F)(F)F)c(F)cc3[nH]2)nn1CC(F)(F)F ZINC000587093109 GI Annotated Mild Cc1nc2[nH]c(-c3ncoc3CCC(F)(F)F)nc2cc1Br ZINC000587093110 GI Annotated Anodyne Oc1c(Br)ccc2nc(-c3ncoc3CCC(F)(F)F)[nH]c12 ZINC000587093165 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c([C@H]3C[C@@H]3C(F)(F)F)nc2c1 ZINC000587093472 GI Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2c(C)cnc(Cl)c2[nH]1)C(F)(F)F ZINC000587093835 GI Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2c(C)cnc(Cl)c2[nH]1)C(F)(F)F ZINC000587093838 GI Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2cc(F)c(F)c(F)c2[nH]1)C(F)(F)F ZINC000587093855 GI Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2cc(F)c(F)c(F)c2[nH]1)C(F)(F)F ZINC000587093858 GI Annotated Anodyne CCOc1ccccc1[C@](N)(c1nc2ccc3ncccc3c2[nH]1)C(F)(F)F ZINC000587093907 GI Annotated Anodyne CCOc1ccccc1[C@@](N)(c1nc2ccc3ncccc3c2[nH]1)C(F)(F)F ZINC000587093908 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)C(F)(F)F)n1 ZINC000587093924 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3ccc(C(F)(F)F)cc3[nH]2)C(F)(F)F)n1 ZINC000587093925 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3ccnc(SCC(F)(F)F)c3)[nH]c2cc1[N+](=O)[O-] ZINC000587093945 GI Annotated Bother N=c1[nH]c2nc(-c3cc(C(F)(F)F)ccc3C(F)(F)F)nc-2c(Cl)[nH]1 ZINC000587093969 GI Annotated Anodyne O=C1CCc2cc3nc(-c4ccnc(SCC(F)(F)F)c4)[nH]c3cc2N1 ZINC000587093976 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cc(Cl)cc(F)c3[nH]2)C(F)(F)F)n1 ZINC000587094034 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cc(Cl)cc(F)c3[nH]2)C(F)(F)F)n1 ZINC000587094035 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3ccc(OC(C)C)cc3[nH]2)C(F)(F)F)n1 ZINC000587094042 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3ccc(OC(C)C)cc3[nH]2)C(F)(F)F)n1 ZINC000587094043 GI Annotated Anodyne C[C@H](NC(=O)CC(F)(F)F)c1nc2ccc(Oc3ccc(N)cc3)cc2[nH]1 ZINC000587094068 GI Annotated Clean C[C@@H](NC(=O)CC(F)(F)F)c1nc2ccc(Oc3ccc(N)cc3)cc2[nH]1 ZINC000587094069 GI Annotated Clean Cc1csc([C@](O)(Cc2nc3cc(Cl)c(F)cc3[nH]2)C(F)(F)F)n1 ZINC000587094072 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cc(Cl)c(F)cc3[nH]2)C(F)(F)F)n1 ZINC000587094073 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cc(Cl)c(F)c(F)c3[nH]2)C(F)(F)F)n1 ZINC000587094102 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cc(Cl)c(F)c(F)c3[nH]2)C(F)(F)F)n1 ZINC000587094103 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3ccc(C(C)(C)C)nc3[nH]2)C(F)(F)F)n1 ZINC000587094164 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3ccc(C(C)(C)C)nc3[nH]2)C(F)(F)F)n1 ZINC000587094165 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cc4ccccc4cc3[nH]2)C(F)(F)F)n1 ZINC000587094206 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cc4ccccc4cc3[nH]2)C(F)(F)F)n1 ZINC000587094207 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3c(Cl)c(Cl)cnc3[nH]2)C(F)(F)F)n1 ZINC000587094386 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3c(Cl)c(Cl)cnc3[nH]2)C(F)(F)F)n1 ZINC000587094387 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cc(Cl)c(Cl)nc3[nH]2)C(F)(F)F)n1 ZINC000587094398 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cc(Cl)c(Cl)nc3[nH]2)C(F)(F)F)n1 ZINC000587094399 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3ccc4c(c3[nH]2)CCCC4)C(F)(F)F)n1 ZINC000587094400 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3ccc4c(c3[nH]2)CCCC4)C(F)(F)F)n1 ZINC000587094401 GI Annotated Anodyne N=c1[nH]c2nc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)nc-2c(Cl)[nH]1 ZINC000587094575 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3ccc(Cl)c(C)c3[nH]2)C(F)(F)F)n1 ZINC000587094714 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3ccc(Cl)c(C)c3[nH]2)C(F)(F)F)n1 ZINC000587094715 GI Annotated Anodyne C[C@@H](NC(=O)CC(F)(F)F)c1nc2cc(Br)cc(Cl)c2[nH]1 ZINC000587094716 GI Annotated Anodyne C[C@H](NC(=O)CC(F)(F)F)c1nc2cc(Br)cc(Cl)c2[nH]1 ZINC000587094717 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3c(Cl)cnc(Cl)c3[nH]2)C(F)(F)F)n1 ZINC000587094744 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3c(Cl)cnc(Cl)c3[nH]2)C(F)(F)F)n1 ZINC000587094745 GI Annotated Anodyne COC(=O)c1cc2nc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)[nH]c2cn1 ZINC000587094788 GI Annotated Anodyne FC(F)(F)c1ccc(-c2nc3ccc(-n4cnnn4)cc3[nH]2)c(C(F)(F)F)c1 ZINC000587094823 GI Annotated Anodyne COC(=O)c1cc2nc(-c3cc(C(F)(F)F)ccc3C(F)(F)F)[nH]c2cn1 ZINC000587094840 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)[nH]c2n1 ZINC000587094859 GI Annotated Anodyne Cc1c(Br)cc2nc([C@@H](C)NC(=O)CC(F)(F)F)[nH]c2c1C ZINC000587094882 GI Annotated Anodyne Cc1c(Br)cc2nc([C@H](C)NC(=O)CC(F)(F)F)[nH]c2c1C ZINC000587094883 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3ccc4nc(C)ccc4c3[nH]2)C(F)(F)F)n1 ZINC000587094898 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3ccc4nc(C)ccc4c3[nH]2)C(F)(F)F)n1 ZINC000587094899 GI Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3ccc(C(F)(F)F)cc3C(F)(F)F)nc12 ZINC000587094919 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cc(Cl)nc(Cl)c3[nH]2)C(F)(F)F)n1 ZINC000587094953 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cc(Cl)nc(Cl)c3[nH]2)C(F)(F)F)n1 ZINC000587094954 GI Annotated Anodyne Cc1csc([C@](O)(Cc2nc3cccc(C(F)(F)F)c3[nH]2)C(F)(F)F)n1 ZINC000587094998 GI Annotated Anodyne Cc1csc([C@@](O)(Cc2nc3cccc(C(F)(F)F)c3[nH]2)C(F)(F)F)n1 ZINC000587094999 GI Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3cc(C(F)(F)F)ccc3C(F)(F)F)nc12 ZINC000587095029 GI Annotated Anodyne FC(F)(F)c1ccc(C(F)(F)F)c(-c2nc3ccc(-n4cnnn4)cc3[nH]2)c1 ZINC000587095059 GI Annotated Anodyne Cc1ccc(Cc2nc3ccc(OCCN(C)C)cc3[nH]2)cc1C(F)(F)F ZINC000587095127 GI Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3ccc(C(F)(F)F)cc3C(F)(F)F)nc12 ZINC000587095152 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cc(C(F)(F)F)ccc3C(F)(F)F)[nH]c2n1 ZINC000587095209 GI Annotated Anodyne N#Cc1cc(Br)c2[nH]c(-c3ccc(N)cc3C(F)(F)F)nc2c1 ZINC000587095238 GI Annotated Mild COC(=O)c1ccnc2[nH]c(-c3cc(C(F)(F)F)ccc3C(F)(F)F)nc12 ZINC000587095365 GI Annotated Anodyne Cc1ccc(Cc2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)cc1C(F)(F)F ZINC000587095562 GI Annotated Bother Cc1ccc(Cc2nc3ccc(CN4CCOCC4)cc3[nH]2)cc1C(F)(F)F ZINC000587095590 GI Annotated Anodyne Nc1ccc(-c2nc3c(F)cnc(Br)c3[nH]2)c(C(F)(F)F)c1 ZINC000587095603 GI Annotated Anodyne COC(=O)c1cc2[nH]c(Cc3ccc(C)c(C(F)(F)F)c3)nc2cc1OC ZINC000587095621 GI Annotated Anodyne Nc1ccc(-c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)c(C(F)(F)F)c1 ZINC000587095672 GI Annotated Anodyne COC(=O)c1ccc2nc(Cc3ccc(C)c(C(F)(F)F)c3)[nH]c2c1OC ZINC000587095735 GI Annotated Anodyne Cc1ccc2c3c(cc(-c4cnc5ncnn5c4C)nc13)-c1ccccc1C2=O ZINC000587095835 GI Annotated Anodyne CC1=C(c2cc3c4c(ccc(C)c4n2)C(=O)c2ccccc2-3)[C@@H](C)N2NN=NC2=N1 ZINC000587096117 GI Annotated Anodyne CC1=C(c2cc3c4c(ccc(C)c4n2)C(=O)c2ccccc2-3)[C@H](C)N2NN=NC2=N1 ZINC000587096123 GI Annotated Anodyne Cc1ccc2c3c(c4c(nc13)[C@H](Cn1cncn1)CCC4)-c1ccccc1C2=O ZINC000587096190 GI Annotated Anodyne Cc1ccc2c3c(c4c(nc13)[C@@H](Cn1cncn1)CCC4)-c1ccccc1C2=O ZINC000587096192 GI Annotated Anodyne CCOC(=O)C[C@H](C(C)=O)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000587096317 GI Annotated Anodyne CCOC(=O)C[C@@H](C(C)=O)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000587096319 GI Annotated Anodyne CCOC(=O)[C@@H]1C(=O)Cc2nc3c(C)ccc4c3c(c2[C@@H]1C)-c1ccccc1C4=O ZINC000587096336 GI Annotated Anodyne CCOC(=O)[C@H]1C(=O)Cc2nc3c(C)ccc4c3c(c2[C@@H]1C)-c1ccccc1C4=O ZINC000587096338 GI Annotated Anodyne CCOC(=O)[C@@H]1C(=O)Cc2nc3c(C)ccc4c3c(c2[C@H]1C)-c1ccccc1C4=O ZINC000587096339 GI Annotated Anodyne CCOC(=O)[C@H]1C(=O)Cc2nc3c(C)ccc4c3c(c2[C@H]1C)-c1ccccc1C4=O ZINC000587096340 GI Annotated Anodyne CCOC(=O)C(=O)[C@@H]1CCCc2c1nc1c(C)ccc3c1c2-c1ccccc1C3=O ZINC000587096490 GI Annotated Anodyne CCOC(=O)C(=O)[C@H]1CCCc2c1nc1c(C)ccc3c1c2-c1ccccc1C3=O ZINC000587096492 GI Annotated Anodyne C=C1N=C2N=CNN2C(C)=C1c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000587096605 GI Annotated Anodyne Cc1ccc2c3c(c4c(nc13)-c1ccc(=O)n(C)c1CC4)-c1ccccc1C2=O ZINC000587096666 GI Annotated Anodyne COc1ccc(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)c(C(F)(F)F)c1 ZINC000587096691 GI Annotated Bother CCOC(=O)Cc1ccc2nc(-c3ccc(OC)cc3C(F)(F)F)[nH]c2c1 ZINC000587096747 GI Annotated Anodyne CCOC(=O)[C@@H](CC(C)=O)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000587096753 GI Annotated Anodyne CCOC(=O)[C@H](CC(C)=O)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000587096755 GI Annotated Anodyne Cc1ccc2c3c(cc(-c4cnc5nncn5c4C)nc13)-c1ccccc1C2=O ZINC000587096832 GI Annotated Anodyne CCOC(=O)[C@@H](CCOC)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000587096947 GI Annotated Anodyne CCOC(=O)[C@H](CCOC)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000587096949 GI Annotated Anodyne Cc1nn(CC(=O)O)c(C)c1-c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000587097042 GI Annotated Anodyne Cc1ccc2c3c(c(CC(=O)O)c(-c4ccccn4)nc13)-c1ccccc1C2=O ZINC000587097264 GI Annotated Anodyne Cc1ccc2c3c(c(CC(=O)O)c(-c4ccncc4)nc13)-c1ccccc1C2=O ZINC000587097514 GI Annotated Anodyne CC1=C(c2cc3c4c(ccc(C)c4n2)C(=O)c2ccccc2-3)Cn2ncnc2N1C ZINC000587097523 GI Annotated Anodyne COC(=O)c1cc2[nH]c(-c3ccc(OC)cc3C(F)(F)F)nc2cc1OC ZINC000587097563 GI Annotated Anodyne CCC(=O)[C@H](C(=O)OC)c1nc2c(C)ccc3c2c(c1C)-c1ccccc1C3=O ZINC000587097653 GI Annotated Anodyne CCC(=O)[C@@H](C(=O)OC)c1nc2c(C)ccc3c2c(c1C)-c1ccccc1C3=O ZINC000587097658 GI Annotated Anodyne Cc1ccc2c3c(c4c(nc13)-c1c(O)cc(O)nc1CC4)-c1ccccc1C2=O ZINC000587097764 GI Annotated Anodyne COc1ccc(-c2nc3ccc(CN4CCOCC4)cc3[nH]2)c(C(F)(F)F)c1 ZINC000587097827 GI Annotated Anodyne COC(=O)CC[C@@H](C(C)=O)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000587097851 GI Annotated Anodyne COC(=O)CC[C@H](C(C)=O)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000587097853 GI Annotated Anodyne Cc1ccc2c3c(cc(-c4cccc(-n5cnnn5)c4)nc13)-c1ccccc1C2=O ZINC000587097876 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3ccc(OC)cc3C(F)(F)F)[nH]c2c1OC ZINC000587098013 GI Annotated Anodyne CCOC(=O)[C@@H](C(C)=O)c1c(C)nc2c(C)ccc3c2c1-c1ccccc1C3=O ZINC000587098070 GI Annotated Anodyne CCOC(=O)[C@H](C(C)=O)c1c(C)nc2c(C)ccc3c2c1-c1ccccc1C3=O ZINC000587098072 GI Annotated Anodyne Cc1ccc2c3c(cc(Cn4nc([N+](=O)[O-])cc4C)nc13)-c1ccccc1C2=O ZINC000587098127 GI Annotated Bother CC1=C(c2cc3c4c(ccc(C)c4n2)C(=O)c2ccccc2-3)[C@H](C)N2NC=NC2=N1 ZINC000587098195 GI Annotated Anodyne CC1=C(c2cc3c4c(ccc(C)c4n2)C(=O)c2ccccc2-3)[C@@H](C)N2NC=NC2=N1 ZINC000587098197 GI Annotated Anodyne Cc1ccc2c3c(cc(Cc4ncccc4C(=O)O)nc13)-c1ccccc1C2=O ZINC000587098448 GI Annotated Anodyne Cc1nc2ncc(-c3cc4c5c(ccc(C)c5n3)C(=O)c3ccccc3-4)c(C)n2n1 ZINC000587098509 GI Annotated Anodyne CCOC(=O)[C@@H](Cc1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2)C(C)=O ZINC000587098767 GI Annotated Anodyne CCOC(=O)[C@H](Cc1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2)C(C)=O ZINC000587098772 GI Annotated Anodyne Fc1cccc(-c2nc3ccc(CN4CCOCC4)cc3[nH]2)c1C(F)(F)F ZINC000587098869 GI Annotated Anodyne Cc1ccc2c3c(cc(-c4cc([N+](=O)[O-])cnc4O)nc13)-c1ccccc1C2=O ZINC000587099019 GI Annotated Bother Cc1ccc2c3c(cc(-c4ccc(-n5cnnn5)cc4)nc13)-c1ccccc1C2=O ZINC000587099052 GI Annotated Anodyne O=C1c2ccccc2-c2cc(Cn3cc(Br)cn3)nc3cccc1c23 ZINC000587100843 GI Annotated Anodyne Cc1ccc2c3c(c4c(nc13)[C@@]1(C)CCC(=O)C[C@@]1(O)C4)-c1ccccc1C2=O ZINC000587101495 GI Annotated Anodyne Cc1ccc2c3c(cc(C4CCS(=O)(=O)CC4)nc13)-c1ccccc1C2=O ZINC000587101549 GI Annotated Anodyne CC1=CC(=O)[C@@H](c2nc3c(C)ccc4c3c(c2C)-c2ccccc2C4=O)C(=O)O1 ZINC000587101731 GI Annotated Mild CC1=CC(=O)[C@H](c2nc3c(C)ccc4c3c(c2C)-c2ccccc2C4=O)C(=O)O1 ZINC000587101734 GI Annotated Mild O=C1c2ccccc2-c2c3c(nc4cccc1c24)C(=O)[C@@H](Br)CC3 ZINC000587101785 GI Annotated Reactive O=C1c2ccccc2-c2c3c(nc4cccc1c24)C(=O)[C@H](Br)CC3 ZINC000587101788 GI Annotated Reactive CC(C)[C@H](NC(=O)CCl)c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587102065 GI Annotated Reactive CC(C)[C@@H](NC(=O)CCl)c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587102066 GI Annotated Reactive O=C1c2ccccc2-c2c3c(nc4cccc1c24)[C@H](Br)C(=O)CC3 ZINC000587102180 GI Annotated Reactive O=C1c2ccccc2-c2c3c(nc4cccc1c24)[C@@H](Br)C(=O)CC3 ZINC000587102183 GI Annotated Reactive CSc1ncc(-c2cc3c4c(ccc(C)c4n2)C(=O)c2ccccc2-3)c(=N)[nH]1 ZINC000587102928 GI Annotated Anodyne Cc1ccc2c3c(c4c(nc13)[C@@H](S(C)(=O)=O)CCC4)-c1ccccc1C2=O ZINC000587103395 GI Annotated Anodyne Cc1ccc2c3c(c4c(nc13)[C@H](S(C)(=O)=O)CCC4)-c1ccccc1C2=O ZINC000587103402 GI Annotated Anodyne COP(O)(OC)=C([N+]#N)c1cc2c3c(ccc(C)c3n1)C(=O)c1ccccc1-2 ZINC000587103641 GI Annotated Unstable CCOC(=O)C(F)(F)[C@H]1Cc2nc3cccc4c3c(c2C1)-c1ccccc1C4=O ZINC000587103690 GI Annotated Anodyne CCOC(=O)C(F)(F)[C@@H]1Cc2nc3cccc4c3c(c2C1)-c1ccccc1C4=O ZINC000587103691 GI Annotated Anodyne Cc1cccnc1NC(=O)Cc1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587103776 GI Annotated Anodyne Cc1cccc(NC(=O)Cc2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)n1 ZINC000587103781 GI Annotated Anodyne O=C1c2ccccc2-c2cc(-c3ccc(-n4cnnn4)cc3)nc3cccc1c23 ZINC000587103918 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H]1Cc2nc3cccc4c3c(c2C1)-c1ccccc1C4=O ZINC000587104017 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1Cc2nc3cccc4c3c(c2C1)-c1ccccc1C4=O ZINC000587104019 GI Annotated Anodyne CCOC(=O)[C@@H](F)[C@@H]1CCc2c(nc3cccc4c3c2-c2ccccc2C4=O)C1 ZINC000587104057 GI Annotated Anodyne CCOC(=O)[C@H](F)[C@@H]1CCc2c(nc3cccc4c3c2-c2ccccc2C4=O)C1 ZINC000587104058 GI Annotated Anodyne CCOC(=O)[C@H](F)[C@H]1CCc2c(nc3cccc4c3c2-c2ccccc2C4=O)C1 ZINC000587104059 GI Annotated Anodyne CCOC(=O)[C@@H](F)[C@H]1CCc2c(nc3cccc4c3c2-c2ccccc2C4=O)C1 ZINC000587104060 GI Annotated Anodyne C=CCOC(=O)N[C@H]1CCc2nc3cccc4c3c(c2C1)-c1ccccc1C4=O ZINC000587104114 GI Annotated Mild C=CCOC(=O)N[C@@H]1CCc2nc3cccc4c3c(c2C1)-c1ccccc1C4=O ZINC000587104116 GI Annotated Mild CCOC(=O)/C(=C\N(C)C)c1nc2cccc3c2c(c1C)-c1ccccc1C3=O ZINC000587104146 GI Annotated Anodyne CCOC(=O)/C(=C/N(C)C)c1nc2cccc3c2c(c1C)-c1ccccc1C3=O ZINC000587104149 GI Annotated Anodyne Cc1ccnc(NC(=O)Cc2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)c1 ZINC000587104163 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)[C@H](n1ccc([N+](=O)[O-])n1)CCC3 ZINC000587104312 GI Annotated Bother O=C1c2ccccc2-c2c3c(nc4cccc1c24)[C@@H](n1ccc([N+](=O)[O-])n1)CCC3 ZINC000587104320 GI Annotated Bother O=C1c2ccccc2-c2cc(-c3ccc(O)c([N+](=O)[O-])c3O)nc3cccc1c23 ZINC000587104427 GI Annotated Bother COC(=O)Cc1c(-c2ccccc2N)nc2cccc3c2c1-c1ccccc1C3=O ZINC000587104734 GI Annotated Anodyne O=C(Cc1cc2c3c(cccc3n1)C(=O)c1ccccc1-2)NCc1ccc(F)cc1 ZINC000587104915 GI Annotated Anodyne O=C1c2ccccc2-c2cc(Cn3nc(Cl)nc3Cl)nc3cccc1c23 ZINC000587104928 GI Annotated Anodyne Nc1ccccc1C(=O)OCc1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587104950 GI Annotated Anodyne Nc1cc2c(cc1-c1cc3c4c(cccc4n1)C(=O)c1ccccc1-3)OCCO2 ZINC000587105049 GI Annotated Anodyne Nc1ccc(-c2nc3cccc4c3c(c2CC(=O)O)-c2ccccc2C4=O)cc1 ZINC000587105131 GI Annotated Anodyne O=C1c2ccccc2-c2cc(CN3C(=O)c4ccccc4C3=O)nc3cccc1c23 ZINC000587105148 GI Annotated Anodyne Cc1nn(CCC(=O)O)c(C)c1-c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587105150 GI Annotated Anodyne Cc1nn(CC(=O)O)c(C)c1-c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587105237 GI Annotated Anodyne O=C1c2ccccc2-c2cc(-c3cccc(-n4cnnn4)c3)nc3cccc1c23 ZINC000587105319 GI Annotated Anodyne Cc1nn(Cc2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)c(C)c1[N+](=O)[O-] ZINC000587105366 GI Annotated Bother Cc1nc(O)c(C(=O)O)cc1-c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587105541 GI Annotated Anodyne O=C1COc2cc(-c3cc4c5c(cccc5n3)C(=O)c3ccccc3-4)ccc2N1 ZINC000587105652 GI Annotated Anodyne CC1=C(c2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)[C@@H](C)N2NN=NC2=N1 ZINC000587105698 GI Annotated Anodyne CC1=C(c2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)[C@H](C)N2NN=NC2=N1 ZINC000587105699 GI Annotated Anodyne CC(C)(C)OC(=O)N1CC2(Cc3c2nc2cccc4c2c3-c2ccccc2C4=O)C1 ZINC000587105755 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc(Cc3ccccc3C(F)(F)F)nc-2[nH]1 ZINC000587105843 GI Annotated Anodyne C=CC[C@H]1C(=O)C[C@@H](C(=O)OC)c2c1nc1cccc3c1c2-c1ccccc1C3=O ZINC000587105954 GI Annotated Mild C=CC[C@@H]1C(=O)C[C@@H](C(=O)OC)c2c1nc1cccc3c1c2-c1ccccc1C3=O ZINC000587105956 GI Annotated Mild C=CC[C@H]1C(=O)C[C@H](C(=O)OC)c2c1nc1cccc3c1c2-c1ccccc1C3=O ZINC000587105958 GI Annotated Mild C=CC[C@@H]1C(=O)C[C@H](C(=O)OC)c2c1nc1cccc3c1c2-c1ccccc1C3=O ZINC000587105959 GI Annotated Mild CCOC(=O)[C@@H](CCOC)c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587106176 GI Annotated Anodyne CCOC(=O)[C@H](CCOC)c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587106177 GI Annotated Anodyne CCOC(=O)CC[C@@H](C(C)=O)c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587106259 GI Annotated Anodyne CCOC(=O)CC[C@H](C(C)=O)c1cc2c3c(cccc3n1)C(=O)c1ccccc1-2 ZINC000587106263 GI Annotated Anodyne FC(F)(F)c1ccccc1Cc1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587107012 GI Annotated Anodyne O=C1c2ccccc2-c2cc(Cn3cnc4ccccc4c3=O)nc3cccc1c23 ZINC000587107227 GI Annotated Anodyne Cc1nc2ncc(-c3cc4c5c(cccc5n3)C(=O)c3ccccc3-4)c(C)n2n1 ZINC000587107349 GI Annotated Anodyne CCC1=C(C)N[C@@H]2c3nc4cccc5c4c(c3CCN2C1=O)-c1ccccc1C5=O ZINC000587107360 GI Annotated Anodyne CCC1=C(C)N[C@H]2c3nc4cccc5c4c(c3CCN2C1=O)-c1ccccc1C5=O ZINC000587107368 GI Annotated Anodyne CC1=C(c2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)[C@H](C)n2ncnc2N1C ZINC000587107387 GI Annotated Anodyne CC1=C(c2cc3c4c(cccc4n2)C(=O)c2ccccc2-3)[C@@H](C)n2ncnc2N1C ZINC000587107405 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(-c3ccc(C(F)(F)F)cc3C(=O)O)nc2c1 ZINC000587107482 GI Annotated Anodyne O=C(O)c1cc2c(nc1O)CCc1c-2nc2cccc3c2c1-c1ccccc1C3=O ZINC000587107491 GI Annotated Anodyne O=C(O)c1ccc(C(F)(F)F)cc1-c1nc2cc(Br)cnc2[nH]1 ZINC000587107636 GI Annotated Anodyne O=C(O)c1cc(C(F)(F)F)ccc1-c1nc2c(Br)ccnc2[nH]1 ZINC000587108354 GI Annotated Anodyne O=C(O)c1ccc(C(F)(F)F)cc1-c1nc2ccnc(Br)c2[nH]1 ZINC000587108399 GI Annotated Anodyne O=[N+]([O-])c1cc(Br)cc2nc(-c3ncccc3C(F)(F)F)[nH]c12 ZINC000587108413 GI Annotated Bother O=[N+]([O-])c1c(Br)ccc2nc(-c3ncccc3C(F)(F)F)[nH]c12 ZINC000587108435 GI Annotated Bother O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3ncccc3C(F)(F)F)[nH]c21 ZINC000587108618 GI Annotated Clean O=C(O)c1ccc(C(F)(F)F)cc1-c1nc2c(Br)ccnc2[nH]1 ZINC000587108649 GI Annotated Anodyne O=C(O)c1ccc(C(F)(F)F)cc1-c1nc2cncc(Br)c2[nH]1 ZINC000587108683 GI Annotated Anodyne FC(F)(F)c1cccnc1-c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587108721 GI Annotated Anodyne Fc1cc(C(F)(F)F)ccc1-c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587108944 GI Annotated Anodyne CCOC(=O)c1ccc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c2c1 ZINC000587108948 GI Annotated Bother O=C(O)c1ccc(C(F)(F)F)cc1-c1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000587108978 GI Annotated Anodyne O=C(O)c1ccc(C(F)(F)F)cc1-c1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587108987 GI Annotated Anodyne FC(F)(F)c1cccnc1-c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587109175 GI Annotated Anodyne O=[N+]([O-])c1cc(C(F)(F)F)ccc1Cc1nc2cc(C(F)(F)F)cnc2[nH]1 ZINC000587109347 GI Annotated Bother N#Cc1nc(Cl)cc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c12 ZINC000587109406 GI Annotated Mild O=C(O)c1cc(C(F)(F)F)ccc1-c1nc2ccnc(Br)c2[nH]1 ZINC000587109488 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(-c3cc(C(F)(F)F)ccc3C(=O)O)nc2c1 ZINC000587109502 GI Annotated Anodyne O=C(O)c1cc(C(F)(F)F)ccc1-c1nc2cc(Br)cnc2[nH]1 ZINC000587109520 GI Annotated Anodyne O=C(O)c1cc(C(F)(F)F)ccc1-c1nc2cncc(Br)c2[nH]1 ZINC000587109552 GI Annotated Anodyne O=[N+]([O-])c1cncc2nc(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[nH]c12 ZINC000587109616 GI Annotated Bother COc1cc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c2cc1OC ZINC000587109783 GI Annotated Bother O=[N+]([O-])c1cc(C(F)(F)F)ccc1Cc1nc2cc(C(F)(F)F)ncc2[nH]1 ZINC000587110015 GI Annotated Bother O=[N+]([O-])c1cnc2[nH]c(Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)nc2c1 ZINC000587110190 GI Annotated Bother O=[N+]([O-])c1cc2nc(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])[nH]c2cc1F ZINC000587110236 GI Annotated Bother O=[N+]([O-])c1cc(C(F)(F)F)ccc1Cc1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587110273 GI Annotated Bother COc1cc(OC)c2[nH]c(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])nc2c1 ZINC000587110301 GI Annotated Bother Cc1cc2[nH]c(Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])nc2cc1[N+](=O)[O-] ZINC000587110318 GI Annotated Bother O=[N+]([O-])c1cc(C(F)(F)F)ccc1Cc1nc2cc(F)c(F)c(F)c2[nH]1 ZINC000587110350 GI Annotated Bother Oc1nccc2nc(CCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)[nH]c12 ZINC000587110566 GI Annotated Anodyne Fc1cc(Cl)cc2nc(Cn3nnc(-c4ccc(C(F)(F)F)cc4)n3)[nH]c12 ZINC000587111114 GI Annotated Anodyne C=CCc1cccc2nc(Cn3nnc(-c4ccc(C(F)(F)F)cc4)n3)[nH]c12 ZINC000587111261 GI Annotated Mild Cn1cc(-c2nc3ccc(I)cc3[nH]2)c(C(F)(F)F)c1 ZINC000587111655 GI Annotated Anodyne CC(=O)N[C@@](C)(c1cccc(C(F)(F)F)c1)c1nc2c(Cl)ccnc2[nH]1 ZINC000587111824 GI Annotated Anodyne CC(=O)N[C@](C)(c1cccc(C(F)(F)F)c1)c1nc2c(Cl)ccnc2[nH]1 ZINC000587111827 GI Annotated Anodyne Cn1cc(-c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)c(C(F)(F)F)c1 ZINC000587112006 GI Annotated Bother Cn1cc(-c2nc3cccc(I)c3[nH]2)c(C(F)(F)F)c1 ZINC000587112013 GI Annotated Anodyne COc1cc2nc([C@@](C)(NC(C)=O)c3cccc(C(F)(F)F)c3)[nH]c2cc1C ZINC000587112068 GI Annotated Anodyne COc1cc2nc([C@](C)(NC(C)=O)c3cccc(C(F)(F)F)c3)[nH]c2cc1C ZINC000587112071 GI Annotated Anodyne Cn1cc(-c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)c(C(F)(F)F)c1 ZINC000587112073 GI Annotated Bother Cn1cc(-c2nc3c(Cl)c(Br)cnc3[nH]2)c(C(F)(F)F)c1 ZINC000587112079 GI Annotated Anodyne Cc1c(Cl)ccc2nc(Cn3nnc(-c4ccc(C(F)(F)F)cc4)n3)[nH]c12 ZINC000587112169 GI Annotated Anodyne N[C@@H](Cc1cccc(C(F)(F)F)c1)c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000587112229 GI Annotated Bother CC(=O)N[C@](C)(c1cccc(C(F)(F)F)c1)c1nc2cc(C)cc(F)c2[nH]1 ZINC000587112279 GI Annotated Anodyne CC(=O)N[C@@](C)(c1cccc(C(F)(F)F)c1)c1nc2cc(C)cc(F)c2[nH]1 ZINC000587112290 GI Annotated Anodyne COc1cc2nc([C@](C)(NC(C)=O)c3cccc(C(F)(F)F)c3)[nH]c2cc1F ZINC000587112336 GI Annotated Anodyne COc1cc2nc([C@@](C)(NC(C)=O)c3cccc(C(F)(F)F)c3)[nH]c2cc1F ZINC000587112339 GI Annotated Anodyne CC(=O)N[C@@](C)(c1cccc(C(F)(F)F)c1)c1nc2ccc(Cl)nc2[nH]1 ZINC000587112376 GI Annotated Anodyne CC(=O)N[C@](C)(c1cccc(C(F)(F)F)c1)c1nc2ccc(Cl)nc2[nH]1 ZINC000587112377 GI Annotated Anodyne FC(F)(F)c1ccc2ncc(-c3nc4c(S)nc(S)nc4[nH]3)cc2c1 ZINC000587112380 GI Annotated Anodyne N[C@@H](Cc1cccc(C(F)(F)F)c1)c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587112479 GI Annotated Anodyne CC(=O)N[C@@](C)(c1cccc(C(F)(F)F)c1)c1nc2c(C)cnc(Cl)c2[nH]1 ZINC000587112483 GI Annotated Anodyne CC(=O)N[C@](C)(c1cccc(C(F)(F)F)c1)c1nc2c(C)cnc(Cl)c2[nH]1 ZINC000587112487 GI Annotated Anodyne Cc1cc2nc(Cn3nnc(-c4ccc(C(F)(F)F)cc4)n3)[nH]c2cc1Cl ZINC000587112559 GI Annotated Anodyne CSc1ccc2nc(Cn3nnc(-c4ccc(C(F)(F)F)cc4)n3)[nH]c2c1 ZINC000587112727 GI Annotated Anodyne FC(F)(F)c1ccc(-c2nnn(Cc3nc4cc5ccccc5cc4[nH]3)n2)cc1 ZINC000587112857 GI Annotated Anodyne O=C(CSCc1nc2cccc(O)c2[nH]1)Nc1ccc(C(F)(F)F)cc1 ZINC000587112873 GI Annotated Anodyne CC(=O)N[C@@](C)(c1cccc(C(F)(F)F)c1)c1nc2cc(F)cc(F)c2[nH]1 ZINC000587112907 GI Annotated Anodyne CC(=O)N[C@](C)(c1cccc(C(F)(F)F)c1)c1nc2cc(F)cc(F)c2[nH]1 ZINC000587112919 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc(-c3cccc(C(F)(F)F)c3)nc-2[nH]1 ZINC000587112986 GI Annotated Anodyne FC(F)(F)c1ccc2ncc(-c3nc4nc(Br)c[nH]c-4n3)cc2c1 ZINC000587113097 GI Annotated Anodyne CC(=O)N[C@@](C)(c1cccc(C(F)(F)F)c1)c1nc2ccc(F)c(F)c2[nH]1 ZINC000587113113 GI Annotated Anodyne CC(=O)N[C@](C)(c1cccc(C(F)(F)F)c1)c1nc2ccc(F)c(F)c2[nH]1 ZINC000587113115 GI Annotated Anodyne CC(=O)N[C@@](C)(c1cccc(C(F)(F)F)c1)c1nc2cc(F)c(F)cc2[nH]1 ZINC000587113132 GI Annotated Anodyne CC(=O)N[C@](C)(c1cccc(C(F)(F)F)c1)c1nc2cc(F)c(F)cc2[nH]1 ZINC000587113135 GI Annotated Anodyne CC(=O)N[C@](C)(c1cccc(C(F)(F)F)c1)c1nc2ccc(F)c(C)c2[nH]1 ZINC000587113153 GI Annotated Anodyne CC(=O)N[C@@](C)(c1cccc(C(F)(F)F)c1)c1nc2ccc(F)c(C)c2[nH]1 ZINC000587113155 GI Annotated Anodyne CC(=O)N[C@](C)(c1cccc(C(F)(F)F)c1)c1nc2cc(C)c(F)cc2[nH]1 ZINC000587113175 GI Annotated Anodyne CC(=O)N[C@@](C)(c1cccc(C(F)(F)F)c1)c1nc2cc(C)c(F)cc2[nH]1 ZINC000587113176 GI Annotated Anodyne O=C1COc2cc3[nH]c(-c4cnc5ccc(C(F)(F)F)cc5c4)nc3cc2N1 ZINC000587113184 GI Annotated Anodyne Fc1cc2[nH]c(Cn3nnc(-c4ccc(C(F)(F)F)cc4)n3)nc2cc1Cl ZINC000587113285 GI Annotated Anodyne Cc1cncc2nc(CSCC(=O)Nc3ccc(C(F)(F)F)cc3)[nH]c12 ZINC000587113310 GI Annotated Anodyne Cc1cc(Cl)cc2nc(Cn3nnc(-c4ccc(C(F)(F)F)cc4)n3)[nH]c12 ZINC000587113364 GI Annotated Anodyne N[C@@H](Cc1cccc(C(F)(F)F)c1)c1nc2cc3c(cc2[nH]1)OC(F)(F)O3 ZINC000587113533 GI Annotated Anodyne FC(F)(F)c1cccc(-c2nc3cc(I)cnc3[nH]2)c1 ZINC000587113607 GI Annotated Anodyne Cn1cc(-c2nc3c(Br)cnc(Cl)c3[nH]2)c(C(F)(F)F)c1 ZINC000587113734 GI Annotated Anodyne Oc1nc(O)c2nc(-c3ccc(Oc4ccc(C(F)(F)F)cc4)cc3)[nH]c2n1 ZINC000587113750 GI Annotated Anodyne Cn1cc(-c2nc3cc(Br)cc(C(=O)O)c3[nH]2)c(C(F)(F)F)c1 ZINC000587113761 GI Annotated Anodyne FC(F)(F)c1ccc(-c2nnn(Cc3nc4ccc5c(c4[nH]3)CCCC5)n2)cc1 ZINC000587113782 GI Annotated Anodyne Cc1nc2[nH]c([C@@H](N)Cc3cccc(C(F)(F)F)c3)nc2cc1Br ZINC000587113854 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c([C@@H](N)Cc3cccc(C(F)(F)F)c3)nc2c1 ZINC000587113972 GI Annotated Anodyne CC(=O)N[C@@](C)(c1cccc(C(F)(F)F)c1)c1nc2cc(Cl)ncc2[nH]1 ZINC000587114157 GI Annotated Anodyne CC(=O)N[C@](C)(c1cccc(C(F)(F)F)c1)c1nc2cc(Cl)ncc2[nH]1 ZINC000587114158 GI Annotated Anodyne CC(=O)N[C@@](C)(c1cccc(C(F)(F)F)c1)c1nc2cncc(Cl)c2[nH]1 ZINC000587114288 GI Annotated Anodyne CC(=O)N[C@](C)(c1cccc(C(F)(F)F)c1)c1nc2cncc(Cl)c2[nH]1 ZINC000587114289 GI Annotated Anodyne Cc1c(Br)cnc2[nH]c([C@@H](N)Cc3cccc(C(F)(F)F)c3)nc12 ZINC000587114395 GI Annotated Anodyne C[C@@H](Cc1cccc(C(F)(F)F)c1)c1nc2cc3c(cc2[nH]1)OCC(=O)N3 ZINC000587114404 GI Annotated Anodyne C[C@H](Cc1cccc(C(F)(F)F)c1)c1nc2cc3c(cc2[nH]1)OCC(=O)N3 ZINC000587114406 GI Annotated Anodyne CCCn1cc2c(C(F)(F)F)cc(SCc3nc4cnccc4[nH]3)nc2n1 ZINC000587114459 GI Annotated Anodyne CCOC(=O)c1ccc2nc([C@@H](N)Cc3cccc(C(F)(F)F)c3)[nH]c2c1 ZINC000587114622 GI Annotated Anodyne N#Cc1cccc2nc(CSCC(=O)Nc3ccc(C(F)(F)F)cc3)[nH]c12 ZINC000587114701 GI Annotated Mild FC(F)(F)c1cc(-c2nc3cc(Cl)cnc3[nH]2)c(Br)cn1 ZINC000587114720 GI Annotated Anodyne CCCn1cc2c(C(F)(F)F)cc(SCc3nc4cccnc4[nH]3)nc2n1 ZINC000587114749 GI Annotated Anodyne FC(F)(F)c1cc(-c2nc3cc(Cl)ncc3[nH]2)c(Br)cn1 ZINC000587114764 GI Annotated Anodyne FC(F)(F)c1cc(-c2nc3ccc(Cl)nc3[nH]2)c(Br)cn1 ZINC000587114775 GI Annotated Anodyne C[C@@H](Cc1cccc(C(F)(F)F)c1)c1nc2ccc(S(=O)(=O)O)cc2[nH]1 ZINC000587114858 GI Annotated Anodyne C[C@H](Cc1cccc(C(F)(F)F)c1)c1nc2ccc(S(=O)(=O)O)cc2[nH]1 ZINC000587114860 GI Annotated Anodyne N[C@@H](Cc1cccc(C(F)(F)F)c1)c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587114861 GI Annotated Mild C[C@H](Cc1cccc(C(F)(F)F)c1)c1nc2nc(Br)c[nH]c-2n1 ZINC000587114878 GI Annotated Anodyne C[C@@H](Cc1cccc(C(F)(F)F)c1)c1nc2nc(Br)c[nH]c-2n1 ZINC000587114879 GI Annotated Anodyne O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3cncc(C(F)(F)F)c3)[nH]c21 ZINC000587114976 GI Annotated Clean O=C(O)c1cc(Br)cc2nc(-c3cncc(C(F)(F)F)c3)[nH]c12 ZINC000587115162 GI Annotated Anodyne O=[N+]([O-])c1c(Br)ccc2nc(-c3cncc(C(F)(F)F)c3)[nH]c12 ZINC000587115165 GI Annotated Bother FC(F)(F)c1cncc(-c2nc3cccc(I)c3[nH]2)c1 ZINC000587115177 GI Annotated Anodyne FC(F)(F)c1cncc(-c2nc3c(Br)cnc(Cl)c3[nH]2)c1 ZINC000587115193 GI Annotated Anodyne FC(F)(F)c1cncc(-c2nc3c(Cl)c(Br)cnc3[nH]2)c1 ZINC000587115221 GI Annotated Anodyne FC(F)(F)c1cc(-c2nc3cncc(Cl)c3[nH]2)c(Br)cn1 ZINC000587115302 GI Annotated Anodyne FC(F)(F)c1cc(-c2nc3c(Cl)ccnc3[nH]2)c(Br)cn1 ZINC000587115446 GI Annotated Anodyne FC(F)(F)c1cc(-c2nc3ccnc(Cl)c3[nH]2)c(Br)cn1 ZINC000587115463 GI Annotated Anodyne Cn1cc(-c2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)c(C(F)(F)F)c1 ZINC000587115560 GI Annotated Clean FC(F)(F)c1cncc(-c2nc3ccc(I)cc3[nH]2)c1 ZINC000587115582 GI Annotated Anodyne O=[N+]([O-])c1cc(Br)cc2nc(-c3cncc(C(F)(F)F)c3)[nH]c12 ZINC000587115742 GI Annotated Bother FC(F)(F)c1nc2ccncc2cc1-c1nc2ccnc(Br)c2[nH]1 ZINC000587115860 GI Annotated Anodyne O=C(O)c1cc2nc(-c3cc4cnccc4nc3C(F)(F)F)[nH]c2cc1F ZINC000587115922 GI Annotated Anodyne O=[N+]([O-])c1ccc2nc(-c3cc(C(F)(F)F)ncc3Br)[nH]c2c1 ZINC000587115963 GI Annotated Bother Cn1nc(C(F)(F)F)c(Cl)c1-c1nc2cccc(Br)c2[nH]1 ZINC000587115965 GI Annotated Anodyne O=C(O)c1cc(F)cc2nc(-c3cc4cnccc4nc3C(F)(F)F)[nH]c12 ZINC000587115980 GI Annotated Anodyne O=C1CCc2cc3nc(-c4cc5cnccc5nc4C(F)(F)F)[nH]c3cc2N1 ZINC000587116019 GI Annotated Anodyne O=C(O)c1cccc2nc(-c3cc(C(F)(F)F)ncc3Br)[nH]c12 ZINC000587116057 GI Annotated Anodyne Cc1nc2[nH]c(-c3c(Cl)c(C(F)(F)F)nn3C)nc2cc1Br ZINC000587116076 GI Annotated Anodyne FC(F)(F)c1nc2ccncc2cc1-c1nc2cncc(Br)c2[nH]1 ZINC000587116082 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3cc4cnccc4nc3C(F)(F)F)[nH]c2cc1F ZINC000587116090 GI Annotated Bother Cn1nc(C(F)(F)F)c(Cl)c1-c1nc2ccc(Br)cc2[nH]1 ZINC000587116099 GI Annotated Anodyne CCOC(=O)c1ccc2nc(-c3cc4cnccc4nc3C(F)(F)F)[nH]c2c1 ZINC000587116113 GI Annotated Anodyne FC(F)(F)c1nc2ccncc2cc1-c1nc2c(Br)ccnc2[nH]1 ZINC000587116127 GI Annotated Anodyne FC(F)(F)c1nc2ccncc2cc1-c1nc2cc(Br)cnc2[nH]1 ZINC000587116152 GI Annotated Anodyne FC(F)(F)c1nc2ccncc2cc1-c1nc2ccc(Br)nc2[nH]1 ZINC000587116168 GI Annotated Anodyne FC(F)(F)c1cc(-c2nc3cc4c(cc3[nH]2)OCO4)c(Br)cn1 ZINC000587116172 GI Annotated Anodyne O=C(O)c1ccc2nc(-c3cc(C(F)(F)F)ncc3Br)[nH]c2c1 ZINC000587116181 GI Annotated Anodyne Cn1nc(C(F)(F)F)c(Cl)c1-c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000587116188 GI Annotated Bother FC(F)(F)c1nc2ccncc2cc1-c1nc2cc(Br)ncc2[nH]1 ZINC000587116213 GI Annotated Anodyne N#Cc1ccc2nc(CCn3nc(C(F)(F)F)c(Cl)c3C3CC3)[nH]c2c1 ZINC000587116257 GI Annotated Mild O=[N+]([O-])c1cccc2nc(-c3cc(C(F)(F)F)ncc3Br)[nH]c12 ZINC000587116344 GI Annotated Bother COC(=O)c1cc(Cl)c2[nH]c(-c3c(Cl)c(C(F)(F)F)nn3C)nc2c1 ZINC000587116356 GI Annotated Anodyne Cc1c(Br)cnc2[nH]c(-c3c(Cl)c(C(F)(F)F)nn3C)nc12 ZINC000587116385 GI Annotated Anodyne N#Cc1cc2nc(-c3cc(C(F)(F)F)ncc3Br)[nH]c2cc1C#N ZINC000587116387 GI Annotated Mild FC(F)(F)c1nc2ccncc2cc1-c1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587116469 GI Annotated Anodyne FC(F)(F)c1cc(-c2nc3cc4cn[nH]c4cc3[nH]2)c(Br)cn1 ZINC000587116499 GI Annotated Anodyne Cn1nc(C(F)(F)F)c(Cl)c1-c1nc2ccc(Br)c(O)c2[nH]1 ZINC000587116504 GI Annotated Anodyne FC(F)(F)c1nn(CCc2nc3cc4c(cc3[nH]2)OCO4)c(C2CC2)c1Cl ZINC000587116520 GI Annotated Anodyne O=[N+]([O-])c1cccc2nc(CCn3nc(C(F)(F)F)c(Cl)c3C3CC3)[nH]c12 ZINC000587116557 GI Annotated Bother O=C(O)c1ccc2nc(CCn3nc(C(F)(F)F)c(Cl)c3C3CC3)[nH]c2c1 ZINC000587116576 GI Annotated Anodyne OCCc1ccc2nc(CCn3nc(C(F)(F)F)c(Cl)c3C3CC3)[nH]c2c1 ZINC000587116581 GI Annotated Anodyne FC(F)(F)c1nn(CCc2nc3cc4cn[nH]c4cc3[nH]2)c(C2CC2)c1Cl ZINC000587116595 GI Annotated Anodyne N#Cc1cccc2nc(CCn3nc(C(F)(F)F)c(Cl)c3C3CC3)[nH]c12 ZINC000587116660 GI Annotated Mild Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2ccc(C(C)(C)C)cc2[nH]1 ZINC000587116661 GI Annotated Bother Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2ccc(C(F)(F)F)cc2[nH]1 ZINC000587116663 GI Annotated Bother Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cccc(C(C)(C)C)c2[nH]1 ZINC000587116696 GI Annotated Bother Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cccc(C(F)(F)F)c2[nH]1 ZINC000587116701 GI Annotated Bother FC(F)(F)c1cc(C2CC2)n(Cc2nc3c(Cl)cnc(Cl)c3[nH]2)n1 ZINC000587116791 GI Annotated Anodyne FC(F)(F)c1cc(C2CC2)n(Cc2nc3cc(Cl)c(Cl)nc3[nH]2)n1 ZINC000587116951 GI Annotated Anodyne O=[N+]([O-])c1ccc2nc(CCn3nc(C(F)(F)F)c(Cl)c3C3CC3)[nH]c2c1 ZINC000587116982 GI Annotated Bother Cc1ccc2nc(CCn3cc(Br)c(C(F)(F)F)n3)[nH]c2c1C ZINC000587117120 GI Annotated Anodyne Cc1cc2[nH]c(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)nc2cc1Cl ZINC000587117144 GI Annotated Anodyne Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cc(Cl)cc(Cl)c2[nH]1 ZINC000587117162 GI Annotated Bother N#Cc1cc(Cl)c2nc(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)[nH]c2c1 ZINC000587117170 GI Annotated Mild FC(F)(F)c1ccn(Cc2cc(-c3nc4c5c(ccc4[nH]3)CCCC5)no2)n1 ZINC000587117221 GI Annotated Anodyne Cc1cc2nc(CCn3cc(Br)c(C(F)(F)F)n3)[nH]c2cc1F ZINC000587117226 GI Annotated Anodyne FC(F)(F)c1ccn(CCc2nc3cc(Cl)cc(Br)c3[nH]2)n1 ZINC000587117250 GI Annotated Anodyne Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cc(Cl)c(Cl)cc2[nH]1 ZINC000587117266 GI Annotated Bother FC(F)(F)c1cc(C2CC2)n(Cc2nc3cc(Cl)nc(Cl)c3[nH]2)n1 ZINC000587117333 GI Annotated Anodyne FC(F)(F)c1cc(C2CC2)n(Cc2nc3ccc(Br)cc3[nH]2)n1 ZINC000587117343 GI Annotated Anodyne Fc1cc2nc(CCn3cc(Br)c(C(F)(F)F)n3)[nH]c2cc1F ZINC000587117349 GI Annotated Anodyne FC(F)(F)c1cc(C2CC2)n(Cc2nc3c(Cl)c(Cl)cnc3[nH]2)n1 ZINC000587117355 GI Annotated Anodyne FC(F)(F)c1ccn(CCc2nc3c4cccnc4c4ncccc4c3[nH]2)n1 ZINC000587117358 GI Annotated Bother FC(F)(F)c1nn(CCc2nc3ccc(Cl)cc3[nH]2)cc1Br ZINC000587117393 GI Annotated Anodyne CC(C)Oc1ccc2[nH]c(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)nc2c1 ZINC000587117400 GI Annotated Anodyne FC(F)(F)c1ccn(CCc2nc3cc4nc5ccccc5nc4cc3[nH]2)n1 ZINC000587117459 GI Annotated Bother Cn1nc(C(F)(F)F)cc1-c1nc2cc(Cl)cc(Br)c2[nH]1 ZINC000587117485 GI Annotated Anodyne Cc1cc(Cl)cc2[nH]c(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)nc12 ZINC000587117499 GI Annotated Anodyne O=C(O)c1cccc2nc(CCn3nc(C(F)(F)F)c(Cl)c3C3CC3)[nH]c12 ZINC000587117524 GI Annotated Anodyne Fc1cc(F)c2[nH]c(CCn3cc(Br)c(C(F)(F)F)n3)nc2c1 ZINC000587117534 GI Annotated Anodyne FC(F)(F)c1cnc2[nH]c(Cn3nc(C(F)(F)F)cc3C3CC3)nc2c1 ZINC000587117679 GI Annotated Anodyne FC1(F)Oc2cc3nc(Cn4nc(C(F)(F)F)cc4C4CC4)[nH]c3cc2O1 ZINC000587117693 GI Annotated Anodyne O=[N+]([O-])c1cn(Cc2ccc(-c3nc4ccccc4[nH]3)cc2)nc1C(F)(F)F ZINC000587117814 GI Annotated Bother FC(F)(F)c1ccn(Cc2cc(-c3nc4c(ccc5ncccc54)[nH]3)no2)n1 ZINC000587117912 GI Annotated Anodyne OCc1ccc2nc(CCn3nc(C(F)(F)F)c(Cl)c3C3CC3)[nH]c2c1 ZINC000587117956 GI Annotated Anodyne Cn1nc(C(F)(F)F)cc1-c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587118194 GI Annotated Mild O=[N+]([O-])c1cc2nc(Cn3nc(C(F)(F)F)cc3C3CC3)[nH]c2cc1Cl ZINC000587118249 GI Annotated Bother Fc1ccc2nc(CCn3cc(Br)c(C(F)(F)F)n3)[nH]c2c1F ZINC000587118307 GI Annotated Anodyne FC(F)(F)c1ccn(CCc2nc3cc(Br)cc(Cl)c3[nH]2)n1 ZINC000587118407 GI Annotated Anodyne Cc1ccc(C)c2[nH]c(CCn3cc(Br)c(C(F)(F)F)n3)nc12 ZINC000587118499 GI Annotated Anodyne Cc1c(F)ccc2nc(CCn3cc(Br)c(C(F)(F)F)n3)[nH]c12 ZINC000587118506 GI Annotated Anodyne Nc1ccc(Oc2ccc3nc(CCn4ccc(C(F)(F)F)n4)[nH]c3c2)cc1 ZINC000587118512 GI Annotated Clean Cn1nc(C(F)(F)F)cc1-c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587118560 GI Annotated Anodyne FC(F)(F)c1cc2nc(Cn3nc(C(F)(F)F)cc3C3CC3)[nH]c2cn1 ZINC000587118768 GI Annotated Anodyne COc1cc2[nH]c(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)nc2cc1Cl ZINC000587118814 GI Annotated Anodyne Cc1cc(C)c2[nH]c(CCn3cc(Br)c(C(F)(F)F)n3)nc2c1 ZINC000587118838 GI Annotated Anodyne Fc1cc2[nH]c(Cn3nc(C(F)(F)F)cc3C3CC3)nc2cc1-n1cccn1 ZINC000587118846 GI Annotated Anodyne Fc1c(F)c(F)c2[nH]c(Cn3nc(C(F)(F)F)cc3C3CC3)nc2c1F ZINC000587118859 GI Annotated Mild COC(=O)c1cc(Cl)c2[nH]c(Cn3nc(C(F)(F)F)cc3C3CC3)nc2c1 ZINC000587118865 GI Annotated Anodyne Fc1c(Br)cc2nc(CCn3ccc(C(F)(F)F)n3)[nH]c2c1F ZINC000587118886 GI Annotated Anodyne Cc1c(Cl)ccc2[nH]c(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)nc12 ZINC000587118906 GI Annotated Anodyne CCc1ccc2nc(CCn3cc(Br)c(C(F)(F)F)n3)[nH]c2c1 ZINC000587118922 GI Annotated Anodyne Cc1c(Br)cc2nc(CCn3ccc(C(F)(F)F)n3)[nH]c2c1C ZINC000587118927 GI Annotated Anodyne Cc1c([N+](=O)[O-])c(C(F)(F)F)nn1Cc1nc2cc3ccccc3cc2[nH]1 ZINC000587118935 GI Annotated Bother FC(F)(F)c1cc(C2CC2)n(Cc2nc3cccc(Br)c3[nH]2)n1 ZINC000587118968 GI Annotated Anodyne Cn1nc(C(F)(F)F)cc1-c1nc2cc(Br)cc(Cl)c2[nH]1 ZINC000587118987 GI Annotated Anodyne Fc1cc2nc(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)[nH]c2cc1Cl ZINC000587118993 GI Annotated Anodyne O=C(c1ccccc1)c1ccc2nc(CCn3ccc(C(F)(F)F)n3)[nH]c2c1 ZINC000587118996 GI Annotated Anodyne CC(C)(C)c1ccc2[nH]c(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)nc2n1 ZINC000587119003 GI Annotated Anodyne Cc1cc2nc(CCn3cc(Br)c(C(F)(F)F)n3)[nH]c2cc1C ZINC000587119032 GI Annotated Anodyne Fc1cc(Cl)cc2[nH]c(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)nc12 ZINC000587119291 GI Annotated Anodyne FC(F)(F)c1cnc2[nH]c(Cn3nc(C(F)(F)F)c4c3CCCC4)nc2c1 ZINC000587119326 GI Annotated Anodyne FC(F)(F)c1ccn(Cc2cc(-c3nc4c(cnc5ccccc54)[nH]3)no2)n1 ZINC000587119384 GI Annotated Anodyne CC(C)(C)c1ccc2nc(Cn3nc(C(F)(F)F)c4c3CCCC4)[nH]c2n1 ZINC000587119469 GI Annotated Anodyne FC(F)(F)c1nn(Cc2nc3cccc(Br)c3[nH]2)c2c1CCCC2 ZINC000587119484 GI Annotated Anodyne CC(C)Oc1ccc2nc(Cn3nc(C(F)(F)F)c4c3CCCC4)[nH]c2c1 ZINC000587119506 GI Annotated Anodyne Cc1ccc2c(ccc3[nH]c(-c4cc(Cn5ccc(C(F)(F)F)n5)on4)nc32)n1 ZINC000587119508 GI Annotated Anodyne FC(F)(F)c1nn(CCc2nc3cccc(Cl)c3[nH]2)cc1Br ZINC000587119540 GI Annotated Anodyne FC(F)(F)c1ccn(CCc2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)n1 ZINC000587119560 GI Annotated Mild FC(F)(F)c1nn(Cc2nc3cc(Cl)c(Cl)nc3[nH]2)c2c1CCCC2 ZINC000587119587 GI Annotated Anodyne Cc1cc(F)c2[nH]c(CCn3cc(Br)c(C(F)(F)F)n3)nc2c1 ZINC000587119607 GI Annotated Anodyne Oc1nccc2[nH]c(-c3cc(-c4ccccc4)nc4cc(C(F)(F)F)nn34)nc12 ZINC000587119804 GI Annotated Anodyne FC(F)(F)c1nn(Cc2nc3c(Cl)c(Cl)cnc3[nH]2)c2c1CCCC2 ZINC000587119826 GI Annotated Anodyne Fc1cnc2nc(-c3cc(-c4ccccc4)nc4cc(C(F)(F)F)nn34)[nH]c2c1 ZINC000587120029 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(Cn3nc(C(F)(F)F)c4c3CCCC4)[nH]c2cc1Cl ZINC000587120101 GI Annotated Bother Fc1c(F)c(F)c2[nH]c(Cn3nc(C(F)(F)F)c4c3CCCC4)nc2c1F ZINC000587120104 GI Annotated Mild FC(F)(F)c1nn(Cc2nc3ccc(Br)cc3[nH]2)c2c1CCCC2 ZINC000587120131 GI Annotated Anodyne CSc1ccc2[nH]c(-c3cc(Cn4ccc(C(F)(F)F)n4)on3)nc2c1 ZINC000587120147 GI Annotated Anodyne N#Cc1cc(Cl)c2[nH]c(Cn3nc(C(F)(F)F)c4c3CCCC4)nc2c1 ZINC000587120155 GI Annotated Mild CN(C)CCOc1ccc2nc(-c3ccc4nc(C(F)(F)F)[nH]c4c3)[nH]c2c1 ZINC000587120160 GI Annotated Anodyne COc1cc2nc(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)[nH]c2cc1OC ZINC000587120181 GI Annotated Anodyne FC(F)(F)c1cnc2[nH]c(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)nc2c1 ZINC000587120203 GI Annotated Mild FC(F)(F)c1cc2nc(-c3ccccc3)cc(-c3nc4ccncc4[nH]3)n2n1 ZINC000587120226 GI Annotated Anodyne FC(F)(F)c1nn(Cc2nc3c(Cl)cnc(Cl)c3[nH]2)c2c1CCCC2 ZINC000587120262 GI Annotated Anodyne FC(F)(F)c1nn(Cc2nc3cc(Cl)nc(Cl)c3[nH]2)c2c1CCCC2 ZINC000587120291 GI Annotated Anodyne COc1cc2nc(Cn3nc(C(F)(F)F)c4c3CCCC4)[nH]c2cc1Cl ZINC000587120343 GI Annotated Anodyne FC(F)(F)c1cc2nc(Cn3nc(C(F)(F)F)c4c3CCCC4)[nH]c2cn1 ZINC000587120350 GI Annotated Anodyne FC(F)(F)c1nc2ccc(-c3nc4ccnc(Br)c4[nH]3)cc2[nH]1 ZINC000587120436 GI Annotated Anodyne FC(F)(F)c1nc2ccc(-c3nc4cc(Br)ncc4[nH]3)cc2[nH]1 ZINC000587120455 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)[nH]c2cc1F ZINC000587120456 GI Annotated Mild FC(F)(F)c1cc2nc(-c3ccccc3)cc(-c3nc4ncccc4[nH]3)n2n1 ZINC000587120478 GI Annotated Anodyne FC(F)(F)c1nc2ccc(-c3nc4cc(Br)cnc4[nH]3)cc2[nH]1 ZINC000587120494 GI Annotated Anodyne CCOC(=O)c1ccc2nc(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)[nH]c2c1 ZINC000587120543 GI Annotated Anodyne FC(F)(F)c1nc2ccc(-c3nc4c(Br)ccnc4[nH]3)cc2[nH]1 ZINC000587120569 GI Annotated Anodyne Fc1cc2[nH]c(-c3ccc4nc(C(F)(F)F)[nH]c4c3)nc2cc1-n1cccn1 ZINC000587120674 GI Annotated Anodyne FC(F)(F)c1nc2ccc(-c3nc4cncc(Br)c4[nH]3)cc2[nH]1 ZINC000587120677 GI Annotated Anodyne COc1cc(OC)c2[nH]c(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)nc2c1 ZINC000587120763 GI Annotated Anodyne FC(F)(F)c1cc2nc(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)[nH]c2cn1 ZINC000587120836 GI Annotated Mild FC(F)(F)c1nc2ccc(-c3nc4ccc(Br)nc4[nH]3)cc2[nH]1 ZINC000587120880 GI Annotated Anodyne FC(F)(F)c1n[nH]c(C(F)(F)F)c1-c1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587120998 GI Annotated Anodyne Cc1cc2[nH]c(-c3c(C(F)(F)F)n[nH]c3C(F)(F)F)nc2cc1[N+](=O)[O-] ZINC000587121137 GI Annotated Bother Cc1nc2ccc(OC(F)(F)F)cc2cc1-c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000587121398 GI Annotated Bother Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1-c1nc2cnnc(O)c2[nH]1 ZINC000587121421 GI Annotated Anodyne Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1-c1nc2cc(=N)[nH]cc2[nH]1 ZINC000587121442 GI Annotated Anodyne COC(=O)c1cc2nc(CSCc3cccc(OC(F)(F)F)c3)[nH]c2cn1 ZINC000587121754 GI Annotated Anodyne Cc1nc2ccc(OC(F)(F)F)cc2cc1-c1nc2nc(Cl)c[nH]c-2n1 ZINC000587121755 GI Annotated Anodyne Cc1nc2ccc(OC(F)(F)F)cc2cc1-c1nc2c(Cl)ncnc2[nH]1 ZINC000587121759 GI Annotated Anodyne Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1-c1nc2c(O)ncnc2[nH]1 ZINC000587121784 GI Annotated Anodyne O=[N+]([O-])c1cnc2[nH]c(CSCc3cccc(OC(F)(F)F)c3)nc2c1 ZINC000587121928 GI Annotated Bother OCCc1ccc2nc(CSCc3cccc(OC(F)(F)F)c3)[nH]c2c1 ZINC000587121996 GI Annotated Anodyne Cc1nc2ccc(OC(F)(F)F)cc2cc1-c1nc2cncc([N+](=O)[O-])c2[nH]1 ZINC000587122005 GI Annotated Bother Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1-c1nc2cncnc2[nH]1 ZINC000587122164 GI Annotated Anodyne Fc1c(Br)cc2[nH]c(-c3cccc(OCC(F)F)n3)nc2c1F ZINC000587122201 GI Annotated Anodyne Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1-c1nc2cnncc2[nH]1 ZINC000587122244 GI Annotated Anodyne FC(F)COc1cccc(-c2nc3c(Cl)ncc(Br)c3[nH]2)n1 ZINC000587122359 GI Annotated Anodyne FC(F)COc1cccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)n1 ZINC000587122370 GI Annotated Bother Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1-c1nc2ncc[nH]c-2n1 ZINC000587122656 GI Annotated Anodyne Cc1nc2ccc(OC(F)(F)F)cc2cc1-c1nc2cnc(Cl)[nH]c-2n1 ZINC000587122692 GI Annotated Anodyne FC(F)(F)Oc1ccc2c(-c3nc4nccc(Br)c4[nH]3)n[nH]c2c1 ZINC000587122756 GI Annotated Anodyne Cc1nc(-c2ccc(OC(F)(F)F)cc2)sc1-c1nc2cc[nH]c(=N)c2[nH]1 ZINC000587122807 GI Annotated Anodyne Oc1nc2cc3nc(CSCc4cccc(OC(F)(F)F)c4)[nH]c3cc2[nH]1 ZINC000587122899 GI Annotated Anodyne COC(=O)c1cc2nc(COC(F)(F)F)[nH]c2c(F)c1Nc1ccccc1 ZINC000587122915 GI Annotated Anodyne Cc1cc(-c2nc3c(C)c(C)ccc3[nH]2)ccc1NS(=O)(=O)C(F)(F)F ZINC000587123020 GI Annotated Anodyne FC(F)COc1cccc(-c2nc3cnc(C(F)(F)C(F)(F)F)cc3[nH]2)n1 ZINC000587123531 GI Annotated Mild COC(=O)c1ccc2nc(CSCc3cccc(OC(F)(F)F)c3)[nH]c2n1 ZINC000587123602 GI Annotated Anodyne Cc1cc(C)c2nc(-c3ccc(NS(=O)(=O)C(F)(F)F)c(C)c3)[nH]c2c1 ZINC000587123684 GI Annotated Anodyne O=[N+]([O-])c1cncc2nc(CSCc3cccc(OC(F)(F)F)c3)[nH]c12 ZINC000587123812 GI Annotated Bother COC(=O)c1ccnc2[nH]c(CSCc3cccc(OC(F)(F)F)c3)nc12 ZINC000587123838 GI Annotated Anodyne FC(F)COc1cccc(-c2nc3ncc(Br)c(Cl)c3[nH]2)n1 ZINC000587123883 GI Annotated Anodyne OC1(c2nc3cc(Br)c(F)cc3[nH]2)CCC(C(F)(F)F)CC1 ZINC000587124505 GI Annotated Anodyne OC1(c2nc3ccc(Br)c(F)c3[nH]2)CCC(C(F)(F)F)CC1 ZINC000587124506 GI Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc(Cl)c(Cl)nc4[nH]3)cc2N1 ZINC000587124516 GI Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc(Cl)c(Cl)nc4[nH]3)cc2N1 ZINC000587124519 GI Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc(Cl)c(Cl)nc4[nH]3)cc2N1 ZINC000587124520 GI Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc(Cl)c(Cl)nc4[nH]3)cc2N1 ZINC000587124522 GI Annotated Anodyne OC1(c2nc3cc(Br)cc(F)c3[nH]2)CCC(C(F)(F)F)CC1 ZINC000587124530 GI Annotated Anodyne Cc1cc(-c2nc3c(C)c(F)ccc3[nH]2)ccc1NS(=O)(=O)C(F)(F)F ZINC000587124742 GI Annotated Anodyne Cc1cc(F)c2nc(-c3ccc(NS(=O)(=O)C(F)(F)F)c(C)c3)[nH]c2c1 ZINC000587124878 GI Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4ccc(C(C)(C)C)nc4[nH]3)cc2N1 ZINC000587125058 GI Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4ccc(C(C)(C)C)nc4[nH]3)cc2N1 ZINC000587125061 GI Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4ccc(C(C)(C)C)nc4[nH]3)cc2N1 ZINC000587125063 GI Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4ccc(C(C)(C)C)nc4[nH]3)cc2N1 ZINC000587125064 GI Annotated Anodyne Cc1cc(-c2nc3c(F)cc(F)cc3[nH]2)ccc1NS(=O)(=O)C(F)(F)F ZINC000587125169 GI Annotated Anodyne Cc1cc(-c2nc3c(F)c(F)ccc3[nH]2)ccc1NS(=O)(=O)C(F)(F)F ZINC000587125180 GI Annotated Anodyne FC(F)(F)Sc1ccc(/C=C\c2nc3ccc(-n4cnnn4)cc3[nH]2)cc1 ZINC000587125205 GI Annotated Anodyne FC(F)(F)Sc1ccc(/C=C/c2nc3ccc(-n4cnnn4)cc3[nH]2)cc1 ZINC000587125217 GI Annotated Anodyne OC1(c2nc3cc(F)cc(Br)c3[nH]2)CCC(C(F)(F)F)CC1 ZINC000587125407 GI Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc(C(F)(F)F)ncc4[nH]3)cc2N1 ZINC000587125435 GI Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc(C(F)(F)F)ncc4[nH]3)cc2N1 ZINC000587125440 GI Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc(C(F)(F)F)ncc4[nH]3)cc2N1 ZINC000587125443 GI Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc(C(F)(F)F)ncc4[nH]3)cc2N1 ZINC000587125444 GI Annotated Anodyne OC1(c2nc3c(Cl)c(Br)cnc3[nH]2)CCC(C(F)(F)F)CC1 ZINC000587125517 GI Annotated Anodyne FC(F)(F)OCc1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000587125642 GI Annotated Anodyne FC(F)(F)OCc1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000587125740 GI Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4c(Cl)c(Cl)cnc4[nH]3)cc2N1 ZINC000587125888 GI Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4c(Cl)c(Cl)cnc4[nH]3)cc2N1 ZINC000587125890 GI Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4c(Cl)c(Cl)cnc4[nH]3)cc2N1 ZINC000587125893 GI Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4c(Cl)c(Cl)cnc4[nH]3)cc2N1 ZINC000587125894 GI Annotated Anodyne C[C@@H](F)[C@H](N)c1nc2cc(OCc3ccccc3)c(Br)cc2[nH]1 ZINC000587126072 GI Annotated Anodyne C[C@H](F)[C@@H](N)c1nc2cc(OCc3ccccc3)c(Br)cc2[nH]1 ZINC000587126073 GI Annotated Anodyne C[C@H](F)[C@H](N)c1nc2cc(OCc3ccccc3)c(Br)cc2[nH]1 ZINC000587126074 GI Annotated Anodyne C[C@@H](F)[C@@H](N)c1nc2cc(OCc3ccccc3)c(Br)cc2[nH]1 ZINC000587126075 GI Annotated Anodyne FC(F)(F)OCc1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000587126148 GI Annotated Anodyne Cc1cc(-c2nc3c(C)ccc(C)c3[nH]2)ccc1NS(=O)(=O)C(F)(F)F ZINC000587126224 GI Annotated Anodyne N#Cc1cc2nc(C3(O)CCC(C(F)(F)F)CC3)[nH]c2cc1C(F)(F)F ZINC000587126570 GI Annotated Mild FC(F)(F)Oc1ccc2c(-c3nc4ncc(C(F)(F)F)cc4[nH]3)n[nH]c2c1 ZINC000587126665 GI Annotated Anodyne O=S(=O)(c1ncccc1-c1nc2cc3ccccc3cc2[nH]1)C(F)(F)F ZINC000587126667 GI Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc(F)c(F)c(F)c4[nH]3)cc2N1 ZINC000587126712 GI Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc(F)c(F)c(F)c4[nH]3)cc2N1 ZINC000587126713 GI Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc(F)c(F)c(F)c4[nH]3)cc2N1 ZINC000587126715 GI Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc(F)c(F)c(F)c4[nH]3)cc2N1 ZINC000587126717 GI Annotated Anodyne OC1(c2nc3c(Br)cnc(Cl)c3[nH]2)CCC(C(F)(F)F)CC1 ZINC000587126721 GI Annotated Anodyne FC(F)(F)Oc1ccc2c(-c3nc4nc(Br)ccc4[nH]3)n[nH]c2c1 ZINC000587126735 GI Annotated Anodyne FC(F)COc1cccc(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)n1 ZINC000587126752 GI Annotated Bother O=[N+]([O-])c1cc2[nH]c(-c3n[nH]c4cc(OC(F)(F)F)ccc34)nc2cc1F ZINC000587126906 GI Annotated Bother FC(F)(F)Oc1ccc2c(-c3nc4cnc(C(F)(F)F)cc4[nH]3)n[nH]c2c1 ZINC000587126910 GI Annotated Anodyne O=S(=O)(c1ncccc1-c1nc2c(Cl)cc(Cl)cc2[nH]1)C(F)(F)F ZINC000587127027 GI Annotated Anodyne COc1cc2nc(-c3n[nH]c4cc(OC(F)(F)F)ccc34)[nH]c2cc1OC ZINC000587127034 GI Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc(Cl)nc(Cl)c4[nH]3)cc2N1 ZINC000587127044 GI Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc(Cl)nc(Cl)c4[nH]3)cc2N1 ZINC000587127045 GI Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc(Cl)nc(Cl)c4[nH]3)cc2N1 ZINC000587127046 GI Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc(Cl)nc(Cl)c4[nH]3)cc2N1 ZINC000587127047 GI Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc(C(F)(F)F)cnc4[nH]3)cc2N1 ZINC000587127083 GI Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc(C(F)(F)F)cnc4[nH]3)cc2N1 ZINC000587127085 GI Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc(C(F)(F)F)cnc4[nH]3)cc2N1 ZINC000587127086 GI Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc(C(F)(F)F)cnc4[nH]3)cc2N1 ZINC000587127087 GI Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc(C#N)cc(Cl)c4[nH]3)cc2N1 ZINC000587127125 GI Annotated Mild C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4cc(C#N)cc(Cl)c4[nH]3)cc2N1 ZINC000587127127 GI Annotated Mild C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc(C#N)cc(Cl)c4[nH]3)cc2N1 ZINC000587127129 GI Annotated Mild C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4cc(C#N)cc(Cl)c4[nH]3)cc2N1 ZINC000587127131 GI Annotated Mild OC1(c2nc3ccc(F)c(Br)c3[nH]2)CCC(C(F)(F)F)CC1 ZINC000587127144 GI Annotated Anodyne COc1cc2nc(-c3cc4n(n3)[C@H](C(F)(F)F)C[C@H](C)N4)[nH]c2cc1Cl ZINC000587127150 GI Annotated Anodyne COc1cc2nc(-c3cc4n(n3)[C@@H](C(F)(F)F)C[C@@H](C)N4)[nH]c2cc1Cl ZINC000587127151 GI Annotated Anodyne COc1cc2nc(-c3cc4n(n3)[C@H](C(F)(F)F)C[C@@H](C)N4)[nH]c2cc1Cl ZINC000587127152 GI Annotated Anodyne COc1cc2nc(-c3cc4n(n3)[C@@H](C(F)(F)F)C[C@H](C)N4)[nH]c2cc1Cl ZINC000587127153 GI Annotated Anodyne N#Cc1cc(Br)c2[nH]c(C3(O)CCC(C(F)(F)F)CC3)nc2c1 ZINC000587127162 GI Annotated Mild FC(F)(F)Oc1ccc2c(-c3nc4ncc(Br)cc4[nH]3)n[nH]c2c1 ZINC000587127226 GI Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4c(Cl)cnc(Cl)c4[nH]3)cc2N1 ZINC000587127286 GI Annotated Anodyne C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4c(Cl)cnc(Cl)c4[nH]3)cc2N1 ZINC000587127287 GI Annotated Anodyne C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4c(Cl)cnc(Cl)c4[nH]3)cc2N1 ZINC000587127288 GI Annotated Anodyne C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4c(Cl)cnc(Cl)c4[nH]3)cc2N1 ZINC000587127289 GI Annotated Anodyne C[C@@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4c(F)c(F)c(F)c(F)c4[nH]3)cc2N1 ZINC000587127327 GI Annotated Mild C[C@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4c(F)c(F)c(F)c(F)c4[nH]3)cc2N1 ZINC000587127332 GI Annotated Mild C[C@H]1C[C@H](C(F)(F)F)n2nc(-c3nc4c(F)c(F)c(F)c(F)c4[nH]3)cc2N1 ZINC000587127333 GI Annotated Mild C[C@@H]1C[C@@H](C(F)(F)F)n2nc(-c3nc4c(F)c(F)c(F)c(F)c4[nH]3)cc2N1 ZINC000587127334 GI Annotated Mild FC(F)(F)Oc1ccc2c(-c3nc4cc5c(cc4[nH]3)OCCCO5)n[nH]c2c1 ZINC000587127349 GI Annotated Anodyne FC(F)(F)Oc1ccc2c(-c3nc4c(Br)nccc4[nH]3)n[nH]c2c1 ZINC000587127364 GI Annotated Anodyne FC(F)(F)Oc1ccc2c(-c3nc4cnc(Br)cc4[nH]3)n[nH]c2c1 ZINC000587127371 GI Annotated Anodyne Nc1ccc(-c2ccc3nc(C4(O)CCC(C(F)(F)F)CC4)[nH]c3c2)cc1N ZINC000587127460 GI Annotated Anodyne Cc1cc2nc(-c3n[nH]c4cc(OC(F)(F)F)ccc34)[nH]c2cc1[N+](=O)[O-] ZINC000587127580 GI Annotated Bother FC(F)(F)Oc1ccc2c(-c3nc4c(Br)cncc4[nH]3)n[nH]c2c1 ZINC000587127619 GI Annotated Anodyne FC(F)c1c(-c2nc3cc(Cl)cc(Br)c3[nH]2)cnc2ncnn12 ZINC000587127791 GI Annotated Anodyne FC(F)c1c(-c2nc3ccc(SC(F)(F)F)cc3[nH]2)cnc2ncnn12 ZINC000587127877 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3sc(-c4ccccc4)nc3C(F)F)[nH]c2n1 ZINC000587127895 GI Annotated Anodyne COc1cncc2nc([C@@H](C)n3nc(C(F)F)c(Cl)c3C(F)F)[nH]c12 ZINC000587127929 GI Annotated Anodyne COc1cncc2nc([C@H](C)n3nc(C(F)F)c(Cl)c3C(F)F)[nH]c12 ZINC000587127930 GI Annotated Anodyne FC(F)c1c(-c2nc3cc(C(F)(F)F)c(Cl)cc3[nH]2)cnc2ncnn12 ZINC000587127935 GI Annotated Anodyne COC(=O)c1cc2nc(-c3sc(-c4ccccc4)nc3C(F)F)[nH]c2cn1 ZINC000587127962 GI Annotated Anodyne COc1cc2nc([C@@H](C)n3nc(C(F)F)c(Cl)c3C(F)F)[nH]c2cn1 ZINC000587127967 GI Annotated Anodyne COc1cc2nc([C@H](C)n3nc(C(F)F)c(Cl)c3C(F)F)[nH]c2cn1 ZINC000587127968 GI Annotated Anodyne Cn1nnc(-c2nc3ccc(Br)c(C(F)(F)F)c3[nH]2)c1C(F)F ZINC000587127983 GI Annotated Anodyne Cn1nnc(-c2nc3cc(C(F)(F)F)cc(Br)c3[nH]2)c1C(F)F ZINC000587128062 GI Annotated Anodyne N=c1[nH]c2nc(-c3sc(-c4ccccc4)nc3C(F)F)nc-2c(Cl)[nH]1 ZINC000587128091 GI Annotated Anodyne FC(F)c1c(-c2nc3ccc(OCc4ccccc4)cc3[nH]2)cnc2ncnn12 ZINC000587128137 GI Annotated Anodyne Oc1nc(S)nc2[nH]c(-c3sc(-c4ccccc4)nc3C(F)F)nc12 ZINC000587128160 GI Annotated Anodyne FC(F)c1c(-c2nc3cc(Br)cc(Cl)c3[nH]2)cnc2ncnn12 ZINC000587128308 GI Annotated Anodyne Cn1nnc(-c2nc3cc(C(F)(F)F)c(Br)cc3[nH]2)c1C(F)F ZINC000587128345 GI Annotated Anodyne C[C@@H](c1nc2cncc([N+](=O)[O-])c2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587128359 GI Annotated Bother C[C@H](c1nc2cncc([N+](=O)[O-])c2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587128361 GI Annotated Bother C[C@@H](c1nc2cc([N+](=O)[O-])cnc2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587128377 GI Annotated Bother C[C@H](c1nc2cc([N+](=O)[O-])cnc2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587128378 GI Annotated Bother FC(F)c1nc(-c2ccccc2)sc1-c1nc2ccc(-n3cnnn3)cc2[nH]1 ZINC000587128567 GI Annotated Anodyne C[C@H](c1nc2c(Cl)ncnc2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587128568 GI Annotated Anodyne C[C@@H](c1nc2c(Cl)ncnc2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587128572 GI Annotated Anodyne COc1ccc2nc([C@@H](C)n3nc(C(F)F)c(Cl)c3C(F)F)[nH]c2n1 ZINC000587128760 GI Annotated Anodyne COc1ccc2nc([C@H](C)n3nc(C(F)F)c(Cl)c3C(F)F)[nH]c2n1 ZINC000587128761 GI Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3sc(-c4ccccc4)nc3C(F)F)nc12 ZINC000587128921 GI Annotated Anodyne FC(F)c1c(-c2nc3ccc(Oc4ccccc4)cc3[nH]2)cnc2ncnn12 ZINC000587128925 GI Annotated Anodyne Cn1nnc(-c2nc3cc(C(F)(F)F)cc(C(F)(F)F)c3[nH]2)c1C(F)F ZINC000587129200 GI Annotated Mild Cn1nnc(-c2nc3cc(Br)cc(C(F)(F)F)c3[nH]2)c1C(F)F ZINC000587129232 GI Annotated Anodyne FC(F)c1c(-c2nc3cccc(OCc4ccccc4)c3[nH]2)cnc2ncnn12 ZINC000587129375 GI Annotated Anodyne FC(F)c1c(-c2nc3cc(C(F)(F)F)cc(Cl)c3[nH]2)cnc2ncnn12 ZINC000587129379 GI Annotated Anodyne C[C@H](c1nc2cnc(Cl)[nH]c-2n1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587129465 GI Annotated Anodyne C[C@@H](c1nc2cnc(Cl)[nH]c-2n1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587129466 GI Annotated Anodyne C[C@H](c1nc2ccc(CCO)cc2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587129487 GI Annotated Anodyne C[C@@H](c1nc2ccc(CCO)cc2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587129488 GI Annotated Anodyne CCOc1cc(/C=C/c2nc3cc(C#N)c(C#N)cc3[nH]2)ccc1OC(F)F ZINC000587129540 GI Annotated Mild CCOc1cc(/C=C\c2nc3cc(C#N)c(C#N)cc3[nH]2)ccc1OC(F)F ZINC000587129552 GI Annotated Mild C[C@@H](c1nc2cc(N)c(N)cc2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587129869 GI Annotated Anodyne C[C@H](c1nc2cc(N)c(N)cc2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587129870 GI Annotated Anodyne COc1nccc2nc([C@@H](C)n3nc(C(F)F)c(Cl)c3C(F)F)[nH]c12 ZINC000587129953 GI Annotated Anodyne COc1nccc2nc([C@H](C)n3nc(C(F)F)c(Cl)c3C(F)F)[nH]c12 ZINC000587129954 GI Annotated Anodyne CCOc1cc(/C=C/c2nc3cc([N+](=O)[O-])cnc3[nH]2)ccc1OC(F)F ZINC000587130014 GI Annotated Bother CCOc1cc(/C=C\c2nc3cc([N+](=O)[O-])cnc3[nH]2)ccc1OC(F)F ZINC000587130016 GI Annotated Bother CCOc1cc(/C=C\c2nc3ccc([C@H](N)N=O)cc3[nH]2)ccc1OC(F)F ZINC000587130099 GI Annotated Anodyne CCOc1cc(/C=C\c2nc3ccc([C@@H](N)N=O)cc3[nH]2)ccc1OC(F)F ZINC000587130102 GI Annotated Anodyne CCOc1cc(/C=C/c2nc3ccc([C@@H](N)N=O)cc3[nH]2)ccc1OC(F)F ZINC000587130104 GI Annotated Anodyne CCOc1cc(/C=C/c2nc3ccc([C@H](N)N=O)cc3[nH]2)ccc1OC(F)F ZINC000587130106 GI Annotated Anodyne Cc1cc2nc(C3(C(=O)OC(C)C)CC(F)(F)C3)[nH]c2cc1Br ZINC000587130179 GI Annotated Anodyne Cc1cc(Br)c2[nH]c(C3(C(=O)OC(C)C)CC(F)(F)C3)nc2c1 ZINC000587130190 GI Annotated Anodyne CCOc1cc(/C=C/c2nc3cc4nc(O)[nH]c4cc3[nH]2)ccc1OC(F)F ZINC000587130334 GI Annotated Anodyne CCOc1cc(/C=C\c2nc3cc4nc(O)[nH]c4cc3[nH]2)ccc1OC(F)F ZINC000587130343 GI Annotated Anodyne CC(C)OC(=O)C1(c2nc3cc(C(F)(F)F)c(F)cc3[nH]2)CC(F)(F)C1 ZINC000587130455 GI Annotated Anodyne CC(C)OC(=O)C1(c2nc3ccc(OC(F)(F)F)cc3[nH]2)CC(F)(F)C1 ZINC000587130611 GI Annotated Anodyne C[C@H](c1nc2nc(Cl)c[nH]c-2n1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587130636 GI Annotated Anodyne C[C@@H](c1nc2nc(Cl)c[nH]c-2n1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587130637 GI Annotated Anodyne C[C@@H](c1nc2ccc(CO)cc2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587130638 GI Annotated Anodyne C[C@H](c1nc2ccc(CO)cc2[nH]1)n1nc(C(F)F)c(Cl)c1C(F)F ZINC000587130639 GI Annotated Anodyne CC(C)OC(=O)C1(c2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)CC(F)(F)C1 ZINC000587130728 GI Annotated Mild CC(C)OC(=O)C1(c2nc3cc(F)cc(C(F)(F)F)c3[nH]2)CC(F)(F)C1 ZINC000587130746 GI Annotated Anodyne Cn1nc(-c2nc3ccncc3[nH]2)c2c(-c3cccc(OC(F)F)c3)ccnc21 ZINC000587130761 GI Annotated Anodyne CC(C)OC(=O)C1(c2nc3cccc(OC(F)(F)F)c3[nH]2)CC(F)(F)C1 ZINC000587130795 GI Annotated Anodyne CCOc1cc(/C=C/c2nc3c(S)nc(S)nc3[nH]2)ccc1OC(F)F ZINC000587130935 GI Annotated Anodyne CCOc1cc(/C=C\c2nc3c(S)nc(S)nc3[nH]2)ccc1OC(F)F ZINC000587130937 GI Annotated Anodyne Cc1cc(Br)cc2nc(C3(C(=O)OC(C)C)CC(F)(F)C3)[nH]c12 ZINC000587131117 GI Annotated Anodyne Cn1nc(-c2nc3ncccc3[nH]2)c2c(-c3cccc(OC(F)F)c3)ccnc21 ZINC000587131127 GI Annotated Anodyne Cc1c(Br)ccc2nc(C3(C(=O)OC(C)C)CC(F)(F)C3)[nH]c12 ZINC000587131131 GI Annotated Anodyne CCOc1cc(/C=C/c2nc3cncc([N+](=O)[O-])c3[nH]2)ccc1OC(F)F ZINC000587131206 GI Annotated Bother CCOc1cc(/C=C\c2nc3cncc([N+](=O)[O-])c3[nH]2)ccc1OC(F)F ZINC000587131207 GI Annotated Bother CC(C)OC(=O)C1(c2nc3cc(F)cc(Br)c3[nH]2)CC(F)(F)C1 ZINC000587131294 GI Annotated Anodyne CC(C)OC(=O)C1(c2nc3cc(Br)cc(F)c3[nH]2)CC(F)(F)C1 ZINC000587131316 GI Annotated Anodyne CC(C)OC(=O)C1(c2nc3ccc(Br)c(F)c3[nH]2)CC(F)(F)C1 ZINC000587131428 GI Annotated Anodyne CC1=C(c2ccc3nc(C4CC(F)(c5cccc(F)c5)C4)[nH]c3c2)NNC(=O)C1 ZINC000587131436 GI Annotated Anodyne CC(C)OC(=O)C1(c2nc3c4cccnc4c4ncccc4c3[nH]2)CC(F)(F)C1 ZINC000587131465 GI Annotated Bother CC(C)OC(=O)C1(c2nc3cc(Br)c(F)cc3[nH]2)CC(F)(F)C1 ZINC000587131544 GI Annotated Anodyne Fc1cccc(C2(F)CC(c3nc4ccc(CN5CCOCC5)cc4[nH]3)C2)c1 ZINC000587131588 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](c2nc3ccc4c(c3[nH]2)CCCC4)C(F)(F)C1 ZINC000587131660 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](c2nc3ccc4c(c3[nH]2)CCCC4)C(F)(F)C1 ZINC000587131661 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](c2nc3c(Cl)cnc(Cl)c3[nH]2)C(F)(F)C1 ZINC000587131685 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](c2nc3c(Cl)cnc(Cl)c3[nH]2)C(F)(F)C1 ZINC000587131687 GI Annotated Anodyne CC(C)OC(=O)C1(c2nc3ccc(C(=O)c4ccccc4)cc3[nH]2)CC(F)(F)C1 ZINC000587131716 GI Annotated Anodyne CC(C)OC(=O)C1(c2nc3ccc(F)c(Br)c3[nH]2)CC(F)(F)C1 ZINC000587131805 GI Annotated Anodyne CC(C)OC(=O)C1(c2nc3cc4nc5ccccc5nc4cc3[nH]2)CC(F)(F)C1 ZINC000587131887 GI Annotated Bother CC(C)(C)OC(=O)N1C[C@@H](c2nc3c(F)c(F)c(F)c(F)c3[nH]2)C(F)(F)C1 ZINC000587132064 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](c2nc3c(F)c(F)c(F)c(F)c3[nH]2)C(F)(F)C1 ZINC000587132065 GI Annotated Anodyne CC(C)Oc1ccc2nc([C@H]3CN(C(=O)OC(C)(C)C)CC3(F)F)[nH]c2c1 ZINC000587132069 GI Annotated Anodyne CC(C)Oc1ccc2nc([C@@H]3CN(C(=O)OC(C)(C)C)CC3(F)F)[nH]c2c1 ZINC000587132070 GI Annotated Anodyne FC1(c2nc3c(I)cnc(Cl)c3[nH]2)CCCCC1 ZINC000587132120 GI Annotated Anodyne Cc1ccc2c(ccc3nc([C@H]4CN(C(=O)OC(C)(C)C)CC4(F)F)[nH]c32)n1 ZINC000587132170 GI Annotated Anodyne Cc1ccc2c(ccc3nc([C@@H]4CN(C(=O)OC(C)(C)C)CC4(F)F)[nH]c32)n1 ZINC000587132171 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](c2nc3c(Cl)c(Cl)cnc3[nH]2)C(F)(F)C1 ZINC000587132297 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](c2nc3c(Cl)c(Cl)cnc3[nH]2)C(F)(F)C1 ZINC000587132298 GI Annotated Anodyne COc1c(F)ccc(F)c1-c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587132341 GI Annotated Clean O=C(c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1)c1c(Cl)ccc(F)c1Cl ZINC000587132445 GI Annotated Bother O=C1CCc2cc3[nH]c(C(=O)c4c(Cl)ccc(F)c4Cl)nc3cc2N1 ZINC000587132476 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](c2nc3cc(Cl)c(Cl)nc3[nH]2)C(F)(F)C1 ZINC000587132488 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](c2nc3cc(Cl)c(Cl)nc3[nH]2)C(F)(F)C1 ZINC000587132489 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](c2nc3cc(C#N)cc(Cl)c3[nH]2)C(F)(F)C1 ZINC000587132493 GI Annotated Mild CC(C)(C)OC(=O)N1C[C@H](c2nc3cc(C#N)cc(Cl)c3[nH]2)C(F)(F)C1 ZINC000587132495 GI Annotated Mild COC(=O)c1cc2nc(C(=O)c3c(Cl)ccc(F)c3Cl)[nH]c2cc1OC ZINC000587132564 GI Annotated Anodyne COc1c(F)ccc(F)c1-c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587132617 GI Annotated Bother COc1c(F)ccc(F)c1-c1nc2cccc(I)c2[nH]1 ZINC000587132647 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](c2nc3cc(Cl)cc(F)c3[nH]2)C(F)(F)C1 ZINC000587132756 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](c2nc3cc(Cl)cc(F)c3[nH]2)C(F)(F)C1 ZINC000587132759 GI Annotated Anodyne O=C(c1nc2c(Br)nccc2[nH]1)c1c(Cl)ccc(F)c1Cl ZINC000587132804 GI Annotated Anodyne O=C(c1nc2cc3c(cc2[nH]1)OCCCO3)c1c(Cl)ccc(F)c1Cl ZINC000587132831 GI Annotated Anodyne COc1c(F)ccc(-c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c1N ZINC000587132923 GI Annotated Anodyne COc1cc2nc([C@H]3CN(C(=O)OC(C)(C)C)CC3(F)F)[nH]c2cc1Cl ZINC000587133096 GI Annotated Anodyne COc1cc2nc([C@@H]3CN(C(=O)OC(C)(C)C)CC3(F)F)[nH]c2cc1Cl ZINC000587133097 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](c2nc3cc(Cl)c(F)c(F)c3[nH]2)C(F)(F)C1 ZINC000587133105 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](c2nc3cc(Cl)c(F)c(F)c3[nH]2)C(F)(F)C1 ZINC000587133106 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](c2nc3cc(Cl)nc(Cl)c3[nH]2)C(F)(F)C1 ZINC000587133110 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](c2nc3cc(Cl)nc(Cl)c3[nH]2)C(F)(F)C1 ZINC000587133111 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H](c2nc3ccc(C(C)(C)C)nc3[nH]2)C(F)(F)C1 ZINC000587133145 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H](c2nc3ccc(C(C)(C)C)nc3[nH]2)C(F)(F)C1 ZINC000587133146 GI Annotated Anodyne CCOC(=O)Cc1ccc2[nH]c(C(=O)c3c(Cl)ccc(F)c3Cl)nc2c1 ZINC000587133211 GI Annotated Anodyne O=C(c1nc2nc(C(F)(F)F)ncc2[nH]1)c1c(Cl)ccc(F)c1Cl ZINC000587133255 GI Annotated Anodyne COc1c(F)ccc(F)c1-c1nc2ccc(I)cc2[nH]1 ZINC000587133358 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(-c3c(F)ccc(F)c3OC)nc2c1 ZINC000587133409 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(-c3cc(F)c(C)c(F)c3)nc2c1 ZINC000587133510 GI Annotated Anodyne CN(C)CCOc1ccc2[nH]c(C(=O)c3c(Cl)ccc(F)c3Cl)nc2c1 ZINC000587133534 GI Annotated Anodyne O=C(c1nc2nc(Br)ccc2[nH]1)c1c(Cl)ccc(F)c1Cl ZINC000587133542 GI Annotated Anodyne O=C(c1nc2cnc(Br)cc2[nH]1)c1c(Cl)ccc(F)c1Cl ZINC000587133614 GI Annotated Anodyne O=C(c1nc2nccc(Br)c2[nH]1)c1c(Cl)ccc(F)c1Cl ZINC000587133632 GI Annotated Anodyne O=C(c1nc2c(Br)cncc2[nH]1)c1c(Cl)ccc(F)c1Cl ZINC000587133682 GI Annotated Anodyne COC(=O)c1ccc2[nH]c(C(=O)c3c(Cl)ccc(F)c3Cl)nc2c1OC ZINC000587133689 GI Annotated Anodyne O=C(c1nc2ncc(Br)cc2[nH]1)c1c(Cl)ccc(F)c1Cl ZINC000587133693 GI Annotated Anodyne Fc1c(F)c(-c2nc3cc(Br)ncc3[nH]2)c(F)c(F)c1S ZINC000587133795 GI Annotated Anodyne COC(=O)c1ccc2nc(/C=C/c3c(F)c(F)c(F)c(F)c3F)[nH]c2c1OC ZINC000587133898 GI Annotated Anodyne COC(=O)c1ccc2nc(/C=C\c3c(F)c(F)c(F)c(F)c3F)[nH]c2c1OC ZINC000587133899 GI Annotated Anodyne O=C1CCc2cc3nc(/C=C\c4c(F)c(F)c(F)c(F)c4F)[nH]c3cc2N1 ZINC000587133975 GI Annotated Anodyne O=C1CCc2cc3nc(/C=C/c4c(F)c(F)c(F)c(F)c4F)[nH]c3cc2N1 ZINC000587133976 GI Annotated Anodyne Fc1c(F)c(-c2nc3cncc(Br)c3[nH]2)c(F)c(F)c1S ZINC000587133982 GI Annotated Anodyne Fc1c(F)c(-c2nc3c(F)cnc(Br)c3[nH]2)c(F)c(F)c1S ZINC000587134134 GI Annotated Anodyne Fc1c(F)c(-c2nc3ccc(Br)nc3[nH]2)c(F)c(F)c1S ZINC000587134137 GI Annotated Anodyne COc1c(F)cc(-c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)cc1F ZINC000587134169 GI Annotated Bother COC(=O)c1cc2[nH]c(/C=C\c3c(F)c(F)c(F)c(F)c3F)nc2cc1OC ZINC000587134194 GI Annotated Anodyne COC(=O)c1cc2[nH]c(/C=C/c3c(F)c(F)c(F)c(F)c3F)nc2cc1OC ZINC000587134195 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(-c3cc(F)cc(F)c3O)nc2c1 ZINC000587134334 GI Annotated Anodyne Fc1c(F)c(F)c(/C=C/c2nc3cnc(C(F)(F)F)[nH]c-3n2)c(F)c1F ZINC000587134590 GI Annotated Mild Fc1c(F)c(F)c(/C=C\c2nc3cnc(C(F)(F)F)[nH]c-3n2)c(F)c1F ZINC000587134591 GI Annotated Mild Fc1cc2[nH]c(-c3c(F)c(F)c(S)c(F)c3F)nc2cc1-n1cccn1 ZINC000587134608 GI Annotated Anodyne CN(C)C(=O)c1ccc2nc(/C=C/c3c(F)c(F)c(F)c(F)c3F)[nH]c2c1 ZINC000587134762 GI Annotated Anodyne CN(C)C(=O)c1ccc2nc(/C=C\c3c(F)c(F)c(F)c(F)c3F)[nH]c2c1 ZINC000587134763 GI Annotated Anodyne CN(C)CCOc1ccc2nc(-c3c(F)c(F)c(S)c(F)c3F)[nH]c2c1 ZINC000587134770 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3c(F)c(F)c(S)c(F)c3F)[nH]c2c1 ZINC000587134775 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(-c3cc(F)c(OC)c(F)c3)nc2c1 ZINC000587134843 GI Annotated Anodyne Fc1c(F)c(-c2nc3c(Br)ccnc3[nH]2)c(F)c(F)c1S ZINC000587134917 GI Annotated Anodyne COc1c(F)cc(-c2nc3cccc(I)c3[nH]2)cc1F ZINC000587135039 GI Annotated Anodyne COc1c(F)cc(-c2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)cc1F ZINC000587135108 GI Annotated Clean Fc1c(F)c(-c2nc3ccnc(Br)c3[nH]2)c(F)c(F)c1S ZINC000587135205 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(-c3cc(F)c(N)c(F)c3)nc2c1 ZINC000587135249 GI Annotated Anodyne Fc1c(F)c(-c2nc3cc(Br)cnc3[nH]2)c(F)c(F)c1S ZINC000587135260 GI Annotated Anodyne COc1c(F)cc(-c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)cc1F ZINC000587135345 GI Annotated Bother CN(C)CCOc1ccc2nc(-c3cc(OC(C)(C)C)c(F)cc3N)[nH]c2c1 ZINC000587135681 GI Annotated Anodyne CC(C)(C)Oc1cc(-c2nc3ccnc(Br)c3[nH]2)c(N)cc1F ZINC000587135684 GI Annotated Anodyne Nc1cc(F)c(-c2nc3ccc(Br)c(C(F)(F)F)c3[nH]2)cc1N ZINC000587135737 GI Annotated Anodyne CC(C)Oc1cc2nc(-c3cc(N)c(N)cc3F)[nH]c2cc1Br ZINC000587135755 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3cc(OC(C)(C)C)c(F)cc3N)[nH]c2c1 ZINC000587135790 GI Annotated Anodyne Cc1c(F)cccc1-c1cc(-c2nc3[nH]c(=N)[nH]c(Cl)c-3n2)cc([N+](=O)[O-])c1 ZINC000587135818 GI Annotated Bother CC(C)(C)Oc1cc(-c2nc3c(F)cnc(Br)c3[nH]2)c(N)cc1F ZINC000587135829 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3cc(Br)c(F)cc3F)[nH]c2c1 ZINC000587135847 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3cc(Br)c(F)cc3F)[nH]c2cc1[N+](=O)[O-] ZINC000587135867 GI Annotated Bother CC(C)(C)Oc1cc(-c2nc3ccc(Br)nc3[nH]2)c(N)cc1F ZINC000587135890 GI Annotated Anodyne Fc1cc(F)c(-c2nc3cc4c(cc3[nH]2)OCCCO4)cc1Br ZINC000587135925 GI Annotated Anodyne CN(C)CCOc1ccc2nc(-c3cc(Br)c(F)cc3F)[nH]c2c1 ZINC000587136005 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(-c3cccc(F)c3NC)nc2c1 ZINC000587136022 GI Annotated Anodyne Cc1ccc2c(ccc3nc(CN(C)c4cc(C)c(F)cc4[N+](=O)[O-])[nH]c32)n1 ZINC000587136033 GI Annotated Bother Cc1cc(N(C)Cc2nc3cc(Cl)nc(Cl)c3[nH]2)c([N+](=O)[O-])cc1F ZINC000587136041 GI Annotated Bother Nc1c(F)c(F)cc(-c2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)c1F ZINC000587136094 GI Annotated Clean CC(C)(C)Oc1cc(-c2nc3c(Br)ccnc3[nH]2)c(N)cc1F ZINC000587136227 GI Annotated Anodyne Nc1cc(F)c(-c2nc3cc(C(F)(F)F)c(Br)cc3[nH]2)cc1N ZINC000587136242 GI Annotated Anodyne CC(C)(C)Oc1cc(-c2nc3cc(Br)cnc3[nH]2)c(N)cc1F ZINC000587136281 GI Annotated Anodyne CC(C)(C)Oc1cc(-c2nc3cncc(Br)c3[nH]2)c(N)cc1F ZINC000587136324 GI Annotated Anodyne Cc1cc(N(C)Cc2nc3cc(Cl)c(F)c(F)c3[nH]2)c([N+](=O)[O-])cc1F ZINC000587136329 GI Annotated Bother Nc1c(F)c(F)cc(-c2nc3c(Br)cnc(Cl)c3[nH]2)c1F ZINC000587136462 GI Annotated Anodyne Cc1c(F)cccc1-c1cc(-c2nc3c(O)nc(S)nc3[nH]2)cc([N+](=O)[O-])c1 ZINC000587136466 GI Annotated Bother Nc1c(F)c(F)cc(-c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c1F ZINC000587136485 GI Annotated Mild COC(=O)c1cc2[nH]c(-c3cc(Br)c(F)cc3F)nc2cc1OC ZINC000587136572 GI Annotated Anodyne CCCOc1cc2nc(-c3cc(N)c(N)cc3F)[nH]c2cc1Br ZINC000587136579 GI Annotated Anodyne Nc1cc(F)c(-c2nc3cc(Br)cc(C(F)(F)F)c3[nH]2)cc1N ZINC000587136606 GI Annotated Anodyne CCCCOc1cc2nc(-c3cc(N)c(N)cc3F)[nH]c2cc1Br ZINC000587136637 GI Annotated Anodyne Nc1cc(F)c(-c2nc3cc(C(F)(F)F)cc(Br)c3[nH]2)cc1N ZINC000587136639 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cc(Br)c(F)cc3F)[nH]c2c1OC ZINC000587136648 GI Annotated Anodyne CC(C)(C)Oc1cc(-c2nc3cc4c(cc3[nH]2)OC(F)(F)O4)c(N)cc1F ZINC000587136658 GI Annotated Anodyne Cc1cc(N(C)Cc2nc3c(F)c(F)c(F)c(F)c3[nH]2)c([N+](=O)[O-])cc1F ZINC000587136678 GI Annotated Bother Cc1cc(N(C)Cc2nc3cc(Cl)c(Cl)nc3[nH]2)c([N+](=O)[O-])cc1F ZINC000587136683 GI Annotated Bother COc1cc2nc(CN(C)c3cc(C)c(F)cc3[N+](=O)[O-])[nH]c2cc1Cl ZINC000587136703 GI Annotated Bother CC(C)(C)Oc1cc(-c2nc3cc(-n4cccn4)c(F)cc3[nH]2)c(N)cc1F ZINC000587136793 GI Annotated Anodyne CC(C)(C)Oc1cc(-c2nc3cc(Br)ncc3[nH]2)c(N)cc1F ZINC000587136823 GI Annotated Anodyne Cc1cc(N(C)Cc2nc3ccc(Br)cc3[nH]2)c([N+](=O)[O-])cc1F ZINC000587136873 GI Annotated Bother O=C1CCc2cc3nc(-c4cc(Br)c(F)cc4F)[nH]c3cc2N1 ZINC000587136886 GI Annotated Anodyne Cc1cc(N(C)Cc2nc3cccc(Br)c3[nH]2)c([N+](=O)[O-])cc1F ZINC000587136897 GI Annotated Bother Cc1cc(N(C)Cc2nc3c(Cl)c(Cl)cnc3[nH]2)c([N+](=O)[O-])cc1F ZINC000587136973 GI Annotated Bother Cc1cc(N(C)Cc2nc3cc([N+](=O)[O-])c(Cl)cc3[nH]2)c([N+](=O)[O-])cc1F ZINC000587137180 GI Annotated Bother Cc1cc(N(C)Cc2nc3cccc(OC(F)(F)F)c3[nH]2)c([N+](=O)[O-])cc1F ZINC000587137206 GI Annotated Bother Cc1cc(N(C)Cc2nc3ccc(OC(F)(F)F)cc3[nH]2)c([N+](=O)[O-])cc1F ZINC000587137218 GI Annotated Bother Cc1cc(N(C)Cc2nc3c(Cl)cnc(Cl)c3[nH]2)c([N+](=O)[O-])cc1F ZINC000587137228 GI Annotated Bother Nc1c(F)c(F)cc(-c2nc3cc(Br)c(F)c(F)c3[nH]2)c1F ZINC000587137305 GI Annotated Anodyne Fc1cc(Br)c(Cl)cc1-c1nc2c(S)nc(S)nc2[nH]1 ZINC000587137597 GI Annotated Anodyne Fc1cc(F)c(-c2nc3cncc(Br)c3[nH]2)cc1Br ZINC000587137624 GI Annotated Anodyne Fc1cc(F)c(-c2nc3cnc(C(F)(F)F)[nH]c-3n2)cc1Br ZINC000587137688 GI Annotated Anodyne Fc1cc(F)c(-c2nc3cc(Br)cnc3[nH]2)cc1Br ZINC000587137692 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cc(F)c(C)cc3Br)[nH]c2c1OC ZINC000587137695 GI Annotated Anodyne Oc1nc2cc3nc(-c4cc(Cl)c(Br)cc4F)[nH]c3cc2[nH]1 ZINC000587137783 GI Annotated Anodyne Fc1cc(F)c(-c2nc3ccc(Br)nc3[nH]2)cc1Br ZINC000587137928 GI Annotated Anodyne COC(=O)c1cc2[nH]c(-c3cc(F)c(C)cc3Br)nc2cc1OC ZINC000587137929 GI Annotated Anodyne O=C1COc2cc3[nH]c(-c4cc(Cl)c(Br)cc4F)nc3cc2N1 ZINC000587137932 GI Annotated Anodyne Fc1cc(F)c(-c2nc3ccnc(Br)c3[nH]2)cc1Br ZINC000587137941 GI Annotated Anodyne Cc1cc(Br)c(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)cc1F ZINC000587137983 GI Annotated Bother Fc1cc(F)c(-c2nc3c(Br)ccnc3[nH]2)cc1Br ZINC000587138077 GI Annotated Anodyne Fc1cc(F)c(-c2nc3cc(Br)ncc3[nH]2)cc1Br ZINC000587138078 GI Annotated Anodyne Cc1cc(Br)c(-c2nc3cnc(C(F)(F)F)[nH]c-3n2)cc1F ZINC000587138086 GI Annotated Anodyne COc1ccc2nc(-c3ccc(-c4cc(C(=O)O)ccc4F)cc3F)[nH]c2n1 ZINC000587138255 GI Annotated Anodyne O=C(O)c1ccc(F)c(-c2ccc(-c3nc4c(Cl)ncnc4[nH]3)c(F)c2)c1 ZINC000587138378 GI Annotated Anodyne O=C(O)c1ccc(-c2cc(-c3nc4nc(Cl)c[nH]c-4n3)ccc2F)cc1F ZINC000587138393 GI Annotated Anodyne COc1cncc2nc(-c3ccc(F)c(-c4ccc(C(=O)O)c(F)c4)c3)[nH]c12 ZINC000587138396 GI Annotated Anodyne O=C(O)c1ccc(-c2cc(-c3nc4c(Cl)ncnc4[nH]3)ccc2F)cc1F ZINC000587138456 GI Annotated Anodyne O=C(O)c1ccc(F)c(-c2ccc(-c3nc4cnc(Cl)[nH]c-4n3)c(F)c2)c1 ZINC000587138462 GI Annotated Anodyne COc1nccc2nc(-c3ccc(-c4cc(C(=O)O)ccc4F)cc3F)[nH]c12 ZINC000587138484 GI Annotated Anodyne COc1ccc2nc(-c3ccc(F)c(-c4ccc(C(=O)O)c(F)c4)c3)[nH]c2n1 ZINC000587138494 GI Annotated Anodyne O=C(O)c1ccc(-c2cc(-c3nc4cncc([N+](=O)[O-])c4[nH]3)ccc2F)cc1F ZINC000587138642 GI Annotated Bother COc1nccc2nc(-c3ccc(F)c(-c4ccc(C(=O)O)c(F)c4)c3)[nH]c12 ZINC000587138653 GI Annotated Anodyne O=C(O)c1ccc(F)c(-c2ccc(-c3nc4nc(Cl)c[nH]c-4n3)c(F)c2)c1 ZINC000587138721 GI Annotated Anodyne Fc1cc(CCc2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)cc(F)c1F ZINC000587138791 GI Annotated Anodyne O=[N+]([O-])c1cc(Cl)cc(-c2nc3c(F)cnc(Br)c3[nH]2)c1F ZINC000587138883 GI Annotated Bother N#Cc1cc(Br)c2[nH]c(CCc3cc(F)c(F)c(F)c3)nc2c1 ZINC000587138925 GI Annotated Mild O=C(O)c1ccc(-c2cc(-c3nc4cnc(Cl)[nH]c-4n3)ccc2F)cc1F ZINC000587138971 GI Annotated Anodyne O=C(O)c1ccc(F)c(-c2ccc(-c3nc4cncc([N+](=O)[O-])c4[nH]3)c(F)c2)c1 ZINC000587138984 GI Annotated Bother O=C(O)c1ccc(F)c(-c2ccc(-c3nc4cc([N+](=O)[O-])cnc4[nH]3)c(F)c2)c1 ZINC000587138987 GI Annotated Bother COC(=O)c1ccnc2[nH]c(-c3ccc(F)c(-c4ccc(C(C)=O)cc4)c3)nc12 ZINC000587139194 GI Annotated Anodyne CC(=O)c1ccc(-c2cc(-c3nc4c(O)nc(S)nc4[nH]3)ccc2F)cc1 ZINC000587139265 GI Annotated Anodyne O=[N+]([O-])c1cc(Cl)cc(-c2nc3ccc(Br)c(O)c3[nH]2)c1F ZINC000587139424 GI Annotated Bother CCOC(=O)Cc1ccc2nc(-c3cc(Cl)cc([N+](=O)[O-])c3F)[nH]c2c1 ZINC000587139573 GI Annotated Bother Cc1nc2[nH]c(-c3cc(Cl)cc([N+](=O)[O-])c3F)nc2cc1Br ZINC000587139610 GI Annotated Bother Cc1c(Br)cnc2[nH]c(-c3cc(Cl)cc([N+](=O)[O-])c3F)nc12 ZINC000587139612 GI Annotated Bother O=[N+]([O-])c1cc(Cl)cc(-c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)c1F ZINC000587139617 GI Annotated Bother Nc1cc(-c2nc3c(Br)ccc(Br)c3[nH]2)ccc1F ZINC000587139748 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3ccc(F)c(-c4ccc(C(C)=O)cc4)c3)[nH]c2n1 ZINC000587139790 GI Annotated Anodyne CC(=O)c1ccc(-c2cc(-c3nc4[nH]c(=N)[nH]c(Cl)c-4n3)ccc2F)cc1 ZINC000587139798 GI Annotated Anodyne O=[N+]([O-])c1cc(Cl)cc(-c2nc3cc(-n4cccn4)c(F)cc3[nH]2)c1F ZINC000587139895 GI Annotated Bother O=C(O)c1cc(Br)cc2nc(CCc3cc(F)c(F)c(F)c3)[nH]c12 ZINC000587140288 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(-c3cc(Cl)cc([N+](=O)[O-])c3F)nc2c1 ZINC000587140314 GI Annotated Bother COC(=O)c1cc(Br)c2[nH]c(-c3cc(S)ccc3F)nc2c1 ZINC000587140457 GI Annotated Anodyne CCCOc1cc2nc(Cc3cc(N)ccc3F)[nH]c2cc1Br ZINC000587140593 GI Annotated Anodyne Oc1nc(O)c2nc(-c3cccc(CSc4cc(F)ccc4F)c3)[nH]c2n1 ZINC000587140925 GI Annotated Anodyne CC(C)Oc1cc2nc(-c3cc(CO)ccc3F)[nH]c2cc1Br ZINC000587141046 GI Annotated Anodyne CCCOc1cc2nc(-c3cc(CO)ccc3F)[nH]c2cc1Br ZINC000587141049 GI Annotated Anodyne Nc1ccc(F)c(Cc2nc3c(Br)ccc(Br)c3[nH]2)c1 ZINC000587141078 GI Annotated Anodyne CC(C)Oc1cc2nc(Cc3cc(N)ccc3F)[nH]c2cc1Br ZINC000587141268 GI Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc(Cc4cc(N)ccc4F)[nH]c3c2)cc1 ZINC000587141392 GI Annotated Anodyne Nc1ccc(F)c(Cc2nc3cc(Br)c(Br)cc3[nH]2)c1 ZINC000587141468 GI Annotated Anodyne COc1cc2nc(C[C@@H](N)c3ccc(Br)cc3F)[nH]c2cc1Cl ZINC000587142446 GI Annotated Anodyne COc1cc2nc(C[C@H](N)c3ccc(Br)cc3F)[nH]c2cc1Cl ZINC000587142447 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3ccc(Br)cc3F)[nH]c2c1 ZINC000587142575 GI Annotated Anodyne Cc1cnc(Cl)c2[nH]c(C[C@@H](N)c3ccc(Br)cc3F)nc12 ZINC000587142740 GI Annotated Anodyne Cc1cnc(Cl)c2[nH]c(C[C@H](N)c3ccc(Br)cc3F)nc12 ZINC000587142742 GI Annotated Anodyne N[C@H](Cc1nc2cc(Cl)c(F)cc2[nH]1)c1ccc(Br)cc1F ZINC000587142744 GI Annotated Anodyne N[C@@H](Cc1nc2cc(Cl)c(F)cc2[nH]1)c1ccc(Br)cc1F ZINC000587142745 GI Annotated Anodyne N[C@H](Cc1nc2cc(Cl)cc(F)c2[nH]1)c1ccc(Br)cc1F ZINC000587142846 GI Annotated Anodyne N[C@@H](Cc1nc2cc(Cl)cc(F)c2[nH]1)c1ccc(Br)cc1F ZINC000587142847 GI Annotated Anodyne N[C@@H](Cc1nc2cc(F)c(F)c(F)c2[nH]1)c1ccc(Br)cc1F ZINC000587143057 GI Annotated Anodyne N[C@H](Cc1nc2cc(F)c(F)c(F)c2[nH]1)c1ccc(Br)cc1F ZINC000587143058 GI Annotated Anodyne N#Cc1cc(Cl)c2[nH]c(C[C@@H](N)c3ccc(Br)cc3F)nc2c1 ZINC000587143088 GI Annotated Mild N#Cc1cc(Cl)c2[nH]c(C[C@H](N)c3ccc(Br)cc3F)nc2c1 ZINC000587143092 GI Annotated Mild CN(C)CCOc1ccc2nc(-c3ccc(Br)cc3F)[nH]c2c1 ZINC000587143118 GI Annotated Anodyne Fc1cc(Br)ccc1-c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587143142 GI Annotated Anodyne COc1cc(-c2nc3cccc(O)c3[nH]2)cc(-c2ccc(C(=O)O)cc2F)c1 ZINC000587143293 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4cnc(Cl)[nH]c-4n3)cc2F)c1 ZINC000587143306 GI Annotated Anodyne COc1cc(-c2nc3cncc(C)c3[nH]2)cc(-c2ccc(C(=O)O)cc2F)c1 ZINC000587143365 GI Annotated Anodyne COc1cc(-c2nc3c(Cl)ncnc3[nH]2)cc(-c2ccc(C(=O)O)cc2F)c1 ZINC000587143528 GI Annotated Anodyne COc1ccc(C(=O)c2ccccc2-c2nc3c(Cl)ncnc3[nH]2)cc1F ZINC000587143600 GI Annotated Anodyne N#Cc1ccc(-c2nc3c(Br)cnc(Br)c3[nH]2)cc1F ZINC000587143607 GI Annotated Mild CC(C)Oc1ccc2nc(C[C@H](N)c3ccc(Br)cc3F)[nH]c2c1 ZINC000587143711 GI Annotated Anodyne CC(C)Oc1ccc2nc(C[C@@H](N)c3ccc(Br)cc3F)[nH]c2c1 ZINC000587143713 GI Annotated Anodyne COc1cc(-c2nc3nc(Cl)c[nH]c-3n2)cc(-c2ccc(C(=O)O)cc2F)c1 ZINC000587143767 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4cccc(O)c4[nH]3)cc2F)c1 ZINC000587143843 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4cncc(OC)c4[nH]3)cc2F)c1 ZINC000587143862 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1-c1ccc(-c2nc3cc([N+](=O)[O-])cnc3[nH]2)c(F)c1 ZINC000587143872 GI Annotated Bother COc1cc(-c2nc3cnc(Cl)[nH]c-3n2)cc(-c2ccc(C(=O)O)cc2F)c1 ZINC000587143890 GI Annotated Anodyne COc1ccc2nc(-c3ccc(-c4ccc(C(=O)O)cc4C)cc3F)[nH]c2n1 ZINC000587143919 GI Annotated Anodyne Fc1ccc(-c2nc3c(Br)cnc(Br)c3[nH]2)cc1F ZINC000587143928 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1-c1ccc(-c2nc3cncc([N+](=O)[O-])c3[nH]2)c(F)c1 ZINC000587143983 GI Annotated Bother COc1cc(-c2nc3cncc(OC)c3[nH]2)cc(-c2ccc(C(=O)O)cc2F)c1 ZINC000587143987 GI Annotated Anodyne N[C@@H](Cc1nc2ccc3ncccc3c2[nH]1)c1ccc(Br)cc1F ZINC000587144013 GI Annotated Anodyne N[C@H](Cc1nc2ccc3ncccc3c2[nH]1)c1ccc(Br)cc1F ZINC000587144015 GI Annotated Anodyne COc1ccc(C(=O)c2ccccc2-c2nc3cc4c(cc3[nH]2)OCO4)cc1F ZINC000587144064 GI Annotated Anodyne CC(C)(C)c1ccc2nc(C[C@@H](N)c3ccc(Br)cc3F)[nH]c2n1 ZINC000587144081 GI Annotated Anodyne CC(C)(C)c1ccc2nc(C[C@H](N)c3ccc(Br)cc3F)[nH]c2n1 ZINC000587144082 GI Annotated Anodyne COc1cc(-c2nc3c(C)ccnc3[nH]2)cc(-c2ccc(C(=O)O)cc2F)c1 ZINC000587144094 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4c(C)nccc4[nH]3)cc2F)c1 ZINC000587144103 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4ccnc(OC)c4[nH]3)cc2F)c1 ZINC000587144146 GI Annotated Anodyne COc1cc(-c2nc3ccnc(OC)c3[nH]2)cc(-c2ccc(C(=O)O)cc2F)c1 ZINC000587144168 GI Annotated Anodyne COc1ccc(C(=O)c2ccccc2-c2nc3ccnc(OC)c3[nH]2)cc1F ZINC000587144170 GI Annotated Anodyne COc1ccc(C(=O)c2ccccc2-c2nc3nc(Cl)c[nH]c-3n2)cc1F ZINC000587144200 GI Annotated Anodyne COc1cc(-c2nc3c(C)nccc3[nH]2)cc(-c2ccc(C(=O)O)cc2F)c1 ZINC000587144203 GI Annotated Anodyne COc1cc2[nH]c(-c3ccc(-c4ccc(C(=O)O)c(F)c4)c(C)c3)nc2cn1 ZINC000587144263 GI Annotated Anodyne COc1cncc2[nH]c(-c3ccc(-c4ccc(C(=O)O)c(F)c4)c(C)c3)nc12 ZINC000587144287 GI Annotated Anodyne COc1ccc(C(=O)c2ccccc2-c2nc3cccc(C(=O)O)c3[nH]2)cc1F ZINC000587144309 GI Annotated Anodyne COc1ccc2[nH]c(-c3ccc(-c4ccc(C(=O)O)c(F)c4)c(C)c3)nc2n1 ZINC000587144354 GI Annotated Anodyne COc1ccc(C(=O)c2ccccc2-c2nc3cc(C#N)c(C#N)cc3[nH]2)cc1F ZINC000587144359 GI Annotated Mild Cc1cc(-c2nc3nc(Cl)c[nH]c-3n2)ccc1-c1ccc(C(=O)O)c(F)c1 ZINC000587144390 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4cncc(C)c4[nH]3)cc2F)c1 ZINC000587144396 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4nc(Cl)c[nH]c-4n3)cc2F)c1 ZINC000587144407 GI Annotated Anodyne COc1cc2nc(-c3ccccc3C(=O)c3ccc(OC)c(F)c3)[nH]c2cn1 ZINC000587144520 GI Annotated Anodyne CSc1ccc2nc(C[C@@H](N)c3ccc(Br)cc3F)[nH]c2c1 ZINC000587144521 GI Annotated Anodyne CSc1ccc2nc(C[C@H](N)c3ccc(Br)cc3F)[nH]c2c1 ZINC000587144522 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1-c1ccc(-c2nc3c(Cl)ncnc3[nH]2)c(F)c1 ZINC000587144535 GI Annotated Anodyne Cc1cc(-c2nc3ncc([N+](=O)[O-])cc3[nH]2)ccc1-c1ccc(C(=O)O)c(F)c1 ZINC000587144540 GI Annotated Bother Cc1cc(C(=O)O)ccc1-c1ccc(-c2nc3cnc(Cl)[nH]c-3n2)c(F)c1 ZINC000587144548 GI Annotated Anodyne COc1ccc(C(=O)c2ccccc2-c2nc3cnc(Cl)[nH]c-3n2)cc1F ZINC000587144579 GI Annotated Anodyne COc1nccc2[nH]c(-c3ccc(-c4ccc(C(=O)O)c(F)c4)c(C)c3)nc12 ZINC000587144642 GI Annotated Anodyne Fc1cc(Cc2nc3nc(Br)c[nH]c-3n2)ccc1-c1ccccc1 ZINC000587144877 GI Annotated Anodyne COc1ccc2nc(-c3ccccc3C(=O)c3ccc(OC)c(F)c3)[nH]c2n1 ZINC000587144907 GI Annotated Anodyne Cc1cc(-c2nc3c([N+](=O)[O-])cncc3[nH]2)ccc1-c1ccc(C(=O)O)c(F)c1 ZINC000587145066 GI Annotated Bother COc1nccc2nc(-c3ccc(-c4ccc(C(=O)O)cc4C)cc3F)[nH]c12 ZINC000587145072 GI Annotated Anodyne COc1cncc2nc(-c3ccc(-c4ccc(C(=O)O)cc4C)cc3F)[nH]c12 ZINC000587145087 GI Annotated Anodyne COc1cc2nc(C[C@@H](N)c3ccc(Br)cc3F)[nH]c2cc1C ZINC000587145258 GI Annotated Anodyne COc1cc2nc(C[C@H](N)c3ccc(Br)cc3F)[nH]c2cc1C ZINC000587145262 GI Annotated Anodyne COc1ccc(C(=O)c2ccccc2-c2nc3cncc(OC)c3[nH]2)cc1F ZINC000587145347 GI Annotated Anodyne Cc1cc(-c2nc3nc(Cl)ncc3[nH]2)ccc1-c1ccc(C(=O)O)c(F)c1 ZINC000587145396 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1-c1ccc(-c2nc3nc(Cl)c[nH]c-3n2)c(F)c1 ZINC000587145506 GI Annotated Anodyne Cc1cc(-c2nc3ncnc(Cl)c3[nH]2)ccc1-c1ccc(C(=O)O)c(F)c1 ZINC000587145553 GI Annotated Anodyne Fc1ccc(-c2nc3c(I)cnc(Cl)c3[nH]2)cc1F ZINC000587145968 GI Annotated Anodyne Cc1ccc(/C=C\c2nc3cc(I)cnc3[nH]2)cc1F ZINC000587146192 GI Annotated Anodyne Cc1ccc(/C=C/c2nc3cc(I)cnc3[nH]2)cc1F ZINC000587146193 GI Annotated Anodyne Cc1ccc(/C=C\c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)cc1F ZINC000587146215 GI Annotated Anodyne Cc1ccc(/C=C/c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)cc1F ZINC000587146216 GI Annotated Anodyne Cc1ccc(/C=C\c2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)cc1F ZINC000587146450 GI Annotated Anodyne Cc1ccc(/C=C/c2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)cc1F ZINC000587146451 GI Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc(/C=C/c3ccc(C)c(F)c3)[nH]c2c1 ZINC000587146704 GI Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc(/C=C\c3ccc(C)c(F)c3)[nH]c2c1 ZINC000587146705 GI Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc(/C=C/c3ccc(C)c(F)c3)[nH]c2c1 ZINC000587146811 GI Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc(/C=C\c3ccc(C)c(F)c3)[nH]c2c1 ZINC000587146812 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4ccnc(OC)c4[nH]3)c(F)c2)c1 ZINC000587146948 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4ccc(OC)nc4[nH]3)c(F)c2)c1 ZINC000587146952 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4cnc(Cl)[nH]c-4n3)c(F)c2)c1 ZINC000587146987 GI Annotated Anodyne COc1cc(-c2ccc(C(=O)O)c(F)c2)cc(-c2nc3cncc(OC)c3[nH]2)c1 ZINC000587147025 GI Annotated Anodyne CCNC(=O)c1ccc(-c2ccc(Cc3nc4cccc(O)c4[nH]3)cc2)cc1F ZINC000587147036 GI Annotated Anodyne CCNC(=O)c1ccc(-c2ccc(Cc3nc4cc(F)cnc4[nH]3)cc2)cc1F ZINC000587147050 GI Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2cc3c(cc2[nH]1)OC(F)(F)O3 ZINC000587147062 GI Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587147201 GI Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2nccc(Br)c2[nH]1 ZINC000587147231 GI Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2nc(Br)ccc2[nH]1 ZINC000587147236 GI Annotated Anodyne CCNC(=O)c1ccc(-c2ccc(Cc3nc4cc(C)cnc4[nH]3)cc2)cc1F ZINC000587147262 GI Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2c(Br)nccc2[nH]1 ZINC000587147271 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4c(C)ccnc4[nH]3)c(F)c2)c1 ZINC000587147337 GI Annotated Anodyne COc1cc(-c2ccc(C(=O)O)c(F)c2)cc(-c2nc3ccc(OC)nc3[nH]2)c1 ZINC000587147353 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4cccc(O)c4[nH]3)c(F)c2)c1 ZINC000587147360 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4cncc(OC)c4[nH]3)c(F)c2)c1 ZINC000587147371 GI Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2cnc(C(F)(F)F)cc2[nH]1 ZINC000587147407 GI Annotated Anodyne CCNC(=O)c1ccc(-c2ccc(Cc3nc4ccc(C)nc4[nH]3)cc2)cc1F ZINC000587147417 GI Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2c(Br)cncc2[nH]1 ZINC000587147478 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4ccc(C)nc4[nH]3)c(F)c2)c1 ZINC000587147490 GI Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2cnc(Br)cc2[nH]1 ZINC000587147511 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4nc(Cl)c[nH]c-4n3)c(F)c2)c1 ZINC000587147563 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4cncc(C)c4[nH]3)c(F)c2)c1 ZINC000587147566 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4c(Cl)ncnc4[nH]3)c(F)c2)c1 ZINC000587147580 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4ccc(O)cc4[nH]3)c(F)c2)c1 ZINC000587147611 GI Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587147687 GI Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2ncc(Br)cc2[nH]1 ZINC000587147705 GI Annotated Anodyne COc1cc(C(=O)O)cc(-c2ccc(-c3nc4c(C)nccc4[nH]3)c(F)c2)c1 ZINC000587147771 GI Annotated Anodyne COc1cc(-c2ccc(C(=O)O)c(F)c2)cc(-c2nc3nc(Cl)c[nH]c-3n2)c1 ZINC000587147783 GI Annotated Anodyne O=C1C[C@@H](c2nc3c(Cl)cnc(Cl)c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587147792 GI Annotated Anodyne O=C1C[C@H](c2nc3c(Cl)cnc(Cl)c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587147794 GI Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2cc(Cl)c([N+](=O)[O-])cc2[nH]1 ZINC000587147802 GI Annotated Bother O=C1C[C@@H](c2nc3cc(Cl)c(F)c(F)c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587147884 GI Annotated Anodyne O=C1C[C@H](c2nc3cc(Cl)c(F)c(F)c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587147885 GI Annotated Anodyne O=C1C[C@@H](c2nc3ccc(C(F)(F)F)cc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587147909 GI Annotated Anodyne O=C1C[C@H](c2nc3ccc(C(F)(F)F)cc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587147912 GI Annotated Anodyne CC(C)Oc1ccc2nc([C@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c2c1 ZINC000587147925 GI Annotated Anodyne CC(C)Oc1ccc2nc([C@@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c2c1 ZINC000587147927 GI Annotated Anodyne O=C1C[C@H](c2nc3ccc4c(c3[nH]2)CCCC4)CN1Cc1ccc(F)cc1F ZINC000587147952 GI Annotated Anodyne O=C1C[C@@H](c2nc3ccc4c(c3[nH]2)CCCC4)CN1Cc1ccc(F)cc1F ZINC000587147956 GI Annotated Anodyne CCNC(=O)c1ccc(-c2ccc(Cc3nc4c(C)ccnc4[nH]3)cc2)cc1F ZINC000587148000 GI Annotated Anodyne Cc1cc(Cl)cc2nc([C@@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c12 ZINC000587148011 GI Annotated Anodyne Cc1cc(Cl)cc2nc([C@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c12 ZINC000587148013 GI Annotated Anodyne O=C1C[C@H](c2nc3cc(Cl)cc(F)c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587148051 GI Annotated Anodyne O=C1C[C@@H](c2nc3cc(Cl)cc(F)c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587148052 GI Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2ncc(C(F)(F)F)cc2[nH]1 ZINC000587148056 GI Annotated Anodyne Cn1nc(-c2ccc(F)c(F)c2)cc1-c1nc2cc(F)c(-n3cccn3)cc2[nH]1 ZINC000587148058 GI Annotated Anodyne O=C(c1ccccc1)c1ccc2nc(COc3ccc([N+](=O)[O-])c(F)c3)[nH]c2c1 ZINC000587148142 GI Annotated Bother COc1ccc(Cc2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c(F)c1 ZINC000587148166 GI Annotated Anodyne Nc1ccc(-c2ccc3nc(COc4ccc([N+](=O)[O-])c(F)c4)[nH]c3c2)cc1N ZINC000587148172 GI Annotated Bother O=[N+]([O-])c1ccc(OCc2nc3cc4nc5ccccc5nc4cc3[nH]2)cc1F ZINC000587148180 GI Annotated Bother O=[N+]([O-])c1ccc(OCc2nc3cc(Br)cc(F)c3[nH]2)cc1F ZINC000587148228 GI Annotated Bother O=C1C[C@@H](c2nc3cc(Cl)c(Cl)nc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587148231 GI Annotated Anodyne O=C1C[C@H](c2nc3cc(Cl)c(Cl)nc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587148232 GI Annotated Anodyne Cc1ccc2c(ccc3nc([C@H]4CC(=O)N(Cc5ccc(F)cc5F)C4)[nH]c32)n1 ZINC000587148259 GI Annotated Anodyne Cc1ccc2c(ccc3nc([C@@H]4CC(=O)N(Cc5ccc(F)cc5F)C4)[nH]c32)n1 ZINC000587148264 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(CCc3ccccc3F)nc2c1 ZINC000587148363 GI Annotated Anodyne O=[N+]([O-])c1ccc(OCc2nc3ccc(Br)c(F)c3[nH]2)cc1F ZINC000587148429 GI Annotated Bother N#Cc1cc2nc(COc3ccc([N+](=O)[O-])c(F)c3)[nH]c2cc1C(F)(F)F ZINC000587148460 GI Annotated Mild Cc1cc(Br)cc2nc(COc3ccc([N+](=O)[O-])c(F)c3)[nH]c12 ZINC000587148494 GI Annotated Bother COC(=O)c1ccnc2[nH]c([C@H](Oc3ccc(F)c(F)c3)c3ccccc3)nc12 ZINC000587148559 GI Annotated Anodyne COC(=O)c1ccnc2[nH]c([C@@H](Oc3ccc(F)c(F)c3)c3ccccc3)nc12 ZINC000587148561 GI Annotated Anodyne COc1ccc(Cc2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)c(F)c1 ZINC000587148592 GI Annotated Clean COC(=O)c1ccnc2[nH]c([C@@H](Nc3ccccc3)c3ccccc3F)nc12 ZINC000587148677 GI Annotated Anodyne COC(=O)c1ccnc2[nH]c([C@H](Nc3ccccc3)c3ccccc3F)nc12 ZINC000587148679 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(CCc3ccccc3F)nc2c1 ZINC000587148745 GI Annotated Anodyne O=[N+]([O-])c1ccc(OCc2nc3c4cccnc4c4ncccc4c3[nH]2)cc1F ZINC000587148852 GI Annotated Bother Cc1c(Br)ccc2nc(COc3ccc([N+](=O)[O-])c(F)c3)[nH]c12 ZINC000587148887 GI Annotated Bother O=[N+]([O-])c1cncc2nc([C@H](Oc3ccc(F)c(F)c3)c3ccccc3)[nH]c12 ZINC000587149066 GI Annotated Bother CCCOc1cc2nc([C@@H](N)c3ccc(F)cc3F)[nH]c2cc1Br ZINC000587149068 GI Annotated Anodyne O=[N+]([O-])c1cncc2nc([C@@H](Oc3ccc(F)c(F)c3)c3ccccc3)[nH]c12 ZINC000587149074 GI Annotated Bother O=[N+]([O-])c1ccc(OCc2nc3ccc(F)c(Br)c3[nH]2)cc1F ZINC000587149095 GI Annotated Bother O=C1C[C@@H](c2nc3c(Cl)c(Cl)cnc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587149146 GI Annotated Anodyne O=C1C[C@H](c2nc3c(Cl)c(Cl)cnc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587149147 GI Annotated Anodyne O=C1C[C@@H](c2nc3cccc(C(F)(F)F)c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587149178 GI Annotated Anodyne O=C1C[C@H](c2nc3cccc(C(F)(F)F)c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587149179 GI Annotated Anodyne CC(C)(C)c1ccc2nc([C@@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c2n1 ZINC000587149181 GI Annotated Anodyne CC(C)(C)c1ccc2nc([C@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c2n1 ZINC000587149182 GI Annotated Anodyne Fc1ccccc1[C@@H](Nc1ccccc1)c1nc2c(S)nc(S)nc2[nH]1 ZINC000587149205 GI Annotated Anodyne Fc1ccccc1[C@H](Nc1ccccc1)c1nc2c(S)nc(S)nc2[nH]1 ZINC000587149206 GI Annotated Anodyne COC(=O)c1cc2nc([C@@H](Oc3ccc(F)c(F)c3)c3ccccc3)[nH]c2cn1 ZINC000587149376 GI Annotated Anodyne COC(=O)c1cc2nc([C@H](Oc3ccc(F)c(F)c3)c3ccccc3)[nH]c2cn1 ZINC000587149378 GI Annotated Anodyne C[C@@H](Oc1ccc(F)c(F)c1)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587149624 GI Annotated Anodyne C[C@H](Oc1ccc(F)c(F)c1)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587149625 GI Annotated Anodyne Cc1c(Cl)ccc2nc([C@@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c12 ZINC000587149651 GI Annotated Anodyne Cc1c(Cl)ccc2nc([C@H]3CC(=O)N(Cc4ccc(F)cc4F)C3)[nH]c12 ZINC000587149652 GI Annotated Anodyne O=C1COc2cc3[nH]c([C@@H](Nc4ccccc4)c4ccccc4F)nc3cc2N1 ZINC000587149820 GI Annotated Anodyne O=C1COc2cc3[nH]c([C@H](Nc4ccccc4)c4ccccc4F)nc3cc2N1 ZINC000587149821 GI Annotated Anodyne COC(=O)c1cc2nc([C@@H](Nc3ccccc3)c3ccccc3F)[nH]c2cn1 ZINC000587149869 GI Annotated Anodyne COC(=O)c1cc2nc([C@H](Nc3ccccc3)c3ccccc3F)[nH]c2cn1 ZINC000587149872 GI Annotated Anodyne O=[N+]([O-])c1ccc(OCc2nc3cc(Br)c(F)cc3[nH]2)cc1F ZINC000587149941 GI Annotated Bother O=[N+]([O-])c1ccc(OCc2nc3cc(F)cc(Br)c3[nH]2)cc1F ZINC000587149994 GI Annotated Bother CCCCNS(=O)(=O)c1ccc2nc(/C=C\c3ccc(F)cc3F)[nH]c2c1 ZINC000587150015 GI Annotated Anodyne CCCCNS(=O)(=O)c1ccc2nc(/C=C/c3ccc(F)cc3F)[nH]c2c1 ZINC000587150018 GI Annotated Anodyne N[C@H](c1nc2cc(OC(F)(F)F)c(Cl)cc2[nH]1)c1ccc(F)cc1F ZINC000587150100 GI Annotated Anodyne O=[N+]([O-])c1cnc2[nH]c([C@@H](Oc3ccc(F)c(F)c3)c3ccccc3)nc2c1 ZINC000587150171 GI Annotated Bother Fc1ccccc1CCc1nc2c(Br)cnc(Br)c2[nH]1 ZINC000587150472 GI Annotated Anodyne O=[N+]([O-])c1cnc2[nH]c([C@H](Oc3ccc(F)c(F)c3)c3ccccc3)nc2c1 ZINC000587150502 GI Annotated Bother C[C@@H](Oc1ccc(F)c(F)c1)c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587150598 GI Annotated Anodyne C[C@H](Oc1ccc(F)c(F)c1)c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587150600 GI Annotated Anodyne Fc1cccc([C@H]2C[C@H]2c2nc3cc(I)cnc3[nH]2)c1F ZINC000587150680 GI Annotated Anodyne Fc1cccc([C@@H]2C[C@@H]2c2nc3cc(I)cnc3[nH]2)c1F ZINC000587150682 GI Annotated Anodyne Fc1cccc([C@@H]2C[C@H]2c2nc3cc(I)cnc3[nH]2)c1F ZINC000587150685 GI Annotated Anodyne Fc1cccc([C@H]2C[C@@H]2c2nc3cc(I)cnc3[nH]2)c1F ZINC000587150687 GI Annotated Anodyne Fc1ccc(/C=C/c2nc3cc(I)cnc3[nH]2)c(F)c1 ZINC000587150715 GI Annotated Anodyne Fc1ccc(/C=C\c2nc3cc(I)cnc3[nH]2)c(F)c1 ZINC000587150717 GI Annotated Anodyne NC(=O)c1cccc2nc([C@@H](Oc3ccc(F)c(F)c3)c3ccccc3)[nH]c12 ZINC000587150733 GI Annotated Anodyne NC(=O)c1cccc2nc([C@H](Oc3ccc(F)c(F)c3)c3ccccc3)[nH]c12 ZINC000587150735 GI Annotated Anodyne COC(=O)c1ccc2nc([C@H](Nc3ccccc3)c3ccccc3F)[nH]c2n1 ZINC000587150954 GI Annotated Anodyne COC(=O)c1ccc2nc([C@@H](Nc3ccccc3)c3ccccc3F)[nH]c2n1 ZINC000587150955 GI Annotated Anodyne O=C1C[C@H](c2nc3cc(Cl)c(F)cc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587150969 GI Annotated Anodyne O=C1C[C@@H](c2nc3cc(Cl)c(F)cc3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587150970 GI Annotated Anodyne Cc1cc(Br)c2[nH]c(COc3ccc([N+](=O)[O-])c(F)c3)nc2c1 ZINC000587151068 GI Annotated Bother O=C1C[C@@H](c2nc3cc(Cl)nc(Cl)c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587151228 GI Annotated Anodyne O=C1C[C@H](c2nc3cc(Cl)nc(Cl)c3[nH]2)CN1Cc1ccc(F)cc1F ZINC000587151230 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc(/C=C/c3ccc(F)cc3F)[nH]c12 ZINC000587151424 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc(/C=C\c3ccc(F)cc3F)[nH]c12 ZINC000587151426 GI Annotated Anodyne COc1ccc(-c2ccc(-c3nc4cncc([N+](=O)[O-])c4[nH]3)c(F)c2)c(F)c1 ZINC000587151488 GI Annotated Bother Oc1nc(NCc2ccccc2)c2nc(/C=C\c3ccc(F)cc3F)nc-2[nH]1 ZINC000587151537 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc(/C=C/c3ccc(F)cc3F)nc-2[nH]1 ZINC000587151539 GI Annotated Anodyne CC(C)Oc1cc2nc([C@@H](N)c3ccc(F)cc3F)[nH]c2cc1Br ZINC000587152064 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3ccc(-c4ccc(OC)cc4F)cc3F)[nH]c2n1 ZINC000587152214 GI Annotated Anodyne C[C@@H](Oc1ccc(F)c(F)c1)c1nc2[nH]c(O)nc(NCc3ccccc3)c-2n1 ZINC000587152255 GI Annotated Anodyne C[C@H](Oc1ccc(F)c(F)c1)c1nc2[nH]c(O)nc(NCc3ccccc3)c-2n1 ZINC000587152260 GI Annotated Anodyne COC(=O)c1ccc2nc([C@H](Oc3ccc(F)c(F)c3)c3ccccc3)[nH]c2n1 ZINC000587152315 GI Annotated Anodyne COC(=O)c1ccc2nc([C@@H](Oc3ccc(F)c(F)c3)c3ccccc3)[nH]c2n1 ZINC000587152317 GI Annotated Anodyne Cc1cc2nc(COc3ccc([N+](=O)[O-])c(F)c3)[nH]c2cc1Br ZINC000587152376 GI Annotated Bother Oc1nc(NCc2ccccc2)c2nc([C@H]3C[C@H]3c3cccc(F)c3F)nc-2[nH]1 ZINC000587152448 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@H]3C[C@@H]3c3cccc(F)c3F)nc-2[nH]1 ZINC000587152449 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@@H]3C[C@H]3c3cccc(F)c3F)nc-2[nH]1 ZINC000587152450 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@@H]3C[C@@H]3c3cccc(F)c3F)nc-2[nH]1 ZINC000587152451 GI Annotated Anodyne Fc1ccccc1[C@H](Nc1ccccc1)c1nc2nc(Br)c[nH]c-2n1 ZINC000587153138 GI Annotated Anodyne Fc1ccccc1[C@@H](Nc1ccccc1)c1nc2nc(Br)c[nH]c-2n1 ZINC000587153141 GI Annotated Anodyne C[C@@]1(c2nc3cc(Br)cc(F)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587153863 GI Annotated Anodyne C[C@]1(c2nc3cc(Br)cc(F)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587153864 GI Annotated Anodyne C[C@@]1(c2nc3ccc(OC(F)(F)F)cc3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587153881 GI Annotated Anodyne C[C@]1(c2nc3ccc(OC(F)(F)F)cc3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587153882 GI Annotated Anodyne N[C@]1(c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)C[C@H]1c1ccccc1F ZINC000587153889 GI Annotated Anodyne N[C@@]1(c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)C[C@@H]1c1ccccc1F ZINC000587153890 GI Annotated Anodyne N[C@]1(c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)C[C@@H]1c1ccccc1F ZINC000587153891 GI Annotated Anodyne N[C@@]1(c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)C[C@H]1c1ccccc1F ZINC000587153892 GI Annotated Anodyne O=C(COc1ccccc1-c1nc2cc(Cl)cnc2[nH]1)Nc1ccccc1F ZINC000587153921 GI Annotated Anodyne O=C(COc1ccccc1-c1nc2c(Cl)ccnc2[nH]1)Nc1ccccc1F ZINC000587153939 GI Annotated Anodyne COc1cccc2nc(-c3cccc(S(=O)(=O)Nc4ccccc4F)c3)[nH]c12 ZINC000587153941 GI Annotated Anodyne O=C(COc1ccccc1-c1nc2cccc(O)c2[nH]1)Nc1ccccc1F ZINC000587153978 GI Annotated Anodyne C[C@@]1(c2nc3cc(F)cc(Br)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587154021 GI Annotated Anodyne C[C@]1(c2nc3cc(F)cc(Br)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587154022 GI Annotated Anodyne Cc1ccc2nc(-c3ccccc3OCC(=O)Nc3ccccc3F)[nH]c2n1 ZINC000587154140 GI Annotated Anodyne Cc1cncc2nc(-c3ccccc3OCC(=O)Nc3ccccc3F)[nH]c12 ZINC000587154162 GI Annotated Anodyne CC[C@@H](Oc1ccccc1F)c1nc2cc(I)cnc2[nH]1 ZINC000587154215 GI Annotated Anodyne CC[C@H](Oc1ccccc1F)c1nc2cc(I)cnc2[nH]1 ZINC000587154219 GI Annotated Anodyne CC[C@H](Oc1ccccc1F)c1nc2[nH]c(O)nc(NCc3ccccc3)c-2n1 ZINC000587154233 GI Annotated Anodyne CC[C@@H](Oc1ccccc1F)c1nc2[nH]c(O)nc(NCc3ccccc3)c-2n1 ZINC000587154234 GI Annotated Anodyne N[C@@]1(c2nc3cc(Cl)cc(Br)c3[nH]2)C[C@@H]1c1ccccc1F ZINC000587154351 GI Annotated Anodyne N[C@]1(c2nc3cc(Cl)cc(Br)c3[nH]2)C[C@H]1c1ccccc1F ZINC000587154352 GI Annotated Anodyne N[C@@]1(c2nc3cc(Cl)cc(Br)c3[nH]2)C[C@H]1c1ccccc1F ZINC000587154353 GI Annotated Anodyne N[C@]1(c2nc3cc(Cl)cc(Br)c3[nH]2)C[C@@H]1c1ccccc1F ZINC000587154354 GI Annotated Anodyne N[C@@]1(c2nc3cc(Br)c(F)c(F)c3[nH]2)C[C@@H]1c1ccccc1F ZINC000587154373 GI Annotated Anodyne N[C@@]1(c2nc3cc(Br)c(F)c(F)c3[nH]2)C[C@H]1c1ccccc1F ZINC000587154374 GI Annotated Anodyne N[C@]1(c2nc3cc(Br)c(F)c(F)c3[nH]2)C[C@@H]1c1ccccc1F ZINC000587154375 GI Annotated Anodyne N[C@]1(c2nc3cc(Br)c(F)c(F)c3[nH]2)C[C@H]1c1ccccc1F ZINC000587154376 GI Annotated Anodyne Cc1nccc2[nH]c(-c3ccccc3OCC(=O)Nc3ccccc3F)nc12 ZINC000587154413 GI Annotated Anodyne O=C(COc1ccccc1-c1nc2ccc(Cl)nc2[nH]1)Nc1ccccc1F ZINC000587154481 GI Annotated Anodyne N#Cc1cc(Br)c2[nH]c(-c3ncc(Br)cc3F)nc2c1 ZINC000587154598 GI Annotated Mild Fc1cc(Br)cnc1-c1nc2ccc(Br)c(F)c2[nH]1 ZINC000587154610 GI Annotated Anodyne Fc1ccc(-c2nc3c(F)cc(Br)cc3[nH]2)nc1Br ZINC000587154633 GI Annotated Anodyne C[C@]1(c2nc3cc(C#N)cc(Br)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587154705 GI Annotated Mild C[C@@]1(c2nc3cc(C#N)cc(Br)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587154708 GI Annotated Mild O=C(COc1ccccc1-c1nc2cncc(Cl)c2[nH]1)Nc1ccccc1F ZINC000587154854 GI Annotated Anodyne N#Cc1cccc2nc(-c3ccccc3OCC(=O)Nc3ccccc3F)[nH]c12 ZINC000587154882 GI Annotated Mild Fc1cc(Br)cnc1-c1nc2cccc(OC(F)(F)F)c2[nH]1 ZINC000587154892 GI Annotated Anodyne Nc1ccc(-c2ccc3[nH]c(-c4ccc(F)c(Br)n4)nc3c2)cc1N ZINC000587154911 GI Annotated Anodyne Fc1ccc(-c2nc3c(OC(F)(F)F)cccc3[nH]2)nc1Br ZINC000587154917 GI Annotated Anodyne Fc1cc2[nH]c(-c3ncc(Br)cc3F)nc2cc1Br ZINC000587155088 GI Annotated Anodyne C[C@@]1(c2nc3cccc(OC(F)(F)F)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587155156 GI Annotated Anodyne C[C@]1(c2nc3cccc(OC(F)(F)F)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587155158 GI Annotated Anodyne N[C@@]1(c2nc3cc(Br)cc(Cl)c3[nH]2)C[C@@H]1c1ccccc1F ZINC000587155258 GI Annotated Anodyne COc1cc(-c2nc3cc([N+](=O)[O-])c(Cl)cc3[nH]2)nn1-c1ccccc1F ZINC000587155259 GI Annotated Bother O=C(COc1ccccc1-c1nc2ccnc(Cl)c2[nH]1)Nc1ccccc1F ZINC000587155273 GI Annotated Anodyne Cc1cc2[nH]c(-c3ccccc3OCC(=O)Nc3ccccc3F)nc2c(C)n1 ZINC000587155330 GI Annotated Anodyne COc1cc(-c2nc3ccc(OC(F)(F)F)cc3[nH]2)nn1-c1ccccc1F ZINC000587155336 GI Annotated Anodyne Fc1ccc(-c2nc3c(Br)c(F)ccc3[nH]2)nc1Br ZINC000587155386 GI Annotated Anodyne Cc1ccnc2[nH]c(-c3ccccc3OCC(=O)Nc3ccccc3F)nc12 ZINC000587155430 GI Annotated Anodyne N#Cc1cccc2nc(-c3cccc(S(=O)(=O)Nc4ccccc4F)c3)[nH]c12 ZINC000587155498 GI Annotated Mild CCCCCOc1cc2nc(-c3nn(C)c(O)c3F)[nH]c2cc1Br ZINC000587155561 GI Annotated Anodyne CCCc1nc(-c2nc3cc4c(cc3[nH]2)OCCCO4)nn1-c1ccccc1F ZINC000587155596 GI Annotated Anodyne N[C@]1(c2nc3cc(Br)cc(Cl)c3[nH]2)C[C@H]1c1ccccc1F ZINC000587155597 GI Annotated Anodyne N[C@@]1(c2nc3cc(Br)cc(Cl)c3[nH]2)C[C@H]1c1ccccc1F ZINC000587155598 GI Annotated Anodyne N[C@]1(c2nc3cc(Br)cc(Cl)c3[nH]2)C[C@@H]1c1ccccc1F ZINC000587155599 GI Annotated Anodyne C[C@@]1(c2nc3cc(Br)c(F)cc3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587155650 GI Annotated Anodyne C[C@]1(c2nc3cc(Br)c(F)cc3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587155651 GI Annotated Anodyne N#Cc1cc(Br)c2nc(-c3ccc(F)c(Br)n3)[nH]c2c1 ZINC000587155731 GI Annotated Mild Fc1ccc(-c2nc3c(F)c(Br)ccc3[nH]2)nc1Br ZINC000587155798 GI Annotated Anodyne N#Cc1cc2nc(-c3ncc(Br)cc3F)[nH]c2cc1C(F)(F)F ZINC000587155800 GI Annotated Mild Fc1cc2nc(-c3ccc(F)c(Br)n3)[nH]c2cc1Br ZINC000587155860 GI Annotated Anodyne Fc1ccc(-c2nc3cc(OC(F)(F)F)ccc3[nH]2)nc1Br ZINC000587155862 GI Annotated Anodyne Fc1cc(Br)c2nc(-c3ccc(F)c(Br)n3)[nH]c2c1 ZINC000587155866 GI Annotated Anodyne CCCc1nc(-c2nc3cnc(C(F)(F)F)cc3[nH]2)nn1-c1ccccc1F ZINC000587155873 GI Annotated Anodyne CCCc1nc(-c2nc3c(F)c(F)c(F)cc3[nH]2)nn1-c1ccccc1F ZINC000587155881 GI Annotated Anodyne COc1cc(-c2nc3cccc(OC(F)(F)F)c3[nH]2)nn1-c1ccccc1F ZINC000587155925 GI Annotated Anodyne CCCc1nc(-c2nc3c(F)c(F)c(F)c(F)c3[nH]2)nn1-c1ccccc1F ZINC000587155951 GI Annotated Anodyne Fc1cc(Br)cnc1-c1nc2cc(Br)cc(F)c2[nH]1 ZINC000587156146 GI Annotated Anodyne N#Cc1cc2[nH]c(-c3ccc(F)c(Br)n3)nc2cc1C(F)(F)F ZINC000587156182 GI Annotated Mild Fc1cc(Br)cnc1-c1nc2ccc(F)c(Br)c2[nH]1 ZINC000587156194 GI Annotated Anodyne Fc1cc(Br)cnc1-c1nc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000587156206 GI Annotated Anodyne Fc1cc(Br)c2[nH]c(-c3ncc(Br)cc3F)nc2c1 ZINC000587156214 GI Annotated Anodyne COc1cc(-c2nc3c(Cl)cnc(Cl)c3[nH]2)nn1-c1ccccc1F ZINC000587156344 GI Annotated Anodyne COc1cc(-c2nc3ccc(Br)cc3[nH]2)nn1-c1ccccc1F ZINC000587156357 GI Annotated Anodyne CCCc1nc(-c2nc3c(Cl)cc(C#N)cc3[nH]2)nn1-c1ccccc1F ZINC000587156461 GI Annotated Mild CCCc1nc(-c2nc3cc(C)c([N+](=O)[O-])cc3[nH]2)nn1-c1ccccc1F ZINC000587156534 GI Annotated Bother CCCc1nc(-c2nc3ncc(C(F)(F)F)cc3[nH]2)nn1-c1ccccc1F ZINC000587156814 GI Annotated Anodyne COc1cc(-c2nc3c(Cl)c(Cl)cnc3[nH]2)nn1-c1ccccc1F ZINC000587156841 GI Annotated Anodyne COc1cc(-c2nc3cccc(Br)c3[nH]2)nn1-c1ccccc1F ZINC000587156862 GI Annotated Anodyne Fc1ccc(Br)c(-c2nnc(CCc3nc4ccccc4[nH]3)o2)c1 ZINC000587156933 GI Annotated Anodyne C[C@]1(c2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587157003 GI Annotated Mild C[C@@]1(c2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587157004 GI Annotated Mild COc1cc(-c2nc3cc(Cl)nc(Cl)c3[nH]2)nn1-c1ccccc1F ZINC000587157125 GI Annotated Anodyne COc1cc(-c2nc3cc(Cl)c(F)c(F)c3[nH]2)nn1-c1ccccc1F ZINC000587157270 GI Annotated Anodyne Nc1ccc(-c2ccc3nc(-c4ncc(Br)cc4F)[nH]c3c2)cc1N ZINC000587157457 GI Annotated Anodyne N#Cc1cc(F)ccc1-c1nc2c(Br)ncc(Br)c2[nH]1 ZINC000587157961 GI Annotated Mild O=Cc1ccc(-c2cc(F)ccc2-c2nc3c(S)nc(S)nc3[nH]2)cc1 ZINC000587158029 GI Annotated Anodyne Cc1cc(Br)c2[nH]c(COc3cc(F)ccc3[N+](=O)[O-])nc2c1 ZINC000587158216 GI Annotated Bother C[C@@]1(c2nc3ccc(F)c(Br)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587158282 GI Annotated Anodyne C[C@]1(c2nc3ccc(F)c(Br)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587158284 GI Annotated Anodyne O=Cc1ccc(-c2cc(F)ccc2-c2nc3nc(Br)c[nH]c-3n2)cc1 ZINC000587158515 GI Annotated Anodyne Fc1ccc(-n2cnc3ccccc32)c(-c2nc3cc4c(cc3[nH]2)OCCO4)c1 ZINC000587158682 GI Annotated Anodyne COC(=O)c1cccc2nc(-c3cc(F)ccc3-n3cnc4ccccc43)[nH]c12 ZINC000587158699 GI Annotated Anodyne O=[N+]([O-])c1ccc(F)cc1OCc1nc2ccc(F)c(Br)c2[nH]1 ZINC000587158741 GI Annotated Bother O=[N+]([O-])c1ccc(F)cc1OCc1nc2cc(Br)cc(F)c2[nH]1 ZINC000587158800 GI Annotated Bother Fc1ccc(-n2cnc3ccccc32)c(-c2nc3cnc(C(F)(F)F)[nH]c-3n2)c1 ZINC000587159025 GI Annotated Anodyne Fc1ccc(-n2cnc3ccccc32)c(-c2nc3c(S)nc(S)nc3[nH]2)c1 ZINC000587159042 GI Annotated Anodyne Oc1nc2cc3nc(-c4cc(F)ccc4-n4cnc5ccccc54)[nH]c3cc2[nH]1 ZINC000587159067 GI Annotated Anodyne N[C@@H](N=O)c1ccc2nc(-c3cc(F)ccc3-n3cnc4ccccc43)[nH]c2c1 ZINC000587159085 GI Annotated Anodyne N[C@H](N=O)c1ccc2nc(-c3cc(F)ccc3-n3cnc4ccccc43)[nH]c2c1 ZINC000587159086 GI Annotated Anodyne C[C@@]1(c2nc3ccc(Br)c(F)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587159102 GI Annotated Anodyne C[C@]1(c2nc3ccc(Br)c(F)c3[nH]2)C=C(c2ccccc2F)NO1 ZINC000587159104 GI Annotated Anodyne O=[N+]([O-])c1ccc(F)cc1OCc1nc2cc(Br)c(F)cc2[nH]1 ZINC000587159178 GI Annotated Bother Cc1cc(Br)cc2nc(COc3cc(F)ccc3[N+](=O)[O-])[nH]c12 ZINC000587159220 GI Annotated Bother COC(=O)c1ccc2[nH]c(-c3ccc(F)cc3-c3ccc(C=O)cc3)nc2n1 ZINC000587159258 GI Annotated Anodyne O=C(c1ccccc1)c1ccc2nc(COc3cc(F)ccc3[N+](=O)[O-])[nH]c2c1 ZINC000587159288 GI Annotated Bother COC(=O)c1cc2[nH]c(-c3ccc(F)cc3-c3ccc(C=O)cc3)nc2cn1 ZINC000587159319 GI Annotated Anodyne O=[N+]([O-])c1ccc(F)cc1OCc1nc2cc3nc4ccccc4nc3cc2[nH]1 ZINC000587159535 GI Annotated Bother Cc1c(Br)ccc2nc(COc3cc(F)ccc3[N+](=O)[O-])[nH]c12 ZINC000587159598 GI Annotated Bother N#Cc1cc2nc(COc3cc(F)ccc3[N+](=O)[O-])[nH]c2cc1C(F)(F)F ZINC000587159609 GI Annotated Mild O=C1COc2cc3[nH]c(-c4cc(F)ccc4-n4cnc5ccccc54)nc3cc2N1 ZINC000587159668 GI Annotated Anodyne Nc1ccc(-c2ccc3nc(COc4cc(F)ccc4[N+](=O)[O-])[nH]c3c2)cc1N ZINC000587159706 GI Annotated Bother O=[N+]([O-])c1ccc(F)cc1OCc1nc2ccc(Br)c(F)c2[nH]1 ZINC000587159728 GI Annotated Bother Cc1cc2nc(COc3cc(F)ccc3[N+](=O)[O-])[nH]c2cc1Br ZINC000587159729 GI Annotated Bother O=[N+]([O-])c1ccc(F)cc1OCc1nc2c3cccnc3c3ncccc3c2[nH]1 ZINC000587159772 GI Annotated Bother O=[N+]([O-])c1ccc(F)cc1OCc1nc2cc(F)cc(Br)c2[nH]1 ZINC000587159783 GI Annotated Bother N#Cc1cc2nc(-c3cc(F)ccc3-n3cnc4ccccc43)[nH]c2cc1C#N ZINC000587159888 GI Annotated Mild O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3cc(F)cc([N+](=O)[O-])c3)[nH]c21 ZINC000587160028 GI Annotated Clean COc1cccc(-c2cc(F)cc(-c3nc4c(S)nc(S)nc4[nH]3)c2)c1 ZINC000587160138 GI Annotated Anodyne COc1cccc(-c2cc(F)cc(-c3nc4cc5c(cc4[nH]3)OCC(=O)N5)c2)c1 ZINC000587160196 GI Annotated Anodyne O=[N+]([O-])c1cc(F)cc(-c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c1 ZINC000587160249 GI Annotated Bother Fc1cccc(Cn2nnc(-c3nc4c(Cl)cnc(Cl)c4[nH]3)c2Cl)c1 ZINC000587160319 GI Annotated Anodyne COc1cccc(-c2cc(F)cc(-c3nc4ccc(-n5cnnn5)cc4[nH]3)c2)c1 ZINC000587160393 GI Annotated Anodyne COc1cc2nc(-c3nnn(Cc4cccc(F)c4)c3Cl)[nH]c2cc1Cl ZINC000587160478 GI Annotated Anodyne Fc1cccc(Cn2nnc(-c3nc4cc(Cl)c(Cl)nc4[nH]3)c2Cl)c1 ZINC000587160491 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@H]3C[C@@H]3c3cccc(F)c3)[nH]c12 ZINC000587160498 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@@H]3C[C@H]3c3cccc(F)c3)[nH]c12 ZINC000587160500 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@H]3C[C@H]3c3cccc(F)c3)[nH]c12 ZINC000587160503 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc([C@@H]3C[C@@H]3c3cccc(F)c3)[nH]c12 ZINC000587160505 GI Annotated Anodyne Fc1cccc(Cn2nnc(-c3nc4cc(C(F)(F)F)cnc4[nH]3)c2Cl)c1 ZINC000587160644 GI Annotated Anodyne Fc1cccc(Cn2nnc(-c3nc4cc(Cl)c(F)cc4[nH]3)c2Cl)c1 ZINC000587160960 GI Annotated Anodyne CC(C)Oc1ccc2nc(-c3nnn(Cc4cccc(F)c4)c3Cl)[nH]c2c1 ZINC000587160976 GI Annotated Anodyne Fc1ccc(Oc2ccc(-c3nc4ncc[nH]c-4n3)cn2)c(Br)c1 ZINC000587160986 GI Annotated Anodyne Fc1cc(Br)cc(-c2nc3cc(-n4cccn4)c(F)cc3[nH]2)c1 ZINC000587160997 GI Annotated Anodyne Fc1cccc(Cn2nnc(-c3nc4c(Cl)c(Cl)cnc4[nH]3)c2Cl)c1 ZINC000587161143 GI Annotated Anodyne CN(C)CCOc1ccc2nc(-c3cc(F)cc(Br)c3)[nH]c2c1 ZINC000587161326 GI Annotated Anodyne Fc1cccc(Cn2nnc(-c3nc4cnc5ccccc5c4[nH]3)c2Cl)c1 ZINC000587161333 GI Annotated Anodyne Cc1cnc(Cl)c2[nH]c(-c3nnn(Cc4cccc(F)c4)c3Cl)nc12 ZINC000587161351 GI Annotated Anodyne Fc1cc(Br)cc(-c2nc3c(F)cnc(Br)c3[nH]2)c1 ZINC000587161361 GI Annotated Anodyne Fc1cccc(Cn2nnc(-c3nc4c(F)c(F)c(F)c(F)c4[nH]3)c2Cl)c1 ZINC000587161415 GI Annotated Anodyne Fc1ccc(Oc2ccc(-c3nc4cncnc4[nH]3)cn2)c(Br)c1 ZINC000587161486 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@H]3C[C@@H]3c3cccc(F)c3)nc-2[nH]1 ZINC000587161620 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@H]3C[C@H]3c3cccc(F)c3)nc-2[nH]1 ZINC000587161621 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@@H]3C[C@@H]3c3cccc(F)c3)nc-2[nH]1 ZINC000587161623 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc([C@@H]3C[C@H]3c3cccc(F)c3)nc-2[nH]1 ZINC000587161625 GI Annotated Anodyne O=C(CCc1nc2c(Br)cnc(Cl)c2[nH]1)c1ccc(F)cc1 ZINC000587161758 GI Annotated Anodyne Fc1cccc(Cn2nnc(-c3nc4ccc5ncccc5c4[nH]3)c2Cl)c1 ZINC000587161779 GI Annotated Anodyne Fc1cccc(Cn2nnc(-c3nc4cc(F)c(F)c(F)c4[nH]3)c2Cl)c1 ZINC000587161838 GI Annotated Anodyne N#Cc1cc(Cl)c2[nH]c(-c3nnn(Cc4cccc(F)c4)c3Cl)nc2c1 ZINC000587161846 GI Annotated Mild O=C1CCc2cc3nc(-c4ccccc4C(=O)c4ccc(F)cc4)[nH]c3cc2N1 ZINC000587161975 GI Annotated Anodyne O=C(CCc1nc2cccc(I)c2[nH]1)c1ccc(F)cc1 ZINC000587162023 GI Annotated Anodyne CC(C)(C)c1ccc2nc(-c3nnn(Cc4cccc(F)c4)c3Cl)[nH]c2n1 ZINC000587162152 GI Annotated Anodyne O=C(c1ccc(F)cc1)c1ccccc1-c1nc2cc(F)cc(C(=O)O)c2[nH]1 ZINC000587162184 GI Annotated Anodyne O=C(c1ccc(F)cc1)c1ccccc1-c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000587162193 GI Annotated Anodyne O=C(CCc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1)c1ccc(F)cc1 ZINC000587162195 GI Annotated Bother CN(C)[C@@H](c1ccc(F)cc1)c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587162381 GI Annotated Anodyne CN(C)[C@H](c1ccc(F)cc1)c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587162383 GI Annotated Anodyne CN(C)[C@@H](c1ccc(F)cc1)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587162447 GI Annotated Bother CN(C)[C@H](c1ccc(F)cc1)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587162448 GI Annotated Bother Fc1cccc(Cn2nnc(-c3nc4cc(Cl)nc(Cl)c4[nH]3)c2Cl)c1 ZINC000587162545 GI Annotated Anodyne Fc1cccc(Cn2nnc(-c3nc4cc(C(F)(F)F)ncc4[nH]3)c2Cl)c1 ZINC000587162600 GI Annotated Anodyne CN(C)[C@@H](c1ccc(F)cc1)c1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1 ZINC000587162735 GI Annotated Anodyne CN(C)[C@H](c1ccc(F)cc1)c1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1 ZINC000587162737 GI Annotated Anodyne O=C(CCc1nc2cc(Br)c(F)c(F)c2[nH]1)Nc1cccc(F)c1 ZINC000587162744 GI Annotated Anodyne O=C(CCc1nc2cc(F)cc(Br)c2[nH]1)Nc1cccc(F)c1 ZINC000587162886 GI Annotated Anodyne Fc1cccc(Cn2nnc(-c3nc4cc(Cl)cc(F)c4[nH]3)c2Cl)c1 ZINC000587163048 GI Annotated Anodyne O=C(CCc1nc2ccc(Br)c(F)c2[nH]1)Nc1cccc(F)c1 ZINC000587163146 GI Annotated Anodyne O=C(CCc1nc2ccc(F)c(Br)c2[nH]1)Nc1cccc(F)c1 ZINC000587163151 GI Annotated Anodyne O=C(CCc1nc2c(Br)cnc(Cl)c2[nH]1)Nc1cccc(F)c1 ZINC000587163157 GI Annotated Anodyne CN(C)[C@H](c1ccc(F)cc1)c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587163222 GI Annotated Anodyne CN(C)[C@@H](c1ccc(F)cc1)c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587163224 GI Annotated Anodyne CN(C)[C@@H](c1ccc(F)cc1)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587163270 GI Annotated Bother CN(C)[C@H](c1ccc(F)cc1)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587163273 GI Annotated Bother O=C(CCc1nc2c(Cl)c(Br)cnc2[nH]1)c1ccc(F)cc1 ZINC000587163297 GI Annotated Anodyne Fc1ccc(/C=C(/c2nc3ccc(-n4cnnn4)cc3[nH]2)c2cccs2)cc1 ZINC000587163305 GI Annotated Anodyne Fc1ccc(/C=C(\c2nc3ccc(-n4cnnn4)cc3[nH]2)c2cccs2)cc1 ZINC000587163311 GI Annotated Anodyne CC(C)(C)c1ccc2nc(C3=CCC(=O)N(Cc4ccc(F)cc4)N3)[nH]c2c1 ZINC000587163466 GI Annotated Anodyne O=C(CCc1nc2c3cccnc3c3ncccc3c2[nH]1)Nc1cccc(F)c1 ZINC000587163536 GI Annotated Bother Cc1cc(Br)cc2nc(CCC(=O)Nc3cccc(F)c3)[nH]c12 ZINC000587163590 GI Annotated Anodyne O=C(c1ccc(F)cc1)c1ccccc1-c1nc2nc(Br)c[nH]c-2n1 ZINC000587163635 GI Annotated Anodyne O=C(CCc1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O)c1ccc(F)cc1 ZINC000587163698 GI Annotated Clean O=C(CCc1nc2ccc(I)cc2[nH]1)c1ccc(F)cc1 ZINC000587163709 GI Annotated Anodyne O=C(CCc1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1)c1ccc(F)cc1 ZINC000587163919 GI Annotated Bother O=C1CC=C(c2nc3cc(Cl)cc(Cl)c3[nH]2)NN1Cc1ccc(F)cc1 ZINC000587163957 GI Annotated Anodyne Cc1c(Br)ccc2nc(CCC(=O)Nc3cccc(F)c3)[nH]c12 ZINC000587164015 GI Annotated Anodyne O=C(CCc1nc2cc(Br)cc(F)c2[nH]1)Nc1cccc(F)c1 ZINC000587164050 GI Annotated Anodyne O=C(CCc1nc2c(Cl)c(Br)cnc2[nH]1)Nc1cccc(F)c1 ZINC000587164079 GI Annotated Anodyne CN(C)[C@@H](c1ccc(F)cc1)c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587164419 GI Annotated Anodyne CN(C)[C@H](c1ccc(F)cc1)c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587164420 GI Annotated Anodyne CC(C)(C)c1cccc2nc(C3=CCC(=O)N(Cc4ccc(F)cc4)N3)[nH]c12 ZINC000587164446 GI Annotated Anodyne O=C1CC=C(c2nc3cc(Cl)c(Cl)cc3[nH]2)NN1Cc1ccc(F)cc1 ZINC000587164558 GI Annotated Anodyne CN(C)[C@@H](c1ccc(F)cc1)c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587164564 GI Annotated Clean CN(C)[C@H](c1ccc(F)cc1)c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587164565 GI Annotated Clean CN(C)[C@H](c1ccc(F)cc1)c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587164670 GI Annotated Anodyne CN(C)[C@@H](c1ccc(F)cc1)c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587164672 GI Annotated Anodyne N#Cc1cc(Br)c2[nH]c(Cn3cc(-c4ccc(F)cc4)cn3)nc2c1 ZINC000587164807 GI Annotated Mild COC(=O)c1cc(Cl)c2[nH]c(Cn3cc(-c4ccc(F)cc4)cn3)nc2c1 ZINC000587164974 GI Annotated Anodyne Oc1c(Br)ccc2nc(Cn3cc(-c4ccc(F)cc4)cn3)[nH]c12 ZINC000587164991 GI Annotated Anodyne Nc1ccc(-c2ccc3nc(Cn4cc(-c5ccc(F)cc5)cn4)[nH]c3c2)cc1N ZINC000587165016 GI Annotated Anodyne Cc1nc2[nH]c(Cn3cc(-c4ccc(F)cc4)cn3)nc2cc1Br ZINC000587165288 GI Annotated Anodyne Fc1ccc(-c2cnn(Cc3nc4[nH]c(Cl)nc(C(F)(F)F)c-4n3)c2)cc1 ZINC000587165563 GI Annotated Anodyne Cc1c(Br)cnc2[nH]c(Cn3cc(-c4ccc(F)cc4)cn3)nc12 ZINC000587165570 GI Annotated Anodyne CCOC(=O)c1cc(-c2ccc(F)cc2)n(CCc2nc3cccnc3[nH]2)c1C ZINC000587165631 GI Annotated Anodyne Fc1ccc(-c2ccnc3c2c(C2CC2)nn3Cc2nc3cnccc3[nH]2)cc1 ZINC000587165644 GI Annotated Anodyne Cc1c(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)cc(-c2ccc(F)cc2)n1C ZINC000587165668 GI Annotated Bother O=C(O)c1cccc2nc(Cc3csc4nc(-c5ccc(F)cc5)cn34)[nH]c12 ZINC000587165673 GI Annotated Anodyne Cc1c(-c2nc3cnc(C(F)(F)F)[nH]c-3n2)cc(-c2ccc(F)cc2)n1C ZINC000587165762 GI Annotated Anodyne COc1nccc2nc(Cc3csc4nc(-c5ccc(F)cc5)cn34)[nH]c12 ZINC000587165794 GI Annotated Anodyne Nc1ccnc2[nH]c(Cn3nc(C4CC4)c4c(-c5ccc(F)cc5)ccnc43)nc12 ZINC000587165835 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cc(-c4ccc(F)cc4)n(C)c3C)[nH]c2c1OC ZINC000587165928 GI Annotated Anodyne Fc1ccc(-c2cn3c(Cc4nc5cc6c(cc5[nH]4)OCO6)csc3n2)cc1 ZINC000587165989 GI Annotated Anodyne Fc1ccc(-c2ccnc3c2c(C2CC2)nn3Cc2nc3cccnc3[nH]2)cc1 ZINC000587166028 GI Annotated Anodyne N#Cc1cc2nc(Cc3csc4nc(-c5ccc(F)cc5)cn34)[nH]c2cc1C#N ZINC000587166058 GI Annotated Mild Cc1c(-c2nc3ccc(C(=O)N(C)C)cc3[nH]2)cc(-c2ccc(F)cc2)n1C ZINC000587166083 GI Annotated Anodyne O=C(O)c1ccc2nc(Cc3csc4nc(-c5ccc(F)cc5)cn34)[nH]c2c1 ZINC000587166129 GI Annotated Anodyne COc1cncc2nc(Cc3csc4nc(-c5ccc(F)cc5)cn34)[nH]c12 ZINC000587166142 GI Annotated Anodyne CCOC(=O)c1cc(-c2ccc(F)cc2)n(CCc2nc3cnccc3[nH]2)c1C ZINC000587166159 GI Annotated Anodyne Fc1ccc(-c2cn3c(Cc4nc5cnc(Cl)[nH]c-5n4)csc3n2)cc1 ZINC000587166196 GI Annotated Anodyne O=C(/C=C/c1nc2cc(F)cc(Br)c2[nH]1)Nc1ccc(F)cc1 ZINC000587166239 GI Annotated Anodyne O=C(/C=C\c1nc2cc(F)cc(Br)c2[nH]1)Nc1ccc(F)cc1 ZINC000587166240 GI Annotated Anodyne COC(=O)c1cc2[nH]c(-c3cc(-c4ccc(F)cc4)n(C)c3C)nc2cc1OC ZINC000587166297 GI Annotated Anodyne COc1cc2nc(Cc3csc4nc(-c5ccc(F)cc5)cn34)[nH]c2cn1 ZINC000587166357 GI Annotated Anodyne Cc1c(-c2nc3nc(Br)c[nH]c-3n2)cc(-c2ccc(F)cc2)n1C ZINC000587166360 GI Annotated Anodyne O=C(/C=C/c1nc2c(Br)cnc(Cl)c2[nH]1)Nc1ccc(F)cc1 ZINC000587166454 GI Annotated Anodyne O=C(/C=C\c1nc2c(Br)cnc(Cl)c2[nH]1)Nc1ccc(F)cc1 ZINC000587166455 GI Annotated Anodyne Fc1ccc(-c2cn3c(Cc4nc5nc(Cl)c[nH]c-5n4)csc3n2)cc1 ZINC000587166527 GI Annotated Anodyne COc1ccc2nc(Cc3csc4nc(-c5ccc(F)cc5)cn34)[nH]c2n1 ZINC000587166597 GI Annotated Anodyne OCCc1ccc2nc(Cc3csc4nc(-c5ccc(F)cc5)cn34)[nH]c2c1 ZINC000587166601 GI Annotated Anodyne OCc1ccc2nc(Cc3csc4nc(-c5ccc(F)cc5)cn34)[nH]c2c1 ZINC000587166608 GI Annotated Anodyne Fc1ccc(-c2cn3c(Cc4nc5c(Cl)ncnc5[nH]4)csc3n2)cc1 ZINC000587166674 GI Annotated Anodyne O=C(/C=C/c1nc2cc(Br)c(F)c(F)c2[nH]1)Nc1ccc(F)cc1 ZINC000587166675 GI Annotated Anodyne O=C(/C=C\c1nc2cc(Br)c(F)c(F)c2[nH]1)Nc1ccc(F)cc1 ZINC000587166677 GI Annotated Anodyne O=C(/C=C\c1nc2c3cccnc3c3ncccc3c2[nH]1)Nc1ccc(F)cc1 ZINC000587166678 GI Annotated Bother O=C(/C=C/c1nc2c3cccnc3c3ncccc3c2[nH]1)Nc1ccc(F)cc1 ZINC000587166679 GI Annotated Bother O=C(/C=C/c1nc2c(Cl)c(Br)cnc2[nH]1)Nc1ccc(F)cc1 ZINC000587166687 GI Annotated Anodyne O=C(/C=C\c1nc2c(Cl)c(Br)cnc2[nH]1)Nc1ccc(F)cc1 ZINC000587166688 GI Annotated Anodyne N#Cc1cccc2nc(-c3sccc3S(=O)(=O)Nc3ccc(F)cc3)[nH]c12 ZINC000587167296 GI Annotated Mild O=C(/C=C/c1nc2ccc(Br)c(F)c2[nH]1)Nc1ccc(F)cc1 ZINC000587167326 GI Annotated Anodyne O=C(/C=C\c1nc2ccc(Br)c(F)c2[nH]1)Nc1ccc(F)cc1 ZINC000587167327 GI Annotated Anodyne O=C(/C=C/c1nc2ccc(F)c(Br)c2[nH]1)Nc1ccc(F)cc1 ZINC000587167367 GI Annotated Anodyne O=C(/C=C\c1nc2ccc(F)c(Br)c2[nH]1)Nc1ccc(F)cc1 ZINC000587167368 GI Annotated Anodyne N#Cc1ccc2nc(-c3sccc3S(=O)(=O)Nc3ccc(F)cc3)[nH]c2c1 ZINC000587167502 GI Annotated Mild O=S(=O)(Nc1ccc(F)cc1)c1ccsc1-c1nc2cccc(F)c2[nH]1 ZINC000587167724 GI Annotated Anodyne Fc1ccc(-n2nnc(-c3nc4c(F)c(F)c(F)c(F)c4[nH]3)c2C2CC2)cc1 ZINC000587167749 GI Annotated Anodyne Fc1ccc(-n2nnc(-c3nc4cc(C(F)(F)F)ncc4[nH]3)c2C2CC2)cc1 ZINC000587167765 GI Annotated Anodyne COc1cc2nc(-c3nnn(-c4ccc(F)cc4)c3C3CC3)[nH]c2cc1Cl ZINC000587167770 GI Annotated Anodyne O=C(/C=C/c1nc2cc(Br)cc(F)c2[nH]1)Nc1ccc(F)cc1 ZINC000587167859 GI Annotated Anodyne O=C(/C=C\c1nc2cc(Br)cc(F)c2[nH]1)Nc1ccc(F)cc1 ZINC000587167860 GI Annotated Anodyne C[C@@H](Oc1ccc(F)cc1)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587167961 GI Annotated Anodyne C[C@H](Oc1ccc(F)cc1)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587167962 GI Annotated Anodyne C[C@@H](Oc1ccc(F)cc1)c1nc2cccc(I)c2[nH]1 ZINC000587168021 GI Annotated Anodyne C[C@H](Oc1ccc(F)cc1)c1nc2cccc(I)c2[nH]1 ZINC000587168022 GI Annotated Anodyne Cc1cc2[nH]c(-c3nnn(-c4ccc(F)cc4)c3C3CC3)nc2cc1[N+](=O)[O-] ZINC000587168371 GI Annotated Bother COC(=O)c1cc(Br)c2[nH]c([C@@H](C)Oc3ccc(F)cc3)nc2c1 ZINC000587168760 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c([C@H](C)Oc3ccc(F)cc3)nc2c1 ZINC000587168761 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(COc3ccc(F)cc3)nc2c1 ZINC000587168777 GI Annotated Anodyne N#Cc1cc(Cl)c2[nH]c(-c3nnn(-c4ccc(F)cc4)c3C3CC3)nc2c1 ZINC000587168865 GI Annotated Mild Fc1ccc(-n2nnc(-c3nc4cc(C(F)(F)F)cnc4[nH]3)c2C2CC2)cc1 ZINC000587169106 GI Annotated Anodyne Fc1ccc(-n2nnc(-c3nc4cc5c(cc4[nH]3)OC(F)(F)O5)c2C2CC2)cc1 ZINC000587169114 GI Annotated Anodyne C[C@@H](Oc1ccc(F)cc1)c1nc2ccc(I)cc2[nH]1 ZINC000587169176 GI Annotated Anodyne C[C@H](Oc1ccc(F)cc1)c1nc2ccc(I)cc2[nH]1 ZINC000587169177 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3nnn(-c4ccc(F)cc4)c3C3CC3)[nH]c2cc1Cl ZINC000587169192 GI Annotated Bother N#Cc1cccc2nc(-c3sccc3NS(=O)(=O)c3ccc(F)cc3)[nH]c12 ZINC000587169805 GI Annotated Mild O=S(=O)(Nc1ccsc1-c1nc2cccc(F)c2[nH]1)c1ccc(F)cc1 ZINC000587170161 GI Annotated Anodyne Cc1cccc2nc([C@@H](NS(=O)(=O)c3ccc(F)cc3)c3ccccc3)[nH]c12 ZINC000587170309 GI Annotated Anodyne Cc1cccc2nc([C@H](NS(=O)(=O)c3ccc(F)cc3)c3ccccc3)[nH]c12 ZINC000587170312 GI Annotated Anodyne COc1cc2nc(-c3cn(C4CC4)c4cc(F)c(F)cc4c3=O)[nH]c2cc1F ZINC000587170499 GI Annotated Anodyne O=C(c1ccccc1)c1ccc2nc(Cc3cc(F)cc4c3OCOC4)[nH]c2c1 ZINC000587170528 GI Annotated Anodyne C[C@H](CSc1ccc(F)cc1)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587170536 GI Annotated Bother C[C@@H](CSc1ccc(F)cc1)c1nc2cc([N+](=O)[O-])c([N+](=O)[O-])cc2[nH]1 ZINC000587170537 GI Annotated Bother Fc1cc2c(c(Cc3nc4cc5nc6ccccc6nc5cc4[nH]3)c1)OCOC2 ZINC000587170608 GI Annotated Bother Cc1cc(Br)cc2nc(Cc3cc(F)cc4c3OCOC4)[nH]c12 ZINC000587170822 GI Annotated Anodyne N#Cc1nc(Cl)cc2nc(-c3cn(C4CC4)c4cc(F)c(F)cc4c3=O)[nH]c12 ZINC000587171553 GI Annotated Mild O=c1c(-c2nc3c(F)cnc(Cl)c3[nH]2)cn(C2CC2)c2cc(F)c(F)cc12 ZINC000587171561 GI Annotated Anodyne N#Cc1cccc2nc(-c3ccccc3NS(=O)(=O)c3ccc(F)cc3)[nH]c12 ZINC000587171562 GI Annotated Mild Fc1cc2c(c(Cc3nc4cc(Br)c(F)cc4[nH]3)c1)OCOC2 ZINC000587171595 GI Annotated Anodyne C[C@@H](CSc1ccc(F)cc1)c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587171601 GI Annotated Anodyne C[C@H](CSc1ccc(F)cc1)c1nc2ccc(CN3CCOCC3)cc2[nH]1 ZINC000587171602 GI Annotated Anodyne CC1=C(c2ccc3nc([C@H](C)CSc4ccc(F)cc4)[nH]c3c2)NNC(=O)C1 ZINC000587171603 GI Annotated Anodyne CC1=C(c2ccc3nc([C@@H](C)CSc4ccc(F)cc4)[nH]c3c2)NNC(=O)C1 ZINC000587171604 GI Annotated Anodyne Fc1cc2c(c(Cc3nc4cc(F)cc(Br)c4[nH]3)c1)OCOC2 ZINC000587171628 GI Annotated Anodyne Fc1cc2c(c(Cc3nc4ccc(Br)c(F)c4[nH]3)c1)OCOC2 ZINC000587171704 GI Annotated Anodyne Cc1cc2nc(Cc3cc(F)cc4c3OCOC4)[nH]c2cc1Br ZINC000587171779 GI Annotated Anodyne C[C@@]1(c2nc3cccc(Br)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587171825 GI Annotated Anodyne C[C@]1(c2nc3cccc(Br)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587171826 GI Annotated Anodyne Fc1cc2c(c(Cc3nc4c5cccnc5c5ncccc5c4[nH]3)c1)OCOC2 ZINC000587171845 GI Annotated Bother Fc1cc2c(c(Cc3nc4cc(Br)c(F)c(F)c4[nH]3)c1)OCOC2 ZINC000587171860 GI Annotated Anodyne Fc1cc2c(c(Cc3nc4cc(Br)cc(F)c4[nH]3)c1)OCOC2 ZINC000587172139 GI Annotated Anodyne Cc1cc(Br)c2[nH]c(Cc3cc(F)cc4c3OCOC4)nc2c1 ZINC000587172158 GI Annotated Anodyne N#Cc1cc2nc(Cc3cc(F)cc4c3OCOC4)[nH]c2cc1C(F)(F)F ZINC000587172159 GI Annotated Mild Fc1cc2c(c(Cc3nc4ccc(F)c(Br)c4[nH]3)c1)OCOC2 ZINC000587172203 GI Annotated Anodyne Cc1c(Br)ccc2nc(Cc3cc(F)cc4c3OCOC4)[nH]c12 ZINC000587172216 GI Annotated Anodyne O=c1c(-c2nc3cccc([N+](=O)[O-])c3[nH]2)cn(C2CC2)c2cc(F)c(F)cc12 ZINC000587172308 GI Annotated Bother O=c1c(-c2nc3cc4cn[nH]c4cc3[nH]2)cn(C2CC2)c2cc(F)c(F)cc12 ZINC000587172374 GI Annotated Anodyne COc1cc2nc(-c3cn(C4CC4)c4cc(F)c(F)cc4c3=O)[nH]c2cc1OC ZINC000587172511 GI Annotated Anodyne Cc1cc2[nH]c(-c3cn(C4CC4)c4cc(F)c(F)cc4c3=O)nc2cc1[N+](=O)[O-] ZINC000587172645 GI Annotated Bother C[C@@]1(c2nc3cc(C(F)(F)F)c(F)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587172680 GI Annotated Anodyne C[C@]1(c2nc3cc(C(F)(F)F)c(F)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587172681 GI Annotated Anodyne Cc1cc2nc([C@@]3(C)Cc4ccc(F)cc4C(=O)O3)[nH]c2cc1Br ZINC000587172689 GI Annotated Anodyne Cc1cc2nc([C@]3(C)Cc4ccc(F)cc4C(=O)O3)[nH]c2cc1Br ZINC000587172690 GI Annotated Anodyne C[C@]1(c2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587172699 GI Annotated Mild C[C@@]1(c2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587172700 GI Annotated Mild CC(=O)c1ccc2nc(-c3cn(C4CC4)c4cc(F)c(F)cc4c3=O)[nH]c2c1 ZINC000587172762 GI Annotated Anodyne COc1cc(OC)c2[nH]c(-c3cn(C4CC4)c4cc(F)c(F)cc4c3=O)nc2c1 ZINC000587172763 GI Annotated Anodyne Cc1cc(Br)c2[nH]c([C@@]3(C)Cc4ccc(F)cc4C(=O)O3)nc2c1 ZINC000587172841 GI Annotated Anodyne Cc1cc(Br)c2[nH]c([C@]3(C)Cc4ccc(F)cc4C(=O)O3)nc2c1 ZINC000587172842 GI Annotated Anodyne C[C@@]1(c2nc3cc(F)cc(C(F)(F)F)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587172883 GI Annotated Anodyne C[C@]1(c2nc3cc(F)cc(C(F)(F)F)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587172884 GI Annotated Anodyne COc1cc2nc(-c3cn(C4CC4)c4cc(F)c(F)cc4c3=O)[nH]c2cc1C ZINC000587173019 GI Annotated Anodyne Cc1c(Br)ccc2nc([C@@]3(C)Cc4ccc(F)cc4C(=O)O3)[nH]c12 ZINC000587173112 GI Annotated Anodyne Cc1c(Br)ccc2nc([C@]3(C)Cc4ccc(F)cc4C(=O)O3)[nH]c12 ZINC000587173113 GI Annotated Anodyne C[C@]1(c2nc3cc4nc5ccccc5nc4cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587173266 GI Annotated Bother C[C@@]1(c2nc3cc4nc5ccccc5nc4cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587173268 GI Annotated Bother C[C@@]1(c2nc3cc(Br)c(F)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587173333 GI Annotated Anodyne C[C@]1(c2nc3cc(Br)c(F)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587173334 GI Annotated Anodyne Cc1cc(Br)cc2nc([C@@]3(C)Cc4ccc(F)cc4C(=O)O3)[nH]c12 ZINC000587173374 GI Annotated Anodyne Cc1cc(Br)cc2nc([C@]3(C)Cc4ccc(F)cc4C(=O)O3)[nH]c12 ZINC000587173375 GI Annotated Anodyne C[C@@]1(c2nc3ccc(Br)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587173378 GI Annotated Anodyne C[C@]1(c2nc3ccc(Br)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587173380 GI Annotated Anodyne O=c1c(-c2nc3ccc([N+](=O)[O-])cc3[nH]2)cn(C2CC2)c2cc(F)c(F)cc12 ZINC000587173470 GI Annotated Bother C[C@]1(c2nc3c4cccnc4c4ncccc4c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587173524 GI Annotated Bother C[C@@]1(c2nc3c4cccnc4c4ncccc4c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587173525 GI Annotated Bother C[C@@]1(c2nc3cc(Br)cc(F)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587173704 GI Annotated Anodyne C[C@]1(c2nc3cc(Br)cc(F)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587173705 GI Annotated Anodyne O=[N+]([O-])c1c(Br)ccc2nc([C@H]3Cc4cc(F)ccc4O3)[nH]c12 ZINC000587173757 GI Annotated Bother O=[N+]([O-])c1c(Br)ccc2nc([C@@H]3Cc4cc(F)ccc4O3)[nH]c12 ZINC000587173758 GI Annotated Bother Fc1ccc2[nH]c(-c3nc4ccc(CN5CCOCC5)cc4[nH]3)c(Cl)c2c1 ZINC000587173950 GI Annotated Anodyne C[C@@]1(c2nc3ccc(Br)c(F)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587174129 GI Annotated Anodyne C[C@]1(c2nc3ccc(Br)c(F)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587174130 GI Annotated Anodyne O=C1c2ccccc2C(=O)c2c1ccc1nc([C@H]3Cc4cc(F)ccc4O3)[nH]c21 ZINC000587174408 GI Annotated Clean O=C1c2ccccc2C(=O)c2c1ccc1nc([C@@H]3Cc4cc(F)ccc4O3)[nH]c21 ZINC000587174411 GI Annotated Clean C[C@@]1(c2nc3ccc(F)c(Br)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587174423 GI Annotated Anodyne C[C@]1(c2nc3ccc(F)c(Br)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587174425 GI Annotated Anodyne C[C@@]1(c2nc3cc(F)cc(Br)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587174722 GI Annotated Anodyne C[C@]1(c2nc3cc(F)cc(Br)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587174724 GI Annotated Anodyne O=[N+]([O-])c1cc(Br)cc2nc([C@H]3Cc4cc(F)ccc4O3)[nH]c12 ZINC000587174823 GI Annotated Bother O=[N+]([O-])c1cc(Br)cc2nc([C@@H]3Cc4cc(F)ccc4O3)[nH]c12 ZINC000587174826 GI Annotated Bother O=[N+]([O-])c1cc2nc(-c3[nH]c4ccc(F)cc4c3Cl)[nH]c2cc1[N+](=O)[O-] ZINC000587175115 GI Annotated Bother Fc1cncc(Cl)c1Cc1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587175234 GI Annotated Anodyne C[C@@]1(c2nc3ccc(OC(F)(F)F)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175298 GI Annotated Anodyne C[C@]1(c2nc3ccc(OC(F)(F)F)cc3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175302 GI Annotated Anodyne C[C@@]1(c2nc3cccc(OC(F)(F)F)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175505 GI Annotated Anodyne C[C@]1(c2nc3cccc(OC(F)(F)F)c3[nH]2)Cc2ccc(F)cc2C(=O)O1 ZINC000587175509 GI Annotated Anodyne Fc1ccc2c(-c3nc4cc(I)cnc4[nH]3)coc2c1 ZINC000587175639 GI Annotated Anodyne CC1=C(c2ccc3nc(-c4[nH]c5ccc(F)cc5c4Cl)[nH]c3c2)NNC(=O)C1 ZINC000587175700 GI Annotated Anodyne COc1ncc(F)cc1-c1nc2cc(Br)c(OC(C)C)cc2[nH]1 ZINC000587175872 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc(-c3coc4cc(F)ccc34)nc-2[nH]1 ZINC000587175919 GI Annotated Anodyne N#Cc1cc(Br)c2[nH]c(-c3cnc4c(F)cccc4c3N)nc2c1 ZINC000587175932 GI Annotated Mild Fc1cncc(Cl)c1Cc1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587176130 GI Annotated Anodyne O=[N+]([O-])c1cc(Br)cc2nc(Cc3c(F)cncc3Cl)[nH]c12 ZINC000587176145 GI Annotated Bother CCCOc1cc2[nH]c(-c3cc(F)cnc3OC)nc2cc1Br ZINC000587176355 GI Annotated Anodyne Fc1cncc(Cl)c1Cc1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587176404 GI Annotated Anodyne Nc1c(-c2nc3cc(Br)c(F)cc3[nH]2)cnc2c(F)cccc12 ZINC000587176516 GI Annotated Anodyne Fc1cncc(Cl)c1Cc1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587176560 GI Annotated Anodyne O=C1c2ccccc2C(=O)c2c1ccc1nc(Cc3c(F)cncc3Cl)[nH]c21 ZINC000587176649 GI Annotated Clean O=[N+]([O-])c1c(Br)ccc2nc(Cc3c(F)cncc3Cl)[nH]c12 ZINC000587176667 GI Annotated Bother COc1ccc(-c2nnc(-c3ccc4nc(-c5cncc(F)c5)[nH]c4c3)o2)cc1 ZINC000587176732 GI Annotated Anodyne Nc1c(-c2nc3c(Cl)c(Br)cnc3[nH]2)cnc2c(F)cccc12 ZINC000587176753 GI Annotated Anodyne Fc1cncc(-c2nc3cc(Br)cc(OC(F)(F)F)c3[nH]2)c1 ZINC000587176884 GI Annotated Anodyne Fc1cncc(-c2nc3cc(OC(F)(F)F)cc(Br)c3[nH]2)c1 ZINC000587177032 GI Annotated Anodyne Fc1cc(-c2nc3c(Br)cnc(Cl)c3[nH]2)cc(N2CCCC2)n1 ZINC000587177162 GI Annotated Anodyne Fc1cc(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)cc(N2CCCC2)n1 ZINC000587177197 GI Annotated Bother N#Cc1cc2nc(-c3cc(F)nc(N4CCCC4)c3)[nH]c2cc1C(F)(F)F ZINC000587177217 GI Annotated Mild Cc1c(Br)ccc2nc(-c3cc(F)nc(N4CCCC4)c3)[nH]c12 ZINC000587177396 GI Annotated Anodyne Fc1cc(-c2nc3cc(Br)cc(F)c3[nH]2)cc(N2CCCC2)n1 ZINC000587177420 GI Annotated Anodyne Fc1cc(-c2nc3cc(Br)c(F)c(F)c3[nH]2)cc(N2CCCC2)n1 ZINC000587177431 GI Annotated Anodyne COC(=O)c1cc2nc(-c3cncc(F)c3)[nH]c2c(F)c1Nc1ccccc1 ZINC000587177476 GI Annotated Anodyne Fc1cncc(-c2nc3cc(OC(F)(F)F)c(Br)cc3[nH]2)c1 ZINC000587177487 GI Annotated Anodyne Cc1cc2nc(-c3cc(F)nc(N4CCCC4)c3)[nH]c2cc1Br ZINC000587177531 GI Annotated Anodyne Nc1ccc(-c2ccc3nc(-c4cc(F)nc(N5CCCC5)c4)[nH]c3c2)cc1N ZINC000587177542 GI Annotated Anodyne Fc1cc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc(N2CCCC2)n1 ZINC000587177548 GI Annotated Bother Fc1cc(-c2nc3cc(Br)c(F)cc3[nH]2)cc(N2CCCC2)n1 ZINC000587177597 GI Annotated Anodyne Fc1cc(-c2nc3ccc(F)c(Br)c3[nH]2)cc(N2CCCC2)n1 ZINC000587177599 GI Annotated Anodyne Fc1cc(-c2nc3ccc(Br)c(F)c3[nH]2)cc(N2CCCC2)n1 ZINC000587177606 GI Annotated Anodyne Cc1cc(Br)cc2nc(-c3cc(F)nc(N4CCCC4)c3)[nH]c12 ZINC000587177611 GI Annotated Anodyne O=C1c2ccccc2C(=O)c2c1ccc1[nH]c(-c3n[nH]c4c(F)cccc34)nc21 ZINC000587177615 GI Annotated Clean Cc1cc(Br)c2[nH]c(-c3cc(F)nc(N4CCCC4)c3)nc2c1 ZINC000587177624 GI Annotated Anodyne Fc1cc(Br)c2[nH]c(-c3cc(F)nc(N4CCCC4)c3)nc2c1 ZINC000587177695 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(-c3ccc(Cl)nc3F)nc2c1 ZINC000587177730 GI Annotated Anodyne Fc1ncc(Br)cc1-c1nc2ccc(Br)c(F)c2[nH]1 ZINC000587177848 GI Annotated Anodyne Fc1cc2[nH]c(-c3cc(Br)cnc3F)nc2cc1Br ZINC000587177862 GI Annotated Anodyne O=S(=O)(F)c1ccc(Cl)c(-c2nc3c(Cl)c(Cl)cnc3[nH]2)c1 ZINC000587177885 GI Annotated Unstable Fc1ncc(Br)cc1-c1nc2ccc(OC(F)(F)F)cc2[nH]1 ZINC000587177910 GI Annotated Anodyne O=S(=O)(F)c1ccc(Cl)c(-c2nc3cc(Cl)c(F)c(F)c3[nH]2)c1 ZINC000587177955 GI Annotated Unstable Fc1ncc(Br)cc1-c1nc2cccc(OC(F)(F)F)c2[nH]1 ZINC000587177959 GI Annotated Anodyne Fc1ccc2nc(-c3cc(Br)cnc3F)[nH]c2c1Br ZINC000587178001 GI Annotated Anodyne O=S(=O)(F)c1ccc(Cl)c(-c2nc3c(F)c(F)c(F)c(F)c3[nH]2)c1 ZINC000587178019 GI Annotated Unstable O=S(=O)(F)c1ccc(Cl)c(-c2nc3cccc(OC(F)(F)F)c3[nH]2)c1 ZINC000587178028 GI Annotated Unstable O=[N+]([O-])c1cc2nc(-c3cc(S(=O)(=O)F)ccc3Cl)[nH]c2cc1Cl ZINC000587178057 GI Annotated Unstable N#Cc1cc2nc(-c3cc(Br)cnc3F)[nH]c2cc1C(F)(F)F ZINC000587178087 GI Annotated Mild O=C1c2ccccc2C(=O)c2c1ccc1nc(-c3ccc(Cl)nc3F)[nH]c21 ZINC000587178120 GI Annotated Clean Fc1cc(Br)c2[nH]c(-c3cc(Br)cnc3F)nc2c1 ZINC000587178169 GI Annotated Anodyne Fc1ncc(Br)cc1-c1nc2cc(Br)cc(F)c2[nH]1 ZINC000587178207 GI Annotated Anodyne O=S(=O)(F)c1ccc(Cl)c(-c2nc3cc(Cl)c(Cl)nc3[nH]2)c1 ZINC000587178220 GI Annotated Unstable O=S(=O)(F)c1ccc(Cl)c(-c2nc3cc(Cl)nc(Cl)c3[nH]2)c1 ZINC000587178246 GI Annotated Unstable O=S(=O)(F)c1ccc(Cl)c(-c2nc3cccc(Br)c3[nH]2)c1 ZINC000587178260 GI Annotated Unstable N#Cc1cc(Br)c2[nH]c(-c3cc(Br)cnc3F)nc2c1 ZINC000587178291 GI Annotated Mild O=S(=O)(F)c1ccc(Cl)c(-c2nc3c(Cl)cnc(Cl)c3[nH]2)c1 ZINC000587178293 GI Annotated Unstable Nc1ccc(-c2ccc3nc(-c4cc(Br)cnc4F)[nH]c3c2)cc1N ZINC000587178296 GI Annotated Anodyne COc1cc(N)c(I)cc1-c1nc2cc(C)c(C)cc2[nH]1 ZINC000587178784 GI Annotated Anodyne FC(F)(F)c1ccc(-c2nc3cnccc3[nH]2)c(I)c1 ZINC000587178859 GI Annotated Anodyne COc1cc(N)c(I)cc1-c1nc2c(C)ccc(C)c2[nH]1 ZINC000587178874 GI Annotated Anodyne COc1cc(N)c(I)cc1-c1nc2cc(C)cc(C)c2[nH]1 ZINC000587179079 GI Annotated Anodyne COc1cc(N)c(I)cc1-c1nc2ccc(C)c(C)c2[nH]1 ZINC000587179119 GI Annotated Anodyne COc1cc(N)c(I)cc1-c1nc2ccc(Cl)cc2[nH]1 ZINC000587179167 GI Annotated Anodyne FC(F)(F)c1ccc(-c2nc3cccnc3[nH]2)c(I)c1 ZINC000587179517 GI Annotated Anodyne COc1ccc(-c2nc3c(C)ccc(C)c3[nH]2)c(I)c1 ZINC000587179535 GI Annotated Anodyne COc1ccc(-c2nc3cc(C)cc(F)c3[nH]2)c(I)c1 ZINC000587179659 GI Annotated Anodyne COc1ccc(-c2nc3cc(C)c(F)cc3[nH]2)c(I)c1 ZINC000587179754 GI Annotated Anodyne COc1ccc(-c2nc3cc(C)cc(C)c3[nH]2)c(I)c1 ZINC000587179789 GI Annotated Anodyne COc1ccc(-c2nc3c(C)cnc(Cl)c3[nH]2)c(I)c1 ZINC000587179874 GI Annotated Anodyne COc1ccc(-c2nc3cc(F)cc(F)c3[nH]2)c(I)c1 ZINC000587179884 GI Annotated Anodyne COc1ccc(-c2nc3cc(OC)c(C)cc3[nH]2)c(I)c1 ZINC000587179903 GI Annotated Anodyne COc1ccc(-c2nc3ccc(C)c(C)c3[nH]2)c(I)c1 ZINC000587180089 GI Annotated Anodyne COc1cc(N)c(I)cc1-c1nc2cccc(Cl)c2[nH]1 ZINC000587180294 GI Annotated Anodyne COc1ccc(-c2nc3cc(C)c(C)cc3[nH]2)c(I)c1 ZINC000587180530 GI Annotated Anodyne CC[C@H](C)n1ncc(I)c1-c1nc2cc(C)ccc2[nH]1 ZINC000587180653 GI Annotated Anodyne CC[C@@H](C)n1ncc(I)c1-c1nc2cc(C)ccc2[nH]1 ZINC000587180656 GI Annotated Anodyne COc1ccc(-c2nc3cc(F)c(F)cc3[nH]2)c(I)c1 ZINC000587180675 GI Annotated Anodyne COc1ccc(-c2nc3ccc(F)c(F)c3[nH]2)c(I)c1 ZINC000587180758 GI Annotated Anodyne CC[C@@H](C)n1ncc(I)c1-c1nc2cc(C)nc(C)c2[nH]1 ZINC000587181049 GI Annotated Anodyne CC[C@H](C)n1ncc(I)c1-c1nc2cc(C)nc(C)c2[nH]1 ZINC000587181050 GI Annotated Anodyne CC[C@@H](C)n1ncc(I)c1-c1nc2c(F)cc(C)cc2[nH]1 ZINC000587181127 GI Annotated Anodyne CC[C@H](C)n1ncc(I)c1-c1nc2c(F)cc(C)cc2[nH]1 ZINC000587181131 GI Annotated Anodyne CC[C@@H](C)n1ncc(I)c1-c1nc2c(F)cccc2[nH]1 ZINC000587181218 GI Annotated Anodyne CC[C@H](C)n1ncc(I)c1-c1nc2c(F)cccc2[nH]1 ZINC000587181224 GI Annotated Anodyne CC[C@@H](C)n1ncc(I)c1-c1nc2cc(F)c(C)cc2[nH]1 ZINC000587181247 GI Annotated Anodyne CC[C@H](C)n1ncc(I)c1-c1nc2cc(F)c(C)cc2[nH]1 ZINC000587181248 GI Annotated Anodyne CC[C@@H](C)n1ncc(I)c1-c1nc2cc(OC)ccc2[nH]1 ZINC000587181263 GI Annotated Anodyne CC[C@H](C)n1ncc(I)c1-c1nc2cc(OC)ccc2[nH]1 ZINC000587181264 GI Annotated Anodyne CC[C@H](C)n1ncc(I)c1-c1nc2c(C)cccc2[nH]1 ZINC000587181269 GI Annotated Anodyne CC[C@@H](C)n1ncc(I)c1-c1nc2c(C)cccc2[nH]1 ZINC000587181270 GI Annotated Anodyne Cc1ccc2c(ccc3nc(-c4cc(S(=O)(=O)F)ccc4Cl)[nH]c32)n1 ZINC000587181415 GI Annotated Unstable CC[C@@H](C)n1ncc(I)c1-c1nc2cc(F)ccc2[nH]1 ZINC000587181490 GI Annotated Anodyne CC[C@H](C)n1ncc(I)c1-c1nc2cc(F)ccc2[nH]1 ZINC000587181491 GI Annotated Anodyne CC[C@@H](C)n1ncc(I)c1-c1nc2c(C)c(F)ccc2[nH]1 ZINC000587181506 GI Annotated Anodyne CC[C@H](C)n1ncc(I)c1-c1nc2c(C)c(F)ccc2[nH]1 ZINC000587181507 GI Annotated Anodyne CC[C@@H](C)n1ncc(I)c1-c1nc2c(OC)cccc2[nH]1 ZINC000587181653 GI Annotated Anodyne CC[C@H](C)n1ncc(I)c1-c1nc2c(OC)cccc2[nH]1 ZINC000587181654 GI Annotated Anodyne CSc1ccc2nc([C@@H](C)n3ncc(I)c3C)[nH]c2c1 ZINC000587181855 GI Annotated Anodyne CSc1ccc2nc([C@H](C)n3ncc(I)c3C)[nH]c2c1 ZINC000587181856 GI Annotated Anodyne Clc1ccc(I)cc1-c1nc2cc3c(cc2[nH]1)OCO3 ZINC000587182156 GI Annotated Anodyne Cc1cnc(Cl)c2[nH]c(-c3cc(I)ccc3F)nc12 ZINC000587182233 GI Annotated Anodyne Cc1cc2[nH]c(-c3cc(I)ccc3Cl)nc2c(C)n1 ZINC000587182461 GI Annotated Anodyne C=CCc1cccc2nc([C@@H](C)n3ncc(I)c3C)[nH]c12 ZINC000587182609 GI Annotated Mild C=CCc1cccc2nc([C@H](C)n3ncc(I)c3C)[nH]c12 ZINC000587182619 GI Annotated Mild Cc1cc2[nH]c(-c3cc(I)ccc3F)nc2cc1[N+](=O)[O-] ZINC000587182636 GI Annotated Bother COc1cc2nc(-c3cc(I)ccc3F)[nH]c2cc1F ZINC000587182670 GI Annotated Anodyne Clc1cc(I)cc(-c2nc3cc4c(cc3[nH]2)OCO4)c1 ZINC000587182830 GI Annotated Anodyne Clc1ccc(I)cc1-c1nc2cc3cn[nH]c3cc2[nH]1 ZINC000587182832 GI Annotated Anodyne COc1cc2nc(-c3cc(I)ccc3F)[nH]c2cc1C ZINC000587182965 GI Annotated Anodyne O=[N+]([O-])c1cccc2nc(-c3cc(I)ccc3Cl)[nH]c12 ZINC000587182989 GI Annotated Bother Cc1cc(C)c2[nH]c([C@@H](N)Cc3ccc(I)cc3)nc2c1 ZINC000587183144 GI Annotated Anodyne Cc1cc(C)c2[nH]c([C@H](N)Cc3ccc(I)cc3)nc2c1 ZINC000587183147 GI Annotated Anodyne OCCc1ccc2nc(-c3cc(Cl)cc(I)c3)[nH]c2c1 ZINC000587183175 GI Annotated Anodyne Clc1ccnc2[nH]c(/C=C\c3cccc(I)c3)nc12 ZINC000587183208 GI Annotated Anodyne Clc1ccnc2[nH]c(/C=C/c3cccc(I)c3)nc12 ZINC000587183214 GI Annotated Anodyne N#Cc1cc(Cl)c2[nH]c(-c3cc(I)ccc3F)nc2c1 ZINC000587183250 GI Annotated Mild COc1cccc2nc(-c3cc(Cl)cc(I)c3)[nH]c12 ZINC000587183299 GI Annotated Anodyne Fc1ccc(I)cc1-c1nc2c(F)cnc(Cl)c2[nH]1 ZINC000587183383 GI Annotated Anodyne Cc1cc2[nH]c(-c3cc(Cl)cc(I)c3)nc2c(C)n1 ZINC000587183396 GI Annotated Anodyne Fc1ccc(I)cc1-c1nc2cc(F)c(F)c(F)c2[nH]1 ZINC000587183399 GI Annotated Anodyne O=[N+]([O-])c1cccc2nc(-c3cc(Cl)cc(I)c3)[nH]c12 ZINC000587183510 GI Annotated Bother OCCc1ccc2nc(-c3cc(I)ccc3Cl)[nH]c2c1 ZINC000587183529 GI Annotated Anodyne N#Cc1cc2nc(/C=C\c3cccc(I)c3)[nH]c2cc1C#N ZINC000587183627 GI Annotated Mild N#Cc1cc2nc(/C=C/c3cccc(I)c3)[nH]c2cc1C#N ZINC000587183630 GI Annotated Mild Cc1cc2[nH]c(/C=C\c3cccc(I)c3)nc2c(C)n1 ZINC000587183673 GI Annotated Anodyne Cc1cc2[nH]c(/C=C/c3cccc(I)c3)nc2c(C)n1 ZINC000587183674 GI Annotated Anodyne O=C(O)c1cccc2nc(/C=C/c3cccc(I)c3)[nH]c12 ZINC000587183703 GI Annotated Anodyne O=C(O)c1cccc2nc(/C=C\c3cccc(I)c3)[nH]c12 ZINC000587183704 GI Annotated Anodyne COc1cccc2nc(/C=C/c3cccc(I)c3)[nH]c12 ZINC000587183721 GI Annotated Anodyne COc1cccc2nc(/C=C\c3cccc(I)c3)[nH]c12 ZINC000587183722 GI Annotated Anodyne O=[N+]([O-])c1cccc2nc(/C=C/c3cccc(I)c3)[nH]c12 ZINC000587183747 GI Annotated Bother O=[N+]([O-])c1cccc2nc(/C=C\c3cccc(I)c3)[nH]c12 ZINC000587183748 GI Annotated Bother Ic1cccc(/C=C\c2nc3cc4cn[nH]c4cc3[nH]2)c1 ZINC000587183754 GI Annotated Anodyne Ic1cccc(/C=C/c2nc3cc4cn[nH]c4cc3[nH]2)c1 ZINC000587183755 GI Annotated Anodyne N[C@H](Cc1ccc(I)cc1)c1nc2cccc(Cl)c2[nH]1 ZINC000587183880 GI Annotated Anodyne N[C@@H](Cc1ccc(I)cc1)c1nc2cccc(Cl)c2[nH]1 ZINC000587183881 GI Annotated Anodyne Cc1ccc(C)c2[nH]c([C@@H](N)Cc3ccc(I)cc3)nc12 ZINC000587183927 GI Annotated Anodyne Cc1ccc(C)c2[nH]c([C@H](N)Cc3ccc(I)cc3)nc12 ZINC000587183928 GI Annotated Anodyne Clc1ccc2nc(/C=C\c3cccc(I)c3)[nH]c2n1 ZINC000587183946 GI Annotated Anodyne Clc1ccc2nc(/C=C/c3cccc(I)c3)[nH]c2n1 ZINC000587183947 GI Annotated Anodyne Cc1cc2nc([C@@H](N)Cc3ccc(I)cc3)[nH]c2cc1C ZINC000587183983 GI Annotated Anodyne Cc1cc2nc([C@H](N)Cc3ccc(I)cc3)[nH]c2cc1C ZINC000587183984 GI Annotated Anodyne Clc1cc(I)cc(-c2nc3cc4cn[nH]c4cc3[nH]2)c1 ZINC000587183998 GI Annotated Anodyne CC[C@H](c1nc2c(C)ccc(C)c2[nH]1)n1cc(I)c(C)n1 ZINC000587184065 GI Annotated Anodyne CC[C@@H](c1nc2c(C)ccc(C)c2[nH]1)n1cc(I)c(C)n1 ZINC000587184066 GI Annotated Anodyne CC[C@@H](c1nc2cc(C)cc(C)c2[nH]1)n1cc(I)c(C)n1 ZINC000587184124 GI Annotated Anodyne CC[C@H](c1nc2cc(C)cc(C)c2[nH]1)n1cc(I)c(C)n1 ZINC000587184126 GI Annotated Anodyne Clc1cncc2nc(/C=C\c3cccc(I)c3)[nH]c12 ZINC000587184177 GI Annotated Anodyne Clc1cncc2nc(/C=C/c3cccc(I)c3)[nH]c12 ZINC000587184178 GI Annotated Anodyne Clc1nccc2nc(/C=C\c3cccc(I)c3)[nH]c12 ZINC000587184195 GI Annotated Anodyne Clc1nccc2nc(/C=C/c3cccc(I)c3)[nH]c12 ZINC000587184196 GI Annotated Anodyne CC(C)Oc1ccc2nc(-c3cncc(I)c3)[nH]c2c1 ZINC000587184286 GI Annotated Anodyne Ic1cncc(-c2nc3ccc4c(c3[nH]2)CCCC4)c1 ZINC000587184292 GI Annotated Anodyne Ic1cccc(/C=C\c2nc3cc4c(cc3[nH]2)OCO4)c1 ZINC000587184337 GI Annotated Anodyne Ic1cccc(/C=C/c2nc3cc4c(cc3[nH]2)OCO4)c1 ZINC000587184338 GI Annotated Anodyne Clc1cc2nc(/C=C\c3cccc(I)c3)[nH]c2cn1 ZINC000587184364 GI Annotated Anodyne Clc1cc2nc(/C=C/c3cccc(I)c3)[nH]c2cn1 ZINC000587184365 GI Annotated Anodyne Cc1ccc2nc([C@@H](N)Cc3ccc(I)cc3)[nH]c2c1C ZINC000587184420 GI Annotated Anodyne Cc1ccc2nc([C@H](N)Cc3ccc(I)cc3)[nH]c2c1C ZINC000587184421 GI Annotated Anodyne CC[C@H](c1nc2ccc(F)c(C)c2[nH]1)n1cc(I)c(C)n1 ZINC000587184547 GI Annotated Anodyne CC[C@@H](c1nc2ccc(F)c(C)c2[nH]1)n1cc(I)c(C)n1 ZINC000587184548 GI Annotated Anodyne N[C@H](Cc1ccc(I)cc1)c1nc2ccc(Cl)cc2[nH]1 ZINC000587184775 GI Annotated Anodyne N[C@@H](Cc1ccc(I)cc1)c1nc2ccc(Cl)cc2[nH]1 ZINC000587184776 GI Annotated Anodyne CC[C@@H](c1nc2cc(C)c(C)cc2[nH]1)n1cc(I)c(C)n1 ZINC000587184942 GI Annotated Anodyne CC[C@H](c1nc2cc(C)c(C)cc2[nH]1)n1cc(I)c(C)n1 ZINC000587184943 GI Annotated Anodyne FC(F)(F)c1cccc2nc(-c3cncc(I)c3)[nH]c12 ZINC000587184945 GI Annotated Anodyne Cc1ccc2c(ccc3nc(-c4cncc(I)c4)[nH]c32)n1 ZINC000587185078 GI Annotated Anodyne Clc1cnc2[nH]c(/C=C\c3cccc(I)c3)nc2c1 ZINC000587185108 GI Annotated Anodyne Clc1cnc2[nH]c(/C=C/c3cccc(I)c3)nc2c1 ZINC000587185109 GI Annotated Anodyne O=C(O)c1ccc2nc(/C=C\c3cccc(I)c3)[nH]c2c1 ZINC000587185234 GI Annotated Anodyne O=C(O)c1ccc2nc(/C=C/c3cccc(I)c3)[nH]c2c1 ZINC000587185235 GI Annotated Anodyne CC[C@@H](c1nc2ccc(C)c(C)c2[nH]1)n1cc(I)c(C)n1 ZINC000587185403 GI Annotated Anodyne CC[C@H](c1nc2ccc(C)c(C)c2[nH]1)n1cc(I)c(C)n1 ZINC000587185404 GI Annotated Anodyne CCc1ccc2nc([C@H](CC)n3cc(I)c(C)n3)[nH]c2c1 ZINC000587185489 GI Annotated Anodyne CCc1ccc2nc([C@@H](CC)n3cc(I)c(C)n3)[nH]c2c1 ZINC000587185490 GI Annotated Anodyne Fc1c(Cl)cc2nc(-c3cncc(I)c3)[nH]c2c1F ZINC000587185652 GI Annotated Anodyne CC[C@@H](c1nc2cc(C)c(F)cc2[nH]1)n1cc(I)c(C)n1 ZINC000587185809 GI Annotated Anodyne CC[C@H](c1nc2cc(C)c(F)cc2[nH]1)n1cc(I)c(C)n1 ZINC000587185812 GI Annotated Anodyne CC[C@H](c1nc2cc(C)cc(F)c2[nH]1)n1cc(I)c(C)n1 ZINC000587186133 GI Annotated Anodyne CC[C@@H](c1nc2cc(C)cc(F)c2[nH]1)n1cc(I)c(C)n1 ZINC000587186134 GI Annotated Anodyne Clc1cccc2nc(-c3ccc4ncc(I)n4c3)[nH]c12 ZINC000587186668 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(-c3cccc([C@@H](C)C#N)c3)nc2c1 ZINC000587186940 GI Annotated Mild COC(=O)c1cc(Br)c2[nH]c(-c3cccc([C@H](C)C#N)c3)nc2c1 ZINC000587186941 GI Annotated Mild Cc1ccc(-c2nc3c(I)cnc(Cl)c3[nH]2)cc1C#N ZINC000587187563 GI Annotated Mild Cc1ccc(C)c2[nH]c(-c3ccc4ncc(I)n4c3)nc12 ZINC000587187587 GI Annotated Anodyne Cc1ccc2nc(-c3ccc4ncc(I)n4c3)[nH]c2c1C ZINC000587187816 GI Annotated Anodyne Cc1cc(C)c2[nH]c(-c3ccc4ncc(I)n4c3)nc2c1 ZINC000587187911 GI Annotated Anodyne Cc1ccc(-c2nc3c(Br)cnc(Br)c3[nH]2)cc1C#N ZINC000587188088 GI Annotated Mild N#Cc1cc(-c2nc3cc(Br)cc(OC(F)(F)F)c3[nH]2)ccc1O ZINC000587188199 GI Annotated Mild COC(=O)c1cc(Br)c2[nH]c(/C(C#N)=C\c3ccc(C)cc3)nc2c1 ZINC000587188211 GI Annotated Reactive COC(=O)c1cc(Br)c2[nH]c(/C(C#N)=C/c3ccc(C)cc3)nc2c1 ZINC000587188214 GI Annotated Reactive CCc1ccc2nc(-c3ccc4ncc(I)n4c3)[nH]c2c1 ZINC000587188438 GI Annotated Anodyne Cc1cc2nc(-c3ccc4ncc(I)n4c3)[nH]c2cc1C ZINC000587188490 GI Annotated Anodyne N#Cc1cc(-c2nc3cc(OC(F)(F)F)c(Br)cc3[nH]2)ccc1O ZINC000587188608 GI Annotated Mild N#Cc1cc(-c2nc3c(Br)ccc(Br)c3[nH]2)ccc1O ZINC000587188621 GI Annotated Mild N#Cc1cc(-c2nc3cc(OC(F)(F)F)cc(Br)c3[nH]2)ccc1O ZINC000587188628 GI Annotated Mild COC(=O)c1cc(Br)c2[nH]c(/C(C#N)=C/c3ccccc3)nc2c1 ZINC000587188815 GI Annotated Reactive COC(=O)c1cc(Br)c2[nH]c(/C(C#N)=C\c3ccccc3)nc2c1 ZINC000587188816 GI Annotated Reactive CCCCNS(=O)(=O)c1ccc2nc(/C(C#N)=C\c3ccc(C)cc3)[nH]c2c1 ZINC000587188875 GI Annotated Reactive CCCCNS(=O)(=O)c1ccc2nc(/C(C#N)=C/c3ccc(C)cc3)[nH]c2c1 ZINC000587188877 GI Annotated Reactive Cc1ccc(/C=C(/C#N)c2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)cc1 ZINC000587189061 GI Annotated Reactive N#Cc1cc(O)cc(-c2nc3c(Br)ccc(Br)c3[nH]2)c1 ZINC000587189062 GI Annotated Mild Cc1ccc(/C=C(\C#N)c2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)cc1 ZINC000587189063 GI Annotated Reactive N#C/C(=C\c1ccccc1)c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587189130 GI Annotated Reactive N#C/C(=C/c1ccccc1)c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587189132 GI Annotated Reactive CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2cc(C(=O)O)c(F)cc2[nH]1 ZINC000587189327 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2cc(C(=O)O)c(F)cc2[nH]1 ZINC000587189328 GI Annotated Anodyne COC(=O)c1ccc2nc([C@@H](c3ccccc3)N(C)C(=O)OC(C)(C)C)[nH]c2c1 ZINC000587189403 GI Annotated Anodyne COC(=O)c1ccc2nc([C@H](c3ccccc3)N(C)C(=O)OC(C)(C)C)[nH]c2c1 ZINC000587189405 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000587189410 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2cc3c(cc2[nH]1)OCCO3 ZINC000587189415 GI Annotated Anodyne C[C@@H](Oc1ccc(C#N)cc1)c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587189915 GI Annotated Mild C[C@H](Oc1ccc(C#N)cc1)c1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587189918 GI Annotated Mild CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2ccc(CCO)cc2[nH]1 ZINC000587189982 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2ccc(CCO)cc2[nH]1 ZINC000587189984 GI Annotated Anodyne C=C(CN(C)C)c1nc2cc(OCc3ccccc3)c(Br)cc2[nH]1 ZINC000587190188 GI Annotated Mild CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2cc(F)cc(C(=O)O)c2[nH]1 ZINC000587190309 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2cc(F)cc(C(=O)O)c2[nH]1 ZINC000587190312 GI Annotated Anodyne N#Cc1cc(O)cc(-c2nc3cc(OC(F)(F)F)cc(Br)c3[nH]2)c1 ZINC000587190442 GI Annotated Mild CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2cccc([N+](=O)[O-])c2[nH]1 ZINC000587190536 GI Annotated Bother CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2cccc([N+](=O)[O-])c2[nH]1 ZINC000587190544 GI Annotated Bother CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2ccc(C(=O)O)cc2[nH]1 ZINC000587190555 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2ccc(C(=O)O)cc2[nH]1 ZINC000587190558 GI Annotated Anodyne C=C(CN(C)C)c1nc2cccc(C(=O)Nc3ccc(C(F)(F)F)cc3)c2[nH]1 ZINC000587190592 GI Annotated Mild CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2cc3c(cc2[nH]1)OCO3 ZINC000587190850 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2cc3c(cc2[nH]1)OCO3 ZINC000587190854 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2ccc([N+](=O)[O-])cc2[nH]1 ZINC000587190909 GI Annotated Bother CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2ccc([N+](=O)[O-])cc2[nH]1 ZINC000587190910 GI Annotated Bother CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2cc(C#N)c(C#N)cc2[nH]1 ZINC000587190965 GI Annotated Mild CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2cc(C#N)c(C#N)cc2[nH]1 ZINC000587190970 GI Annotated Mild C[C@H](Cc1nc2cc(OCc3ccccc3)c(Br)cc2[nH]1)N(C)C ZINC000587190984 GI Annotated Anodyne C[C@@H](Cc1nc2cc(OCc3ccccc3)c(Br)cc2[nH]1)N(C)C ZINC000587190991 GI Annotated Anodyne C[C@@H](Oc1ccc(C#N)cc1)c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587191068 GI Annotated Mild C[C@H](Oc1ccc(C#N)cc1)c1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587191071 GI Annotated Mild O=NCc1ccc(-c2nc3c(Cl)ncc(I)c3[nH]2)cc1 ZINC000587191310 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2cccc(C(=O)O)c2[nH]1 ZINC000587191354 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2cccc(C(=O)O)c2[nH]1 ZINC000587191355 GI Annotated Anodyne O=NCc1ccc(-c2nc3c(Br)ncc(Br)c3[nH]2)cc1 ZINC000587191392 GI Annotated Anodyne C[C@@H](Oc1ccc(C#N)cc1)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587191483 GI Annotated Mild C[C@H](Oc1ccc(C#N)cc1)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587191486 GI Annotated Mild COC(=O)c1cccc2nc([C@@H](c3ccccc3)N(C)C(=O)OC(C)(C)C)[nH]c12 ZINC000587191516 GI Annotated Anodyne COC(=O)c1cccc2nc([C@H](c3ccccc3)N(C)C(=O)OC(C)(C)C)[nH]c12 ZINC000587191518 GI Annotated Anodyne C[C@H](Oc1ccc(C#N)cc1)c1nc2ccc(I)cc2[nH]1 ZINC000587191547 GI Annotated Mild C[C@@H](Oc1ccc(C#N)cc1)c1nc2ccc(I)cc2[nH]1 ZINC000587191548 GI Annotated Mild C[C@H](Oc1ccc(C#N)cc1)c1nc2cccc(I)c2[nH]1 ZINC000587191563 GI Annotated Mild C[C@@H](Oc1ccc(C#N)cc1)c1nc2cccc(I)c2[nH]1 ZINC000587191565 GI Annotated Mild CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2cc3cn[nH]c3cc2[nH]1 ZINC000587191757 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2cc3cn[nH]c3cc2[nH]1 ZINC000587191758 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000587191790 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2cc3nc(O)[nH]c3cc2[nH]1 ZINC000587191792 GI Annotated Anodyne C[C@@H](Oc1ccc(C#N)cc1)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587191821 GI Annotated Mild C[C@H](Oc1ccc(C#N)cc1)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587191822 GI Annotated Mild C[C@@H](Oc1ccc(C#N)cc1)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587191885 GI Annotated Mild C[C@H](Oc1ccc(C#N)cc1)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587191886 GI Annotated Mild N#Cc1cc(O)cc(-c2nc3cc(Br)cc(OC(F)(F)F)c3[nH]2)c1 ZINC000587191888 GI Annotated Mild CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2cc(Cl)nc(C#N)c2[nH]1 ZINC000587192021 GI Annotated Mild CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2cc(Cl)nc(C#N)c2[nH]1 ZINC000587192022 GI Annotated Mild N#Cc1cc(O)cc(-c2nc3cc(Br)c(Br)cc3[nH]2)c1 ZINC000587192252 GI Annotated Mild N#Cc1cc(O)cc(-c2nc3cc(OC(F)(F)F)c(Br)cc3[nH]2)c1 ZINC000587192347 GI Annotated Mild C[C@@H](Oc1ccc(C#N)cc1)c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587192356 GI Annotated Mild C[C@H](Oc1ccc(C#N)cc1)c1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587192357 GI Annotated Mild CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000587192531 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@H](c1ccccc1)c1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000587192532 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2ccc([C@@H](N)N=O)cc2[nH]1 ZINC000587192533 GI Annotated Anodyne CN(C(=O)OC(C)(C)C)[C@@H](c1ccccc1)c1nc2ccc([C@H](N)N=O)cc2[nH]1 ZINC000587192534 GI Annotated Anodyne CN(CCO)c1ccc(-c2nc3c(Br)cc(Cl)cc3[nH]2)cc1 ZINC000587192958 GI Annotated Clean Brc1c[nH]c2nc(CN(Cc3ccccc3)c3ccccc3)nc-2n1 ZINC000587192959 GI Annotated Anodyne CN(CCO)c1ccc(-c2nc3c(Cl)cc(Br)cc3[nH]2)cc1 ZINC000587193004 GI Annotated Clean O=C(O)CCN(CCc1nc2cc(Cl)cc(Cl)c2[nH]1)Cc1ccccc1 ZINC000587193191 GI Annotated Anodyne O=C(O)CCN(CCc1nc2cc(Cl)c(F)c(F)c2[nH]1)Cc1ccccc1 ZINC000587193340 GI Annotated Anodyne O=C(O)CCN(CCc1nc2cccc(C(F)(F)F)c2[nH]1)Cc1ccccc1 ZINC000587193404 GI Annotated Anodyne CC(C)(C)c1ccc2nc(CCN(CCC(=O)O)Cc3ccccc3)[nH]c2c1 ZINC000587193529 GI Annotated Anodyne CN(CCc1nc2cnccc2[nH]1)C(=O)OCC1c2ccccc2-c2ccccc21 ZINC000587193867 GI Annotated Anodyne CC(C)(C)c1cccc2nc(CCN(CCC(=O)O)Cc3ccccc3)[nH]c12 ZINC000587194068 GI Annotated Anodyne CN(C)c1ccc(-c2nc3cc(Br)c(Br)cc3[nH]2)nc1 ZINC000587194191 GI Annotated Anodyne Cc1nc(N(C)C)ncc1-c1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1 ZINC000587194293 GI Annotated Anodyne CN(C)c1ccc(-c2nc3c(Br)cc(C(F)(F)F)cc3[nH]2)nc1 ZINC000587194296 GI Annotated Anodyne CC(C)Oc1cc2[nH]c(-c3ccc(N(C)C)cn3)nc2cc1Br ZINC000587194480 GI Annotated Anodyne CN(C)c1ccc(-c2nc3c(Br)ccc(Br)c3[nH]2)nc1 ZINC000587194535 GI Annotated Anodyne CN(CCc1nc2cccnc2[nH]1)C(=O)OCC1c2ccccc2-c2ccccc21 ZINC000587194591 GI Annotated Anodyne CN(C)c1ccc(N=Nc2ccc(-c3nc4c(O)nc(S)nc4[nH]3)cc2)cc1 ZINC000587194704 GI Annotated Clean CCCOc1cc2[nH]c(-c3ccc(N(C)C)cn3)nc2cc1Br ZINC000587194706 GI Annotated Anodyne CN(C)c1ccc(-c2nc3c(C(F)(F)F)c(Br)ccc3[nH]2)nc1 ZINC000587194756 GI Annotated Anodyne CN(C)c1ccc(-c2nc3c(C(F)(F)F)cc(Br)cc3[nH]2)nc1 ZINC000587194832 GI Annotated Anodyne C[C@H](c1ccc(N(C)C)cc1)c1nc2ccc(I)cc2[nH]1 ZINC000587194834 GI Annotated Anodyne C[C@@H](c1ccc(N(C)C)cc1)c1nc2ccc(I)cc2[nH]1 ZINC000587194836 GI Annotated Anodyne C[C@H](c1ccc(N(C)C)cc1)c1nc2ccc(S(=O)(=O)C(F)(F)F)cc2[nH]1 ZINC000587194962 GI Annotated Anodyne C[C@@H](c1ccc(N(C)C)cc1)c1nc2ccc(S(=O)(=O)C(F)(F)F)cc2[nH]1 ZINC000587194968 GI Annotated Anodyne COc1cc2nc(CN(C[C@H]3CCCO3)C(=O)OC(C)(C)C)[nH]c2cc1Cl ZINC000587195117 GI Annotated Anodyne COc1cc2nc(CN(C[C@@H]3CCCO3)C(=O)OC(C)(C)C)[nH]c2cc1Cl ZINC000587195119 GI Annotated Anodyne CN(C)c1ncccc1-c1nc2c(Br)cc(C(F)(F)F)cc2[nH]1 ZINC000587195126 GI Annotated Anodyne CN(C)c1ncccc1-c1nc2c(C(F)(F)F)cc(Br)cc2[nH]1 ZINC000587195128 GI Annotated Anodyne CN(C)c1ncccc1-c1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587195205 GI Annotated Anodyne Sc1nc(S)c2nc(CN(Cc3ccccc3)c3ccccc3)[nH]c2n1 ZINC000587195249 GI Annotated Anodyne CC(C)COc1cc2[nH]c(-c3ccc(N(C)C)cn3)nc2cc1Br ZINC000587195258 GI Annotated Anodyne C[C@@H](c1ccc(N(C)C)cc1)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587195344 GI Annotated Bother C[C@H](c1ccc(N(C)C)cc1)c1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587195345 GI Annotated Bother CCCOc1cc2[nH]c(-c3cccnc3N(C)C)nc2cc1Br ZINC000587195469 GI Annotated Anodyne CN(C)c1ccc(-c2nc3cc(Br)c(C(F)(F)F)cc3[nH]2)nc1 ZINC000587195494 GI Annotated Anodyne Cc1c(Cl)ccc2nc(CN(C[C@H]3CCCO3)C(=O)OC(C)(C)C)[nH]c12 ZINC000587195643 GI Annotated Anodyne Cc1c(Cl)ccc2nc(CN(C[C@@H]3CCCO3)C(=O)OC(C)(C)C)[nH]c12 ZINC000587195651 GI Annotated Anodyne Cc1cc2nc(CN(C[C@H]3CCCO3)C(=O)OC(C)(C)C)[nH]c2cc1Cl ZINC000587195654 GI Annotated Anodyne Cc1cc2nc(CN(C[C@@H]3CCCO3)C(=O)OC(C)(C)C)[nH]c2cc1Cl ZINC000587195656 GI Annotated Anodyne O=S(=O)(O)c1ccc2nc(CN(Cc3ccccc3)c3ccccc3)[nH]c2c1 ZINC000587195691 GI Annotated Anodyne O=C1COc2cc3[nH]c(CN(Cc4ccccc4)c4ccccc4)nc3cc2N1 ZINC000587195711 GI Annotated Anodyne CN(C)c1ccc(N=Nc2ccc(-c3nc4nc(C#N)c(C#N)[nH]c-4n3)cc2)cc1 ZINC000587195817 GI Annotated Mild COC(=O)c1cc2nc(-c3cc(C)ccc3N(C)C(=O)OC(C)(C)C)[nH]c2cn1 ZINC000587195875 GI Annotated Anodyne C[C@H](c1ccc(N(C)C)cc1)c1nc2cccc(I)c2[nH]1 ZINC000587196105 GI Annotated Anodyne C[C@@H](c1ccc(N(C)C)cc1)c1nc2cccc(I)c2[nH]1 ZINC000587196106 GI Annotated Anodyne CC(C)Oc1cc2[nH]c(-c3cccnc3N(C)C)nc2cc1Br ZINC000587196202 GI Annotated Anodyne CN(C)c1ncccc1-c1nc2cc(Br)c(C(F)(F)F)cc2[nH]1 ZINC000587196479 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cc(C)ccc3N(C)C(=O)OC(C)(C)C)[nH]c2n1 ZINC000587196480 GI Annotated Anodyne CN(C)c1ncccc1-c1nc2c(C(F)(F)F)c(Br)ccc2[nH]1 ZINC000587196506 GI Annotated Anodyne CN(C)c1ncccc1-c1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587196520 GI Annotated Anodyne Cc1ccc(N(C)C(=O)OC(C)(C)C)c(-c2nc3ccc(CCO)cc3[nH]2)c1 ZINC000587196525 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2ccc(C(F)(F)F)cc2[nH]1)C[C@H]1CCCO1 ZINC000587196750 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2ccc(C(F)(F)F)cc2[nH]1)C[C@@H]1CCCO1 ZINC000587196751 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2cc(C#N)cc(Cl)c2[nH]1)C[C@H]1CCCO1 ZINC000587196802 GI Annotated Mild CC(C)(C)OC(=O)N(Cc1nc2cc(C#N)cc(Cl)c2[nH]1)C[C@@H]1CCCO1 ZINC000587196803 GI Annotated Mild Cc1cc(Cl)cc2nc(CN(C[C@@H]3CCCO3)C(=O)OC(C)(C)C)[nH]c12 ZINC000587196920 GI Annotated Anodyne Cc1cc(Cl)cc2nc(CN(C[C@H]3CCCO3)C(=O)OC(C)(C)C)[nH]c12 ZINC000587196921 GI Annotated Anodyne CC(C)Oc1ccc2nc(CN(C[C@@H]3CCCO3)C(=O)OC(C)(C)C)[nH]c2c1 ZINC000587196943 GI Annotated Anodyne CC(C)Oc1ccc2nc(CN(C[C@H]3CCCO3)C(=O)OC(C)(C)C)[nH]c2c1 ZINC000587196944 GI Annotated Anodyne C[C@@H](c1ccc(N(C)C)cc1)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587197046 GI Annotated Anodyne C[C@H](c1ccc(N(C)C)cc1)c1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587197047 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2ccc(C(C)(C)C)nc2[nH]1)C[C@@H]1CCCO1 ZINC000587197049 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2ccc(C(C)(C)C)nc2[nH]1)C[C@H]1CCCO1 ZINC000587197050 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2ccc3ncccc3c2[nH]1)C[C@@H]1CCCO1 ZINC000587197161 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2ccc3ncccc3c2[nH]1)C[C@H]1CCCO1 ZINC000587197162 GI Annotated Anodyne CC(C)[C@@H](c1nc2cc(C(=O)O)c(F)cc2[nH]1)N(C)C(=O)OCc1ccccc1 ZINC000587197316 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2cc(Cl)cc(F)c2[nH]1)C[C@H]1CCCO1 ZINC000587197433 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2cc(Cl)cc(F)c2[nH]1)C[C@@H]1CCCO1 ZINC000587197434 GI Annotated Anodyne CSc1ccc2nc(CN(C[C@H]3CCCO3)C(=O)OC(C)(C)C)[nH]c2c1 ZINC000587197491 GI Annotated Anodyne CSc1ccc2nc(CN(C[C@@H]3CCCO3)C(=O)OC(C)(C)C)[nH]c2c1 ZINC000587197495 GI Annotated Anodyne C[C@@H](c1ccc(N(C)C)cc1)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587197529 GI Annotated Bother C[C@H](c1ccc(N(C)C)cc1)c1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587197530 GI Annotated Bother CC(C)[C@H](c1nc2c(Br)ccnc2[nH]1)N(C)C(=O)OC(C)(C)C ZINC000587197558 GI Annotated Anodyne CC(C)[C@H](c1nc2cc3c(cc2[nH]1)OCCCO3)N(C)C(=O)OC(C)(C)C ZINC000587197577 GI Annotated Anodyne CC(C)[C@H](c1nc2cc(Br)cnc2[nH]1)N(C)C(=O)OC(C)(C)C ZINC000587197586 GI Annotated Anodyne CC(C)[C@H](c1nc2cncc(Br)c2[nH]1)N(C)C(=O)OC(C)(C)C ZINC000587197625 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2ccc3c(c2[nH]1)CCCC3)C[C@@H]1CCCO1 ZINC000587197634 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2ccc3c(c2[nH]1)CCCC3)C[C@H]1CCCO1 ZINC000587197635 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2cnc3ccccc3c2[nH]1)C[C@@H]1CCCO1 ZINC000587197695 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2cnc3ccccc3c2[nH]1)C[C@H]1CCCO1 ZINC000587197696 GI Annotated Anodyne CC(C)[C@@H](c1nc2ccc(C(=O)O)cc2[nH]1)N(C)C(=O)OCc1ccccc1 ZINC000587197750 GI Annotated Anodyne CCOC(=O)c1ccc2nc([C@@H](C(C)C)N(C)C(=O)OC(C)(C)C)[nH]c2c1 ZINC000587197770 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2cc(Cl)c(F)cc2[nH]1)C[C@H]1CCCO1 ZINC000587197860 GI Annotated Anodyne CC(C)(C)OC(=O)N(Cc1nc2cc(Cl)c(F)cc2[nH]1)C[C@@H]1CCCO1 ZINC000587197861 GI Annotated Anodyne CN(C(=O)c1ccccc1N)c1ccccc1-c1nc2ccc(Cl)nc2[nH]1 ZINC000587197901 GI Annotated Anodyne CC(C)[C@H](c1nc2cc(-n3cccn3)c(F)cc2[nH]1)N(C)C(=O)OC(C)(C)C ZINC000587197913 GI Annotated Anodyne COc1cc2nc(-c3ccccc3N(C)C(=O)c3ccccc3N)[nH]c2cc1C ZINC000587198010 GI Annotated Anodyne CC(C)[C@@H](c1nc2ccc([C@@H](N)N=O)cc2[nH]1)N(C)C(=O)OCc1ccccc1 ZINC000587198024 GI Annotated Anodyne CC(C)[C@@H](c1nc2ccc([C@H](N)N=O)cc2[nH]1)N(C)C(=O)OCc1ccccc1 ZINC000587198026 GI Annotated Anodyne CC(C)[C@H](c1nc2cc(Br)ncc2[nH]1)N(C)C(=O)OC(C)(C)C ZINC000587198075 GI Annotated Anodyne CC(C)[C@H](c1nc2ccnc(Br)c2[nH]1)N(C)C(=O)OC(C)(C)C ZINC000587198089 GI Annotated Anodyne CN(C(=O)c1ccccc1N)c1ccccc1-c1nc2c(F)cnc(Cl)c2[nH]1 ZINC000587198106 GI Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3cc(C)ccc3N(C)C(=O)OC(C)(C)C)nc12 ZINC000587198150 GI Annotated Anodyne Cc1ccc2c(ccc3nc(CN(C[C@@H]4CCCO4)C(=O)OC(C)(C)C)[nH]c32)n1 ZINC000587198160 GI Annotated Anodyne Cc1ccc2c(ccc3nc(CN(C[C@H]4CCCO4)C(=O)OC(C)(C)C)[nH]c32)n1 ZINC000587198163 GI Annotated Anodyne CC(C)[C@@H](c1nc2cc3cn[nH]c3cc2[nH]1)N(C)C(=O)OCc1ccccc1 ZINC000587198197 GI Annotated Anodyne CC(C)[C@@H](c1nc2cc(Br)c(Br)cc2[nH]1)N(C)C ZINC000587198333 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc([C@@H](C(C)C)N(C)C(=O)OC(C)(C)C)[nH]c2c1 ZINC000587198337 GI Annotated Anodyne CC(C)[C@H](c1nc2ccc(Br)nc2[nH]1)N(C)C(=O)OC(C)(C)C ZINC000587198352 GI Annotated Anodyne CC(C)[C@@H](c1nc2ccc(CCO)cc2[nH]1)N(C)C(=O)OCc1ccccc1 ZINC000587198370 GI Annotated Anodyne CN(C(=O)c1ccccc1N)c1ccccc1-c1nc2cc(F)cc(F)c2[nH]1 ZINC000587198406 GI Annotated Anodyne CC(C)[C@@H](c1nc2c(Br)ccc(Br)c2[nH]1)N(C)C ZINC000587198508 GI Annotated Anodyne CC(C)[C@@H](c1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1)N(C)C ZINC000587198518 GI Annotated Anodyne COC(=O)c1cc2nc([C@H](C(C)C)N(C)C)[nH]c2c(F)c1Nc1ccccc1 ZINC000587198542 GI Annotated Anodyne Cc1ccc(N(C)C(=O)OC(C)(C)C)c(-c2nc3cc4nc(O)[nH]c4cc3[nH]2)c1 ZINC000587198588 GI Annotated Anodyne CN(C(=O)c1ccccc1N)c1ccccc1-c1nc2c(Cl)ccnc2[nH]1 ZINC000587198620 GI Annotated Anodyne CC(C)[C@@H](c1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1)N(C)C ZINC000587198738 GI Annotated Anodyne CC(C)[C@@H](c1nc2cc3c(cc2[nH]1)OCCO3)N(C)C(=O)OCc1ccccc1 ZINC000587198762 GI Annotated Anodyne CC(C)[C@@H](c1nc2cc3c(cc2[nH]1)OCO3)N(C)C(=O)OCc1ccccc1 ZINC000587198766 GI Annotated Anodyne CC(C)[C@@H](c1nc2ccc([N+](=O)[O-])cc2[nH]1)N(C)C(=O)OCc1ccccc1 ZINC000587198775 GI Annotated Bother Cc1ccc(N(C)C(=O)OC(C)(C)C)c(-c2nc3cncc([N+](=O)[O-])c3[nH]2)c1 ZINC000587198821 GI Annotated Bother CN(C(=O)c1ccccc1N)c1ccccc1-c1nc2cncc(Cl)c2[nH]1 ZINC000587198877 GI Annotated Anodyne Cc1cnc(Cl)c2[nH]c(-c3ccccc3N(C)C(=O)c3ccccc3N)nc12 ZINC000587198889 GI Annotated Anodyne Cc1ccc(N(C)C(=O)OC(C)(C)C)c(-c2nc3cc([N+](=O)[O-])cnc3[nH]2)c1 ZINC000587198904 GI Annotated Bother CN(C(=O)c1ccccc1N)c1ccccc1-c1nc2cc(Cl)cnc2[nH]1 ZINC000587199008 GI Annotated Anodyne CN(C(=O)c1ccccc1N)c1ccccc1-c1nc2ccnc(Cl)c2[nH]1 ZINC000587199097 GI Annotated Anodyne CN(C(=O)c1ccccc1N)c1ccccc1-c1nc2ccc(F)c(F)c2[nH]1 ZINC000587199107 GI Annotated Anodyne CC(C)[C@@H](c1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1)N(C)C ZINC000587199192 GI Annotated Anodyne C[C@@H](c1nc2cncnc2[nH]1)N(C)C(=O)OCC1c2ccccc2-c2ccccc21 ZINC000587199505 GI Annotated Anodyne C[C@@H](c1nc2ncc[nH]c-2n1)N(C)C(=O)OCC1c2ccccc2-c2ccccc21 ZINC000587199555 GI Annotated Anodyne C[C@@H](c1nc2cnncc2[nH]1)N(C)C(=O)OCC1c2ccccc2-c2ccccc21 ZINC000587200231 GI Annotated Anodyne COc1cc2nc(C(C)(C)C(C)(C)NC(=O)OC(C)(C)C)[nH]c2cc1OC ZINC000587200873 GI Annotated Anodyne COc1ccc(NC(C)(C)c2nc3cc(Br)c(C)nc3[nH]2)cc1 ZINC000587200900 GI Annotated Anodyne CC(C)(C)OC(=O)NC(C)(C)C(C)(C)c1nc2cc(Br)cnc2[nH]1 ZINC000587200922 GI Annotated Anodyne COc1cc(OC)c2[nH]c(C(C)(C)C(C)(C)NC(=O)OC(C)(C)C)nc2c1 ZINC000587200973 GI Annotated Anodyne Cc1cc2[nH]c(C(C)(C)C(C)(C)NC(=O)OC(C)(C)C)nc2cc1[N+](=O)[O-] ZINC000587201048 GI Annotated Bother CC(C)(C)OC(=O)NC(C)(C)C(C)(C)c1nc2ccnc(Br)c2[nH]1 ZINC000587201114 GI Annotated Anodyne CC(C)(C)OC(=O)NC(C)(C)C(C)(C)c1nc2cc(Br)ncc2[nH]1 ZINC000587201123 GI Annotated Anodyne COc1ccc(NC(C)(C)c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)cc1 ZINC000587201178 GI Annotated Anodyne COc1ccc(NC(C)(C)c2nc3c(F)cnc(Br)c3[nH]2)cc1 ZINC000587201206 GI Annotated Anodyne CC(C)(C)OC(=O)NC(C)(C)C(C)(C)c1nc2ccc(Br)nc2[nH]1 ZINC000587201208 GI Annotated Anodyne CC(C)(C)OC(=O)NC(C)(C)C(C)(C)c1nc2cc3c(cc2[nH]1)NC(=O)CC3 ZINC000587201511 GI Annotated Anodyne CC(C)(C)OC(=O)NC(C)(C)C(C)(C)c1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587201530 GI Annotated Anodyne CC(C)(C)OC(=O)NC(C)(C)C(C)(C)c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 ZINC000587201541 GI Annotated Bother CCOC(=O)c1ccc2nc(C(C)(C)C(C)(C)NC(=O)OC(C)(C)C)[nH]c2c1 ZINC000587201558 GI Annotated Anodyne COc1ccc(NC(C)(C)c2nc3ccc(Br)c(O)c3[nH]2)cc1 ZINC000587201590 GI Annotated Anodyne CC(C)(C)OC(=O)NC(C)(C)C(C)(C)c1nc2cc(Cl)nc(C#N)c2[nH]1 ZINC000587201825 GI Annotated Mild CC(C)(C)OC(=O)NC(C)(C)C(C)(C)c1nc2cncc(Br)c2[nH]1 ZINC000587201913 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](Cc1nc2cc([N+](=O)[O-])c(F)cc2[nH]1)C(C)(C)C ZINC000587202352 GI Annotated Bother CC(C)(C)OC(=O)N[C@H](Cc1nc2cc([N+](=O)[O-])c(F)cc2[nH]1)C(C)(C)C ZINC000587202355 GI Annotated Bother CC(C)(C)OC(=O)N[C@H](Cc1nc2cncc(Br)c2[nH]1)C(C)(C)C ZINC000587202559 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](Cc1nc2cncc(Br)c2[nH]1)C(C)(C)C ZINC000587202561 GI Annotated Anodyne CC(C)(C)OC(=O)NC(=N)c1cccc(-c2nc3c(F)cnc(Cl)c3[nH]2)c1 ZINC000587202797 GI Annotated Anodyne CC(C)(C)OC(=O)NC(C)(C)C(C)(C)c1nc2c(Br)ccnc2[nH]1 ZINC000587202891 GI Annotated Anodyne Cc1cnc(Cl)c2[nH]c(-c3cccc(C(=N)NC(=O)OC(C)(C)C)c3)nc12 ZINC000587202916 GI Annotated Anodyne COc1cc2nc(-c3cccc(C(=N)NC(=O)OC(C)(C)C)c3)[nH]c2cc1F ZINC000587203406 GI Annotated Anodyne CC(C)(C)OC(=O)NC(=N)c1cccc(-c2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)c1 ZINC000587203879 GI Annotated Bother Cc1cc2[nH]c(-c3cccc(C(=N)NC(=O)OC(C)(C)C)c3)nc2cc1[N+](=O)[O-] ZINC000587203928 GI Annotated Bother CC(C)(C)OC(=O)NC(=N)c1cccc(-c2nc3cc(F)c(F)c(F)c3[nH]2)c1 ZINC000587203947 GI Annotated Anodyne COc1cc(OC)c2[nH]c(-c3cccc(C(=N)NC(=O)OC(C)(C)C)c3)nc2c1 ZINC000587203971 GI Annotated Anodyne Cc1cc2[nH]c(C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C)nc2cc1[N+](=O)[O-] ZINC000587204161 GI Annotated Bother Cc1cc2[nH]c(C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)nc2cc1[N+](=O)[O-] ZINC000587204163 GI Annotated Bother COc1cc(OC)c2[nH]c(C[C@H](NC(=O)OC(C)(C)C)C(C)(C)C)nc2c1 ZINC000587204167 GI Annotated Anodyne COc1cc(OC)c2[nH]c(C[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)nc2c1 ZINC000587204168 GI Annotated Anodyne CC(C)(C)OC(=O)NC(=N)c1cccc(-c2nc3cc(Cl)nc(C#N)c3[nH]2)c1 ZINC000587204401 GI Annotated Mild CC(C)(C)OC(=O)N[C@H](Cc1nc2cc(C(F)(F)F)ncc2[nH]1)C(C)(C)C ZINC000587205019 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](Cc1nc2cc(C(F)(F)F)ncc2[nH]1)C(C)(C)C ZINC000587205021 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](Cc1nc2cc3c(cc2[nH]1)OCCCO3)C(C)(C)C ZINC000587205495 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](Cc1nc2cc3c(cc2[nH]1)OCCCO3)C(C)(C)C ZINC000587205501 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2ccc(Br)c(F)c2[nH]1)c1ccc(C)cc1 ZINC000587205561 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccc(Br)c(F)c2[nH]1)c1ccc(C)cc1 ZINC000587205563 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc(C)cc(Br)c2[nH]1)c1ccc(C)cc1 ZINC000587205824 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(C)cc(Br)c2[nH]1)c1ccc(C)cc1 ZINC000587205826 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc(Br)cc(F)c2[nH]1)c1ccc(C)cc1 ZINC000587205852 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(Br)cc(F)c2[nH]1)c1ccc(C)cc1 ZINC000587205854 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc(Br)cc(C)c2[nH]1)c1ccc(C)cc1 ZINC000587205992 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(Br)cc(C)c2[nH]1)c1ccc(C)cc1 ZINC000587205994 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cccc(OC(F)(F)F)c2[nH]1)c1ccc(C)cc1 ZINC000587205995 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cccc(OC(F)(F)F)c2[nH]1)c1ccc(C)cc1 ZINC000587205996 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc(F)cc(C(F)(F)F)c2[nH]1)c1ccc(C)cc1 ZINC000587206348 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(F)cc(C(F)(F)F)c2[nH]1)c1ccc(C)cc1 ZINC000587206349 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2ccc(OC(F)(F)F)cc2[nH]1)c1ccc(C)cc1 ZINC000587206397 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccc(OC(F)(F)F)cc2[nH]1)c1ccc(C)cc1 ZINC000587206398 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](Cc1nc2cc(Br)ncc2[nH]1)C(C)(C)C ZINC000587206678 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](Cc1nc2cc(Br)ncc2[nH]1)C(C)(C)C ZINC000587206679 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](Cc1nc2ccnc(Br)c2[nH]1)C(C)(C)C ZINC000587206966 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](Cc1nc2ccnc(Br)c2[nH]1)C(C)(C)C ZINC000587206968 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc(Br)c(F)cc2[nH]1)c1ccc(C)cc1 ZINC000587207045 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(Br)c(F)cc2[nH]1)c1ccc(C)cc1 ZINC000587207048 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](Cc1nc2cc(C(F)(F)F)cnc2[nH]1)C(C)(C)C ZINC000587207054 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](Cc1nc2cc(C(F)(F)F)cnc2[nH]1)C(C)(C)C ZINC000587207055 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc(C)c(Br)cc2[nH]1)c1ccc(C)cc1 ZINC000587207102 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(C)c(Br)cc2[nH]1)c1ccc(C)cc1 ZINC000587207104 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1)c1ccc(C)cc1 ZINC000587207367 GI Annotated Mild CC(=O)N[C@H](Cc1nc2cc(C#N)c(C(F)(F)F)cc2[nH]1)c1ccc(C)cc1 ZINC000587207368 GI Annotated Mild CC(=O)N[C@@H](Cc1nc2cc(C(F)(F)F)c(F)cc2[nH]1)c1ccc(C)cc1 ZINC000587207417 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(C(F)(F)F)c(F)cc2[nH]1)c1ccc(C)cc1 ZINC000587207418 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2ccc(F)c(Br)c2[nH]1)c1ccc(C)cc1 ZINC000587207455 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccc(F)c(Br)c2[nH]1)c1ccc(C)cc1 ZINC000587207456 GI Annotated Anodyne O=C1COc2cc(-c3cc4c5c(cccc5n3)CC4)c(Br)cc2N1 ZINC000587207656 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2ccc(Br)c(C)c2[nH]1)c1ccc(C)cc1 ZINC000587207828 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccc(Br)c(C)c2[nH]1)c1ccc(C)cc1 ZINC000587207829 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2cc(F)cc(Br)c2[nH]1)c1ccc(C)cc1 ZINC000587207838 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2cc(F)cc(Br)c2[nH]1)c1ccc(C)cc1 ZINC000587207839 GI Annotated Anodyne O=C1c2ccccc2-c2cc(-c3ccccc3[C@@H](O)C(=O)O)nc3cccc1c23 ZINC000587207995 GI Annotated Anodyne O=C1c2ccccc2-c2cc(-c3ccccc3[C@H](O)C(=O)O)nc3cccc1c23 ZINC000587207996 GI Annotated Anodyne O=C(O)Cc1c(-c2cc(Br)ccc2O)nc2cccc3c2c1CC3 ZINC000587208009 GI Annotated Anodyne CN(C)/C=C/c1nc(O)c(Br)cc1-c1cc2c3c(cccc3n1)CC2 ZINC000587208547 GI Annotated Anodyne CN(C)/C=C\c1nc(O)c(Br)cc1-c1cc2c3c(cccc3n1)CC2 ZINC000587208548 GI Annotated Anodyne COC(=O)Cc1c(-c2ccc(Br)cc2)nc2cccc3c2c1CC3 ZINC000587208737 GI Annotated Anodyne O=C(O)CCc1nc2cccc3c2c(c1CC(=O)c1ccc(Cl)cc1)CC3 ZINC000587208760 GI Annotated Anodyne O=C1C=C(Br)C(=O)c2oc(-c3cc4c5c(cccc5n3)CC4)cc21 ZINC000587208826 GI Annotated Mild COCc1nc2cccc3c2c(c1CCCC1OCCO1)-c1ccccc1C3=O ZINC000587208896 GI Annotated Anodyne O=C1c2ccccc2-c2c3c(nc4cccc1c24)-c1ccccc1S(=O)(=O)CC3 ZINC000587209183 GI Annotated Anodyne O=C(O)Cc1c(CCC(=O)c2ccc(Cl)cc2)nc2cccc3c2c1CC3 ZINC000587209209 GI Annotated Anodyne COc1cc(NC(=O)Cc2cc3c4c(cccc4n2)CC3)c(OC)cc1Cl ZINC000587209211 GI Annotated Anodyne Brc1cnc(Br)c(-c2cc3c4c(cccc4n2)CC3)n1 ZINC000587209261 GI Annotated Anodyne CCOC(=O)c1[nH]c2c(c1Br)CCc1c-2nc2cccc3c2c1CC3 ZINC000587209578 GI Annotated Anodyne CCOC(=O)c1c(NC(=O)CCl)oc(C)c1-c1cc2c3c(cccc3n1)CC2 ZINC000587209840 GI Annotated Reactive O=C1c2ccccc2-c2cc(CS(=O)(=O)c3ccccc3)nc3cccc1c23 ZINC000587209897 GI Annotated Anodyne O=S(=O)(Oc1ccc(-c2cc3c4c(cccc4n2)CC3)cc1)C(F)(F)F ZINC000587210086 GI Annotated Unstable O=S(=O)(CC(F)(F)F)c1ccc(-c2cc3c4c(cccc4n2)CC3)cc1 ZINC000587210327 GI Annotated Anodyne COc1cc(-c2cc3c4c(cccc4n2)CC3)ccc1S(=O)(=O)C(F)F ZINC000587210865 GI Annotated Anodyne CC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cc2c3c(cccc3n1)CC2 ZINC000587211151 GI Annotated Bother CC(=O)[C@@H](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cc2c3c(cccc3n1)CC2 ZINC000587211152 GI Annotated Bother CN(C)/C=C1/C[C@H](NC(=O)OC(C)(C)C)Cc2c1nc1cccc3c1c2CC3 ZINC000587211780 GI Annotated Anodyne CN(C)/C=C1\C[C@H](NC(=O)OC(C)(C)C)Cc2c1nc1cccc3c1c2CC3 ZINC000587211796 GI Annotated Anodyne CN(C)/C=C1\C[C@@H](NC(=O)OC(C)(C)C)Cc2c1nc1cccc3c1c2CC3 ZINC000587211797 GI Annotated Anodyne CN(C)/C=C1/C[C@@H](NC(=O)OC(C)(C)C)Cc2c1nc1cccc3c1c2CC3 ZINC000587211798 GI Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(F)cc2)CCc2nc3cccc4c3c(c2C1)CC4 ZINC000587212107 GI Annotated Anodyne CCOC(=O)[C@]1(c2ccc(F)cc2)CCc2nc3cccc4c3c(c2C1)CC4 ZINC000587212108 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1nc2cccc3c2c(c1CCCC1OCCO1)CC3 ZINC000587212429 GI Annotated Anodyne Cc1cc(I)cc(-c2cc3c4c(cccc4n2)CC3)c1N ZINC000587213290 GI Annotated Anodyne Cc1nc(O)c(I)cc1-c1cc2c3c(cccc3n1)CC2 ZINC000587214041 GI Annotated Anodyne CCOc1ccc(-c2nc3cccc4c3c(c2CC(=O)O)CC4)cc1OCC ZINC000587215068 GI Annotated Anodyne Oc1ccc(Cc2c(-c3c(O)cc(O)cc3O)nc3cccc4c3c2CC4)cc1 ZINC000587215969 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2c3cccnc3c3ncccc3c2[nH]1)c1ccc(C)cc1 ZINC000587216400 GI Annotated Bother CC(=O)N[C@H](Cc1nc2c3cccnc3c3ncccc3c2[nH]1)c1ccc(C)cc1 ZINC000587216401 GI Annotated Bother O=S(=O)(Cl)c1cc2c(cc1Cl)Cc1c-2nc2cccc3c2c1CC3 ZINC000587216437 GI Annotated Unstable COc1ccc(-c2cc3c4c(cccc4n2)CC3)cc1CSc1nncn1C ZINC000587216452 GI Annotated Anodyne CCOC(=O)c1c(NC(=O)Cc2cc3c4c(cccc4n2)CC3)sc(C)c1C ZINC000587216556 GI Annotated Anodyne O=C(N[C@@H](c1ccccc1)c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1)c1ccccc1 ZINC000587216933 GI Annotated Bother O=C(N[C@H](c1ccccc1)c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1)c1ccccc1 ZINC000587216939 GI Annotated Bother Cc1ccc(S(=O)(=O)OC[C@H]2CCc3nc4cccc5c4c(c3C2)CC5)cc1 ZINC000587217060 GI Annotated Mild Cc1ccc(S(=O)(=O)OC[C@@H]2CCc3nc4cccc5c4c(c3C2)CC5)cc1 ZINC000587217073 GI Annotated Mild COc1cc2nc([C@@H](NC(=O)c3ccccc3)c3ccccc3)[nH]c2cc1F ZINC000587217335 GI Annotated Anodyne COc1cc2nc([C@H](NC(=O)c3ccccc3)c3ccccc3)[nH]c2cc1F ZINC000587217336 GI Annotated Anodyne O=S(=O)(NCc1ccco1)c1ccc(-c2cc3c4c(cccc4n2)CC3)cc1 ZINC000587217520 GI Annotated Anodyne CC(=O)N[C@H](Cc1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1)c1ccc(C)cc1 ZINC000587217526 GI Annotated Anodyne CC(=O)N[C@@H](Cc1nc2ccc(-c3ccc(N)c(N)c3)cc2[nH]1)c1ccc(C)cc1 ZINC000587217532 GI Annotated Anodyne COc1cc(-c2nc3cccc(C(C)(C)C)c3[nH]2)ccc1OCC(=O)NC(C)C ZINC000587219029 GI Annotated Anodyne COc1cc(OC)c2[nH]c([C@@H](NC(=O)c3ccccc3)c3ccccc3)nc2c1 ZINC000587219198 GI Annotated Anodyne COc1cc(OC)c2[nH]c([C@H](NC(=O)c3ccccc3)c3ccccc3)nc2c1 ZINC000587219199 GI Annotated Anodyne O=C(N[C@H](c1ccccc1)c1nc2cc(F)c(F)c(F)c2[nH]1)c1ccccc1 ZINC000587219609 GI Annotated Anodyne O=C(N[C@@H](c1ccccc1)c1nc2cc(F)c(F)c(F)c2[nH]1)c1ccccc1 ZINC000587219610 GI Annotated Anodyne O=C(N[C@H](c1ccccc1)c1nc2cc(C(F)(F)F)ncc2[nH]1)c1ccccc1 ZINC000587220433 GI Annotated Anodyne O=C(N[C@@H](c1ccccc1)c1nc2cc(C(F)(F)F)ncc2[nH]1)c1ccccc1 ZINC000587220436 GI Annotated Anodyne CN[C@@H](c1cccnc1)c1nc2cc(OCC(C)C)c(Br)cc2[nH]1 ZINC000587220915 GI Annotated Anodyne CN[C@H](c1cccnc1)c1nc2cc(OCC(C)C)c(Br)cc2[nH]1 ZINC000587220918 GI Annotated Anodyne O=C(N[C@@H](c1ccccc1)c1nc2c(F)cnc(Cl)c2[nH]1)c1ccccc1 ZINC000587221113 GI Annotated Anodyne O=C(N[C@H](c1ccccc1)c1nc2c(F)cnc(Cl)c2[nH]1)c1ccccc1 ZINC000587221117 GI Annotated Anodyne CN[C@H](c1cccnc1)c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587221179 GI Annotated Anodyne CN[C@@H](c1cccnc1)c1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587221181 GI Annotated Anodyne COc1cc(-c2nc3ccc4c(c3[nH]2)CCCC4)ccc1OCC(=O)NC(C)C ZINC000587221330 GI Annotated Anodyne CN[C@H](c1cccnc1)c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587221739 GI Annotated Anodyne CN[C@@H](c1cccnc1)c1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587221741 GI Annotated Anodyne N#Cc1nc(Cl)cc2nc([C@H](NC(=O)c3ccccc3)c3ccccc3)[nH]c12 ZINC000587221952 GI Annotated Mild N#Cc1nc(Cl)cc2nc([C@@H](NC(=O)c3ccccc3)c3ccccc3)[nH]c12 ZINC000587221959 GI Annotated Mild Cc1cnc(Cl)c2[nH]c([C@@H](NC(=O)c3ccccc3)c3ccccc3)nc12 ZINC000587222173 GI Annotated Anodyne Cc1cnc(Cl)c2[nH]c([C@H](NC(=O)c3ccccc3)c3ccccc3)nc12 ZINC000587222178 GI Annotated Anodyne CN[C@H](c1cccnc1)c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587222944 GI Annotated Anodyne CN[C@@H](c1cccnc1)c1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587222945 GI Annotated Anodyne O=C(N[C@H](c1ccccc1)c1nc2cc3c(cc2[nH]1)OCCCO3)c1ccccc1 ZINC000587222988 GI Annotated Anodyne O=C(N[C@@H](c1ccccc1)c1nc2cc3c(cc2[nH]1)OCCCO3)c1ccccc1 ZINC000587222989 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](c1nc2cc(Br)ncc2[nH]1)C1CCCC1 ZINC000587223450 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](c1nc2cc(Br)ncc2[nH]1)C1CCCC1 ZINC000587223451 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](c1nc2ccnc(Br)c2[nH]1)C1CCCC1 ZINC000587223633 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](c1nc2ccnc(Br)c2[nH]1)C1CCCC1 ZINC000587223635 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](c1nc2cc(Cl)nc(C#N)c2[nH]1)C1CCCC1 ZINC000587224227 GI Annotated Mild CC(C)(C)OC(=O)N[C@@H](c1nc2cc(Cl)nc(C#N)c2[nH]1)C1CCCC1 ZINC000587224234 GI Annotated Mild COc1cc(OC)c2[nH]c([C@@H](NC(=O)OC(C)(C)C)C3CCCC3)nc2c1 ZINC000587224779 GI Annotated Anodyne COc1cc(OC)c2[nH]c([C@H](NC(=O)OC(C)(C)C)C3CCCC3)nc2c1 ZINC000587224781 GI Annotated Anodyne CCCCOc1cc2nc([C@@H](NC)c3cccnc3)[nH]c2cc1Br ZINC000587224899 GI Annotated Anodyne CCCCOc1cc2nc([C@H](NC)c3cccnc3)[nH]c2cc1Br ZINC000587224902 GI Annotated Anodyne C[C@H](Oc1ccccc1)C(=O)NCc1nc2cc(C(F)(F)F)cc(Cl)c2[nH]1 ZINC000587224943 GI Annotated Anodyne C[C@@H](Oc1ccccc1)C(=O)NCc1nc2cc(C(F)(F)F)cc(Cl)c2[nH]1 ZINC000587224945 GI Annotated Anodyne CCOC(=O)Nc1ccc(C(=O)NCc2nc3ccc(Cl)c(C)c3[nH]2)cc1 ZINC000587224947 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](c1nc2cc3c(cc2[nH]1)NC(=O)CC3)C1CCCC1 ZINC000587225082 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](c1nc2cc3c(cc2[nH]1)NC(=O)CC3)C1CCCC1 ZINC000587225084 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](c1nc2cncc(Br)c2[nH]1)C1CCCC1 ZINC000587225096 GI Annotated Anodyne C[C@@H](Oc1ccccc1)C(=O)NCc1nc2ccc(SC(F)(F)F)cc2[nH]1 ZINC000587225228 GI Annotated Anodyne C[C@H](Oc1ccccc1)C(=O)NCc1nc2ccc(SC(F)(F)F)cc2[nH]1 ZINC000587225229 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](c1nc2cncc(Br)c2[nH]1)C1CCCC1 ZINC000587225253 GI Annotated Anodyne CCOC(=O)CNc1ccc(-c2nc3c4cccnc4c4ncccc4c3[nH]2)cc1 ZINC000587225325 GI Annotated Bother CC(C)(C)OC(=O)N[C@H](c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1)C1CCCC1 ZINC000587225443 GI Annotated Bother CC(C)(C)OC(=O)N[C@@H](c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1)C1CCCC1 ZINC000587225468 GI Annotated Bother CN[C@H](c1cccnc1)c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587225578 GI Annotated Anodyne CN[C@@H](c1cccnc1)c1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587225580 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](c1nc2ccc(Br)nc2[nH]1)C1CCCC1 ZINC000587225877 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](c1nc2ccc(Br)nc2[nH]1)C1CCCC1 ZINC000587225878 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](c1nc2cnc(C(F)(F)F)[nH]c-2n1)C1CCCC1 ZINC000587225891 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](c1nc2cnc(C(F)(F)F)[nH]c-2n1)C1CCCC1 ZINC000587225892 GI Annotated Anodyne CCOC(=O)CNc1ccc(-c2nc3c(C(F)(F)F)cc(F)cc3[nH]2)cc1 ZINC000587226667 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](c1nc2cc(C(=O)O)c(F)cc2[nH]1)C1CCCC1 ZINC000587226783 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](c1nc2cc(C(=O)O)c(F)cc2[nH]1)C1CCCC1 ZINC000587226784 GI Annotated Anodyne COc1cc2nc([C@@H](NC(=O)OC(C)(C)C)C3CCCC3)[nH]c2cc1OC ZINC000587226794 GI Annotated Anodyne COc1cc2nc([C@H](NC(=O)OC(C)(C)C)C3CCCC3)[nH]c2cc1OC ZINC000587226795 GI Annotated Anodyne CN(C)C(=O)c1ccc2nc([C@@H](NC(=O)OC(C)(C)C)C3CCCC3)[nH]c2c1 ZINC000587226819 GI Annotated Anodyne CN(C)C(=O)c1ccc2nc([C@H](NC(=O)OC(C)(C)C)C3CCCC3)[nH]c2c1 ZINC000587226820 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](c1nc2c(Br)ccnc2[nH]1)C1CCCC1 ZINC000587226829 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](c1nc2c(Br)ccnc2[nH]1)C1CCCC1 ZINC000587226830 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](c1nc2cc(Br)cnc2[nH]1)C1CCCC1 ZINC000587226864 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](c1nc2cc(Br)cnc2[nH]1)C1CCCC1 ZINC000587226865 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](c1nc2cc3c(cc2[nH]1)OCCCO3)C1CCCC1 ZINC000587227285 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](c1nc2cc3c(cc2[nH]1)OCCCO3)C1CCCC1 ZINC000587227289 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H](c1nc2cc(F)cc(C(=O)O)c2[nH]1)C1CCCC1 ZINC000587227531 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H](c1nc2cc(F)cc(C(=O)O)c2[nH]1)C1CCCC1 ZINC000587227532 GI Annotated Anodyne CCCCCCCC(=O)NCCCc1nc2c(C)c(Br)cnc2[nH]1 ZINC000587227861 GI Annotated Mild COc1ccc(C)cc1NCCCc1nc2ccc(Br)c(O)c2[nH]1 ZINC000587227953 GI Annotated Anodyne COc1ccc(C)cc1NCCCc1nc2cc(Br)c(C)nc2[nH]1 ZINC000587227960 GI Annotated Anodyne CCCCCCCC(=O)NCCCc1nc2cc(C(=O)OC)cc(Cl)c2[nH]1 ZINC000587228270 GI Annotated Mild CCCCCCCC(=O)NCCCc1nc2ccc(CC(=O)OCC)cc2[nH]1 ZINC000587228281 GI Annotated Mild COC(=O)c1cc(Cl)c2[nH]c(CCCNc3cc(C)ccc3OC)nc2c1 ZINC000587228386 GI Annotated Anodyne CCOC(=O)Nc1ccc(C(=O)NCc2nc3ccc(C(C)(C)C)cc3[nH]2)cc1 ZINC000587228406 GI Annotated Anodyne COc1ccc(C)cc1NCCCc1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587228423 GI Annotated Anodyne COc1ccc(C)cc1NCCCc1nc2c(Br)ccnc2[nH]1 ZINC000587228623 GI Annotated Anodyne CCOC(=O)Nc1ccc(C(=O)NCc2nc3cccc(C(C)(C)C)c3[nH]2)cc1 ZINC000587228671 GI Annotated Anodyne COc1ccc(C)cc1NCCCc1nc2c(C)c(Br)cnc2[nH]1 ZINC000587228681 GI Annotated Anodyne COc1ccc(C)cc1NCCCc1nc2ccc(Br)nc2[nH]1 ZINC000587228820 GI Annotated Anodyne COc1ccc(C)cc1NCCCc1nc2c(F)cnc(Br)c2[nH]1 ZINC000587229018 GI Annotated Anodyne COc1ccc(C)cc1NCCCc1nc2cncc(Br)c2[nH]1 ZINC000587229151 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1ccc(-c2nc3ccc(CO)cc3[nH]2)c(C2CC2)n1 ZINC000587229282 GI Annotated Anodyne COc1ccc(C)cc1NCCCc1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587229404 GI Annotated Anodyne COc1ccc(C)cc1NCCCc1nc2ccnc(Br)c2[nH]1 ZINC000587229497 GI Annotated Anodyne Brc1cc2nc(-c3cccnc3NCc3ccccc3)[nH]c2cn1 ZINC000587229501 GI Annotated Anodyne Cc1cc2[nH]c(-c3cccc(CNc4ncccc4C#N)c3)nc2cc1[N+](=O)[O-] ZINC000587229608 GI Annotated Mild COc1ccc(C)cc1NCCCc1nc2cc(Br)ncc2[nH]1 ZINC000587229616 GI Annotated Anodyne O=[N+]([O-])c1cc2nc(-c3cccnc3NCc3ccccc3)[nH]c2cc1[N+](=O)[O-] ZINC000587229636 GI Annotated Bother CC(C)(C)OC(=O)NCc1ccc(-c2nc3ccc(C#N)cc3[nH]2)c(C2CC2)n1 ZINC000587229643 GI Annotated Mild COc1cc2nc(-c3cccc(CNc4ncccc4C#N)c3)[nH]c2cc1OC ZINC000587229707 GI Annotated Mild Brc1ccnc2[nH]c(-c3cccnc3NCc3ccccc3)nc12 ZINC000587229980 GI Annotated Anodyne COc1cc(OC)c2[nH]c(-c3cccc(CNc4ncccc4C#N)c3)nc2c1 ZINC000587230059 GI Annotated Mild N#Cc1cccnc1NCc1cccc(-c2nc3cc4c(cc3[nH]2)OCCCO4)c1 ZINC000587230068 GI Annotated Mild Cc1cnc2[nH]c(-c3ccccc3NCCNc3ccccc3C(=O)O)nc2c1 ZINC000587230174 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1ccc(-c2nc3cc(F)cnc3[nH]2)c(C2CC2)n1 ZINC000587230211 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(-c3cccnc3NCc3ccccc3)[nH]c2c1 ZINC000587230242 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1ccc(-c2nc3ccc(O)cc3[nH]2)c(C2CC2)n1 ZINC000587230251 GI Annotated Anodyne Brc1nccc2nc(-c3cccnc3NCc3ccccc3)[nH]c12 ZINC000587230347 GI Annotated Anodyne Brc1ccc2nc(-c3cccnc3NCc3ccccc3)[nH]c2n1 ZINC000587230357 GI Annotated Anodyne c1ccc(CNc2ncccc2-c2nc3ccc(CN4CCOCC4)cc3[nH]2)cc1 ZINC000587230375 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1ccc(-c2nc3cccc(C#N)c3[nH]2)c(C2CC2)n1 ZINC000587230688 GI Annotated Mild Cc1ccc2nc(-c3ccccc3NCCNc3ccccc3C(=O)O)[nH]c2n1 ZINC000587230693 GI Annotated Anodyne N#Cc1cccnc1NCc1cccc(-c2nc3cc(Cl)nc(C#N)c3[nH]2)c1 ZINC000587230738 GI Annotated Mild Brc1cncc2nc(-c3cccnc3NCc3ccccc3)[nH]c12 ZINC000587230793 GI Annotated Anodyne O=C(O)c1ccccc1NCCNc1ccccc1-c1nc2cccc(O)c2[nH]1 ZINC000587231105 GI Annotated Anodyne N#Cc1cccnc1NCc1cccc(-c2nc3cc([N+](=O)[O-])c(F)cc3[nH]2)c1 ZINC000587231116 GI Annotated Mild N#Cc1cccc2nc(-c3ccccc3NCCNc3ccccc3C(=O)O)[nH]c12 ZINC000587231199 GI Annotated Mild FC1(F)Oc2cc3nc(-c4ccc(CNCc5ccco5)cc4)[nH]c3cc2O1 ZINC000587231395 GI Annotated Anodyne Cc1cnc2[nH]c(-c3ccc(CNC(=O)OC(C)(C)C)nc3C3CC3)nc2c1 ZINC000587231418 GI Annotated Anodyne Cc1nccc2[nH]c(-c3ccc(CNC(=O)OC(C)(C)C)nc3C3CC3)nc12 ZINC000587231447 GI Annotated Anodyne Cc1nccc2[nH]c(-c3ccccc3NCCNc3ccccc3C(=O)O)nc12 ZINC000587231533 GI Annotated Anodyne Brc1cc2[nH]c(-c3ccc(CNCc4ccco4)cc3)nc2cn1 ZINC000587231540 GI Annotated Anodyne Cc1ccnc2[nH]c(-c3ccc(CNC(=O)OC(C)(C)C)nc3C3CC3)nc12 ZINC000587231629 GI Annotated Anodyne Brc1nccc2[nH]c(-c3ccc(CNCc4ccco4)cc3)nc12 ZINC000587231714 GI Annotated Anodyne Brc1cnc2nc(-c3ccc(CNCc4ccco4)cc3)[nH]c2c1 ZINC000587231884 GI Annotated Anodyne Cc1cncc2nc(-c3ccccc3NCCNc3ccccc3C(=O)O)[nH]c12 ZINC000587231990 GI Annotated Anodyne c1coc(CNCc2ccc(-c3nc4cc5c(cc4[nH]3)OCCCO5)cc2)c1 ZINC000587232188 GI Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@H]1c1nc2ccc(Oc3ccccc3)cc2[nH]1 ZINC000587232265 GI Annotated Anodyne COCCNC(=O)[C@H]1CCCC[C@@H]1c1nc2ccc(Oc3ccccc3)cc2[nH]1 ZINC000587232266 GI Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@@H]1c1nc2ccc(Oc3ccccc3)cc2[nH]1 ZINC000587232267 GI Annotated Anodyne COCCNC(=O)[C@@H]1CCCC[C@H]1c1nc2ccc(Oc3ccccc3)cc2[nH]1 ZINC000587232268 GI Annotated Anodyne Brc1cncc2[nH]c(-c3ccc(CNCc4ccco4)cc3)nc12 ZINC000587232416 GI Annotated Anodyne Cc1cncc2nc(-c3ccc(CNC(=O)OC(C)(C)C)nc3C3CC3)[nH]c12 ZINC000587232452 GI Annotated Anodyne Brc1ccnc2nc(-c3ccc(CNCc4ccco4)cc3)[nH]c12 ZINC000587232461 GI Annotated Anodyne Brc1ccc2[nH]c(-c3ccc(CNCc4ccco4)cc3)nc2n1 ZINC000587232617 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1ccc(-c2nc3cccc(O)c3[nH]2)c(C2CC2)n1 ZINC000587232640 GI Annotated Anodyne Fc1cc2nc(-c3ccc(CNCc4ccco4)cc3)[nH]c2cc1-n1cccn1 ZINC000587232649 GI Annotated Anodyne Cc1ccc2nc(-c3ccc(CNC(=O)OC(C)(C)C)nc3C3CC3)[nH]c2n1 ZINC000587232671 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000587232767 GI Annotated Bother CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1c1nc2cc([N+](=O)[O-])c(Cl)cc2[nH]1 ZINC000587232831 GI Annotated Bother CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587232855 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587232876 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587232948 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587232952 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1c1nc2cc(Br)cnc2[nH]1 ZINC000587233070 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1c1nc2c(Br)ccnc2[nH]1 ZINC000587233184 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1c1nc2ccc(Br)cc2[nH]1 ZINC000587233294 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1c1nc2ccc(Br)cc2[nH]1 ZINC000587233328 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1c1nc2cc(Br)ncc2[nH]1 ZINC000587233339 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1c1nc2cncc(Br)c2[nH]1 ZINC000587233412 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1c1nc2ccc(Br)nc2[nH]1 ZINC000587233419 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1c1nc2cc(Cl)nc(C#N)c2[nH]1 ZINC000587233443 GI Annotated Mild CC(C)(C)OC(=O)NC1(c2nc3ccc4c(c3[nH]2)CCCC4)CCC(=O)CC1 ZINC000587233708 GI Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3ccc(C(F)(F)F)cc3[nH]2)CCC(=O)CC1 ZINC000587233732 GI Annotated Anodyne Cc1ccc2c(ccc3nc(C4(NC(=O)OC(C)(C)C)CCC(=O)CC4)[nH]c32)n1 ZINC000587233820 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1c1nc2cccc(Br)c2[nH]1 ZINC000587233861 GI Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3ccc(C(C)(C)C)nc3[nH]2)CCC(=O)CC1 ZINC000587233869 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]1c1nc2ccc(Br)c(O)c2[nH]1 ZINC000587233974 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c([C@H]3CCC[C@@H]3NC(=O)OC(C)(C)C)nc2c1 ZINC000587233996 GI Annotated Anodyne Cc1c(Br)cnc2[nH]c([C@H]3CCC[C@@H]3NC(=O)OC(C)(C)C)nc12 ZINC000587234033 GI Annotated Anodyne Cc1nc2[nH]c([C@H]3CCC[C@@H]3NC(=O)OC(C)(C)C)nc2cc1Br ZINC000587234045 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1c1nc2cccc(Br)c2[nH]1 ZINC000587234071 GI Annotated Anodyne CSc1ccc2nc(C3(NC(=O)OC(C)(C)C)CCC(=O)CC3)[nH]c2c1 ZINC000587234229 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1c1nc2ccnc(Br)c2[nH]1 ZINC000587234234 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]1c1nc2ccc(Br)c(O)c2[nH]1 ZINC000587234238 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c([C@H]3CCC[C@H]3NC(=O)OC(C)(C)C)nc2c1 ZINC000587234268 GI Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cccc(C(F)(F)F)c3[nH]2)CCC(=O)CC1 ZINC000587234271 GI Annotated Anodyne Cc1c(Br)cnc2[nH]c([C@H]3CCC[C@H]3NC(=O)OC(C)(C)C)nc12 ZINC000587234301 GI Annotated Anodyne Cc1nc2[nH]c([C@H]3CCC[C@H]3NC(=O)OC(C)(C)C)nc2cc1Br ZINC000587234317 GI Annotated Anodyne CC(=O)NC1(c2nc3cc(Br)c(F)c(F)c3[nH]2)CCC(C)CC1 ZINC000587234366 GI Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc(Cl)c(Cl)nc3[nH]2)CCC(=O)CC1 ZINC000587234388 GI Annotated Anodyne CC(=O)NC1(c2nc3ccc(Oc4ccc(N)cc4)cc3[nH]2)CCC(C)CC1 ZINC000587234431 GI Annotated Clean CC(C)(C)OC(=O)NC1(c2nc3cc(Cl)c(F)cc3[nH]2)CCC(=O)CC1 ZINC000587234607 GI Annotated Anodyne CC(=O)NC1(c2nc3ccc(C(=O)c4ccccc4)cc3[nH]2)CCC(C)CC1 ZINC000587234612 GI Annotated Anodyne CC(=O)NC1(c2nc3cc(Br)c(C)c(C)c3[nH]2)CCC(C)CC1 ZINC000587234721 GI Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc(Cl)c(F)c(F)c3[nH]2)CCC(=O)CC1 ZINC000587234743 GI Annotated Anodyne CC(C)Oc1ccc2nc(C3(NC(=O)OC(C)(C)C)CCC(=O)CC3)[nH]c2c1 ZINC000587234769 GI Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc(Cl)cc(F)c3[nH]2)CCC(=O)CC1 ZINC000587234776 GI Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc(Cl)nc(Cl)c3[nH]2)CCC(=O)CC1 ZINC000587234779 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587234817 GI Annotated Anodyne Cc1c(Cl)ccc2nc(C3(NC(=O)OC(C)(C)C)CCC(=O)CC3)[nH]c12 ZINC000587234901 GI Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3c(Cl)c(Cl)cnc3[nH]2)CCC(=O)CC1 ZINC000587234948 GI Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3c(Cl)cnc(Cl)c3[nH]2)CCC(=O)CC1 ZINC000587234966 GI Annotated Anodyne CC(=O)NC1(c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)CCC(C)CC1 ZINC000587234981 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1c1nc2cc([N+](=O)[O-])c(F)cc2[nH]1 ZINC000587235188 GI Annotated Bother COc1cc(OC)c2[nH]c([C@@H]3CCCC[C@H]3NC(=O)OC(C)(C)C)nc2c1 ZINC000587235225 GI Annotated Anodyne Cc1cc2nc(C3(NC(=O)OC(C)(C)C)CCC(=O)CC3)[nH]c2cc1Cl ZINC000587235257 GI Annotated Anodyne COc1cc2nc(C3(NC(=O)OC(C)(C)C)CCC(=O)CC3)[nH]c2cc1Cl ZINC000587235264 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@@H]1CCCC[C@H]1c1nc2cc3c(cc2[nH]1)OCCCO3 ZINC000587235272 GI Annotated Anodyne Cc1cc(Cl)cc2nc(C3(NC(=O)OC(C)(C)C)CCC(=O)CC3)[nH]c12 ZINC000587235399 GI Annotated Anodyne COc1cc2nc([C@@H]3CCCC[C@H]3NC(=O)OC(C)(C)C)[nH]c2cc1OC ZINC000587235446 GI Annotated Anodyne CCOC(=O)c1ccc2nc([C@@H]3CCCC[C@H]3NC(=O)OC(C)(C)C)[nH]c2c1 ZINC000587236033 GI Annotated Anodyne CNc1cccc(-c2cccc(-c3nc4nc(Br)c[nH]c-4n3)c2)c1 ZINC000587236541 GI Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cccc(C(F)(F)F)c3[nH]2)CCC(O)CC1 ZINC000587236590 GI Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc(Cl)cc(F)c3[nH]2)CCC(O)CC1 ZINC000587236621 GI Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3ccc4c(c3[nH]2)CCCC4)CCC(O)CC1 ZINC000587236626 GI Annotated Anodyne Cc1ccc(NC2(c3nc4cccc(S(=O)(=O)N(C)C)c4[nH]3)CCCC2)cc1 ZINC000587236655 GI Annotated Anodyne CNC(=O)c1cccc(-c2cccc(Cc3nc4cccc([N+](=O)[O-])c4[nH]3)c2)c1 ZINC000587236780 GI Annotated Bother CC(C)(C)OC(=O)NC1(c2nc3cc4ccccc4cc3[nH]2)CCC(O)CC1 ZINC000587236858 GI Annotated Anodyne Cc1cc(Cl)cc2nc(C3(NC(=O)OC(C)(C)C)CCC(O)CC3)[nH]c12 ZINC000587236973 GI Annotated Anodyne Cc1cc2nc(C3(NC(=O)OC(C)(C)C)CCC(O)CC3)[nH]c2cc1Cl ZINC000587237045 GI Annotated Anodyne Cc1ccc2c(ccc3nc(C4(NC(=O)OC(C)(C)C)CCC(O)CC4)[nH]c32)n1 ZINC000587237248 GI Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3ccc(C(F)(F)F)cc3[nH]2)CCC(O)CC1 ZINC000587237521 GI Annotated Anodyne Cc1c(Cl)ccc2nc(C3(NC(=O)OC(C)(C)C)CCC(O)CC3)[nH]c12 ZINC000587237533 GI Annotated Anodyne CC(C)Oc1ccc2nc(C3(NC(=O)OC(C)(C)C)CCC(O)CC3)[nH]c2c1 ZINC000587237579 GI Annotated Anodyne CC(C)(C)OC(=O)NC1(c2nc3cc(Cl)c(F)cc3[nH]2)CCC(O)CC1 ZINC000587237782 GI Annotated Anodyne Cc1ccc(NC2(c3nc4ccc(S(=O)(=O)N(C)C)cc4[nH]3)CCCC2)cc1 ZINC000587237786 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@]1(c2nc3ccc(F)cc3[nH]2)[C@@H]2CCCO[C@H]2C1(C)C ZINC000587238400 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@]1(c2nc3ccc(F)cc3[nH]2)[C@H]2CCCO[C@@H]2C1(C)C ZINC000587238402 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@]1(c2nc3ccc(F)cc3[nH]2)[C@H]2CCCO[C@H]2C1(C)C ZINC000587238403 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@]1(c2nc3ccc(F)cc3[nH]2)[C@@H]2CCCO[C@@H]2C1(C)C ZINC000587238404 GI Annotated Anodyne Cc1cccc2nc([C@]3(NC(=O)OC(C)(C)C)[C@@H]4CCCO[C@@H]4C3(C)C)[nH]c12 ZINC000587238405 GI Annotated Anodyne Cc1cccc2nc([C@]3(NC(=O)OC(C)(C)C)[C@H]4CCCO[C@@H]4C3(C)C)[nH]c12 ZINC000587238406 GI Annotated Anodyne Cc1cccc2nc([C@]3(NC(=O)OC(C)(C)C)[C@@H]4CCCO[C@H]4C3(C)C)[nH]c12 ZINC000587238407 GI Annotated Anodyne Cc1cccc2nc([C@]3(NC(=O)OC(C)(C)C)[C@H]4CCCO[C@H]4C3(C)C)[nH]c12 ZINC000587238408 GI Annotated Anodyne Cc1cccc(NC(=O)Cc2nc3cc(Br)c(F)c(F)c3[nH]2)c1C ZINC000587238531 GI Annotated Anodyne Cc1ccc2nc([C@]3(NC(=O)OC(C)(C)C)[C@@H]4CCCO[C@@H]4C3(C)C)[nH]c2c1 ZINC000587238614 GI Annotated Anodyne Cc1ccc2nc([C@]3(NC(=O)OC(C)(C)C)[C@H]4CCCO[C@@H]4C3(C)C)[nH]c2c1 ZINC000587238615 GI Annotated Anodyne Cc1ccc2nc([C@]3(NC(=O)OC(C)(C)C)[C@@H]4CCCO[C@H]4C3(C)C)[nH]c2c1 ZINC000587238616 GI Annotated Anodyne Cc1ccc2nc([C@]3(NC(=O)OC(C)(C)C)[C@H]4CCCO[C@H]4C3(C)C)[nH]c2c1 ZINC000587238617 GI Annotated Anodyne Cc1cccc(NC(=O)Cc2nc3cc(F)cc(Br)c3[nH]2)c1C ZINC000587238930 GI Annotated Anodyne Cc1c(NC(N)=O)cccc1-c1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587239179 GI Annotated Anodyne Cc1cccc(NC(=O)Cc2nc3cc4nc5ccccc5nc4cc3[nH]2)c1C ZINC000587239201 GI Annotated Bother Cc1cccc(NC(=O)Cc2nc3c(Cl)c(Br)cnc3[nH]2)c1C ZINC000587239203 GI Annotated Anodyne Cc1cccc(NC(=O)Cc2nc3ccc(Br)c(F)c3[nH]2)c1C ZINC000587239257 GI Annotated Anodyne Cc1cccc(NC(=O)Cc2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c1C ZINC000587239268 GI Annotated Anodyne Cc1cccc(NC(=O)Cc2nc3c(Br)cnc(Cl)c3[nH]2)c1C ZINC000587239302 GI Annotated Anodyne Cc1cccc(NC(=O)Cc2nc3cc(Br)c(F)cc3[nH]2)c1C ZINC000587239492 GI Annotated Anodyne Cc1cccc(NC(=O)Cc2nc3cc(Br)cc(F)c3[nH]2)c1C ZINC000587239500 GI Annotated Anodyne Cc1cccc(NC(=O)Cc2nc3ccc(F)c(Br)c3[nH]2)c1C ZINC000587239501 GI Annotated Anodyne Cc1c(NC(N)=O)cccc1-c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1 ZINC000587239675 GI Annotated Anodyne Cc1cccc(NC(=O)Cc2nc3ccc(-c4ccc(N)c(N)c4)cc3[nH]2)c1C ZINC000587239757 GI Annotated Anodyne Cc1cccc(NC(=O)Cc2nc3c4cccnc4c4ncccc4c3[nH]2)c1C ZINC000587239836 GI Annotated Bother COc1ccccc1Nc1ccccc1-c1nc2cc3c(cc2[nH]1)OCC(=O)N3 ZINC000587240044 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@]1(c2nc3cccc(F)c3[nH]2)[C@@H]2CCCO[C@H]2C1(C)C ZINC000587240243 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@]1(c2nc3cccc(F)c3[nH]2)[C@H]2CCCO[C@H]2C1(C)C ZINC000587240244 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@]1(c2nc3cccc(F)c3[nH]2)[C@@H]2CCCO[C@@H]2C1(C)C ZINC000587240246 GI Annotated Anodyne CC(C)(C)OC(=O)N[C@]1(c2nc3cccc(F)c3[nH]2)[C@H]2CCCO[C@@H]2C1(C)C ZINC000587240248 GI Annotated Anodyne Cc1cc(C)cc(Nc2c(N)cccc2-c2nc3ccc(-n4cnnn4)cc3[nH]2)c1 ZINC000587240373 GI Annotated Anodyne COC(=O)c1cc2nc(-c3cccc(N)c3Nc3cc(C)cc(C)c3)[nH]c2cn1 ZINC000587240445 GI Annotated Anodyne CCc1ccccc1NC(=O)c1nc2c(F)c(F)c(Br)cc2[nH]1 ZINC000587240662 GI Annotated Anodyne Cc1ccccc1CC(=O)Nc1ccc(-c2nc3c(Cl)ccnc3[nH]2)c(O)c1 ZINC000587240690 GI Annotated Anodyne CCc1ccccc1NC(=O)c1nc2c3c(ccc2[nH]1)C(=O)c1ccccc1C3=O ZINC000587240711 GI Annotated Clean CC(C)(C)OC(=O)Nc1cc(O)cc(-c2nc3cc(Cl)nc(C#N)c3[nH]2)c1 ZINC000587240893 GI Annotated Mild CC(C)(C)OC(=O)Nc1cc(O)cc(-c2nc3cnc(C(F)(F)F)[nH]c-3n2)c1 ZINC000587240900 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cccc(N)c3Nc3cc(C)cc(C)c3)[nH]c2n1 ZINC000587240918 GI Annotated Anodyne COc1ccccc1Nc1ccccc1-c1nc2c(S)nc(S)nc2[nH]1 ZINC000587240993 GI Annotated Anodyne CCc1ccccc1NC(=O)c1nc2c(Cl)ncc(Br)c2[nH]1 ZINC000587240997 GI Annotated Anodyne COC(=O)c1ccnc2[nH]c(-c3cccc(N)c3Nc3cc(C)cc(C)c3)nc12 ZINC000587241011 GI Annotated Anodyne Cc1c(NC(N)=O)cccc1-c1nc2cc(Cl)cc(Br)c2[nH]1 ZINC000587241114 GI Annotated Anodyne CCc1ccccc1NC(=O)c1nc2ncc(Br)c(Cl)c2[nH]1 ZINC000587241212 GI Annotated Anodyne CCc1ccccc1NC(=O)c1nc2c([N+](=O)[O-])c(Br)ccc2[nH]1 ZINC000587241369 GI Annotated Bother COC(=O)c1cccc2nc(-c3cc(O)cc(NC(=O)OC(C)(C)C)c3)[nH]c12 ZINC000587241402 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cc(O)cc(-c2nc3cc4c(cc3[nH]2)OCCO4)c1 ZINC000587241503 GI Annotated Anodyne COc1ccccc1Nc1ccccc1-c1nc2nc(Br)c[nH]c-2n1 ZINC000587241560 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cccc(NC(=O)C(C)(C)C)c3)[nH]c2c1OC ZINC000587241680 GI Annotated Anodyne CC(C)(C)CC(=O)Nc1cccc(-c2nc3nc(Br)c[nH]c-3n2)c1 ZINC000587241733 GI Annotated Anodyne Oc1ccc(Nc2cccc(-c3nc4nc(Br)c[nH]c-4n3)c2)cc1 ZINC000587241745 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cc(O)cc(-c2nc3cc(F)cc(C(=O)O)c3[nH]2)c1 ZINC000587241772 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cccc(Nc4ccc(O)cc4)c3)[nH]c2c1OC ZINC000587241863 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cc(O)cc(-c2nc3c(F)cnc(Cl)c3[nH]2)c1 ZINC000587242050 GI Annotated Anodyne COc1cc(OC)c2[nH]c(-c3cc(O)cc(NC(=O)OC(C)(C)C)c3)nc2c1 ZINC000587242341 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cc(O)cc(-c2nc3cc4c(cc3[nH]2)OCCCO4)c1 ZINC000587242562 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cc(O)cc(-c2nc3ccc([C@@H](N)N=O)cc3[nH]2)c1 ZINC000587242575 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cc(O)cc(-c2nc3ccc([C@H](N)N=O)cc3[nH]2)c1 ZINC000587242576 GI Annotated Anodyne CC(C)(C)OC(=O)Nc1cc(O)cc(-c2nc3cc4c(cc3[nH]2)NC(=O)CC4)c1 ZINC000587242696 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cccc(NC(=O)CC(C)(C)C)c3)[nH]c2c1OC ZINC000587242769 GI Annotated Anodyne CC(=O)Nc1cccc(Cc2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c1 ZINC000587242776 GI Annotated Anodyne CC(=O)Nc1cccc(Cc2nc3cc(Br)c(F)c(F)c3[nH]2)c1 ZINC000587242869 GI Annotated Anodyne Cc1oncc1C(=O)Nc1ccc(Cc2nc3ccc4ncccc4c3[nH]2)cc1 ZINC000587243745 GI Annotated Anodyne Cc1oncc1C(=O)Nc1ccc(Cc2nc3c(C)cnc(Cl)c3[nH]2)cc1 ZINC000587243862 GI Annotated Anodyne O=C(/C=C\c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1)Nc1ccccc1 ZINC000587244200 GI Annotated Anodyne O=C(/C=C/c1nc2cc(C(F)(F)C(F)(F)F)ncc2[nH]1)Nc1ccccc1 ZINC000587244204 GI Annotated Anodyne Cc1oncc1C(=O)Nc1ccc(Cc2nc3ccc(C(C)(C)C)nc3[nH]2)cc1 ZINC000587245719 GI Annotated Anodyne NCCOCc1nc2cc(S(F)(F)(F)(F)F)cc(Br)c2[nH]1 ZINC000587245770 GI Annotated Reactive COc1ccc2c(c1)CC[C@](N)(c1nc3cc(C(F)(F)F)c(F)cc3[nH]1)C2 ZINC000587246004 GI Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3cc(C(F)(F)F)c(F)cc3[nH]1)C2 ZINC000587246005 GI Annotated Anodyne NCc1cccc(-c2nc3c(Br)ccc(Br)c3[nH]2)c1 ZINC000587246099 GI Annotated Anodyne N[C@@H]1CC[C@H](c2nc3cc(OCc4ccccc4)c(Br)cc3[nH]2)C1 ZINC000587246426 GI Annotated Anodyne COC(=O)c1cc2nc(-c3cccc(CN)c3)[nH]c2c(F)c1Nc1ccccc1 ZINC000587246499 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3cc4ccccc4cc3NC(=O)C(C)C)[nH]c2n1 ZINC000587246599 GI Annotated Anodyne NCc1cccc(-c2nc3cc(OC(F)(F)F)cc(Br)c3[nH]2)c1 ZINC000587246613 GI Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3cc4nc5ccccc5nc4cc3[nH]1)C2 ZINC000587246671 GI Annotated Bother COc1ccc2c(c1)CC[C@](N)(c1nc3cc4nc5ccccc5nc4cc3[nH]1)C2 ZINC000587246674 GI Annotated Bother Cc1nc2[nH]c(-c3ccc(NC(=O)C(C)(C)C)nc3)nc2cc1Br ZINC000587246678 GI Annotated Anodyne NCc1cccc(-c2nc3cc(OC(F)(F)F)c(Br)cc3[nH]2)c1 ZINC000587246861 GI Annotated Anodyne NCc1cccc(-c2nc3cc(Br)cc(OC(F)(F)F)c3[nH]2)c1 ZINC000587246941 GI Annotated Anodyne CC(C)(C)C(=O)Nc1ccc(-c2nc3cc(C#N)cc(Br)c3[nH]2)cn1 ZINC000587247068 GI Annotated Mild COc1ccc2c(c1)CC[C@](N)(c1nc3cc(F)cc(C(F)(F)F)c3[nH]1)C2 ZINC000587247520 GI Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3cc(F)cc(C(F)(F)F)c3[nH]1)C2 ZINC000587247522 GI Annotated Anodyne COc1ccc2c(c1)CC[C@](N)(c1nc3cccc(OCc4ccccc4)c3[nH]1)C2 ZINC000587247538 GI Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3cccc(OCc4ccccc4)c3[nH]1)C2 ZINC000587247541 GI Annotated Anodyne CC(C)(C)C(=O)Nc1ccc(-c2nc3ccc(Br)c(O)c3[nH]2)cn1 ZINC000587247550 GI Annotated Anodyne COc1ccc2c(c1)CC[C@@](N)(c1nc3c4cccnc4c4ncccc4c3[nH]1)C2 ZINC000587247649 GI Annotated Bother COc1ccc2c(c1)CC[C@](N)(c1nc3c4cccnc4c4ncccc4c3[nH]1)C2 ZINC000587247650 GI Annotated Bother COC(=O)c1ccnc2[nH]c(-c3cc4ccccc4cc3NC(=O)C(C)C)nc12 ZINC000587247793 GI Annotated Anodyne CC(C)(C)C(=O)Nc1ccc(-c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)cn1 ZINC000587247866 GI Annotated Anodyne CC(C)C(=O)Nc1cc2ccccc2cc1-c1nc2c(S)nc(S)nc2[nH]1 ZINC000587247889 GI Annotated Anodyne COC(=O)c1cc2nc(-c3cc4ccccc4cc3NC(=O)C(C)C)[nH]c2cn1 ZINC000587247912 GI Annotated Anodyne CC(C)C(=O)Nc1cc2ccccc2cc1-c1nc2cc([N+](=O)[O-])cnc2[nH]1 ZINC000587247935 GI Annotated Bother CC(C)Oc1cc2nc(-c3c(N)cccc3C(=O)O)[nH]c2cc1Br ZINC000587248091 GI Annotated Anodyne CCCOc1cc2nc(-c3c(N)cccc3C(=O)O)[nH]c2cc1Br ZINC000587248224 GI Annotated Anodyne CC(C)Oc1cc2nc(-c3cccc(N)c3C(=O)O)[nH]c2cc1Br ZINC000587248286 GI Annotated Anodyne N#Cc1cc(-c2nc3cc(Br)cc(C(F)(F)F)c3[nH]2)ccc1N ZINC000587248617 GI Annotated Mild N#Cc1cc(-c2nc3cc(C(F)(F)F)c(Br)cc3[nH]2)ccc1N ZINC000587248636 GI Annotated Mild N#Cc1cc(-c2nc3ccc(Br)c(C(F)(F)F)c3[nH]2)ccc1N ZINC000587248672 GI Annotated Mild N#Cc1cc(-c2nc3cc(C(F)(F)F)cc(Br)c3[nH]2)ccc1N ZINC000587248928 GI Annotated Mild Nc1cccc(O)c1-c1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000587249033 GI Annotated Anodyne N#Cc1cc(-c2nc3cc(Br)cc(OC(F)(F)F)c3[nH]2)ccc1N ZINC000587249082 GI Annotated Mild N=c1cc[nH]cc1-c1nc2cc(OCc3ccccc3)c(Br)cc2[nH]1 ZINC000587249165 GI Annotated Anodyne COC(=O)c1cc2nc(-c3c(N)cccc3O)[nH]c2c(F)c1Nc1ccccc1 ZINC000587249212 GI Annotated Anodyne Nc1cccc(O)c1-c1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000587249215 GI Annotated Anodyne CCCCCOc1cc2nc(-c3c[nH]ccc3=N)[nH]c2cc1Br ZINC000587249489 GI Annotated Anodyne Cc1ccc(CCc2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)cc1N ZINC000587249711 GI Annotated Clean Nc1cccc(O)c1-c1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587249803 GI Annotated Anodyne N#Cc1cc(-c2nc3cc(OC(F)(F)F)cc(Br)c3[nH]2)ccc1N ZINC000587250038 GI Annotated Mild N#Cc1cc(-c2nc3c(Br)ccc(Br)c3[nH]2)ccc1N ZINC000587250052 GI Annotated Mild CC(C)CCOc1cc2nc(-c3c[nH]ccc3=N)[nH]c2cc1Br ZINC000587250179 GI Annotated Anodyne CCCCOc1cc2nc(-c3c(N)cccc3O)[nH]c2cc1Br ZINC000587250320 GI Annotated Anodyne COc1ccc(-c2nnc(-c3ccc4nc(-c5c(N)cccc5O)[nH]c4c3)o2)cc1 ZINC000587250414 GI Annotated Anodyne N#Cc1cc(-c2nc3cc(OC(F)(F)F)c(Br)cc3[nH]2)ccc1N ZINC000587250604 GI Annotated Mild Nc1cccc(O)c1-c1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000587251138 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(/C=C/c3ccc(N)cc3)nc2c1 ZINC000587251418 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(/C=C\c3ccc(N)cc3)nc2c1 ZINC000587251419 GI Annotated Anodyne Nc1ccc(C(=O)CCc2nc3cc(Cl)cc(Br)c3[nH]2)cc1 ZINC000587251716 GI Annotated Anodyne Nc1ccc(C(=O)CCc2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)cc1 ZINC000587251769 GI Annotated Anodyne Nc1ccc(C(=O)CCc2nc3cc(Br)c(F)c(F)c3[nH]2)cc1 ZINC000587251860 GI Annotated Anodyne Nc1ccc(/C=C\c2nc3c(Br)cnc(Br)c3[nH]2)cc1 ZINC000587251948 GI Annotated Anodyne Nc1ccc(/C=C/c2nc3c(Br)cnc(Br)c3[nH]2)cc1 ZINC000587251950 GI Annotated Anodyne Nc1ccc(C(=O)CCc2nc3cc(Br)cc(Cl)c3[nH]2)cc1 ZINC000587252119 GI Annotated Anodyne Nc1cc(-c2nc3cc(Br)cc(C(=O)O)c3[nH]2)c2ccccc2c1 ZINC000587252149 GI Annotated Anodyne Nc1ccc2oc(-c3nc4cccc(I)c4[nH]3)cc2c1 ZINC000587252156 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(-c3cc4cc(N)ccc4o3)nc2c1 ZINC000587252235 GI Annotated Anodyne Nc1cc(-c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)c2ccccc2c1 ZINC000587252589 GI Annotated Anodyne COc1cncc(N)c1-c1nc2c(C(F)(F)F)cc(C(F)(F)F)cc2[nH]1 ZINC000587252788 GI Annotated Anodyne Nc1ccc2oc(-c3nc4ccc5c(c4[nH]3)C(=O)c3ccccc3C5=O)cc2c1 ZINC000587252846 GI Annotated Clean CCCCOc1cc2[nH]c(-c3c(N)cncc3OC)nc2cc1Br ZINC000587252848 GI Annotated Anodyne COc1cncc(N)c1-c1nc2cc(Br)c(OCC(C)C)cc2[nH]1 ZINC000587253041 GI Annotated Anodyne CC(C)CCOc1cc2nc(Cc3ccc(=N)[nH]c3)[nH]c2cc1Br ZINC000587253329 GI Annotated Anodyne CC(C)CCOc1cc2nc(Cc3cccnc3N)[nH]c2cc1Br ZINC000587253451 GI Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4c5cccnc5c5ncccc5c4[nH]3)c2)c[nH]1 ZINC000587253526 GI Annotated Bother N=c1ncc(-c2cccc(-c3nc4cc5nc6ccccc6nc5cc4[nH]3)c2)c[nH]1 ZINC000587253591 GI Annotated Bother CCCCCOc1cc2nc(Cc3ccc(=N)[nH]c3)[nH]c2cc1Br ZINC000587253679 GI Annotated Anodyne CC(C)CCOc1cc2nc(-c3cncc(N)c3)[nH]c2cc1Br ZINC000587253720 GI Annotated Anodyne Nc1c(-c2nc3[nH]c(O)nc(NCc4ccccc4)c-3n2)ccc2ccccc12 ZINC000587253809 GI Annotated Anodyne N=c1cc(-c2nc3cc(Br)c(F)c(F)c3[nH]2)c2ccccc2[nH]1 ZINC000587253893 GI Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4ccc(Oc5ccc(N)cc5)cc4[nH]3)c2)c[nH]1 ZINC000587254034 GI Annotated Clean Cc1c(Br)cc2nc(-c3cccc(-c4cnc(=N)[nH]c4)c3)[nH]c2c1C ZINC000587254089 GI Annotated Anodyne CCCCOc1cc2nc(Cc3cccnc3N)[nH]c2cc1Br ZINC000587254157 GI Annotated Anodyne Cc1c(Br)ccc2nc(-c3cccc(-c4cnc(=N)[nH]c4)c3)[nH]c12 ZINC000587254562 GI Annotated Anodyne N=c1cc(-c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c2ccccc2[nH]1 ZINC000587254684 GI Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4cc(Br)cc(F)c4[nH]3)c2)c[nH]1 ZINC000587254822 GI Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4cc(F)cc(Br)c4[nH]3)c2)c[nH]1 ZINC000587254831 GI Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4ccc(F)c(Br)c4[nH]3)c2)c[nH]1 ZINC000587254856 GI Annotated Anodyne Cc1cc(Br)c2[nH]c(-c3cccc(-c4cnc(=N)[nH]c4)c3)nc2c1 ZINC000587254861 GI Annotated Anodyne CCCCCOc1cc2nc(Cc3cccnc3N)[nH]c2cc1Br ZINC000587254864 GI Annotated Anodyne Cc1cc2nc(-c3cccc(-c4cnc(=N)[nH]c4)c3)[nH]c2cc1Br ZINC000587254874 GI Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4ccc(Br)c(F)c4[nH]3)c2)c[nH]1 ZINC000587254936 GI Annotated Anodyne N=c1ncc(-c2cccc(-c3nc4cc(Br)c(F)cc4[nH]3)c2)c[nH]1 ZINC000587255006 GI Annotated Anodyne Cc1cc(Br)cc2nc(-c3cccc(-c4cnc(=N)[nH]c4)c3)[nH]c12 ZINC000587255029 GI Annotated Anodyne NC1CC(Cc2nc3cc(OCc4ccccc4)c(Br)cc3[nH]2)C1 ZINC000587255423 GI Annotated Anodyne CC(C)(C)OC(=O)[C@H](N)CCc1nc2ccc(Sc3ccccc3)cc2[nH]1 ZINC000587255734 GI Annotated Anodyne NC1CCC(c2nc3cc(OC(F)(F)F)c(Br)cc3[nH]2)CC1 ZINC000587256021 GI Annotated Anodyne COc1ccc(-c2nnc(-c3ccc4nc(C5CCC(N)CC5)[nH]c4c3)o2)cc1 ZINC000587256872 GI Annotated Anodyne NC1CCC(c2nc3cc(OC(F)(F)F)cc(Br)c3[nH]2)CC1 ZINC000587256884 GI Annotated Anodyne COC(=O)c1cc2nc(C3CCC(N)CC3)[nH]c2c(F)c1Nc1ccccc1 ZINC000587256895 GI Annotated Anodyne NC1CCC(c2nc3cc(Br)cc(OC(F)(F)F)c3[nH]2)CC1 ZINC000587256930 GI Annotated Anodyne CC(C)(C)OC(=O)[C@H](N)CCc1nc2c3ccccc3c3ccccc3c2[nH]1 ZINC000587257027 GI Annotated Bother C=CC[C@@](C)(N)c1nc2ccc(-c3nnc(-c4ccc(OC)cc4)o3)cc2[nH]1 ZINC000587257797 GI Annotated Mild N[C@@H](Cc1nc2c(F)cnc(Br)c2[nH]1)c1cccc2ccccc12 ZINC000587258359 GI Annotated Anodyne Cc1nc2[nH]c(C[C@H](N)c3cccc4ccccc34)nc2cc1Br ZINC000587258731 GI Annotated Anodyne N[C@@H](Cc1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1)c1cccc2ccccc12 ZINC000587258938 GI Annotated Anodyne N[C@@H](CCCNC(=O)OCc1ccccc1)c1nc2ccc3c(c2[nH]1)CCCC3 ZINC000587259363 GI Annotated Anodyne COc1ccc(-c2nnc(-c3ccc4nc([C@@H](N)C(C)(C)C)[nH]c4c3)o2)cc1 ZINC000587259498 GI Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc(CCCCCCN=[N+]=[N-])[nH]c2c1 ZINC000587259595 GI Annotated Clean COC(=O)c1cc(Cl)c2[nH]c(C[C@H](N)c3cccc4ccccc34)nc2c1 ZINC000587259607 GI Annotated Anodyne Cc1c(Br)cnc2[nH]c(C[C@H](N)c3cccc4ccccc34)nc12 ZINC000587259619 GI Annotated Anodyne N[C@@H](Cc1nc2ccc(Br)c(O)c2[nH]1)c1cccc2ccccc12 ZINC000587259679 GI Annotated Anodyne [N-]=[N+]=NCCCCCCc1nc2ccc(S(=O)(=O)C(F)(F)F)cc2[nH]1 ZINC000587259942 GI Annotated Clean NC(=O)c1cccc(C[C@H](N)c2nc3ccc(Sc4ccccc4)cc3[nH]2)c1 ZINC000587260706 GI Annotated Anodyne COc1cc(-c2nc3cc(F)cc(C(F)(F)F)c3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587260742 GI Annotated Bother COc1cc(-c2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587260743 GI Annotated Mild COc1cc(-c2nc3cc(Br)cc(C)c3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587260752 GI Annotated Bother Cc1c(-c2nc3cccc(I)c3[nH]2)cccc1[N+](=O)[O-] ZINC000587260771 GI Annotated Bother COc1cc(-c2nc3cc(Br)c(F)cc3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587260787 GI Annotated Bother Cc1c(-c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)cccc1[N+](=O)[O-] ZINC000587260794 GI Annotated Bother COc1cc(-c2nc3cc(C)cc(Br)c3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587260811 GI Annotated Bother COc1cc(-c2nc3cc(F)cc(Br)c3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587260822 GI Annotated Bother COc1cc(-c2nc3cccc(OC(F)(F)F)c3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587260898 GI Annotated Bother COc1cc(-c2nc3ccc(Br)c(F)c3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587260937 GI Annotated Bother COc1cc(-c2nc3ccc(Br)c(C)c3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587260996 GI Annotated Bother Cc1c(-c2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)cccc1[N+](=O)[O-] ZINC000587261037 GI Annotated Clean COc1cc(-c2nc3ccc(F)c(Br)c3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587261131 GI Annotated Bother COc1cc(-c2nc3cc(Br)cc(F)c3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587261180 GI Annotated Bother COc1cc(-c2nc3cc(C)c(Br)cc3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587261205 GI Annotated Bother COc1cc(-c2nc3cc(C(F)(F)F)c(F)cc3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587261207 GI Annotated Bother COc1cc(-c2nc3ccc(OC(F)(F)F)cc3[nH]2)c(OC)c([N+](=O)[O-])c1 ZINC000587261231 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC000587261448 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2ccc(Cl)cc2[nH]1 ZINC000587261455 GI Annotated Bother Cc1ccc([N+](=O)[O-])c(OCCc2nc3cc4nc5ccccc5nc4cc3[nH]2)c1 ZINC000587261464 GI Annotated Bother Cc1ccc([N+](=O)[O-])c(OCCc2nc3cccc(OC(F)(F)F)c3[nH]2)c1 ZINC000587261478 GI Annotated Bother Cc1cc(C#Cc2nc3ccc(C(=O)c4ccccc4)cc3[nH]2)ccc1[N+](=O)[O-] ZINC000587261593 GI Annotated Mild Cc1ccc([N+](=O)[O-])c(OCCc2nc3cc(F)cc(Br)c3[nH]2)c1 ZINC000587261641 GI Annotated Bother Cc1ccc([N+](=O)[O-])c(OCCc2nc3ccc(OC(F)(F)F)cc3[nH]2)c1 ZINC000587261644 GI Annotated Bother Cc1ccc([N+](=O)[O-])c(OCCc2nc3cc(C)cc(Br)c3[nH]2)c1 ZINC000587261832 GI Annotated Bother Cc1cc(C#Cc2nc3cc(Br)c(F)c(F)c3[nH]2)ccc1[N+](=O)[O-] ZINC000587261940 GI Annotated Mild Cc1cc(C#Cc2nc3c4cccnc4c4ncccc4c3[nH]2)ccc1[N+](=O)[O-] ZINC000587262023 GI Annotated Mild COCCNc1ccc(-c2nc3cc(Cl)c(F)c(F)c3[nH]2)cc1[N+](=O)[O-] ZINC000587262080 GI Annotated Bother Cc1cc(C#Cc2nc3ccc(-c4ccc(N)c(N)c4)cc3[nH]2)ccc1[N+](=O)[O-] ZINC000587262102 GI Annotated Mild Cc1cc(C#Cc2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)ccc1[N+](=O)[O-] ZINC000587262138 GI Annotated Mild CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cc(F)cc(F)c2[nH]1 ZINC000587262220 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cc(F)cc(F)c2[nH]1 ZINC000587262221 GI Annotated Bother Cc1ccc([N+](=O)[O-])c(OCCc2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)c1 ZINC000587262305 GI Annotated Mild COCCNc1ccc(-c2nc3cccc(C(F)(F)F)c3[nH]2)cc1[N+](=O)[O-] ZINC000587262321 GI Annotated Bother Cc1ccc([N+](=O)[O-])c(OCCc2nc3ccc(Br)c(F)c3[nH]2)c1 ZINC000587262400 GI Annotated Bother COCCNc1ccc(-c2nc3cc(F)cc(C(F)(F)F)c3[nH]2)cc1[N+](=O)[O-] ZINC000587262496 GI Annotated Bother COCCNc1ccc(-c2nc3cccc(OC(F)(F)F)c3[nH]2)cc1[N+](=O)[O-] ZINC000587262513 GI Annotated Bother Cc1ccc([N+](=O)[O-])c(OCCc2nc3cccc(Br)c3[nH]2)c1 ZINC000587262691 GI Annotated Bother Cc1ccc([N+](=O)[O-])c(OCCc2nc3ccc(Br)c(C)c3[nH]2)c1 ZINC000587262836 GI Annotated Bother Cc1cc(C#Cc2nc3cc4nc5ccccc5nc4cc3[nH]2)ccc1[N+](=O)[O-] ZINC000587262860 GI Annotated Mild C[C@@H]1CC(=O)[C@@H](Cc2nc3ccc(Oc4ccccc4)cc3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587262954 GI Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3ccc(Oc4ccccc4)cc3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587262957 GI Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3ccc(Oc4ccccc4)cc3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587262959 GI Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3ccc(Oc4ccccc4)cc3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587262960 GI Annotated Bother COc1cc(OCc2nc3cc(C)cc(Br)c3[nH]2)ccc1[N+](=O)[O-] ZINC000587263080 GI Annotated Bother COc1cc(OCc2nc3cc(F)cc(C(F)(F)F)c3[nH]2)ccc1[N+](=O)[O-] ZINC000587263092 GI Annotated Bother COc1cc(OCc2nc3cc(C(F)(F)F)c(F)cc3[nH]2)ccc1[N+](=O)[O-] ZINC000587263178 GI Annotated Bother COc1cc(OCc2nc3cc(Br)cc(C)c3[nH]2)ccc1[N+](=O)[O-] ZINC000587263283 GI Annotated Bother COc1cc(OCc2nc3ccc(Br)c(C)c3[nH]2)ccc1[N+](=O)[O-] ZINC000587263591 GI Annotated Bother O=[N+]([O-])c1ccc(Cc2nc3cc(C(F)(F)F)c(F)cc3[nH]2)c([N+](=O)[O-])c1 ZINC000587263698 GI Annotated Bother COc1cc(OCc2nc3cc(C)c(Br)cc3[nH]2)ccc1[N+](=O)[O-] ZINC000587263724 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cc(C)cc(F)c2[nH]1 ZINC000587263904 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cc(C)cc(F)c2[nH]1 ZINC000587263906 GI Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3ccc(Sc4ccccc4)cc3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587263988 GI Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3ccc(Sc4ccccc4)cc3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587263989 GI Annotated Bother C[C@@H]1CC(=O)[C@@H](Cc2nc3ccc(Sc4ccccc4)cc3[nH]2)[C@@H]1C[N+](=O)[O-] ZINC000587263990 GI Annotated Bother C[C@@H]1CC(=O)[C@H](Cc2nc3ccc(Sc4ccccc4)cc3[nH]2)[C@H]1C[N+](=O)[O-] ZINC000587263991 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2ccc(C(C)=O)cc2[nH]1 ZINC000587264019 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2ccc(C(C)=O)cc2[nH]1 ZINC000587264020 GI Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cc(Cl)c(F)cc2[nH]1 ZINC000587264102 GI Annotated Bother O=[N+]([O-])c1ccccc1-c1ccc(-c2nc3nc(C(F)(F)F)ncc3[nH]2)o1 ZINC000587264133 GI Annotated Bother COC(=O)c1ccc2[nH]c(-c3ccc(-c4ccccc4[N+](=O)[O-])o3)nc2c1OC ZINC000587264139 GI Annotated Bother N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2ccc(SC(F)(F)F)cc2[nH]1 ZINC000587264165 GI Annotated Bother O=[N+]([O-])c1ccccc1-c1ccc(-c2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)o1 ZINC000587264171 GI Annotated Bother COC(=O)c1cc2nc(-c3ccc(-c4ccccc4[N+](=O)[O-])o3)[nH]c2cc1OC ZINC000587264285 GI Annotated Bother N[C@@H](Cc1ccc(O)c([N+](=O)[O-])c1)c1nc2ccc(Oc3ccccc3)cc2[nH]1 ZINC000587264338 GI Annotated Bother Cc1cc2nc(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[nH]c2cc1Br ZINC000587264368 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cc(C)c(F)cc2[nH]1 ZINC000587264400 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cc(C)c(F)cc2[nH]1 ZINC000587264401 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2ccc(C)c(C)c2[nH]1 ZINC000587264402 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2ccc(C)c(C)c2[nH]1 ZINC000587264403 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cc(C)cc(C)c2[nH]1 ZINC000587264404 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cc(C)cc(C)c2[nH]1 ZINC000587264405 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cc(OC)c(C)cc2[nH]1 ZINC000587264436 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cc(OC)c(C)cc2[nH]1 ZINC000587264437 GI Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cnc3ccccc3c2[nH]1 ZINC000587264474 GI Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2ccc3ncccc3c2[nH]1 ZINC000587264501 GI Annotated Bother Cc1nn(Cc2ccccc2-c2nc3cncc(Cl)c3[nH]2)c(C)c1[N+](=O)[O-] ZINC000587264514 GI Annotated Bother Cc1c(Br)ccc2nc(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[nH]c12 ZINC000587264526 GI Annotated Bother Cc1cc(Br)c2[nH]c(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])nc2c1 ZINC000587264609 GI Annotated Bother CN(C)CCOc1ccc2[nH]c(-c3ccc(-c4ccccc4[N+](=O)[O-])o3)nc2c1 ZINC000587264611 GI Annotated Bother Cc1nn(Cc2ccccc2-c2nc3cc(Cl)cnc3[nH]2)c(C)c1[N+](=O)[O-] ZINC000587264658 GI Annotated Bother Cc1cc(Br)cc2nc(Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[nH]c12 ZINC000587264659 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cc(F)c(F)cc2[nH]1 ZINC000587264753 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cc(F)c(F)cc2[nH]1 ZINC000587264754 GI Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2ccc3c(c2[nH]1)CCCC3 ZINC000587264970 GI Annotated Bother Cc1nn(Cc2ccccc2-c2nc3ccnc(Cl)c3[nH]2)c(C)c1[N+](=O)[O-] ZINC000587265057 GI Annotated Bother Cc1nn(Cc2ccccc2-c2nc3ccc(Cl)nc3[nH]2)c(C)c1[N+](=O)[O-] ZINC000587265128 GI Annotated Bother Cc1nn(Cc2ccccc2-c2nc3cc(Cl)ncc3[nH]2)c(C)c1[N+](=O)[O-] ZINC000587265139 GI Annotated Bother COCCOc1ccc(-c2nc3cccc(OC(F)(F)F)c3[nH]2)cc1[N+](=O)[O-] ZINC000587265203 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2ccc(F)c(C)c2[nH]1 ZINC000587265318 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2ccc(F)c(C)c2[nH]1 ZINC000587265319 GI Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cc(Cl)c(F)c(F)c2[nH]1 ZINC000587265579 GI Annotated Bother Cc1nn(Cc2ccccc2-c2nc3c(Cl)ccnc3[nH]2)c(C)c1[N+](=O)[O-] ZINC000587265591 GI Annotated Bother Cc1nn(Cc2ccccc2-c2nc3c(C)cnc(Cl)c3[nH]2)c(C)c1[N+](=O)[O-] ZINC000587265718 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2c(C)ccc(C)c2[nH]1 ZINC000587265745 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2c(C)ccc(C)c2[nH]1 ZINC000587265748 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cc(C)c(C)cc2[nH]1 ZINC000587265750 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cc(C)c(C)cc2[nH]1 ZINC000587265755 GI Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cc(Cl)cc(F)c2[nH]1 ZINC000587265760 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2cccc(Cl)c2[nH]1 ZINC000587265772 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2cccc(Cl)c2[nH]1 ZINC000587265779 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2ccc(F)c(F)c2[nH]1 ZINC000587265785 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2ccc(F)c(F)c2[nH]1 ZINC000587265791 GI Annotated Bother Cc1ccc2c(ccc3nc([C@H](C)Nc4ccc([N+](=O)[O-])cc4[N+](=O)[O-])[nH]c32)n1 ZINC000587265899 GI Annotated Bother COCCNc1ccc(-c2nc3ccc4nc(C)ccc4c3[nH]2)cc1[N+](=O)[O-] ZINC000587265915 GI Annotated Bother O=[N+]([O-])c1ccc(Cc2nc3cc(F)cc(C(F)(F)F)c3[nH]2)c([N+](=O)[O-])c1 ZINC000587265940 GI Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2ccc(C(C)(C)C)nc2[nH]1 ZINC000587265945 GI Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2c(F)c(F)c(F)c(F)c2[nH]1 ZINC000587266163 GI Annotated Bother CC(C)Oc1ccc2nc([C@H](C)Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[nH]c2c1 ZINC000587266199 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@H](C)c1nc2ccc(CC)cc2[nH]1 ZINC000587266268 GI Annotated Bother CCOc1cc(C=O)cc([N+](=O)[O-])c1O[C@@H](C)c1nc2ccc(CC)cc2[nH]1 ZINC000587266270 GI Annotated Bother COCCOc1ccc(-c2nc3cccc(C(F)(F)F)c3[nH]2)cc1[N+](=O)[O-] ZINC000587266425 GI Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cc(Cl)c(Cl)nc2[nH]1 ZINC000587266653 GI Annotated Bother COc1cc2nc([C@H](C)Nc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])[nH]c2cc1Cl ZINC000587266856 GI Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2cc(Cl)cc(Br)c2[nH]1 ZINC000587266887 GI Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2cc(Cl)cc(Br)c2[nH]1 ZINC000587266888 GI Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cc(C#N)cc(Cl)c2[nH]1 ZINC000587266924 GI Annotated Mild Cc1cc(F)c2[nH]c(-c3ccccc3Cn3nc(C)c([N+](=O)[O-])c3C)nc2c1 ZINC000587266979 GI Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2cc(OC(F)(F)F)c(Cl)cc2[nH]1 ZINC000587267039 GI Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2cc(OC(F)(F)F)c(Cl)cc2[nH]1 ZINC000587267040 GI Annotated Bother Cc1cc2nc(-c3ccccc3Cn3nc(C)c([N+](=O)[O-])c3C)[nH]c2cc1F ZINC000587267093 GI Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2cc(Cl)nc(Cl)c2[nH]1 ZINC000587267127 GI Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2c(Cl)cnc(Cl)c2[nH]1 ZINC000587267129 GI Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2cc(Br)cc(Cl)c2[nH]1 ZINC000587267209 GI Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2cc(Br)cc(Cl)c2[nH]1 ZINC000587267210 GI Annotated Bother Cc1nn(Cc2ccccc2-c2nc3cc(F)cc(F)c3[nH]2)c(C)c1[N+](=O)[O-] ZINC000587267213 GI Annotated Bother COc1ccc2nc(-c3ccccc3Cn3nc(C)c([N+](=O)[O-])c3C)[nH]c2c1 ZINC000587267218 GI Annotated Bother C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1nc2c(Cl)c(Cl)cnc2[nH]1 ZINC000587267404 GI Annotated Bother Cc1nn(Cc2ccccc2-c2nc3ccc(F)c(F)c3[nH]2)c(C)c1[N+](=O)[O-] ZINC000587267528 GI Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2ccc(OCc3ccccc3)cc2[nH]1 ZINC000587267561 GI Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2ccc(OCc3ccccc3)cc2[nH]1 ZINC000587267562 GI Annotated Bother CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2ccc(C(=O)c3ccccc3)cc2[nH]1 ZINC000587267579 GI Annotated Bother Cc1cc2[nH]c(-c3ccccc3Cn3nc(C)c([N+](=O)[O-])c3C)nc2c(C)n1 ZINC000587267640 GI Annotated Bother CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2cc(Br)cc(Cl)c2[nH]1 ZINC000587267665 GI Annotated Bother Cc1c(Br)cc2nc(Cc3c([N+](=O)[O-])cnn3C(C)C)[nH]c2c1C ZINC000587267702 GI Annotated Bother Cc1nn(Cc2ccccc2-c2nc3cc(F)c(F)cc3[nH]2)c(C)c1[N+](=O)[O-] ZINC000587267734 GI Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@@H](C)c1nc2cccc(OCc3ccccc3)c2[nH]1 ZINC000587267768 GI Annotated Bother Cc1c([N+](=O)[O-])cnn1[C@H](C)c1nc2cccc(OCc3ccccc3)c2[nH]1 ZINC000587267769 GI Annotated Bother Cc1nn(Cc2ccccc2-c2nc3ccc(F)c(C)c3[nH]2)c(C)c1[N+](=O)[O-] ZINC000587267776 GI Annotated Bother COc1cc2nc(-c3ccccc3Cn3nc(C)c([N+](=O)[O-])c3C)[nH]c2cc1C ZINC000587267825 GI Annotated Bother CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2ccc(SC(F)(F)F)cc2[nH]1 ZINC000587267867 GI Annotated Bother COc1cc2nc(-c3ccccc3Cn3nc(C)c([N+](=O)[O-])c3C)[nH]c2cc1F ZINC000587267872 GI Annotated Bother CC(=O)c1ccc2nc(-c3ccccc3Cn3nc(C)c([N+](=O)[O-])c3C)[nH]c2c1 ZINC000587267895 GI Annotated Bother CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2cccc(OCc3ccccc3)c2[nH]1 ZINC000587267956 GI Annotated Bother CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2ccc(OCc3ccccc3)cc2[nH]1 ZINC000587268163 GI Annotated Bother COc1cccc2nc(-c3ccccc3Cn3nc(C)c([N+](=O)[O-])c3C)[nH]c12 ZINC000587268256 GI Annotated Bother CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2cc(Cl)cc(Br)c2[nH]1 ZINC000587268283 GI Annotated Bother Nc1ncc(-c2nc3cc(C(F)(F)F)cc(C(F)(F)F)c3[nH]2)cc1[N+](=O)[O-] ZINC000587268410 GI Annotated Bother CC(C)n1ncc([N+](=O)[O-])c1Cc1nc2ccc(Oc3ccc(N)cc3)cc2[nH]1 ZINC000587268456 GI Annotated Clean O=[N+]([O-])c1cccnc1NCc1nc2cc(OC(F)(F)F)c(Cl)cc2[nH]1 ZINC000587268676 GI Annotated Bother O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3c(F)c(F)c(F)c(F)c3[nH]2)c1 ZINC000587268756 GI Annotated Bother C=CCc1cccc2nc(C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)[nH]c12 ZINC000587268812 GI Annotated Mild O=[N+]([O-])c1cccc(-n2cc(-c3nc4cc(Cl)c(Cl)cc4[nH]3)nn2)c1 ZINC000587268920 GI Annotated Bother O=Cc1cc([N+](=O)[O-])ccc1OCc1nc2cc(C(F)(F)F)c(F)cc2[nH]1 ZINC000587268971 GI Annotated Bother O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3c(Cl)cnc(Cl)c3[nH]2)c1 ZINC000587269006 GI Annotated Bother O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3c(Cl)c(Cl)cnc3[nH]2)c1 ZINC000587269023 GI Annotated Bother O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3cc(Cl)nc(Cl)c3[nH]2)c1 ZINC000587269032 GI Annotated Bother O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3cc(Cl)c(Cl)nc3[nH]2)c1 ZINC000587269084 GI Annotated Bother Cc1cc(Cl)cc2nc(C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)[nH]c12 ZINC000587269188 GI Annotated Bother O=[N+]([O-])c1cccnc1NCc1nc2ccc(OCc3ccccc3)cc2[nH]1 ZINC000587269233 GI Annotated Bother O=C1CCc2cc3nc(-c4cncc(-c5cccc([N+](=O)[O-])c5)c4)[nH]c3cc2N1 ZINC000587269236 GI Annotated Bother Cc1cc2[nH]c(-c3cncc(-c4cccc([N+](=O)[O-])c4)c3)nc2cc1[N+](=O)[O-] ZINC000587269283 GI Annotated Bother O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3cc(C(F)(F)F)ncc3[nH]2)c1 ZINC000587269419 GI Annotated Bother O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3cc([N+](=O)[O-])c(Cl)cc3[nH]2)c1 ZINC000587269426 GI Annotated Bother O=Cc1cc([N+](=O)[O-])ccc1OCc1nc2ccc(SC(F)(F)F)cc2[nH]1 ZINC000587269494 GI Annotated Bother O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3cc(C(F)(F)F)cnc3[nH]2)c1 ZINC000587269530 GI Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cc(Br)cc(Cl)c2[nH]1 ZINC000587269531 GI Annotated Bother O=[N+]([O-])c1cccc(-c2cncc(-c3nc4cc5c(cc4[nH]3)OCCCO5)c2)c1 ZINC000587269568 GI Annotated Bother Cc1c(Cl)ccc2nc(C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)[nH]c12 ZINC000587269662 GI Annotated Bother Cc1cc(C)c2[nH]c(C3CCN(C(=O)c4ccc([N+](=O)[O-])cc4)CC3)nc2c1 ZINC000587269813 GI Annotated Bother O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3cc(-n4cccn4)c(F)cc3[nH]2)c1 ZINC000587269827 GI Annotated Bother N#Cc1nc(Cl)cc2nc(-c3cncc(-c4cccc([N+](=O)[O-])c4)c3)[nH]c12 ZINC000587269851 GI Annotated Mild O=[N+]([O-])c1ccc(N2CCCC2)c(-c2nc3cc4c(cc3[nH]2)OC(F)(F)O4)c1 ZINC000587269861 GI Annotated Bother COc1cc(OC)c2[nH]c(-c3cncc(-c4cccc([N+](=O)[O-])c4)c3)nc2c1 ZINC000587269887 GI Annotated Bother O=[N+]([O-])c1cccc(-c2cncc(-c3nc4ccnc(Br)c4[nH]3)c2)c1 ZINC000587269913 GI Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cc(C(F)(F)F)c(Cl)cc2[nH]1 ZINC000587270038 GI Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2ccc(SC(F)(F)F)cc2[nH]1 ZINC000587270039 GI Annotated Bother O=[N+]([O-])c1cccc(-n2cc(-c3nc4cc(Cl)cc(Cl)c4[nH]3)nn2)c1 ZINC000587270127 GI Annotated Bother O=[N+]([O-])c1cccc(CCc2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)c1 ZINC000587270242 GI Annotated Bother O=[N+]([O-])c1cccc(CCc2nc3c(Cl)c(Br)cnc3[nH]2)c1 ZINC000587270255 GI Annotated Bother O=C(O)c1cc(F)cc2nc(-c3cncc(-c4cccc([N+](=O)[O-])c4)c3)[nH]c12 ZINC000587270277 GI Annotated Bother O=[N+]([O-])c1cccc(-c2cncc(-c3nc4cc([N+](=O)[O-])c(F)cc4[nH]3)c2)c1 ZINC000587270302 GI Annotated Bother O=[N+]([O-])c1cccc(-c2cncc(-c3nc4cncc(Br)c4[nH]3)c2)c1 ZINC000587270404 GI Annotated Bother O=Cc1cc([N+](=O)[O-])ccc1OCc1nc2cc(F)cc(C(F)(F)F)c2[nH]1 ZINC000587270491 GI Annotated Bother O=[N+]([O-])c1cccc(CCc2nc3cc(Br)c(F)c(F)c3[nH]2)c1 ZINC000587270640 GI Annotated Bother O=[N+]([O-])c1cccc(CCc2nc3c(Br)cnc(Cl)c3[nH]2)c1 ZINC000587270708 GI Annotated Bother O=[N+]([O-])c1cccc(-c2cncc(-c3nc4ccc(Br)nc4[nH]3)c2)c1 ZINC000587270842 GI Annotated Bother O=[N+]([O-])c1cccc(-c2cncc(-c3nc4c(Br)ccnc4[nH]3)c2)c1 ZINC000587270892 GI Annotated Bother Cc1c(Br)cc2nc([C@@H](N)Cc3ccc([N+](=O)[O-])cc3)[nH]c2c1C ZINC000587270915 GI Annotated Bother O=C1c2ccccc2C(=O)c2c1ccc1nc(CCc3cccc([N+](=O)[O-])c3)[nH]c21 ZINC000587270941 GI Annotated Clean N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cc(Cl)cc(Br)c2[nH]1 ZINC000587270948 GI Annotated Bother O=[N+]([O-])c1cccc(-c2cncc(-c3nc4cc(Br)cnc4[nH]3)c2)c1 ZINC000587270981 GI Annotated Bother N[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc2cc(C(F)(F)F)cc(Cl)c2[nH]1 ZINC000587271017 GI Annotated Bother Nc1ccc(Oc2ccc3nc([C@@H](N)Cc4ccc([N+](=O)[O-])cc4)[nH]c3c2)cc1 ZINC000587271033 GI Annotated Clean O=[N+]([O-])c1ccc(Oc2cccc(-c3nc4c(S)nc(S)nc4[nH]3)c2)cc1 ZINC000587271312 GI Annotated Bother Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3c(Cl)ncnc3[nH]1)[C@@H]1CC=C[C@@H]21 ZINC000587271737 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3c(Cl)ncnc3[nH]1)[C@H]1CC=C[C@H]21 ZINC000587271739 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3c(Cl)ncnc3[nH]1)[C@H]1CC=C[C@@H]21 ZINC000587271744 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3c(Cl)ncnc3[nH]1)[C@@H]1CC=C[C@H]21 ZINC000587271748 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3nc(Cl)c[nH]c-3n1)[C@@H]1CC=C[C@@H]21 ZINC000587271813 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3nc(Cl)c[nH]c-3n1)[C@H]1CC=C[C@H]21 ZINC000587271814 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3nc(Cl)c[nH]c-3n1)[C@@H]1CC=C[C@H]21 ZINC000587271816 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3nc(Cl)c[nH]c-3n1)[C@H]1CC=C[C@@H]21 ZINC000587271817 GI Annotated Clean O=[N+]([O-])c1ccc(Oc2ccc(-c3nc4c(S)nc(S)nc4[nH]3)cc2)cc1 ZINC000587272592 GI Annotated Bother Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cnc(Cl)[nH]c-3n1)[C@@H]1CC=C[C@@H]21 ZINC000587272985 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cnc(Cl)[nH]c-3n1)[C@H]1CC=C[C@H]21 ZINC000587272987 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cnc(Cl)[nH]c-3n1)[C@@H]1CC=C[C@H]21 ZINC000587272990 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cnc(Cl)[nH]c-3n1)[C@H]1CC=C[C@@H]21 ZINC000587272992 GI Annotated Clean Cc1cc(C)c(CC(=O)c2c(CO)oc3cc(Br)cnc23)c(C)c1 ZINC000587273004 GI Annotated Anodyne C[C@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cc(OC(F)(F)F)c(Cl)cc2[nH]1 ZINC000587273012 GI Annotated Bother C[C@@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cc(OC(F)(F)F)c(Cl)cc2[nH]1 ZINC000587273013 GI Annotated Bother Cn1nc([N+](=O)[O-])cc1-c1nc2ccc(-c3nc4ccccc4s3)cc2[nH]1 ZINC000587273532 GI Annotated Bother C#CCC1(C(=O)c2c(CO)oc3cc(Br)cnc23)CCCCC1 ZINC000587273727 GI Annotated Mild O=C(c1c(CO)oc2cc(Br)cnc12)C12CC3CC(CC(C3)C1)C2 ZINC000587273870 GI Annotated Anodyne CC[C@@H](Oc1ccccc1)C(=O)c1c(CO)oc2cc(Br)cnc12 ZINC000587274138 GI Annotated Anodyne CC[C@H](Oc1ccccc1)C(=O)c1c(CO)oc2cc(Br)cnc12 ZINC000587274140 GI Annotated Anodyne C[C@@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cccc(OCc3ccccc3)c2[nH]1 ZINC000587274175 GI Annotated Bother C[C@H](Cn1cc([N+](=O)[O-])cn1)c1nc2cccc(OCc3ccccc3)c2[nH]1 ZINC000587274177 GI Annotated Bother O=C(c1c(CO)oc2cc(Br)cnc12)[C@@]12C[C@@H]3C[C@H]1C[C@@H](C3)C2 ZINC000587274363 GI Annotated Anodyne O=[N+]([O-])c1ccn(CCCc2nc3ccc(Sc4ccccc4)cc3[nH]2)n1 ZINC000587274704 GI Annotated Bother Cc1ncc([N+](=O)[O-])n1Cc1nc2ccc(-c3nc4ccccc4s3)cc2[nH]1 ZINC000587274814 GI Annotated Bother Cc1ncc([N+](=O)[O-])n1Cc1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1 ZINC000587274903 GI Annotated Bother C[C@@H](c1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587275293 GI Annotated Bother C[C@H](c1nc2cc(C(F)(F)F)cc(C(F)(F)F)c2[nH]1)n1cc([N+](=O)[O-])cn1 ZINC000587275294 GI Annotated Bother Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc4cn[nH]c4cc3[nH]1)[C@H]1CC=C[C@@H]21 ZINC000587275299 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc4cn[nH]c4cc3[nH]1)[C@@H]1CC=C[C@@H]21 ZINC000587275300 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc4cn[nH]c4cc3[nH]1)[C@@H]1CC=C[C@H]21 ZINC000587275301 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc4cn[nH]c4cc3[nH]1)[C@H]1CC=C[C@H]21 ZINC000587275302 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3ccc(CO)cc3[nH]1)[C@H]1CC=C[C@H]21 ZINC000587275371 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3ccc(CO)cc3[nH]1)[C@@H]1CC=C[C@H]21 ZINC000587275372 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3ccc(CO)cc3[nH]1)[C@H]1CC=C[C@@H]21 ZINC000587275373 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3ccc(CO)cc3[nH]1)[C@@H]1CC=C[C@@H]21 ZINC000587275374 GI Annotated Clean Cc1cc(Cl)cc(C(=O)c2c(CO)oc3cc(Br)cnc23)c1 ZINC000587275425 GI Annotated Anodyne O=C(c1cccc(F)c1Cl)c1c(CO)oc2cc(Br)cnc12 ZINC000587275446 GI Annotated Anodyne O=C(/C=C/c1ccccc1F)c1c(CO)oc2cc(Br)cnc12 ZINC000587275494 GI Annotated Mild O=C(c1cc2c(s1)CCCC2)c1c(CO)oc2cc(Br)cnc12 ZINC000587275507 GI Annotated Anodyne O=C(c1ccc(CCl)cc1)c1c(CO)oc2cc(Br)cnc12 ZINC000587275529 GI Annotated Reactive O=C(c1cc2ncc(Br)cn2n1)c1coc2ccc(Cl)cc12 ZINC000587275542 GI Annotated Anodyne COc1ccc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@@H]4C=CC[C@@H]43)[nH]c2n1 ZINC000587275553 GI Annotated Clean COc1ccc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@@H]4C=CC[C@H]43)[nH]c2n1 ZINC000587275555 GI Annotated Clean COc1ccc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@H]4C=CC[C@H]43)[nH]c2n1 ZINC000587275556 GI Annotated Clean COc1ccc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@H]4C=CC[C@@H]43)[nH]c2n1 ZINC000587275558 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cccc(C(=O)O)c3[nH]1)[C@H]1CC=C[C@H]21 ZINC000587275575 GI Annotated Clean O=C(c1ccc2ccccc2c1)c1c(CO)oc2cc(Br)cnc12 ZINC000587275576 GI Annotated Anodyne Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cccc(C(=O)O)c3[nH]1)[C@H]1CC=C[C@@H]21 ZINC000587275581 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cccc(C(=O)O)c3[nH]1)[C@@H]1CC=C[C@H]21 ZINC000587275583 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cccc(C(=O)O)c3[nH]1)[C@@H]1CC=C[C@@H]21 ZINC000587275586 GI Annotated Clean Cc1csc(Cl)c1C(=O)c1c(CO)oc2cc(Br)cnc12 ZINC000587275597 GI Annotated Anodyne O=C(c1ccccc1CCl)c1c(CO)oc2cc(Br)cnc12 ZINC000587275605 GI Annotated Reactive O=C(c1ccc(Cl)cc1F)c1c(CO)oc2cc(Br)cnc12 ZINC000587275752 GI Annotated Anodyne O=C(c1c(CO)oc2cc(Br)cnc12)[C@@H](Cl)c1ccccc1 ZINC000587275774 GI Annotated Reactive O=C(c1c(CO)oc2cc(Br)cnc12)[C@H](Cl)c1ccccc1 ZINC000587275778 GI Annotated Reactive O=C(c1cc(F)cc(Cl)c1)c1c(CO)oc2cc(Br)cnc12 ZINC000587275903 GI Annotated Anodyne O=C(c1cccc(CCl)c1)c1c(CO)oc2cc(Br)cnc12 ZINC000587275913 GI Annotated Reactive Cc1c(C(=O)c2c(CO)oc3cc(Br)cnc23)oc2ccccc12 ZINC000587275983 GI Annotated Anodyne O=C(Cc1ccccc1Cl)c1c(CO)oc2cc(Br)cnc12 ZINC000587276216 GI Annotated Anodyne COc1cc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@@H]4C=CC[C@@H]43)[nH]c2cn1 ZINC000587276273 GI Annotated Clean COc1cc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@@H]4C=CC[C@H]43)[nH]c2cn1 ZINC000587276274 GI Annotated Clean COc1cc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@H]4C=CC[C@@H]43)[nH]c2cn1 ZINC000587276276 GI Annotated Clean COc1cc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@H]4C=CC[C@H]43)[nH]c2cn1 ZINC000587276278 GI Annotated Clean COc1cncc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@@H]4C=CC[C@@H]43)[nH]c12 ZINC000587276284 GI Annotated Clean COc1cncc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@@H]4C=CC[C@H]43)[nH]c12 ZINC000587276286 GI Annotated Clean COc1cncc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@H]4C=CC[C@H]43)[nH]c12 ZINC000587276288 GI Annotated Clean O=C(c1cccc2ccccc12)c1c(CO)oc2cc(Br)cnc12 ZINC000587276289 GI Annotated Anodyne COc1cncc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@H]4C=CC[C@@H]43)[nH]c12 ZINC000587276291 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3ccc(C(=O)O)cc3[nH]1)[C@@H]1CC=C[C@H]21 ZINC000587276296 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3ccc(C(=O)O)cc3[nH]1)[C@@H]1CC=C[C@@H]21 ZINC000587276299 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3ccc(C(=O)O)cc3[nH]1)[C@H]1CC=C[C@H]21 ZINC000587276302 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3ccc(C(=O)O)cc3[nH]1)[C@H]1CC=C[C@@H]21 ZINC000587276303 GI Annotated Clean CCCOc1cccc(C(=O)c2c(CO)oc3cc(Br)cnc23)c1 ZINC000587276323 GI Annotated Anodyne Cc1ccc(Cl)c(C(=O)c2c(CO)oc3cc(Br)cnc23)c1 ZINC000587276367 GI Annotated Anodyne O=C(/C=C/c1cccc(F)c1)c1c(CO)oc2cc(Br)cnc12 ZINC000587276447 GI Annotated Mild O=C(c1nn2cccnc2c1Br)c1coc2ccc(Cl)cc12 ZINC000587276455 GI Annotated Anodyne O=C(c1ccc(F)cc1Cl)c1c(CO)oc2cc(Br)cnc12 ZINC000587276457 GI Annotated Anodyne O=C(c1cc(F)ccc1Cl)c1c(CO)oc2cc(Br)cnc12 ZINC000587276502 GI Annotated Anodyne O=C(c1c(CO)oc2cc(Br)cnc12)C1(c2ccc(F)cc2)CC1 ZINC000587276524 GI Annotated Anodyne Cc1ccc(Cl)c(C(=O)c2c(CO)oc3cc(Br)cnc23)c1F ZINC000587276529 GI Annotated Anodyne Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3ccc(CCO)cc3[nH]1)[C@@H]1CC=C[C@H]21 ZINC000587276535 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3ccc(CCO)cc3[nH]1)[C@H]1CC=C[C@H]21 ZINC000587276537 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3ccc(CCO)cc3[nH]1)[C@H]1CC=C[C@@H]21 ZINC000587276540 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3ccc(CCO)cc3[nH]1)[C@@H]1CC=C[C@@H]21 ZINC000587276541 GI Annotated Clean Cc1cc(Cl)ccc1C(=O)c1c(CO)oc2cc(Br)cnc12 ZINC000587276610 GI Annotated Anodyne Cc1c(Cl)cccc1C(=O)c1c(CO)oc2cc(Br)cnc12 ZINC000587276631 GI Annotated Anodyne Cc1ccc(C(=O)c2c(CO)oc3cc(Br)cnc23)cc1Cl ZINC000587276668 GI Annotated Anodyne Cc1cccc(Cl)c1C(=O)c1c(CO)oc2cc(Br)cnc12 ZINC000587276695 GI Annotated Anodyne CSc1ccc(C(=O)c2c(CO)oc3cc(Br)cnc23)cc1 ZINC000587276733 GI Annotated Anodyne O=C(CSc1ccccc1)c1c(CO)oc2cc(Br)cnc12 ZINC000587276753 GI Annotated Anodyne O=C(/C=C/c1ccc(F)cc1)c1c(CO)oc2cc(Br)cnc12 ZINC000587276783 GI Annotated Mild O=C(c1cc(Cl)ccc1F)c1c(CO)oc2cc(Br)cnc12 ZINC000587276785 GI Annotated Anodyne O=C(c1cccc(Cl)c1F)c1c(CO)oc2cc(Br)cnc12 ZINC000587276821 GI Annotated Anodyne Cc1cccc(C(=O)c2c(CO)oc3cc(Br)cnc23)c1Cl ZINC000587276902 GI Annotated Anodyne O=C(c1ccc(F)c(Cl)c1)c1c(CO)oc2cc(Br)cnc12 ZINC000587276909 GI Annotated Anodyne Cc1ccc(F)c(C(=O)c2c(CO)oc3cc(Br)cnc23)c1Cl ZINC000587276932 GI Annotated Anodyne O=C(c1ccc(Cl)c(F)c1)c1c(CO)oc2cc(Br)cnc12 ZINC000587276972 GI Annotated Anodyne O=C(c1c(F)cccc1Cl)c1c(CO)oc2cc(Br)cnc12 ZINC000587277021 GI Annotated Anodyne O=C(CCc1ccc(F)cc1)c1c(CO)oc2cc(Br)cnc12 ZINC000587277031 GI Annotated Anodyne O=C(Cc1ccc(Cl)cc1)c1c(CO)oc2cc(Br)cnc12 ZINC000587277095 GI Annotated Anodyne COc1nccc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@H]4C=CC[C@@H]43)[nH]c12 ZINC000587277248 GI Annotated Clean COc1nccc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@@H]4C=CC[C@@H]43)[nH]c12 ZINC000587277249 GI Annotated Clean COc1nccc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@H]4C=CC[C@H]43)[nH]c12 ZINC000587277250 GI Annotated Clean COc1nccc2nc([C@@H]3Nc4c(C)cc([N+](=O)[O-])cc4[C@@H]4C=CC[C@H]43)[nH]c12 ZINC000587277251 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc4c(cc3[nH]1)OCO4)[C@@H]1CC=C[C@@H]21 ZINC000587277492 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc4c(cc3[nH]1)OCO4)[C@H]1CC=C[C@H]21 ZINC000587277493 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc4c(cc3[nH]1)OCO4)[C@@H]1CC=C[C@H]21 ZINC000587277494 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc4c(cc3[nH]1)OCO4)[C@H]1CC=C[C@@H]21 ZINC000587277495 GI Annotated Clean Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc(C#N)c(C#N)cc3[nH]1)[C@@H]1CC=C[C@H]21 ZINC000587277588 GI Annotated Mild Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc(C#N)c(C#N)cc3[nH]1)[C@H]1CC=C[C@H]21 ZINC000587277589 GI Annotated Mild Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc(C#N)c(C#N)cc3[nH]1)[C@H]1CC=C[C@@H]21 ZINC000587277590 GI Annotated Mild Cc1cc([N+](=O)[O-])cc2c1N[C@H](c1nc3cc(C#N)c(C#N)cc3[nH]1)[C@@H]1CC=C[C@@H]21 ZINC000587277591 GI Annotated Mild N#Cc1ccc2c(C(=O)c3c(F)cccc3I)coc2c1 ZINC000587277619 GI Annotated Mild N#Cc1ccc2c(C(=O)CCCS(=O)(=O)c3ccc(Cl)cc3)coc2c1 ZINC000587277708 GI Annotated Mild N#Cc1ccc2c(C(=O)c3cc4n(n3)C(C(F)F)=CC(=C3CC3)N4)coc2c1 ZINC000587277718 GI Annotated Mild COc1ccc(S(=O)(=O)CCC(=O)c2coc3ccc(Cl)cc23)cc1 ZINC000587277922 GI Annotated Anodyne N#Cc1ccc2c(C(=O)c3cc(I)ccc3F)coc2c1 ZINC000587277933 GI Annotated Mild O=C(c1ccc(S(=O)(=O)N2CCCC2)cc1)c1coc2ccc(Cl)cc12 ZINC000587277935 GI Annotated Anodyne N#Cc1ccc2c(C(=O)c3ccc4c(c3)C(=O)c3ccccc3C4=O)coc2c1 ZINC000587278627 GI Annotated Mild COc1cc(Br)ccc1C(=O)c1coc2cc([N+](=O)[O-])ccc12 ZINC000587278859 GI Annotated Bother O=C(c1cc([N+](=O)[O-])ccc1Br)c1coc2cc([N+](=O)[O-])ccc12 ZINC000587279020 GI Annotated Bother O=C1c2ccccc2C(=O)c2cc(C(=O)c3coc4cc([N+](=O)[O-])ccc34)ccc21 ZINC000587279323 GI Annotated Clean O=C(Cl)c1cc(C(=O)Cl)cc(C(=O)c2coc3cc([N+](=O)[O-])ccc23)c1 ZINC000587279737 GI Annotated Reactive Cc1cc(=O)oc2c(OCC(=O)c3coc4cc([N+](=O)[O-])ccc34)cccc12 ZINC000587279917 GI Annotated Bother O=C(c1coc2cc([N+](=O)[O-])ccc12)[C@@H](Br)CCBr ZINC000587279920 GI Annotated Reactive O=C(c1coc2cc([N+](=O)[O-])ccc12)[C@H](Br)CCBr ZINC000587279921 GI Annotated Reactive Cc1cncc(Oc2ccc(C(=O)c3coc4cc([N+](=O)[O-])ccc34)cc2)n1 ZINC000587279942 GI Annotated Bother COc1ccc(-n2ncc(C(=O)c3coc4cc([N+](=O)[O-])ccc34)c2C)cc1 ZINC000587279991 GI Annotated Bother O=C(c1ccccc1I)c1coc2cc([N+](=O)[O-])ccc12 ZINC000587280031 GI Annotated Bother O=C(c1coc2cc([N+](=O)[O-])ccc12)[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1 ZINC000587280219 GI Annotated Bother O=C(c1coc2cc([N+](=O)[O-])ccc12)[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1 ZINC000587280220 GI Annotated Bother Cc1ccc(S(=O)(=O)CCCC(=O)c2coc3cc([N+](=O)[O-])ccc23)cc1 ZINC000587280274 GI Annotated Bother O=C(c1cc2n(n1)C(C(F)F)=CC(=C1CC1)N2)c1coc2cc([N+](=O)[O-])ccc12 ZINC000587280323 GI Annotated Bother CSc1nc(Cl)c(C(=O)c2coc3cc([N+](=O)[O-])ccc23)c(Cl)n1 ZINC000587280352 GI Annotated Bother O=C(c1ccc(I)cc1)c1coc2cc([N+](=O)[O-])ccc12 ZINC000587280394 GI Annotated Bother O=C(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1coc2cc([N+](=O)[O-])ccc12 ZINC000587280430 GI Annotated Bother O=C(c1cccc(I)c1)c1coc2cc([N+](=O)[O-])ccc12 ZINC000587280444 GI Annotated Bother Cc1c(C(=O)c2coc3ccccc23)nnn1Cc1ccc(Br)cc1 ZINC000587280598 GI Annotated Anodyne O=C(c1ccc(S(=O)(=O)N2CCCCCC2)cc1)c1coc2ccccc12 ZINC000587280986 GI Annotated Anodyne CCCN(CCC)S(=O)(=O)c1ccc(C(=O)c2coc3ccccc23)cc1 ZINC000587281166 GI Annotated Anodyne O=C1c2ccc(O)cc2OC2(CC(CBr)C2)[C@@H]1c1ccc(F)cc1 ZINC000587319885 GI Annotated Reactive O=C1c2ccc(O)cc2OC2(CC(CBr)C2)[C@H]1c1ccc(F)cc1 ZINC000587319889 GI Annotated Reactive C[C@H](Br)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587322420 GI Annotated Reactive C[C@H](Br)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587322425 GI Annotated Reactive C[C@H](Br)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587322426 GI Annotated Reactive C[C@H](Br)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587322432 GI Annotated Reactive CC[C@@]1(CBr)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587322865 GI Annotated Reactive CC[C@]1(CBr)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587322868 GI Annotated Reactive CC[C@]1(CBr)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587322869 GI Annotated Reactive CC[C@@]1(CBr)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587322870 GI Annotated Reactive COC(C)(C)[C@]1(CCl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587324322 GI Annotated Reactive COC(C)(C)[C@@]1(CCl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587324324 GI Annotated Reactive COC(C)(C)[C@@]1(CCl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587324325 GI Annotated Reactive COC(C)(C)[C@]1(CCl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587324326 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@@](CBr)(C2CC2)[C@H]1c1ccc(F)cc1 ZINC000587324397 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@](CBr)(C2CC2)[C@@H]1c1ccc(F)cc1 ZINC000587324398 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@@](CBr)(C2CC2)[C@@H]1c1ccc(F)cc1 ZINC000587324399 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@](CBr)(C2CC2)[C@H]1c1ccc(F)cc1 ZINC000587324400 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@@](CCl)(C2CCOCC2)[C@@H]1c1ccc(F)cc1 ZINC000587325030 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@@](CCl)(C2CCOCC2)[C@H]1c1ccc(F)cc1 ZINC000587325036 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@](CCl)(C2CCOCC2)[C@H]1c1ccc(F)cc1 ZINC000587325038 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@](CCl)(C2CCOCC2)[C@@H]1c1ccc(F)cc1 ZINC000587325040 GI Annotated Reactive O=Cc1cc([C@]2(CCl)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c[nH]1 ZINC000587325432 GI Annotated Reactive O=Cc1cc([C@]2(CCl)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c[nH]1 ZINC000587325433 GI Annotated Reactive O=Cc1cc([C@@]2(CCl)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c[nH]1 ZINC000587325434 GI Annotated Reactive O=Cc1cc([C@@]2(CCl)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c[nH]1 ZINC000587325435 GI Annotated Reactive O=C1c2ccc(O)cc2OC2(CC(Br)C2)[C@H]1c1ccc(F)cc1 ZINC000587325543 GI Annotated Reactive O=C1c2ccc(O)cc2OC2(CC(Br)C2)[C@@H]1c1ccc(F)cc1 ZINC000587325544 GI Annotated Reactive Cn1cccc1[C@]1(CCl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587326543 GI Annotated Reactive Cn1cccc1[C@]1(CCl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587326547 GI Annotated Reactive Cn1cccc1[C@@]1(CCl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587326549 GI Annotated Reactive Cn1cccc1[C@@]1(CCl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587326551 GI Annotated Reactive Cc1cc([C@@]2(CCl)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)on1 ZINC000587326646 GI Annotated Reactive Cc1cc([C@]2(CCl)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)on1 ZINC000587326649 GI Annotated Reactive Cc1cc([C@]2(CCl)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)on1 ZINC000587326651 GI Annotated Reactive Cc1cc([C@@]2(CCl)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)on1 ZINC000587326653 GI Annotated Reactive Cn1ncc(Cl)c1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587326829 GI Annotated Anodyne Cn1ncc(Cl)c1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587326835 GI Annotated Anodyne Cn1ncc(Cl)c1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587326837 GI Annotated Anodyne Cn1ncc(Cl)c1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587326840 GI Annotated Anodyne C[C@]1(c2ccc(Cl)nn2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587326934 GI Annotated Anodyne C[C@@]1(c2ccc(Cl)nn2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587326938 GI Annotated Anodyne C[C@@]1(c2ccc(Cl)nn2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587326939 GI Annotated Anodyne C[C@]1(c2ccc(Cl)nn2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587326941 GI Annotated Anodyne C[C@]1(c2nccnc2Cl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587327129 GI Annotated Anodyne C[C@@]1(c2nccnc2Cl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587327131 GI Annotated Anodyne C[C@@]1(c2nccnc2Cl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587327132 GI Annotated Anodyne C[C@]1(c2nccnc2Cl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587327134 GI Annotated Anodyne CCO[C@@H]1C[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)[C@@H]1Cl ZINC000587327873 GI Annotated Reactive CCO[C@@H]1C[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)[C@H]1Cl ZINC000587327886 GI Annotated Reactive CCO[C@@H]1C[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[C@H]1Cl ZINC000587327887 GI Annotated Reactive CCO[C@@H]1C[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[C@@H]1Cl ZINC000587327890 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@](CO)(c2ccccc2Cl)[C@@H]1c1ccc(F)cc1 ZINC000587327960 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](CO)(c2ccccc2Cl)[C@@H]1c1ccc(F)cc1 ZINC000587327961 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@](CO)(c2ccccc2Cl)[C@H]1c1ccc(F)cc1 ZINC000587327962 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](CO)(c2ccccc2Cl)[C@H]1c1ccc(F)cc1 ZINC000587327963 GI Annotated Anodyne O=C[C@]1(c2cc(F)ccc2F)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587328062 GI Annotated Mild O=C[C@@]1(c2cc(F)ccc2F)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587328071 GI Annotated Mild O=C[C@]1(c2cc(F)ccc2F)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587328074 GI Annotated Mild O=C[C@@]1(c2cc(F)ccc2F)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587328077 GI Annotated Mild Cn1ccc([C@]2(CCl)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1 ZINC000587328094 GI Annotated Reactive Cn1ccc([C@]2(CCl)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1 ZINC000587328095 GI Annotated Reactive Cn1ccc([C@@]2(CCl)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1 ZINC000587328097 GI Annotated Reactive Cn1ccc([C@@]2(CCl)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1 ZINC000587328099 GI Annotated Reactive CCO/C=C\[C@]1(C(F)F)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587328732 GI Annotated Anodyne CCO/C=C/[C@]1(C(F)F)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587328734 GI Annotated Anodyne CCO/C=C/[C@]1(C(F)F)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587328736 GI Annotated Anodyne CCO/C=C\[C@]1(C(F)F)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587328738 GI Annotated Anodyne Cc1cc([C@@]2(C=O)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)ccc1F ZINC000587329229 GI Annotated Mild Cc1cc([C@]2(C=O)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)ccc1F ZINC000587329247 GI Annotated Mild Cc1cc([C@]2(C=O)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)ccc1F ZINC000587329250 GI Annotated Mild Cc1cc([C@@]2(C=O)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)ccc1F ZINC000587329253 GI Annotated Mild O=C1c2ccc(O)cc2O[C@@](CCl)(c2ccccn2)[C@@H]1c1ccc(F)cc1 ZINC000587329451 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@@](CCl)(c2ccccn2)[C@H]1c1ccc(F)cc1 ZINC000587329454 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@](CCl)(c2ccccn2)[C@H]1c1ccc(F)cc1 ZINC000587329456 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@](CCl)(c2ccccn2)[C@@H]1c1ccc(F)cc1 ZINC000587329457 GI Annotated Reactive Cc1oncc1[C@@]1(CCl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587330062 GI Annotated Reactive Cc1oncc1[C@]1(CCl)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587330063 GI Annotated Reactive Cc1oncc1[C@]1(CCl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587330064 GI Annotated Reactive Cc1oncc1[C@@]1(CCl)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587330066 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@](C[N+](=O)[O-])(c2ccccc2)[C@@H]1c1ccc(F)cc1 ZINC000587330358 GI Annotated Bother O=C1c2ccc(O)cc2O[C@@](C[N+](=O)[O-])(c2ccccc2)[C@@H]1c1ccc(F)cc1 ZINC000587330390 GI Annotated Bother O=C1c2ccc(O)cc2O[C@](C[N+](=O)[O-])(c2ccccc2)[C@H]1c1ccc(F)cc1 ZINC000587330393 GI Annotated Bother O=C1c2ccc(O)cc2O[C@@](C[N+](=O)[O-])(c2ccccc2)[C@H]1c1ccc(F)cc1 ZINC000587330411 GI Annotated Bother N=c1cc[nH]cc1[C@@]1(C2CC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587330546 GI Annotated Anodyne N=c1cc[nH]cc1[C@]1(C2CC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587330547 GI Annotated Anodyne N=c1cc[nH]cc1[C@]1(C2CC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587330548 GI Annotated Anodyne N=c1cc[nH]cc1[C@@]1(C2CC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587330549 GI Annotated Anodyne C[C@]1(c2cnc(Cl)cn2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587330743 GI Annotated Anodyne C[C@@]1(c2cnc(Cl)cn2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587330744 GI Annotated Anodyne C[C@@]1(c2cnc(Cl)cn2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587330746 GI Annotated Anodyne C[C@]1(c2cnc(Cl)cn2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587330747 GI Annotated Anodyne O=C[C@]1(c2ccc(F)c(F)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587331402 GI Annotated Mild O=C[C@@]1(c2ccc(F)c(F)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587331404 GI Annotated Mild O=C[C@]1(c2ccc(F)c(F)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587331409 GI Annotated Mild O=C[C@@]1(c2ccc(F)c(F)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587331411 GI Annotated Mild C[C@]1(c2ccc(N)c(C#N)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587331505 GI Annotated Mild C[C@@]1(c2ccc(N)c(C#N)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587331507 GI Annotated Mild C[C@@]1(c2ccc(N)c(C#N)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587331509 GI Annotated Mild C[C@]1(c2ccc(N)c(C#N)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587331510 GI Annotated Mild C[C@]1(c2ccc(N)c(O)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587331551 GI Annotated Anodyne C[C@@]1(c2ccc(N)c(O)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587331555 GI Annotated Anodyne C[C@]1(c2ccc(N)c(O)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587331557 GI Annotated Anodyne C[C@@]1(c2ccc(N)c(O)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587331558 GI Annotated Anodyne N#C[C@@H]1c2ccccc2C[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587331623 GI Annotated Mild N#C[C@@H]1c2ccccc2C[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587331628 GI Annotated Mild N#C[C@@H]1c2ccccc2C[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587331632 GI Annotated Mild N#C[C@@H]1c2ccccc2C[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587331634 GI Annotated Mild Cn1cc(Cl)c([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)n1 ZINC000587332020 GI Annotated Anodyne Cn1cc(Cl)c([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)n1 ZINC000587332023 GI Annotated Anodyne Cn1cc(Cl)c([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)n1 ZINC000587332027 GI Annotated Anodyne Cn1cc(Cl)c([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)n1 ZINC000587332030 GI Annotated Anodyne C[C@@]1(c2ncc(F)cc2F)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587332076 GI Annotated Anodyne C[C@]1(c2ncc(F)cc2F)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587332077 GI Annotated Anodyne C[C@]1(c2ncc(F)cc2F)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587332078 GI Annotated Anodyne C[C@@]1(c2ncc(F)cc2F)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587332079 GI Annotated Anodyne Cc1ccc([C@@]2(CN)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cc1 ZINC000587332185 GI Annotated Anodyne Cc1ccc([C@]2(CN)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cc1 ZINC000587332188 GI Annotated Anodyne Cc1ccc([C@]2(CN)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cc1 ZINC000587332190 GI Annotated Anodyne Cc1ccc([C@@]2(CN)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cc1 ZINC000587332192 GI Annotated Anodyne CN1[C@H]2CCC[C@@H]1C[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587332461 GI Annotated Anodyne CN1[C@H]2CCC[C@H]1CC1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587332475 GI Annotated Anodyne CN1[C@H]2CCC[C@@H]1C[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587332481 GI Annotated Anodyne CN1[C@H]2CCC[C@@H]1C[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587332483 GI Annotated Anodyne CN1[C@H]2CCC[C@H]1CC1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587332484 GI Annotated Anodyne CN1[C@H]2CCC[C@@H]1C[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587332493 GI Annotated Anodyne C[C@]1(c2cn3ccccc3n2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587332524 GI Annotated Anodyne C[C@@]1(c2cn3ccccc3n2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587332532 GI Annotated Anodyne C[C@@]1(c2cn3ccccc3n2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587332535 GI Annotated Anodyne C[C@]1(c2cn3ccccc3n2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587332536 GI Annotated Anodyne CN1CC[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[C@H]2CCC[C@H]21 ZINC000587332722 GI Annotated Anodyne CN1CC[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[C@@H]2CCC[C@@H]21 ZINC000587332724 GI Annotated Anodyne CN1CC[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[C@@H]2CCC[C@H]21 ZINC000587332727 GI Annotated Anodyne CN1CC[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[C@H]2CCC[C@@H]21 ZINC000587332732 GI Annotated Anodyne C=CC(=O)NC(C)(C)C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587332942 GI Annotated Anodyne C=CC(=O)NC(C)(C)C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587332947 GI Annotated Anodyne C=CC(=O)NC(C)(C)C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587332950 GI Annotated Anodyne C=CC(=O)NC(C)(C)C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587332953 GI Annotated Anodyne Nc1cccc2c1CC[C@@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587333150 GI Annotated Anodyne Nc1cccc2c1CC[C@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587333158 GI Annotated Anodyne Nc1cccc2c1CC[C@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587333159 GI Annotated Anodyne Nc1cccc2c1CC[C@@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587333162 GI Annotated Anodyne Nc1ccc2c(c1)[C@@]1(CCO2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587333777 GI Annotated Anodyne Nc1ccc2c(c1)[C@]1(CCO2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587333788 GI Annotated Anodyne Nc1ccc2c(c1)[C@]1(CCO2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587333790 GI Annotated Anodyne Nc1ccc2c(c1)[C@@]1(CCO2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587333791 GI Annotated Anodyne Nc1ccc2c(c1)CC[C@@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587333792 GI Annotated Anodyne Nc1ccc2c(c1)CC[C@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587333793 GI Annotated Anodyne Nc1ccc2c(c1)CC[C@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587333794 GI Annotated Anodyne Nc1ccc2c(c1)CC[C@@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587333795 GI Annotated Anodyne C[C@H](C#N)[C@]1(c2cccnc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587334315 GI Annotated Mild C[C@H](C#N)[C@@]1(c2cccnc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587334333 GI Annotated Mild C[C@H](C#N)[C@@]1(c2cccnc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587334336 GI Annotated Mild C[C@H](C#N)[C@]1(c2cccnc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587334337 GI Annotated Mild C[C@]1(c2cccc(O)c2N)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587334631 GI Annotated Anodyne C[C@@]1(c2cccc(O)c2N)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587334634 GI Annotated Anodyne C[C@]1(c2cccc(O)c2N)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587334637 GI Annotated Anodyne C[C@@]1(c2cccc(O)c2N)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587334640 GI Annotated Anodyne CCc1nccnc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587334679 GI Annotated Anodyne CCc1nccnc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587334687 GI Annotated Anodyne CCc1nccnc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587334690 GI Annotated Anodyne CCc1nccnc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587334691 GI Annotated Anodyne C[C@]1(c2cc(Cl)ncn2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587334842 GI Annotated Anodyne C[C@@]1(c2cc(Cl)ncn2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587334843 GI Annotated Anodyne C[C@@]1(c2cc(Cl)ncn2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587334844 GI Annotated Anodyne C[C@]1(c2cc(Cl)ncn2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587334845 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](CO)(Cc2ccc(F)cc2)[C@@H]1c1ccc(F)cc1 ZINC000587334904 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@](CO)(Cc2ccc(F)cc2)[C@@H]1c1ccc(F)cc1 ZINC000587334905 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@](CO)(Cc2ccc(F)cc2)[C@H]1c1ccc(F)cc1 ZINC000587334908 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](CO)(Cc2ccc(F)cc2)[C@H]1c1ccc(F)cc1 ZINC000587334911 GI Annotated Anodyne COc1cccnc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587334913 GI Annotated Anodyne COc1cccnc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587334918 GI Annotated Anodyne COc1cccnc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587334920 GI Annotated Anodyne COc1cccnc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587334923 GI Annotated Anodyne N#C[C@H](F)[C@@]1(c2ccco2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587335061 GI Annotated Mild N#C[C@H](F)[C@@]1(c2ccco2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587335071 GI Annotated Mild N#C[C@H](F)[C@]1(c2ccco2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587335076 GI Annotated Mild N#C[C@H](F)[C@]1(c2ccco2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587335081 GI Annotated Mild NC[C@]1(c2ccc(Cl)cc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587335162 GI Annotated Anodyne NC[C@@]1(c2ccc(Cl)cc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587335167 GI Annotated Anodyne NC[C@]1(c2ccc(Cl)cc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587335177 GI Annotated Anodyne NC[C@@]1(c2ccc(Cl)cc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587335183 GI Annotated Anodyne Cc1oc(N)c(C#N)c1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587335356 GI Annotated Mild Cc1oc(N)c(C#N)c1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587335358 GI Annotated Mild Cc1oc(N)c(C#N)c1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587335360 GI Annotated Mild Cc1oc(N)c(C#N)c1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587335362 GI Annotated Mild COc1cccc(C[C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)n1 ZINC000587335871 GI Annotated Anodyne COc1cccc(C[C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)n1 ZINC000587335876 GI Annotated Anodyne COc1cccc(C[C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)n1 ZINC000587335879 GI Annotated Anodyne COc1cccc(C[C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)n1 ZINC000587335882 GI Annotated Anodyne CC[C@]1(CC[C@H](C)[N+](=O)[O-])Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336056 GI Annotated Bother CC[C@]1(CC[C@H](C)[N+](=O)[O-])Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336061 GI Annotated Bother CC[C@]1(CC[C@@H](C)[N+](=O)[O-])Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336063 GI Annotated Bother CC[C@]1(CC[C@@H](C)[N+](=O)[O-])Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336064 GI Annotated Bother COc1ncccc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336121 GI Annotated Anodyne COc1ncccc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336123 GI Annotated Anodyne COc1ncccc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336125 GI Annotated Anodyne COc1ncccc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336128 GI Annotated Anodyne Cc1nc(O)ccc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336159 GI Annotated Anodyne Cc1nc(O)ccc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336160 GI Annotated Anodyne Cc1nc(O)ccc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336162 GI Annotated Anodyne Cc1nc(O)ccc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336163 GI Annotated Anodyne Nc1ccc2c(c1)[C@@]1(C=CO2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336475 GI Annotated Anodyne Nc1ccc2c(c1)[C@]1(C=CO2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336486 GI Annotated Anodyne Nc1ccc2c(c1)[C@]1(C=CO2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336490 GI Annotated Anodyne Nc1ccc2c(c1)[C@@]1(C=CO2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336494 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@](CO)(c2ccc(Cl)cc2)[C@@H]1c1ccc(F)cc1 ZINC000587336511 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](CO)(c2ccc(Cl)cc2)[C@@H]1c1ccc(F)cc1 ZINC000587336513 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@](CO)(c2ccc(Cl)cc2)[C@H]1c1ccc(F)cc1 ZINC000587336516 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](CO)(c2ccc(Cl)cc2)[C@H]1c1ccc(F)cc1 ZINC000587336520 GI Annotated Anodyne Nc1cccc2c1[C@@]1(CC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336630 GI Annotated Anodyne Nc1cccc2c1[C@]1(CC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336634 GI Annotated Anodyne Nc1cccc2c1[C@]1(CC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336638 GI Annotated Anodyne Nc1cccc2c1[C@@]1(CC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336641 GI Annotated Anodyne Nc1ccc2c(c1)[C@@]1(CC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336672 GI Annotated Anodyne Nc1ccc2c(c1)[C@]1(CC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336674 GI Annotated Anodyne Nc1ccc2c(c1)[C@]1(CC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336676 GI Annotated Anodyne Nc1ccc2c(c1)[C@@]1(CC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336678 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cc1N ZINC000587336702 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cc1N ZINC000587336704 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cc1N ZINC000587336706 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cc1N ZINC000587336709 GI Annotated Anodyne C[C@]1(c2ccnc(Cl)n2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336725 GI Annotated Anodyne C[C@@]1(c2ccnc(Cl)n2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587336727 GI Annotated Anodyne C[C@@]1(c2ccnc(Cl)n2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336728 GI Annotated Anodyne C[C@]1(c2ccnc(Cl)n2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587336730 GI Annotated Anodyne COc1ccnc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1 ZINC000587336846 GI Annotated Anodyne COc1ccnc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1 ZINC000587336848 GI Annotated Anodyne COc1ccnc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1 ZINC000587336851 GI Annotated Anodyne COc1ccnc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1 ZINC000587336853 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cn1 ZINC000587336855 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cn1 ZINC000587336859 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cn1 ZINC000587336860 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cn1 ZINC000587336863 GI Annotated Anodyne C[C@@]1(c2ncccc2[N+](=O)[O-])Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587337107 GI Annotated Bother C[C@]1(c2ncccc2[N+](=O)[O-])Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587337129 GI Annotated Bother C[C@]1(c2ncccc2[N+](=O)[O-])Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587337136 GI Annotated Bother C[C@@]1(c2ncccc2[N+](=O)[O-])Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587337141 GI Annotated Bother COc1cc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)ccc1N ZINC000587337355 GI Annotated Anodyne COc1cc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)ccc1N ZINC000587337358 GI Annotated Anodyne COc1cc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)ccc1N ZINC000587337361 GI Annotated Anodyne COc1cc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)ccc1N ZINC000587337364 GI Annotated Anodyne COc1cc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)ccn1 ZINC000587337960 GI Annotated Anodyne COc1cc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)ccn1 ZINC000587337964 GI Annotated Anodyne COc1cc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)ccn1 ZINC000587338228 GI Annotated Anodyne COc1cc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)ccn1 ZINC000587338229 GI Annotated Anodyne COc1cncc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1 ZINC000587338275 GI Annotated Anodyne COc1cncc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1 ZINC000587338277 GI Annotated Anodyne COc1cncc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1 ZINC000587338279 GI Annotated Anodyne COc1cncc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1 ZINC000587338281 GI Annotated Anodyne O=N[C@@H]1Cc2ccccc2[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587338324 GI Annotated Anodyne O=N[C@@H]1Cc2ccccc2[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587338327 GI Annotated Anodyne O=N[C@@H]1Cc2ccccc2[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587338329 GI Annotated Anodyne O=N[C@@H]1Cc2ccccc2[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587338331 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@](C(=O)O)(c2ccccc2F)[C@@H]1c1ccc(F)cc1 ZINC000587338402 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](C(=O)O)(c2ccccc2F)[C@@H]1c1ccc(F)cc1 ZINC000587338410 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@](C(=O)O)(c2ccccc2F)[C@H]1c1ccc(F)cc1 ZINC000587338413 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](C(=O)O)(c2ccccc2F)[C@H]1c1ccc(F)cc1 ZINC000587338416 GI Annotated Anodyne C[C@@]1(c2ccncc2[N+](=O)[O-])Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587338495 GI Annotated Bother C[C@@]1(c2ccncc2[N+](=O)[O-])Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587338498 GI Annotated Bother C[C@]1(c2ccncc2[N+](=O)[O-])Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587338502 GI Annotated Bother C[C@]1(c2ccncc2[N+](=O)[O-])Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587338506 GI Annotated Bother O=C1c2ccc(O)cc2O[C@](C(=O)O)(c2ccc(F)cc2)[C@@H]1c1ccc(F)cc1 ZINC000587338672 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](C(=O)O)(c2ccc(F)cc2)[C@@H]1c1ccc(F)cc1 ZINC000587338674 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@](C(=O)O)(c2ccc(F)cc2)[C@H]1c1ccc(F)cc1 ZINC000587338675 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](C(=O)O)(c2ccc(F)cc2)[C@H]1c1ccc(F)cc1 ZINC000587338677 GI Annotated Anodyne CC[C@]1(c2c[nH]ccc2=N)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587338762 GI Annotated Anodyne CC[C@@]1(c2c[nH]ccc2=N)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587338764 GI Annotated Anodyne CC[C@]1(c2c[nH]ccc2=N)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587338766 GI Annotated Anodyne CC[C@@]1(c2c[nH]ccc2=N)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587338768 GI Annotated Anodyne N#CC[C@]1(c2ccc(O)cc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587338996 GI Annotated Mild N#CC[C@@]1(c2ccc(O)cc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587339000 GI Annotated Mild N#CC[C@@]1(c2ccc(O)cc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587339003 GI Annotated Mild CCCn1cc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cn1 ZINC000587339005 GI Annotated Anodyne N#CC[C@]1(c2ccc(O)cc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587339006 GI Annotated Mild CCCn1cc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cn1 ZINC000587339007 GI Annotated Anodyne CCCn1cc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cn1 ZINC000587339009 GI Annotated Anodyne CCCn1cc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cn1 ZINC000587339010 GI Annotated Anodyne Cc1nccn1CC[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587339225 GI Annotated Anodyne Cc1nccn1CC[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587339233 GI Annotated Anodyne Cc1nccn1CC[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587339234 GI Annotated Anodyne Cc1nccn1CC[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587339237 GI Annotated Anodyne N#CCC[C@]1(c2cccnc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587339371 GI Annotated Mild N#CCC[C@@]1(c2cccnc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587339375 GI Annotated Mild N#CCC[C@@]1(c2cccnc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587339377 GI Annotated Mild N#CCC[C@]1(c2cccnc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587339379 GI Annotated Mild CNc1ccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cc1N ZINC000587339434 GI Annotated Anodyne CNc1ccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cc1N ZINC000587339441 GI Annotated Anodyne CNc1ccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cc1N ZINC000587339447 GI Annotated Anodyne CNc1ccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cc1N ZINC000587339450 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)nc1 ZINC000587339452 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)nc1 ZINC000587339454 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)nc1 ZINC000587339457 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)nc1 ZINC000587339461 GI Annotated Anodyne COc1cccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1N ZINC000587339490 GI Annotated Anodyne COc1cccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1N ZINC000587339494 GI Annotated Anodyne COc1cccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1N ZINC000587339498 GI Annotated Anodyne COc1cccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1N ZINC000587339500 GI Annotated Anodyne COc1cnccc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587339620 GI Annotated Anodyne COc1cnccc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587339633 GI Annotated Anodyne COc1cnccc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587339634 GI Annotated Anodyne COc1cnccc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587339640 GI Annotated Anodyne CCn1ncc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1C ZINC000587339845 GI Annotated Anodyne CCn1ncc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1C ZINC000587339846 GI Annotated Anodyne CCn1ncc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1C ZINC000587339847 GI Annotated Anodyne CCn1ncc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1C ZINC000587339848 GI Annotated Anodyne Cc1ncn(C[C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1C ZINC000587339907 GI Annotated Anodyne Cc1ncn(C[C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1C ZINC000587339908 GI Annotated Anodyne Cc1ncn(C[C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1C ZINC000587339909 GI Annotated Anodyne Cc1ncn(C[C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1C ZINC000587339910 GI Annotated Anodyne Cc1cnc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c(C)n1 ZINC000587339943 GI Annotated Anodyne Cc1cnc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c(C)n1 ZINC000587339944 GI Annotated Anodyne Cc1cnc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c(C)n1 ZINC000587339945 GI Annotated Anodyne Cc1cnc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c(C)n1 ZINC000587339946 GI Annotated Anodyne Cc1ncc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c(C)n1 ZINC000587340161 GI Annotated Anodyne Cc1ncc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c(C)n1 ZINC000587340163 GI Annotated Anodyne Cc1ncc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c(C)n1 ZINC000587340165 GI Annotated Anodyne Cc1ncc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c(C)n1 ZINC000587340172 GI Annotated Anodyne CN(C)/C=C/[C@]1(c2ccco2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587340238 GI Annotated Anodyne CN(C)/C=C/[C@@]1(c2ccco2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587340241 GI Annotated Anodyne CN(C)/C=C/[C@]1(c2ccco2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587340244 GI Annotated Anodyne CN(C)/C=C/[C@@]1(c2ccco2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587340247 GI Annotated Anodyne C[C@H](N)[C@@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587340277 GI Annotated Anodyne C[C@H](N)[C@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587340280 GI Annotated Anodyne C[C@H](N)[C@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587340282 GI Annotated Anodyne C[C@H](N)[C@@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587340287 GI Annotated Anodyne C[C@]1(c2cn3c(n2)CCCC3)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587340378 GI Annotated Anodyne C[C@@]1(c2cn3c(n2)CCCC3)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587340380 GI Annotated Anodyne C[C@@]1(c2cn3c(n2)CCCC3)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587340382 GI Annotated Anodyne C[C@]1(c2cn3c(n2)CCCC3)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587340385 GI Annotated Anodyne CC(C)[C@@]1(Cn2cccn2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587340491 GI Annotated Anodyne CC(C)[C@]1(Cn2cccn2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587340494 GI Annotated Anodyne CC(C)[C@@]1(Cn2cccn2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587340499 GI Annotated Anodyne CC(C)[C@]1(Cn2cccn2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587340501 GI Annotated Anodyne COc1cccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)n1 ZINC000587340943 GI Annotated Anodyne COc1cccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)n1 ZINC000587340947 GI Annotated Anodyne COc1cccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)n1 ZINC000587340950 GI Annotated Anodyne COc1cccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)n1 ZINC000587340954 GI Annotated Anodyne CC(C)[C@@]1(c2nccn2C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587340958 GI Annotated Anodyne CC(C)[C@]1(c2nccn2C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587340960 GI Annotated Anodyne CC(C)[C@@]1(c2nccn2C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587340964 GI Annotated Anodyne CC(C)[C@]1(c2nccn2C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587340969 GI Annotated Anodyne C[C@]1(c2cc(O)ccc2N)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587341045 GI Annotated Anodyne C[C@@]1(c2cc(O)ccc2N)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587341048 GI Annotated Anodyne C[C@]1(c2cc(O)ccc2N)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587341050 GI Annotated Anodyne C[C@@]1(c2cc(O)ccc2N)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587341053 GI Annotated Anodyne CC(=O)c1cccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)n1 ZINC000587341352 GI Annotated Anodyne CC(=O)c1cccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)n1 ZINC000587341353 GI Annotated Anodyne CC(=O)c1cccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)n1 ZINC000587341355 GI Annotated Anodyne CC(=O)c1cccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)n1 ZINC000587341357 GI Annotated Anodyne O=C1c2ccc(O)cc2OC2(C[C@@H]3CC[C@H](C2)N3C2CC2)[C@H]1c1ccc(F)cc1 ZINC000587341389 GI Annotated Anodyne O=C1c2ccc(O)cc2OC2(C[C@@H]3CC[C@H](C2)N3C2CC2)[C@@H]1c1ccc(F)cc1 ZINC000587341393 GI Annotated Anodyne Cc1cn2c(n1)[C@]1(CC=C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587341502 GI Annotated Anodyne Cc1cn2c(n1)[C@@]1(CC=C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587341510 GI Annotated Anodyne Cc1cn2c(n1)[C@]1(CC=C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587341514 GI Annotated Anodyne Nc1cccc2c1OCC[C@@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587341515 GI Annotated Anodyne Cc1cn2c(n1)[C@@]1(CC=C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587341517 GI Annotated Anodyne Nc1cccc2c1OCC[C@@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587341518 GI Annotated Anodyne Nc1cccc2c1OCC[C@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587341525 GI Annotated Anodyne Nc1cccc2c1OCC[C@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587341527 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c(N)c1 ZINC000587341649 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c(N)c1 ZINC000587341651 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c(N)c1 ZINC000587341652 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c(N)c1 ZINC000587341653 GI Annotated Anodyne C[C@]1(c2cnc3ccccn23)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587341730 GI Annotated Anodyne C[C@@]1(c2cnc3ccccn23)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587341731 GI Annotated Anodyne C[C@@]1(c2cnc3ccccn23)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587341733 GI Annotated Anodyne C[C@]1(c2cnc3ccccn23)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587341734 GI Annotated Anodyne COc1cc(N)ccc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587341747 GI Annotated Anodyne COc1cc(N)ccc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587341749 GI Annotated Anodyne COc1cc(N)ccc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587341753 GI Annotated Anodyne COc1cc(N)ccc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587341755 GI Annotated Anodyne Cn1cccc1[C@@]1(CC#N)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587342241 GI Annotated Mild Cn1cccc1[C@]1(CC#N)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587342243 GI Annotated Mild Cn1cccc1[C@@]1(CC#N)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587342246 GI Annotated Mild Cn1cccc1[C@]1(CC#N)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587342247 GI Annotated Mild Cc1nn(C)c(C)c1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587342256 GI Annotated Anodyne Cc1nn(C)c(C)c1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587342258 GI Annotated Anodyne Cc1nn(C)c(C)c1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587342260 GI Annotated Anodyne Cc1nn(C)c(C)c1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587342262 GI Annotated Anodyne CC[C@]1(c2cnn(C)c2C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587342431 GI Annotated Anodyne CC[C@@]1(c2cnn(C)c2C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587342432 GI Annotated Anodyne CC[C@]1(c2cnn(C)c2C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587342433 GI Annotated Anodyne CC[C@@]1(c2cnn(C)c2C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587342434 GI Annotated Anodyne CC[C@]1(c2cn(C)nc2C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587342458 GI Annotated Anodyne CC[C@@]1(c2cn(C)nc2C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587342459 GI Annotated Anodyne CC[C@]1(c2cn(C)nc2C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587342460 GI Annotated Anodyne CC[C@@]1(c2cn(C)nc2C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587342461 GI Annotated Anodyne Cn1ccc2c1CCC[C@@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587342926 GI Annotated Anodyne Cn1ccc2c1CCC[C@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587342928 GI Annotated Anodyne Cn1ccc2c1CCC[C@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587342929 GI Annotated Anodyne Cn1ccc2c1CCC[C@@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587342931 GI Annotated Anodyne CCCC(=O)N1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587343759 GI Annotated Anodyne CCCC(=O)N1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587343762 GI Annotated Anodyne Cc1cc(C)n(C[C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)n1 ZINC000587343830 GI Annotated Anodyne Cc1cc(C)n(C[C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)n1 ZINC000587343831 GI Annotated Anodyne Cc1cc(C)n(C[C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)n1 ZINC000587343834 GI Annotated Anodyne Cc1cc(C)n(C[C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)n1 ZINC000587343836 GI Annotated Anodyne CC[C@H](C)OC(=O)C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587343979 GI Annotated Anodyne CC[C@H](C)OC(=O)C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587343980 GI Annotated Anodyne CC[C@H](C)OC(=O)C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587343981 GI Annotated Anodyne CC[C@H](C)OC(=O)C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587343982 GI Annotated Anodyne CCOC(=O)CC[C@]1(C2CC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587344028 GI Annotated Anodyne CCOC(=O)CC[C@@]1(C2CC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587344032 GI Annotated Anodyne CCOC(=O)CC[C@@]1(C2CC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587344034 GI Annotated Anodyne CCOC(=O)CC[C@]1(C2CC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587344035 GI Annotated Anodyne CCc1nccn1C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587344141 GI Annotated Anodyne CCc1nccn1C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587344143 GI Annotated Anodyne CCc1nccn1C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587344145 GI Annotated Anodyne CCc1nccn1C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587344148 GI Annotated Anodyne CCn1cc([C@@]2(CC)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cn1 ZINC000587344191 GI Annotated Anodyne CCn1cc([C@]2(CC)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cn1 ZINC000587344192 GI Annotated Anodyne CCn1cc([C@@]2(CC)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cn1 ZINC000587344194 GI Annotated Anodyne CCn1cc([C@]2(CC)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cn1 ZINC000587344196 GI Annotated Anodyne Cc1ccc2c(c1)NC(=O)[C@@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587344349 GI Annotated Anodyne Cc1ccc2c(c1)NC(=O)[C@@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587344350 GI Annotated Anodyne Cc1ccc2c(c1)NC(=O)[C@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587344351 GI Annotated Anodyne Cc1ccc2c(c1)NC(=O)[C@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587344352 GI Annotated Anodyne CC1(C)Cc2nc[nH]c2[C@]2(C1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587344393 GI Annotated Anodyne CC1(C)Cc2nc[nH]c2[C@@]2(C1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587344396 GI Annotated Anodyne CC1(C)Cc2nc[nH]c2[C@]2(C1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587344398 GI Annotated Anodyne CC1(C)Cc2nc[nH]c2[C@@]2(C1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587344400 GI Annotated Anodyne Cc1ncc2c(n1)CCC[C@@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587344592 GI Annotated Anodyne Cc1ncc2c(n1)CCC[C@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587344594 GI Annotated Anodyne Cc1ncc2c(n1)CCC[C@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587344595 GI Annotated Anodyne Cc1ncc2c(n1)CCC[C@@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587344596 GI Annotated Anodyne CCn1cc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c(C)n1 ZINC000587344705 GI Annotated Anodyne CCn1cc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c(C)n1 ZINC000587344710 GI Annotated Anodyne CCn1cc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c(C)n1 ZINC000587344711 GI Annotated Anodyne CCn1cc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c(C)n1 ZINC000587344712 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCCc3nc(O)ccc32)[C@@H]1c1ccc(F)cc1 ZINC000587344917 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCCc3nc(O)ccc32)[C@@H]1c1ccc(F)cc1 ZINC000587344920 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCCc3nc(O)ccc32)[C@H]1c1ccc(F)cc1 ZINC000587344923 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCCc3nc(O)ccc32)[C@H]1c1ccc(F)cc1 ZINC000587344925 GI Annotated Anodyne Cc1[nH]nc2c1[C@@]1(CCC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587345296 GI Annotated Anodyne Cc1[nH]nc2c1[C@]1(CCC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587345297 GI Annotated Anodyne Cc1[nH]nc2c1[C@@]1(CCC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587345298 GI Annotated Anodyne Cc1[nH]nc2c1[C@]1(CCC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587345299 GI Annotated Anodyne O=C1c2ccc(O)cc2OC2(CCC(n3cnnc3)CC2)[C@H]1c1ccc(F)cc1 ZINC000587345450 GI Annotated Anodyne O=C1c2ccc(O)cc2OC2(CCC(n3cnnc3)CC2)[C@@H]1c1ccc(F)cc1 ZINC000587345458 GI Annotated Anodyne CC(C)CN1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587345574 GI Annotated Anodyne CC(C)CN1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587345576 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCC[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587345612 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCC[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587345613 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCC[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587345614 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCC[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587345615 GI Annotated Anodyne CCCCOC(=O)C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587345766 GI Annotated Anodyne CCCCOC(=O)C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587345768 GI Annotated Anodyne CCCCOC(=O)C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587345769 GI Annotated Anodyne CCCCOC(=O)C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587345771 GI Annotated Anodyne CCOC(=O)C1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587345837 GI Annotated Anodyne CCOC(=O)C1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587345838 GI Annotated Anodyne CC[C@@]1(C2(C(=O)OC)CCC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587345909 GI Annotated Anodyne CC[C@]1(C2(C(=O)OC)CCC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587345911 GI Annotated Anodyne CC[C@@]1(C2(C(=O)OC)CCC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587345912 GI Annotated Anodyne CC[C@]1(C2(C(=O)OC)CCC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587345914 GI Annotated Anodyne Cc1n[nH]c(C)c1C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346124 GI Annotated Anodyne Cc1n[nH]c(C)c1C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346126 GI Annotated Anodyne Cc1n[nH]c(C)c1C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346129 GI Annotated Anodyne Cc1n[nH]c(C)c1C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346130 GI Annotated Anodyne CCO/C=C(/C(C)=O)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346171 GI Annotated Mild CCO/C=C(/C(C)=O)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346175 GI Annotated Mild CCO/C=C(\C(C)=O)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346176 GI Annotated Mild CCO/C=C(\C(C)=O)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346178 GI Annotated Mild CC(=O)OC[C@@]1(C(C)(C)C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346205 GI Annotated Anodyne CC(=O)OC[C@]1(C(C)(C)C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346206 GI Annotated Anodyne CC(=O)OC[C@@]1(C(C)(C)C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346207 GI Annotated Anodyne CC(=O)OC[C@]1(C(C)(C)C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346208 GI Annotated Anodyne COC(=O)[C@@H]1CCCCC[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587346327 GI Annotated Anodyne COC(=O)[C@@H]1CCCCC[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587346330 GI Annotated Anodyne COC(=O)[C@@H]1CCCCC[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587346332 GI Annotated Anodyne COC(=O)[C@@H]1CCCCC[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587346335 GI Annotated Anodyne COC(C[C@]1(C(C)C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1)OC ZINC000587346642 GI Annotated Anodyne COC(C[C@@]1(C(C)C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1)OC ZINC000587346648 GI Annotated Anodyne COC(C[C@]1(C(C)C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1)OC ZINC000587346651 GI Annotated Anodyne COC(C[C@@]1(C(C)C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1)OC ZINC000587346652 GI Annotated Anodyne CC1(C)[C@H]2C[C@@H]1[C@](C)(O)[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346802 GI Annotated Anodyne CC1(C)[C@@H]2C[C@H]1[C@@](C)(O)[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346804 GI Annotated Anodyne CC1(C)[C@H]2C[C@H]1[C@@](C)(O)[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346805 GI Annotated Anodyne CC1(C)[C@H]2C[C@H]1[C@@](C)(O)[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346806 GI Annotated Anodyne CC1(C)[C@@H]2C[C@H]1[C@@](C)(O)[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346809 GI Annotated Anodyne CC1(C)[C@H]2C[C@H]1[C@@](C)(O)[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346811 GI Annotated Anodyne CC1(C)[C@H]2C[C@@H]1[C@](C)(O)[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346813 GI Annotated Anodyne CC1(C)[C@H]2C[C@@H]1[C@](C)(O)[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346814 GI Annotated Anodyne CC1(C)[C@H]2C[C@H]1[C@](C)(O)[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346815 GI Annotated Anodyne CC1(C)[C@H]2C[C@H]1[C@](C)(O)[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346816 GI Annotated Anodyne CC1(C)[C@H]2C[C@H]1[C@](C)(O)[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346818 GI Annotated Anodyne CC1(C)[C@H]2C[C@H]1[C@@](C)(O)[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346819 GI Annotated Anodyne CC1(C)[C@H]2C[C@@H]1[C@](C)(O)[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346821 GI Annotated Anodyne CC1(C)[C@@H]2C[C@H]1[C@@](C)(O)[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346822 GI Annotated Anodyne CC1(C)[C@H]2C[C@H]1[C@](C)(O)[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346824 GI Annotated Anodyne CC1(C)[C@@H]2C[C@H]1[C@@](C)(O)[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346826 GI Annotated Anodyne COC(=O)[C@@H]1CCC[C@@]2(CC1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587346958 GI Annotated Anodyne COC(=O)[C@@H]1CCC[C@@]2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587346959 GI Annotated Anodyne COC(=O)[C@@H]1CCC[C@]2(CC1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587346960 GI Annotated Anodyne COC(=O)[C@@H]1CCC[C@]2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587346961 GI Annotated Anodyne CCC[C@]1(C2CCNCC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346982 GI Annotated Anodyne CCC[C@@]1(C2CCNCC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587346986 GI Annotated Anodyne CCC[C@@]1(C2CCNCC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346988 GI Annotated Anodyne CCC[C@]1(C2CCNCC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587346989 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC2CC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587347044 GI Annotated Anodyne CCOC(=O)C[C@]1(CC2CC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587347045 GI Annotated Anodyne CCOC(=O)C[C@]1(CC2CC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587347046 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC2CC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587347047 GI Annotated Anodyne Cc1noc([C@@H]2CCC[C@]23Oc2cc(O)ccc2C(=O)[C@@H]3c2ccc(F)cc2)n1 ZINC000587347092 GI Annotated Anodyne Cc1noc([C@@H]2CCC[C@]23Oc2cc(O)ccc2C(=O)[C@H]3c2ccc(F)cc2)n1 ZINC000587347094 GI Annotated Anodyne Cc1noc([C@@H]2CCC[C@@]23Oc2cc(O)ccc2C(=O)[C@@H]3c2ccc(F)cc2)n1 ZINC000587347099 GI Annotated Anodyne Cc1noc([C@@H]2CCC[C@@]23Oc2cc(O)ccc2C(=O)[C@H]3c2ccc(F)cc2)n1 ZINC000587347103 GI Annotated Anodyne C[C@@H]1CCCN(C[C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)C1 ZINC000587347212 GI Annotated Anodyne C[C@@H]1CCCN(C[C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)C1 ZINC000587347213 GI Annotated Anodyne C[C@@H]1CCCN(C[C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)C1 ZINC000587347215 GI Annotated Anodyne C[C@@H]1CCCN(C[C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)C1 ZINC000587347216 GI Annotated Anodyne C=Cc1nc(C)c([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)[nH]1 ZINC000587347232 GI Annotated Anodyne C=Cc1nc(C)c([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)[nH]1 ZINC000587347245 GI Annotated Anodyne C=Cc1nc(C)c([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[nH]1 ZINC000587347246 GI Annotated Anodyne C=Cc1nc(C)c([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[nH]1 ZINC000587347250 GI Annotated Anodyne O=C(O)C1C[C@@H]2CC3(C[C@H]2C1)Oc1cc(O)ccc1C(=O)[C@H]3c1ccc(F)cc1 ZINC000587347366 GI Annotated Anodyne O=C(O)[C@@H]1C[C@H]2C[C@]3(C[C@H]2C1)Oc1cc(O)ccc1C(=O)[C@@H]3c1ccc(F)cc1 ZINC000587347367 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(C[C@@H]3C[C@@H](C(=O)O)C[C@@H]3C2)[C@@H]1c1ccc(F)cc1 ZINC000587347370 GI Annotated Anodyne O=C(O)C1C[C@@H]2CC3(C[C@H]2C1)Oc1cc(O)ccc1C(=O)[C@@H]3c1ccc(F)cc1 ZINC000587347372 GI Annotated Anodyne C[C@]1(c2ccc(C(=O)O)o2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587347462 GI Annotated Anodyne C[C@@]1(c2ccc(C(=O)O)o2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587347463 GI Annotated Anodyne C[C@@]1(c2ccc(C(=O)O)o2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587347464 GI Annotated Anodyne C[C@]1(c2ccc(C(=O)O)o2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587347465 GI Annotated Anodyne C[C@@H]1C[C@]2(CC[C@H]1C(=O)O)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587347517 GI Annotated Anodyne C[C@@H]1C[C@]2(CC[C@@H]1C(=O)O)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587347519 GI Annotated Anodyne C[C@@H]1C[C@]2(CC[C@H]1C(=O)O)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587347521 GI Annotated Anodyne C[C@@H]1C[C@]2(CC[C@@H]1C(=O)O)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587347522 GI Annotated Anodyne CCOC(=O)C1([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)CCC1 ZINC000587347596 GI Annotated Anodyne CCOC(=O)C1([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)CCC1 ZINC000587347598 GI Annotated Anodyne CCOC(=O)C1([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)CCC1 ZINC000587347599 GI Annotated Anodyne CCOC(=O)C1([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)CCC1 ZINC000587347600 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCC[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587347601 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCC[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587347602 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCC[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587347605 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCC[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587347611 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCCc3[nH]c(O)cc32)[C@@H]1c1ccc(F)cc1 ZINC000587347631 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCCc3[nH]c(O)cc32)[C@@H]1c1ccc(F)cc1 ZINC000587347632 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCCc3[nH]c(O)cc32)[C@H]1c1ccc(F)cc1 ZINC000587347633 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCCc3[nH]c(O)cc32)[C@H]1c1ccc(F)cc1 ZINC000587347636 GI Annotated Anodyne Cc1cccc2c1NC(=O)[C@@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587347720 GI Annotated Anodyne Cc1cccc2c1NC(=O)[C@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587347725 GI Annotated Anodyne Cc1cccc2c1NC(=O)[C@@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587347727 GI Annotated Anodyne Cc1cccc2c1NC(=O)[C@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587347731 GI Annotated Anodyne CC(C)(C)OC(=O)C1CC2(C1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587347734 GI Annotated Anodyne CC(C)(C)OC(=O)C1CC2(C1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587347738 GI Annotated Anodyne CCCC[C@@]1(C(=O)OCC)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587347781 GI Annotated Anodyne CCCC[C@]1(C(=O)OCC)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587347783 GI Annotated Anodyne CC[C@]1(c2c[nH]c(C(=O)O)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587347889 GI Annotated Anodyne CC[C@@]1(c2c[nH]c(C(=O)O)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587347891 GI Annotated Anodyne CC[C@]1(c2c[nH]c(C(=O)O)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587347895 GI Annotated Anodyne CC[C@@]1(c2c[nH]c(C(=O)O)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587347901 GI Annotated Anodyne O=C1c2ccc(O)cc2OC2(CCN(CC3CC3)CC2)[C@H]1c1ccc(F)cc1 ZINC000587347924 GI Annotated Anodyne O=C1c2ccc(O)cc2OC2(CCN(CC3CC3)CC2)[C@@H]1c1ccc(F)cc1 ZINC000587347926 GI Annotated Anodyne CCCC[C@@]1(C(=O)OCC)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348126 GI Annotated Anodyne CCCC[C@]1(C(=O)OCC)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348128 GI Annotated Anodyne CCCC(=O)O[C@H](C)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587348142 GI Annotated Anodyne CCCC(=O)O[C@H](C)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348146 GI Annotated Anodyne CCCC(=O)O[C@H](C)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587348151 GI Annotated Anodyne CCCC(=O)O[C@H](C)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348154 GI Annotated Anodyne COC(=O)C[C@@H]1CCCC[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587348224 GI Annotated Anodyne CCOC(=O)C[C@]1(C(C)C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587348226 GI Annotated Anodyne COC(=O)C[C@@H]1CCCC[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587348227 GI Annotated Anodyne CCOC(=O)C[C@@]1(C(C)C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587348229 GI Annotated Anodyne CCOC(=O)C[C@]1(C(C)C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348230 GI Annotated Anodyne COC(=O)C[C@@H]1CCCC[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587348232 GI Annotated Anodyne CCOC(=O)C[C@@]1(C(C)C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348233 GI Annotated Anodyne COC(=O)C[C@@H]1CCCC[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587348235 GI Annotated Anodyne CCOC(=O)C(C)(C)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348236 GI Annotated Anodyne CCOC(=O)C(C)(C)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587348239 GI Annotated Anodyne CCOC(=O)C(C)(C)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348242 GI Annotated Anodyne CCOC(=O)C(C)(C)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587348244 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@@]2(C1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587348338 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@@]2(C1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587348341 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@]2(C1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587348345 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@]2(C1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587348347 GI Annotated Anodyne C[C@]1(c2[nH]nc3ncccc23)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348447 GI Annotated Anodyne C[C@]1(c2[nH]nc3ncccc23)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587348449 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CC[C@@H]3C[C@H]2CCC3=O)[C@@H]1c1ccc(F)cc1 ZINC000587348531 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CC[C@@H]3C[C@@H]2CCC3=O)[C@@H]1c1ccc(F)cc1 ZINC000587348534 GI Annotated Anodyne O=C1CC[C@@H]2C[C@H]1CC[C@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348536 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CC[C@@H]3C[C@H]2CCC3=O)[C@@H]1c1ccc(F)cc1 ZINC000587348539 GI Annotated Anodyne O=C1CC[C@@H]2C[C@H]1CC[C@@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348540 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CC[C@@H]3C[C@@H]2CCC3=O)[C@@H]1c1ccc(F)cc1 ZINC000587348542 GI Annotated Anodyne O=C1CC[C@H]2C[C@H]1CC[C@@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348544 GI Annotated Anodyne O=C1CC[C@H]2C[C@H]1CC[C@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348546 GI Annotated Anodyne COC(=O)C1(C)CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587348597 GI Annotated Anodyne COC(=O)C1(C)CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587348601 GI Annotated Anodyne C[C@@]1(c2[nH]nc3ncccc23)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348718 GI Annotated Anodyne C[C@@]1(c2[nH]nc3ncccc23)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587348721 GI Annotated Anodyne COC[C@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587348929 GI Annotated Anodyne COC[C@@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587348931 GI Annotated Anodyne COC[C@@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348934 GI Annotated Anodyne COC[C@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587348938 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@](c2ncc[nH]2)(c2ccco2)[C@@H]1c1ccc(F)cc1 ZINC000587348952 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](c2ncc[nH]2)(c2ccco2)[C@@H]1c1ccc(F)cc1 ZINC000587348954 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@](c2ncc[nH]2)(c2ccco2)[C@H]1c1ccc(F)cc1 ZINC000587348959 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](c2ncc[nH]2)(c2ccco2)[C@H]1c1ccc(F)cc1 ZINC000587348966 GI Annotated Anodyne Cc1cc2c(cn1)[C@@]1(CC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587349291 GI Annotated Anodyne Cc1cc2c(cn1)[C@]1(CC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587349298 GI Annotated Anodyne Cc1cc2c(cn1)[C@]1(CC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587349302 GI Annotated Anodyne Cc1cc2c(cn1)[C@@]1(CC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587349306 GI Annotated Anodyne Cc1ccc2c(c1)[C@]1(Oc3cc(O)ccc3C(=O)[C@H]1c1ccc(F)cc1)C(=O)N2 ZINC000587349373 GI Annotated Anodyne Cc1ccc2c(c1)[C@]1(Oc3cc(O)ccc3C(=O)[C@@H]1c1ccc(F)cc1)C(=O)N2 ZINC000587349380 GI Annotated Anodyne Cc1ccc2c(c1)[C@@]1(Oc3cc(O)ccc3C(=O)[C@H]1c1ccc(F)cc1)C(=O)N2 ZINC000587349387 GI Annotated Anodyne Cc1ccc2c(c1)[C@@]1(Oc3cc(O)ccc3C(=O)[C@@H]1c1ccc(F)cc1)C(=O)N2 ZINC000587349394 GI Annotated Anodyne CCOC(=O)CCC[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587349757 GI Annotated Anodyne CCOC(=O)CCC[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587349761 GI Annotated Anodyne CCOC(=O)CCC[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587349763 GI Annotated Anodyne CCOC(=O)CCC[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587349766 GI Annotated Anodyne C=CC[C@H](C(=O)OCC)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587349919 GI Annotated Mild C=CC[C@H](C(=O)OCC)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587349922 GI Annotated Mild C=CC[C@H](C(=O)OCC)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587349925 GI Annotated Mild C=CC[C@H](C(=O)OCC)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587349928 GI Annotated Mild O=C1c2ccc(O)cc2O[C@@]2(CCc3ncccc3C2)[C@@H]1c1ccc(F)cc1 ZINC000587350057 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCc3ncccc3C2)[C@@H]1c1ccc(F)cc1 ZINC000587350080 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCc3ncccc3C2)[C@H]1c1ccc(F)cc1 ZINC000587350082 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCc3ncccc3C2)[C@H]1c1ccc(F)cc1 ZINC000587350084 GI Annotated Anodyne Cc1ccccc1[C@@]1(C=O)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587350220 GI Annotated Mild Cc1ccccc1[C@]1(C=O)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587350270 GI Annotated Mild Cc1ccccc1[C@]1(C=O)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587350280 GI Annotated Mild Cc1ccccc1[C@@]1(C=O)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587350284 GI Annotated Mild CCOC(=O)C[C@@]1(C2(C)CC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587350340 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2(C)CC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587350344 GI Annotated Anodyne CCOC(=O)C[C@]1(C2(C)CC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587350347 GI Annotated Anodyne CCOC(=O)C[C@]1(C2(C)CC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587350353 GI Annotated Anodyne Cc1ccc([C@]2([C@H](C)O)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cc1 ZINC000587350534 GI Annotated Anodyne Cc1ccc([C@]2([C@@H](C)O)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cc1 ZINC000587350537 GI Annotated Anodyne Cc1ccc([C@]2([C@@H](C)O)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cc1 ZINC000587350538 GI Annotated Anodyne Cc1ccc([C@]2([C@H](C)O)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cc1 ZINC000587350540 GI Annotated Anodyne C[C@@H]1[C@H](CC(=O)O)CC[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587351115 GI Annotated Anodyne C[C@@H]1[C@H](CC(=O)O)CC[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587351116 GI Annotated Anodyne C[C@@H]1[C@H](CC(=O)O)CC[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587351118 GI Annotated Anodyne C[C@@H]1[C@H](CC(=O)O)CC[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587351122 GI Annotated Anodyne CC1(C)Cc2n[nH]cc2[C@@]2(C1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587351186 GI Annotated Anodyne CC1(C)Cc2n[nH]cc2[C@@]2(C1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587351187 GI Annotated Anodyne CC1(C)Cc2n[nH]cc2[C@]2(C1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587351188 GI Annotated Anodyne CC1(C)Cc2n[nH]cc2[C@]2(C1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587351189 GI Annotated Anodyne CCOC(=O)[C@@H]1[C@H](C)CC[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587351446 GI Annotated Anodyne CCOC(=O)[C@@H]1[C@H](C)CC[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587351449 GI Annotated Anodyne CCOC(=O)[C@@H]1[C@H](C)CC[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587351452 GI Annotated Anodyne CCOC(=O)[C@@H]1[C@H](C)CC[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587351458 GI Annotated Anodyne COC(=O)CC1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587351498 GI Annotated Anodyne COC(=O)CC1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587351499 GI Annotated Anodyne COC(=O)C[C@@H]1CC[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[C@@H]1C ZINC000587351634 GI Annotated Anodyne COC(=O)C[C@@H]1CC[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)[C@H]1C ZINC000587351635 GI Annotated Anodyne COC(=O)C[C@@H]1CC[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)[C@H]1C ZINC000587351636 GI Annotated Anodyne COC(=O)C[C@@H]1CC[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)[C@@H]1C ZINC000587351637 GI Annotated Anodyne Cc1ccc([C@@]2(CO)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cc1 ZINC000587351688 GI Annotated Anodyne Cc1ccc([C@]2(CO)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cc1 ZINC000587351693 GI Annotated Anodyne Cc1ccc([C@]2(CO)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cc1 ZINC000587351696 GI Annotated Anodyne Cc1ccc([C@@]2(CO)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cc1 ZINC000587351699 GI Annotated Anodyne O=C(O)CC1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587351700 GI Annotated Anodyne O=C(O)CC1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587351702 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCN[C@@H]3CCCC[C@@H]32)[C@@H]1c1ccc(F)cc1 ZINC000587351796 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCN[C@@H]3CCCC[C@@H]32)[C@H]1c1ccc(F)cc1 ZINC000587351799 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCN[C@@H]3CCCC[C@H]32)[C@H]1c1ccc(F)cc1 ZINC000587351803 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCN[C@@H]3CCCC[C@H]32)[C@@H]1c1ccc(F)cc1 ZINC000587351805 GI Annotated Anodyne CCOC(=O)[C@]1(CC(C)C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587351806 GI Annotated Anodyne CCOC(=O)[C@@]1(CC(C)C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587351807 GI Annotated Anodyne CCOC(=O)[C@]1(CC(C)C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587351808 GI Annotated Anodyne CCOC(=O)[C@@]1(CC(C)C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587351809 GI Annotated Anodyne CCOC(=O)[C@H](CC)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587351878 GI Annotated Anodyne CCOC(=O)[C@H](CC)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587351880 GI Annotated Anodyne CCOC(=O)[C@H](CC)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587351883 GI Annotated Anodyne CCOC(=O)[C@H](CC)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587351888 GI Annotated Anodyne CCC[C@]1(CC(=O)OCC)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587351968 GI Annotated Anodyne CCC[C@@]1(CC(=O)OCC)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587351973 GI Annotated Anodyne CCC[C@]1(CC(=O)OCC)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587351976 GI Annotated Anodyne CCC[C@@]1(CC(=O)OCC)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587351979 GI Annotated Anodyne Cc1ccc(C)c([C@@]2(CO)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1 ZINC000587352089 GI Annotated Anodyne Cc1ccc(C)c([C@@]2(CO)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1 ZINC000587352097 GI Annotated Anodyne Cc1ccc(C)c([C@]2(CO)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1 ZINC000587352100 GI Annotated Anodyne Cc1ccc(C)c([C@]2(CO)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1 ZINC000587352102 GI Annotated Anodyne CCOC(=O)C[C@]1(C2CCC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587352296 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2CCC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587352297 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2CCC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587352298 GI Annotated Anodyne CCOC(=O)C[C@]1(C2CCC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587352299 GI Annotated Anodyne CC(C)CCOC(=O)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587352343 GI Annotated Anodyne CC(C)CCOC(=O)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587352344 GI Annotated Anodyne CC(C)CCOC(=O)[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587352345 GI Annotated Anodyne CC(C)CCOC(=O)[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587352346 GI Annotated Anodyne Cc1ccc2c(n1)NCC[C@@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587352373 GI Annotated Anodyne Cc1ccc2c(n1)NCC[C@@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587352379 GI Annotated Anodyne Cc1ccc2c(n1)NCC[C@]21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587352381 GI Annotated Anodyne Cc1ccc2c(n1)NCC[C@]21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587352386 GI Annotated Anodyne COc1ccc2c(c1)C[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587352458 GI Annotated Anodyne COc1ccc2c(c1)C[C@@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587352465 GI Annotated Anodyne COc1ccc2c(c1)C[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587352468 GI Annotated Anodyne COc1ccc2c(c1)C[C@]1(C2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587352470 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCc3c(O)cccc32)[C@@H]1c1ccc(F)cc1 ZINC000587352514 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCc3c(O)cccc32)[C@@H]1c1ccc(F)cc1 ZINC000587352531 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCc3c(O)cccc32)[C@H]1c1ccc(F)cc1 ZINC000587352534 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCc3c(O)cccc32)[C@H]1c1ccc(F)cc1 ZINC000587352538 GI Annotated Anodyne C[C@]1(CC2(C(=O)O)CCC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587352603 GI Annotated Anodyne C[C@@]1(CC2(C(=O)O)CCC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587352606 GI Annotated Anodyne C[C@@]1(CC2(C(=O)O)CCC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587352609 GI Annotated Anodyne C[C@]1(CC2(C(=O)O)CCC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587352612 GI Annotated Anodyne C[C@]1(c2cccc(CO)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587352716 GI Annotated Anodyne C[C@@]1(c2cccc(CO)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587352720 GI Annotated Anodyne C[C@@]1(c2cccc(CO)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587352723 GI Annotated Anodyne C[C@]1(c2cccc(CO)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587352724 GI Annotated Anodyne CC(=O)OC1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587353031 GI Annotated Anodyne CC(=O)OC1CCC2(CC1)Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587353033 GI Annotated Anodyne C[C@]1(c2cc(C(=O)O)co2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587353195 GI Annotated Anodyne C[C@@]1(c2cc(C(=O)O)co2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587353198 GI Annotated Anodyne C[C@@]1(c2cc(C(=O)O)co2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587353199 GI Annotated Anodyne C[C@]1(c2cc(C(=O)O)co2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587353201 GI Annotated Anodyne CC(C)COC(=O)C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587353308 GI Annotated Anodyne CC(C)COC(=O)C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587353310 GI Annotated Anodyne CC(C)COC(=O)C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587353312 GI Annotated Anodyne CC(C)COC(=O)C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587353314 GI Annotated Anodyne CC(C)(C)OC(=O)C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587353416 GI Annotated Anodyne CC(C)(C)OC(=O)C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587353418 GI Annotated Anodyne CC(C)(C)OC(=O)C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587353419 GI Annotated Anodyne CC(C)(C)OC(=O)C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587353420 GI Annotated Anodyne Cc1cccc2c1[C@]1(Oc3cc(O)ccc3C(=O)[C@H]1c1ccc(F)cc1)C(=O)N2 ZINC000587353451 GI Annotated Anodyne Cc1cccc2c1[C@]1(Oc3cc(O)ccc3C(=O)[C@@H]1c1ccc(F)cc1)C(=O)N2 ZINC000587353453 GI Annotated Anodyne Cc1cccc2c1[C@@]1(Oc3cc(O)ccc3C(=O)[C@H]1c1ccc(F)cc1)C(=O)N2 ZINC000587353454 GI Annotated Anodyne Cc1cccc2c1[C@@]1(Oc3cc(O)ccc3C(=O)[C@@H]1c1ccc(F)cc1)C(=O)N2 ZINC000587353455 GI Annotated Anodyne COC(=O)C[C@@]1(C(C)(C)C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587353684 GI Annotated Anodyne COC(=O)C[C@]1(C(C)(C)C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587353685 GI Annotated Anodyne COC(=O)C[C@@]1(C(C)(C)C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587353687 GI Annotated Anodyne COC(=O)C[C@]1(C(C)(C)C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587353688 GI Annotated Anodyne CO[C@@H]1[C@H](C)[C@@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)C12CCC2 ZINC000587353771 GI Annotated Anodyne CO[C@@H]1[C@H](C)[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)C12CCC2 ZINC000587353773 GI Annotated Anodyne COC(=O)c1coc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1 ZINC000587353905 GI Annotated Anodyne COC(=O)c1coc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c1 ZINC000587353906 GI Annotated Anodyne COC(=O)c1coc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1 ZINC000587353909 GI Annotated Anodyne COC(=O)c1coc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c1 ZINC000587353911 GI Annotated Anodyne O=C(O)CC[C@]1(c2ccco2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587353937 GI Annotated Anodyne O=C(O)CC[C@@]1(c2ccco2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587353942 GI Annotated Anodyne O=C(O)CC[C@]1(c2ccco2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587353944 GI Annotated Anodyne O=C(O)CC[C@@]1(c2ccco2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587353947 GI Annotated Anodyne CCCC[C@]1(CC(=O)OC)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587353965 GI Annotated Anodyne CCCC[C@@]1(CC(=O)OC)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587353966 GI Annotated Anodyne CCCC[C@]1(CC(=O)OC)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587353968 GI Annotated Anodyne CCCC[C@@]1(CC(=O)OC)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587353969 GI Annotated Anodyne CO[C@@H]1[C@H](C)[C@@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)C12CCC2 ZINC000587354020 GI Annotated Anodyne CO[C@@H]1[C@H](C)[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)C12CCC2 ZINC000587354022 GI Annotated Anodyne CC(=O)C12CC([C@@]3(C)Oc4cc(O)ccc4C(=O)[C@H]3c3ccc(F)cc3)(C1)C2 ZINC000587354025 GI Annotated Anodyne CC(=O)C12CC([C@]3(C)Oc4cc(O)ccc4C(=O)[C@H]3c3ccc(F)cc3)(C1)C2 ZINC000587354027 GI Annotated Anodyne CC(=O)C12CC([C@]3(C)Oc4cc(O)ccc4C(=O)[C@@H]3c3ccc(F)cc3)(C1)C2 ZINC000587354031 GI Annotated Anodyne CC(=O)C12CC([C@@]3(C)Oc4cc(O)ccc4C(=O)[C@@H]3c3ccc(F)cc3)(C1)C2 ZINC000587354034 GI Annotated Anodyne CC(=O)[C@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587354172 GI Annotated Anodyne CC(=O)[C@@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587354173 GI Annotated Anodyne CC(=O)[C@@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587354174 GI Annotated Anodyne CC(=O)[C@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587354175 GI Annotated Anodyne O=C1C2CC3CC1CC(C2)C31Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587354308 GI Annotated Anodyne O=C1C2CC3CC1CC(C2)C31Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587354311 GI Annotated Anodyne O=C(O)C1C[C@@H]2CC[C@H](C1)C21Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587354443 GI Annotated Anodyne O=C(O)C1C[C@@H]2CC[C@H](C1)C21Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587354446 GI Annotated Anodyne COC(=O)C[C@]1(C2CCCC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587354555 GI Annotated Anodyne COC(=O)C[C@@]1(C2CCCC2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587354556 GI Annotated Anodyne COC(=O)C[C@@]1(C2CCCC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587354557 GI Annotated Anodyne COC(=O)C[C@]1(C2CCCC2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587354558 GI Annotated Anodyne C[C@@H]1C[C@H](C(=O)O)CC[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587354723 GI Annotated Anodyne C[C@@H]1C[C@H](C(=O)O)CC[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587354724 GI Annotated Anodyne C[C@@H]1C[C@H](C(=O)O)CC[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587354738 GI Annotated Anodyne C[C@@H]1C[C@H](C(=O)O)CC[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587354741 GI Annotated Anodyne O=C1C[C@@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c2ccccc2O1 ZINC000587354765 GI Annotated Anodyne O=C1C[C@]2(Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)c2ccccc2O1 ZINC000587354779 GI Annotated Anodyne O=C1C[C@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c2ccccc2O1 ZINC000587354782 GI Annotated Anodyne O=C1C[C@@]2(Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)c2ccccc2O1 ZINC000587354785 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2([C@H]3CCO[C@H]3C23CCC3)[C@H]1c1ccc(F)cc1 ZINC000587355165 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2([C@@H]1c1ccc(F)cc1)[C@H]1CCO[C@H]1C21CCC1 ZINC000587355170 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2([C@@H]1c1ccc(F)cc1)[C@H]1CCO[C@H]1C21CCC1 ZINC000587355173 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2([C@H]3CCO[C@H]3C23CCC3)[C@H]1c1ccc(F)cc1 ZINC000587355179 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2([C@@H]3[C@@H]4[C@@H]5C[C@H]6[C@H]4C[C@H]3[C@@H]6[C@H]52)[C@H]1c1ccc(F)cc1 ZINC000587355196 GI Annotated Anodyne O=C1c2ccc(O)cc2OC2([C@@H]1c1ccc(F)cc1)[C@H]1[C@H]3C[C@@H]4[C@@H]1[C@@H]1C[C@H]4[C@H]3[C@H]12 ZINC000587355204 GI Annotated Anodyne O=C1c2ccc(O)cc2OC2([C@@H]1c1ccc(F)cc1)[C@H]1[C@H]3C[C@@H]4[C@H]1[C@@H]1C[C@H]4[C@@H]3[C@H]12 ZINC000587355209 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2([C@@H]1c1ccc(F)cc1)[C@@H]1[C@@H]3[C@@H]4C[C@H]5[C@H]3C[C@H]1[C@@H]5[C@H]42 ZINC000587355215 GI Annotated Anodyne CCC[C@]1([C@@H](C)C(=O)OC)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587355259 GI Annotated Anodyne CCC[C@]1([C@@H](C)C(=O)OC)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587355262 GI Annotated Anodyne CCC[C@]1([C@H](C)C(=O)OC)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587355263 GI Annotated Anodyne CCC[C@]1([C@H](C)C(=O)OC)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587355265 GI Annotated Anodyne O=C(O)C[C@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587355285 GI Annotated Anodyne O=C(O)C[C@@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587355288 GI Annotated Anodyne O=C(O)C[C@@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587355290 GI Annotated Anodyne O=C(O)C[C@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587355298 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(C(=O)C=Cc3ccccc32)[C@@H]1c1ccc(F)cc1 ZINC000587355438 GI Annotated Mild O=C1c2ccc(O)cc2O[C@]2(C(=O)C=Cc3ccccc32)[C@H]1c1ccc(F)cc1 ZINC000587355439 GI Annotated Mild O=C1c2ccc(O)cc2O[C@@]2(C(=O)C=Cc3ccccc32)[C@H]1c1ccc(F)cc1 ZINC000587355440 GI Annotated Mild O=C1c2ccc(O)cc2O[C@@]2(C(=O)C=Cc3ccccc32)[C@@H]1c1ccc(F)cc1 ZINC000587355441 GI Annotated Mild O=C1c2ccc(O)cc2O[C@@]2(CCC[C@@H](C(=O)O)CC2)[C@@H]1c1ccc(F)cc1 ZINC000587355491 GI Annotated Anodyne O=C(O)[C@@H]1CCC[C@@]2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587355493 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCC[C@@H](C(=O)O)CC2)[C@@H]1c1ccc(F)cc1 ZINC000587355494 GI Annotated Anodyne O=C(O)[C@@H]1CCC[C@]2(CC1)Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587355497 GI Annotated Anodyne Cc1ccc([C@@]2(C(=O)O)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cc1 ZINC000587355610 GI Annotated Anodyne Cc1ccc([C@@]2(C(=O)O)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cc1 ZINC000587355612 GI Annotated Anodyne Cc1ccc([C@]2(C(=O)O)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)cc1 ZINC000587355614 GI Annotated Anodyne Cc1ccc([C@]2(C(=O)O)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)cc1 ZINC000587355617 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2([C@@H]1c1ccc(F)cc1)[C@H]1[C@@H]3C[C@@H]4[C@@H]5C[C@@H]([C@@H]1[C@@H]53)[C@@H]42 ZINC000587356218 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2([C@@H]1c1ccc(F)cc1)[C@@H]1[C@@H]3[C@H]4[C@H]5C[C@@H]3[C@H]2[C@@H]5C[C@H]41 ZINC000587356219 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2([C@@H]1c1ccc(F)cc1)[C@H]1[C@H]3C[C@@H]4[C@@H]5[C@H]3[C@H]2[C@@H]5C[C@H]41 ZINC000587356220 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2([C@@H]1c1ccc(F)cc1)[C@H]1[C@H]3C[C@@H]4[C@H]5[C@@H](C[C@H]41)[C@@H]2[C@@H]53 ZINC000587356221 GI Annotated Anodyne CC1(C)[C@@H](C(=O)O)C[C@H]1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587356254 GI Annotated Anodyne CC1(C)[C@@H](C(=O)O)C[C@H]1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587356255 GI Annotated Anodyne CC1(C)[C@@H](C(=O)O)C[C@H]1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587356256 GI Annotated Anodyne CC1(C)[C@@H](C(=O)O)C[C@H]1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587356257 GI Annotated Anodyne O=C1c2ccc(O)cc2OC2([C@H]3CC4C[C@H]2CC(O)(C4)C3)[C@H]1c1ccc(F)cc1 ZINC000587356349 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2([C@H]3C[C@H]4C[C@@H]2C[C@@](O)(C4)C3)[C@H]1c1ccc(F)cc1 ZINC000587356352 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2([C@H]3C[C@H]4C[C@@H]2C[C@@](O)(C4)C3)[C@@H]1c1ccc(F)cc1 ZINC000587356355 GI Annotated Anodyne O=C1c2ccc(O)cc2OC2([C@H]3CC4C[C@H]2CC(O)(C4)C3)[C@@H]1c1ccc(F)cc1 ZINC000587356363 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2([C@H]3C[C@H]4C[C@@H]2C[C@@](O)(C4)C3)[C@H]1c1ccc(F)cc1 ZINC000587356367 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2([C@H]3C[C@H]4C[C@@H]2C[C@@](O)(C4)C3)[C@@H]1c1ccc(F)cc1 ZINC000587356370 GI Annotated Anodyne C#CCCCO[C@@H]1CC[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587356378 GI Annotated Mild C#CCCCO[C@@H]1CC[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587356383 GI Annotated Mild C#CCCCO[C@@H]1CC[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587356389 GI Annotated Mild C#CCCCO[C@@H]1CC[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587356392 GI Annotated Mild C[C@]1(c2cc(O)cc(O)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587356519 GI Annotated Anodyne C[C@@]1(c2cc(O)cc(O)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587356521 GI Annotated Anodyne C[C@]1(c2cc(O)cc(O)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587356522 GI Annotated Anodyne C[C@@]1(c2cc(O)cc(O)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587356524 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCOc3cc(O)ccc32)[C@@H]1c1ccc(F)cc1 ZINC000587356594 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCOc3cc(O)ccc32)[C@@H]1c1ccc(F)cc1 ZINC000587356595 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCOc3cc(O)ccc32)[C@H]1c1ccc(F)cc1 ZINC000587356596 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCOc3cc(O)ccc32)[C@H]1c1ccc(F)cc1 ZINC000587356597 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(COCc3ccccc32)[C@@H]1c1ccc(F)cc1 ZINC000587356602 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(COCc3ccccc32)[C@@H]1c1ccc(F)cc1 ZINC000587356603 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(COCc3ccccc32)[C@H]1c1ccc(F)cc1 ZINC000587356604 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(COCc3ccccc32)[C@H]1c1ccc(F)cc1 ZINC000587356605 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCc3cc(O)ccc32)[C@@H]1c1ccc(F)cc1 ZINC000587356806 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCc3cc(O)ccc32)[C@@H]1c1ccc(F)cc1 ZINC000587356809 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCc3cc(O)ccc32)[C@H]1c1ccc(F)cc1 ZINC000587356812 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCc3cc(O)ccc32)[C@H]1c1ccc(F)cc1 ZINC000587356815 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCc3ccc(O)cc32)[C@@H]1c1ccc(F)cc1 ZINC000587356818 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCc3ccc(O)cc32)[C@@H]1c1ccc(F)cc1 ZINC000587356821 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCc3ccc(O)cc32)[C@H]1c1ccc(F)cc1 ZINC000587356824 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCc3ccc(O)cc32)[C@H]1c1ccc(F)cc1 ZINC000587356827 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(C=COc3cc(O)ccc32)[C@@H]1c1ccc(F)cc1 ZINC000587356909 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(C=COc3cc(O)ccc32)[C@@H]1c1ccc(F)cc1 ZINC000587356911 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(C=COc3cc(O)ccc32)[C@H]1c1ccc(F)cc1 ZINC000587356913 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(C=COc3cc(O)ccc32)[C@H]1c1ccc(F)cc1 ZINC000587356915 GI Annotated Anodyne C[C@@H]1CC2(CC[C@@]13Oc1cc(O)ccc1C(=O)[C@H]3c1ccc(F)cc1)OCCO2 ZINC000587356950 GI Annotated Anodyne C[C@@H]1CC2(CC[C@]13Oc1cc(O)ccc1C(=O)[C@@H]3c1ccc(F)cc1)OCCO2 ZINC000587356951 GI Annotated Anodyne C[C@@H]1CC2(CC[C@@]13Oc1cc(O)ccc1C(=O)[C@@H]3c1ccc(F)cc1)OCCO2 ZINC000587356952 GI Annotated Anodyne C[C@@H]1CC2(CC[C@]13Oc1cc(O)ccc1C(=O)[C@H]3c1ccc(F)cc1)OCCO2 ZINC000587356954 GI Annotated Anodyne C[C@H](O)[C@]1(Cc2ccccc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587357603 GI Annotated Anodyne C[C@H](O)[C@@]1(Cc2ccccc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587357604 GI Annotated Anodyne C[C@H](O)[C@@]1(Cc2ccccc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587357605 GI Annotated Anodyne C[C@H](O)[C@]1(Cc2ccccc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587357606 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCc3c2ccc(O)c3O)[C@@H]1c1ccc(F)cc1 ZINC000587357652 GI Annotated Clean O=C1c2ccc(O)cc2O[C@@]2(CCc3c2ccc(O)c3O)[C@H]1c1ccc(F)cc1 ZINC000587357656 GI Annotated Clean O=C1c2ccc(O)cc2O[C@]2(CCc3c2ccc(O)c3O)[C@@H]1c1ccc(F)cc1 ZINC000587357658 GI Annotated Clean O=C1c2ccc(O)cc2O[C@]2(CCc3c2ccc(O)c3O)[C@H]1c1ccc(F)cc1 ZINC000587357661 GI Annotated Clean CC1(C)[C@@H]2OCCC[C@@H]2[C@@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587357955 GI Annotated Anodyne CC1(C)[C@@H]2OCCC[C@@H]2[C@@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587357956 GI Annotated Anodyne CC1(C)[C@@H]2OCCC[C@@H]2[C@]12Oc1cc(O)ccc1C(=O)[C@H]2c1ccc(F)cc1 ZINC000587357957 GI Annotated Anodyne CC1(C)[C@@H]2OCCC[C@@H]2[C@]12Oc1cc(O)ccc1C(=O)[C@@H]2c1ccc(F)cc1 ZINC000587357958 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCc3cc(O)c(O)cc32)[C@@H]1c1ccc(F)cc1 ZINC000587358548 GI Annotated Clean O=C1c2ccc(O)cc2O[C@]2(CCc3cc(O)c(O)cc32)[C@@H]1c1ccc(F)cc1 ZINC000587358551 GI Annotated Clean O=C1c2ccc(O)cc2O[C@]2(CCc3cc(O)c(O)cc32)[C@H]1c1ccc(F)cc1 ZINC000587358552 GI Annotated Clean O=C1c2ccc(O)cc2O[C@@]2(CCc3cc(O)c(O)cc32)[C@H]1c1ccc(F)cc1 ZINC000587358554 GI Annotated Clean COP(=O)(C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1)OC ZINC000587359046 GI Annotated Anodyne COP(=O)(C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1)OC ZINC000587359058 GI Annotated Anodyne COP(=O)(C[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1)OC ZINC000587359059 GI Annotated Anodyne COP(=O)(C[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1)OC ZINC000587359061 GI Annotated Anodyne C[C@]1(c2ccc(O)c(O)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587359378 GI Annotated Clean C[C@@]1(c2ccc(O)c(O)c2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587359382 GI Annotated Clean C[C@]1(c2ccc(O)c(O)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587359386 GI Annotated Clean C[C@@]1(c2ccc(O)c(O)c2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587359389 GI Annotated Clean C#CCNC(=O)[C@H]1Cc2nc3c(oc4ccccc43)c(-c3cccc(OC)c3)c21 ZINC000587361385 GI Annotated Mild C#CCNC(=O)[C@@H]1Cc2nc3c(oc4ccccc43)c(-c3cccc(OC)c3)c21 ZINC000587361386 GI Annotated Mild O=C1c2ccc(O)cc2O[C@@]2(CCOc3ccc(O)cc32)[C@@H]1c1ccc(F)cc1 ZINC000587361430 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCOc3ccc(O)cc32)[C@@H]1c1ccc(F)cc1 ZINC000587361431 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(CCOc3ccc(O)cc32)[C@H]1c1ccc(F)cc1 ZINC000587361432 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(CCOc3ccc(O)cc32)[C@H]1c1ccc(F)cc1 ZINC000587361440 GI Annotated Anodyne CCOC(=O)c1c(NC(C)=O)sc2c1CCc1c-2nc2cccc3c2c1CC3 ZINC000587361639 GI Annotated Anodyne COc1cccc(-c2c3c(nc4c2oc2ccccc24)C[C@@H]2CC(=O)NC[C@H]32)c1 ZINC000587362024 GI Annotated Anodyne COc1cccc(-c2c3c(nc4c2oc2ccccc24)C[C@@H]2CC(=O)NC[C@@H]32)c1 ZINC000587362027 GI Annotated Anodyne COc1cccc(-c2c3c(nc4c2oc2ccccc24)C[C@H]2CC(=O)NC[C@@H]32)c1 ZINC000587362030 GI Annotated Anodyne COc1cccc(-c2c3c(nc4c2oc2ccccc24)C[C@H]2CC(=O)NC[C@H]32)c1 ZINC000587362031 GI Annotated Anodyne COc1cccc(-c2c3c(nc4c2oc2ccccc24)C[C@@H]2CNC(=O)C[C@H]32)c1 ZINC000587362139 GI Annotated Anodyne COc1cccc(-c2c3c(nc4c2oc2ccccc24)C[C@@H]2CNC(=O)C[C@@H]32)c1 ZINC000587362351 GI Annotated Anodyne COc1cccc(-c2c3c(nc4c2oc2ccccc24)C[C@H]2CNC(=O)C[C@@H]32)c1 ZINC000587362353 GI Annotated Anodyne COc1cccc(-c2c3c(nc4c2oc2ccccc24)C[C@H]2CNC(=O)C[C@H]32)c1 ZINC000587362355 GI Annotated Anodyne CCOC(=O)C(=O)c1cc(-c2cccc(OC)c2)c2oc3ccccc3c2n1 ZINC000587363156 GI Annotated Anodyne COC(=O)[C@](C)(O)c1cc(-c2cccc(OC)c2)c2oc3ccccc3c2n1 ZINC000587363307 GI Annotated Anodyne COC(=O)[C@@](C)(O)c1cc(-c2cccc(OC)c2)c2oc3ccccc3c2n1 ZINC000587363308 GI Annotated Anodyne COc1cccc(-c2cc(CN3C(=O)CCC3=O)nc3c2oc2ccccc23)c1 ZINC000587363978 GI Annotated Anodyne COc1cccc(-c2cc(-c3cnc(O)n(C)c3=O)nc3c2oc2ccccc23)c1 ZINC000587364006 GI Annotated Anodyne COCCOC(=O)Cc1cc(-c2cccc(OC)c2)c2oc3ccccc3c2n1 ZINC000587364236 GI Annotated Anodyne CCOC(=O)C(=O)Cc1cc(-c2cccc(OC)c2)c2oc3ccccc3c2n1 ZINC000587364255 GI Annotated Anodyne COc1cccc(-c2c3c(nc4c2oc2ccccc24)CS(=O)(=O)CC3)c1 ZINC000587364721 GI Annotated Anodyne COc1cccc(-c2c3c(nc4c2oc2ccccc24)CC(=O)C[C@@H]3C(=O)O)c1 ZINC000587364951 GI Annotated Anodyne COc1cccc(-c2c3c(nc4c2oc2ccccc24)CC(=O)C[C@H]3C(=O)O)c1 ZINC000587364955 GI Annotated Anodyne CCCc1cc2c(O)nc(O)nc2nc1-c1ccc(Cl)c(Br)c1 ZINC000587365111 GI Annotated Anodyne COc1cccc(-c2c(CCC(=O)O)c(C(=O)O)nc3c2oc2ccccc23)c1 ZINC000587365351 GI Annotated Anodyne COc1ccc2cc(-c3ccc4c(O)nc(O)nc4n3)ccc2c1Br ZINC000587366145 GI Annotated Anodyne CC(C)(C)c1nc2nc(O)nc(O)c2cc1Cc1cccc(Br)c1 ZINC000587366158 GI Annotated Anodyne CCc1cc2c(O)nc(O)nc2nc1-c1ccc(Cl)c(Br)c1 ZINC000587366323 GI Annotated Anodyne CC(C)(C)c1nc2nc(O)nc(O)c2cc1Cc1ccccc1Br ZINC000587367165 GI Annotated Anodyne CC(C)(C)c1nc2nc(O)nc(O)c2cc1Cc1ccc(Br)cc1 ZINC000587367580 GI Annotated Anodyne CCCCc1cc2c(O)nc(O)nc2nc1-c1ccc(OC(F)(F)F)cc1 ZINC000587367975 GI Annotated Anodyne Oc1nc(O)c2ccc(-c3cccc(OCc4c(F)cccc4Cl)c3)nc2n1 ZINC000587367990 GI Annotated Anodyne Cc1cc2c(O)nc(O)nc2nc1-c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000587368059 GI Annotated Anodyne Cc1ccc2nc(C)c(Cc3cc4c(O)nc(O)nc4nc3C)c(Cl)c2c1 ZINC000587368177 GI Annotated Anodyne Oc1nc(O)c2ccc(-c3cc(C(F)(F)F)cc(C(F)(F)F)c3)nc2n1 ZINC000587368285 GI Annotated Anodyne Cc1ccc2nc(C)c(CCc3ccc4c(O)nc(O)nc4n3)c(Cl)c2c1 ZINC000587368368 GI Annotated Anodyne COc1cc(Cl)ccc1-c1ccc(-c2ccc3c(O)nc(O)nc3n2)cc1 ZINC000587368388 GI Annotated Anodyne Oc1nc(O)c2ccc(-c3c(Cl)cc(C(F)(F)F)cc3Cl)nc2n1 ZINC000587368448 GI Annotated Anodyne Cn1c2ccc(Cl)cc2c2cc(-c3ccc4c(O)nc(O)nc4n3)ccc21 ZINC000587368469 GI Annotated Anodyne Oc1nc(O)c2ccc(-c3ccc(OCc4c(F)cccc4Cl)cc3)nc2n1 ZINC000587368505 GI Annotated Anodyne COc1cc(Cl)ccc1-c1cccc(-c2ccc3c(O)nc(O)nc3n2)c1 ZINC000587368577 GI Annotated Anodyne Cc1cccc(COc2ccc(-c3ccc4c(O)nc(O)nc4n3)cc2F)c1 ZINC000587368805 GI Annotated Anodyne Oc1nc(O)c2ccc(-c3cc(Cl)c(Cl)c(C(F)(F)F)c3)nc2n1 ZINC000587368834 GI Annotated Anodyne Oc1nc(O)c2cc3c(nc2n1)[C@@H](c1ccccc1C(F)(F)F)CCCC3 ZINC000587368938 GI Annotated Anodyne Oc1nc(O)c2cc3c(nc2n1)[C@H](c1ccccc1C(F)(F)F)CCCC3 ZINC000587368942 GI Annotated Anodyne C[C@@H](Oc1cccc(F)c1-c1ccc2c(O)nc(O)nc2n1)c1ccccc1 ZINC000587368986 GI Annotated Anodyne C[C@H](Oc1cccc(F)c1-c1ccc2c(O)nc(O)nc2n1)c1ccccc1 ZINC000587368988 GI Annotated Anodyne Cc1nc2nc(O)nc(O)c2cc1Cc1c(C)nc2c(C)cccc2c1Cl ZINC000587369032 GI Annotated Anodyne O=C(O)[C@@H]1CCCC[C@@H]1c1cc2c(O)nc(O)nc2nc1-c1ccc(Cl)cc1 ZINC000587369085 GI Annotated Anodyne Oc1nc(O)c2cc(CCc3ccccc3)c(Cc3ccc(Cl)cc3)nc2n1 ZINC000587369111 GI Annotated Anodyne Cc1nc2c(C)cccc2c(Cl)c1CCc1ccc2c(O)nc(O)nc2n1 ZINC000587369250 GI Annotated Anodyne Oc1nc(O)c2ccc(-c3ccc(C(F)(F)F)cc3C(F)(F)F)nc2n1 ZINC000587369285 GI Annotated Anodyne Oc1nc(O)c2ccc(-c3cc(C(F)(F)F)ccc3C(F)(F)F)nc2n1 ZINC000587369288 GI Annotated Anodyne CCOc1ccc(C=Nc2ccc(-c3ccc4c(O)nc(O)nc4n3)cc2)cc1 ZINC000587369363 GI Annotated Mild COc1ccc2c(c1Br)[C@]1(CC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587369980 GI Annotated Anodyne COc1ccc2c(c1Br)[C@@]1(CC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587369981 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(-n3cc(Br)cn3)cc1)O2 ZINC000587370029 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(-n3cc(Br)cn3)cc1)O2 ZINC000587370031 GI Annotated Anodyne COc1cc2c(cc1Br)CC[C@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587370072 GI Annotated Anodyne COc1cc2c(cc1Br)CC[C@@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587370073 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@H](C#N)c1ccc(Br)cc1)O2 ZINC000587370076 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@H](C#N)c1ccc(Br)cc1)O2 ZINC000587370077 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@@H](C#N)c1ccc(Br)cc1)O2 ZINC000587370078 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@@H](C#N)c1ccc(Br)cc1)O2 ZINC000587370079 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cc(Br)cnc1Cl)O2 ZINC000587370090 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cc(Br)cnc1Cl)O2 ZINC000587370091 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2cc(Br)ccc2NC12CC2 ZINC000587370236 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2cc(Br)ccc2NC12CC2 ZINC000587370237 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ncc(-c3cccc(Br)c3)[nH]1)O2 ZINC000587370267 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ncc(-c3cccc(Br)c3)[nH]1)O2 ZINC000587370268 GI Annotated Anodyne Cc1nsc(N)c1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587370318 GI Annotated Anodyne Cc1nsc(N)c1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587370320 GI Annotated Anodyne Cc1nsc(N)c1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587370322 GI Annotated Anodyne Cc1nsc(N)c1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587370323 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(O)[nH]c3cc(Br)ccc13)O2 ZINC000587370326 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(O)[nH]c3cc(Br)ccc13)O2 ZINC000587370329 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCOc3ccc(Br)cc31)O2 ZINC000587370578 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCOc3ccc(Br)cc31)O2 ZINC000587370580 GI Annotated Anodyne COC[C@H](C)n1c(C)cc([C@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587370734 GI Annotated Reactive COC[C@H](C)n1c(C)cc([C@@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587370739 GI Annotated Reactive COC[C@@H](C)n1c(C)cc([C@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587370741 GI Annotated Reactive COC[C@@H](C)n1c(C)cc([C@@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587370743 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1nc3c(C)cccn3c1Br)O2 ZINC000587371026 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1nc3c(C)cccn3c1Br)O2 ZINC000587371034 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1cc(C)n(-c3cc(C)on3)c1C)O2 ZINC000587371051 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1cc(C)n(-c3cc(C)on3)c1C)O2 ZINC000587371059 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2cc(Br)ccc2OC1(C)C ZINC000587371144 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2cc(Br)ccc2OC1(C)C ZINC000587371151 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1cc3c4c(c1)cc(O)n4CCC3)O2 ZINC000587371160 GI Annotated Reactive COc1ccc(Br)c2c1CC[C@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587371163 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1cc3c4c(c1)cc(O)n4CCC3)O2 ZINC000587371164 GI Annotated Reactive COc1ccc(Br)c2c1CC[C@@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587371165 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1nc3cc(C)ccn3c1Br)O2 ZINC000587371166 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1nc3cc(C)ccn3c1Br)O2 ZINC000587371167 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCOc3c(Br)cccc31)O2 ZINC000587371168 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCOc3c(Br)cccc31)O2 ZINC000587371170 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1c[nH]c3ncc(Br)cc13)O2 ZINC000587371321 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1c[nH]c3ncc(Br)cc13)O2 ZINC000587371324 GI Annotated Anodyne CCOc1ccc([C@@]2(CBr)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587371514 GI Annotated Reactive CCOc1ccc([C@]2(CBr)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587371517 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCNc3ccc(Br)cc31)O2 ZINC000587371573 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCNc3ccc(Br)cc31)O2 ZINC000587371577 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(OCCBr)cc1)O2 ZINC000587371644 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(OCCBr)cc1)O2 ZINC000587371662 GI Annotated Reactive C[C@H](O)[C@@]1(c2cccs2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587371666 GI Annotated Anodyne C[C@H](O)[C@@]1(c2cccs2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587371673 GI Annotated Anodyne C[C@@H](O)[C@]1(c2cccs2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587371675 GI Annotated Anodyne C[C@@H](O)[C@@]1(c2cccs2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587371677 GI Annotated Anodyne C[C@@H](O)[C@@]1(c2cccs2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587371680 GI Annotated Anodyne C[C@H](O)[C@]1(c2cccs2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587371681 GI Annotated Anodyne C[C@H](O)[C@]1(c2cccs2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587371683 GI Annotated Anodyne C[C@@H](O)[C@]1(c2cccs2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587371684 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccccc1OCCBr)O2 ZINC000587371685 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccccc1OCCBr)O2 ZINC000587371687 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@@](Cc2cccs2)(C(=O)O)[C@H]1c1ccc(F)cc1 ZINC000587371704 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@](Cc2cccs2)(C(=O)O)[C@@H]1c1ccc(F)cc1 ZINC000587371713 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@](Cc2cccs2)(C(=O)O)[C@H]1c1ccc(F)cc1 ZINC000587371714 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@](Cc2cccs2)(C(=O)O)[C@@H]1c1ccc(F)cc1 ZINC000587371715 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cnn(-c3cccc(Br)c3)c1)O2 ZINC000587371733 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cnn(-c3cccc(Br)c3)c1)O2 ZINC000587371734 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc(Br)cc1)O2 ZINC000587371781 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc(Br)cc1)O2 ZINC000587371803 GI Annotated Reactive COc1ccc(C)cc1[C@@]1(CBr)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587371815 GI Annotated Reactive COc1ccc(C)cc1[C@]1(CBr)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587371823 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@@]2(C(=O)Sc3ccccc32)[C@@H]1c1ccc(F)cc1 ZINC000587371904 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cnc3cc(C)c(Br)cn13)O2 ZINC000587371907 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cnc3cc(C)c(Br)cn13)O2 ZINC000587371908 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(C(=O)Sc3ccccc32)[C@@H]1c1ccc(F)cc1 ZINC000587371909 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@@]2(C(=O)Sc3ccccc32)[C@H]1c1ccc(F)cc1 ZINC000587371911 GI Annotated Anodyne O=C1c2ccc(O)cc2O[C@]2(C(=O)Sc3ccccc32)[C@H]1c1ccc(F)cc1 ZINC000587371978 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](CCc1cncc(Br)c1C)O2 ZINC000587371984 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](CCc1cncc(Br)c1C)O2 ZINC000587371985 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ncc(Br)cc1Cl)O2 ZINC000587371991 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ncc(Br)cc1Cl)O2 ZINC000587371992 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ncc(-c3ccc(Br)cc3)[nH]1)O2 ZINC000587372174 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ncc(-c3ccc(Br)cc3)[nH]1)O2 ZINC000587372177 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cnn(-c3ccc(Br)cc3)c1)O2 ZINC000587372190 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cnn(-c3ccc(Br)cc3)c1)O2 ZINC000587372193 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(OCCBr)c1)O2 ZINC000587372230 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(OCCBr)c1)O2 ZINC000587372232 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc3c(Br)ccc(O)c3n1)O2 ZINC000587372341 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc3c(Br)ccc(O)c3n1)O2 ZINC000587372344 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(C#N)=COc2ccc(Br)cc21 ZINC000587372365 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc(NC(=O)C(C)C)cc1)O2 ZINC000587372399 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc(NC(=O)C(C)C)cc1)O2 ZINC000587372400 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cnc3c(C)cc(Br)cn13)O2 ZINC000587372441 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cnc3c(C)cc(Br)cn13)O2 ZINC000587372443 GI Annotated Anodyne COc1ccc2[nH]c(C)c([C@@]3(CCl)CC(=O)c4cc(C)cc(N)c4O3)c2c1 ZINC000587372445 GI Annotated Reactive COc1ccc2[nH]c(C)c([C@]3(CCl)CC(=O)c4cc(C)cc(N)c4O3)c2c1 ZINC000587372446 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(C#N)=COc2ccc(Br)cc21 ZINC000587372572 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1cccc(Cl)c1)O2 ZINC000587372619 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1cccc(Cl)c1)O2 ZINC000587372622 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c[nH]nc1-c1ccc(Br)cc1)O2 ZINC000587372779 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c[nH]nc1-c1ccc(Br)cc1)O2 ZINC000587372781 GI Annotated Anodyne COc1ccc(Br)c2c1[C@]1(CC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587372790 GI Annotated Anodyne COc1ccc(Br)c2c1[C@@]1(CC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587372794 GI Annotated Anodyne CCCC(=O)Nc1ccc([C@@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587372952 GI Annotated Reactive CCCC(=O)Nc1ccc([C@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587372953 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cnc3c(Br)cc(C)cn13)O2 ZINC000587373017 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cnc3c(Br)cc(C)cn13)O2 ZINC000587373018 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1ccc3c(c1)C(C)(C)CC(=O)N3)O2 ZINC000587373089 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1ccc3c(c1)C(C)(C)CC(=O)N3)O2 ZINC000587373093 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccccc1NC(=O)CCCCl)O2 ZINC000587373298 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccccc1NC(=O)CCCCl)O2 ZINC000587373301 GI Annotated Reactive COCCCn1c(C)cc([C@@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587373469 GI Annotated Reactive COCCCn1c(C)cc([C@]2(CCl)CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587373472 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1ccccc1Cl)O2 ZINC000587373580 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1ccccc1Cl)O2 ZINC000587373582 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1oc3ccccc3c1NC(=O)CCl)O2 ZINC000587373824 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1oc3ccccc3c1NC(=O)CCl)O2 ZINC000587373828 GI Annotated Reactive COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OCCCCl ZINC000587374005 GI Annotated Reactive COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OCCCCl ZINC000587374007 GI Annotated Reactive CC1=C[C@]2(CC(=O)c3cc(C)cc(N)c3O2)c2cc(Br)ccc2O1 ZINC000587374026 GI Annotated Anodyne CC1=C[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)c2cc(Br)ccc2O1 ZINC000587374033 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCOc3c(Br)cc(C)cc31)O2 ZINC000587374066 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCOc3c(Br)cc(C)cc31)O2 ZINC000587374071 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCOc3cc(Br)ccc31)O2 ZINC000587374073 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCOc3cc(Br)ccc31)O2 ZINC000587374075 GI Annotated Anodyne CCOc1ccccc1[C@@]1(CBr)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587374151 GI Annotated Reactive CCOc1ccccc1[C@]1(CBr)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587374152 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1cc(C)n(-c3ccccn3)c1C)O2 ZINC000587374226 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1cc(C)n(-c3ccccn3)c1C)O2 ZINC000587374231 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1nc3cccc(C)n3c1Br)O2 ZINC000587374261 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1nc3cccc(C)n3c1Br)O2 ZINC000587374262 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1c[nH]c3nccc(Cl)c13)O2 ZINC000587374302 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1c[nH]c3nccc(Cl)c13)O2 ZINC000587374303 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1cc(C)n(-c3ccon3)c1C)O2 ZINC000587374342 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1cc(C)n(-c3ccon3)c1C)O2 ZINC000587374343 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)([C@@H](NC(=O)OC(C)(C)C)C(C)C)O2 ZINC000587374344 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)([C@@H](NC(=O)OC(C)(C)C)C(C)C)O2 ZINC000587374345 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(C)nc3ccc(Br)cn13)O2 ZINC000587374368 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(C)nc3ccc(Br)cn13)O2 ZINC000587374369 GI Annotated Anodyne COc1cc2occ(O)c2cc1[C@@]1(CCl)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587374417 GI Annotated Reactive COc1cc2occ(O)c2cc1[C@]1(CCl)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587374432 GI Annotated Reactive COc1ccc2c(c1Br)CC[C@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587374472 GI Annotated Anodyne COc1ccc2c(c1Br)CC[C@@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587374475 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1ccc3c(c1)CCC3)O2 ZINC000587374517 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1ccc3c(c1)CCC3)O2 ZINC000587374524 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@@](CCl)(c2cscn2)[C@H]1c1ccc(F)cc1 ZINC000587374559 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@](CCl)(c2cscn2)[C@@H]1c1ccc(F)cc1 ZINC000587374565 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@@](CCl)(c2cscn2)[C@@H]1c1ccc(F)cc1 ZINC000587374567 GI Annotated Reactive O=C1c2ccc(O)cc2O[C@](CCl)(c2cscn2)[C@H]1c1ccc(F)cc1 ZINC000587374569 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C=C(CCl)OC=C1OCc1ccccc1)O2 ZINC000587374618 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@]1(C=C(CCl)OC=C1OCc1ccccc1)O2 ZINC000587374621 GI Annotated Reactive CCOc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1Br ZINC000587375043 GI Annotated Anodyne CCOc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1Br ZINC000587375044 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cc(Br)cc([N+](=O)[O-])c1)O2 ZINC000587375056 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cc(Br)cc([N+](=O)[O-])c1)O2 ZINC000587375059 GI Annotated Bother C#CCOc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Br ZINC000587375121 GI Annotated Mild C#CCOc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Br ZINC000587375129 GI Annotated Mild O=C1c2ccc(O)cc2OC2(CSCCSC2)[C@H]1c1ccc(F)cc1 ZINC000587375230 GI Annotated Anodyne O=C1c2ccc(O)cc2OC2(CSCCSC2)[C@@H]1c1ccc(F)cc1 ZINC000587375232 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(C1(c3ccccc3)CC1)O2 ZINC000587375429 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(C1(c3ccccc3)CC1)O2 ZINC000587375430 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccccc1OCCBr)O2 ZINC000587375443 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccccc1OCCBr)O2 ZINC000587375444 GI Annotated Reactive COc1ccc([C@@]2([C@@H](C)Br)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587375490 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)[C@H]2C[C@H]3C[C@@H]1C[C@@](Br)(C3)C2 ZINC000587375492 GI Annotated Anodyne COc1ccc([C@@]2([C@H](C)Br)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587375493 GI Annotated Reactive COc1ccc([C@]2([C@@H](C)Br)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587375494 GI Annotated Reactive COc1ccc([C@]2([C@H](C)Br)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587375495 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)[C@H]2C[C@H]3C[C@@H]1C[C@@](Br)(C3)C2 ZINC000587375496 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(-n3ccnc3)c(Br)c1)O2 ZINC000587375498 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(-n3ccnc3)c(Br)c1)O2 ZINC000587375499 GI Annotated Anodyne COc1cc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1Br ZINC000587375566 GI Annotated Anodyne COc1cc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1Br ZINC000587375568 GI Annotated Anodyne COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc(OC)c1Br ZINC000587375573 GI Annotated Anodyne COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc(OC)c1Br ZINC000587375588 GI Annotated Anodyne COc1cc(OC)c([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1CCl ZINC000587375591 GI Annotated Reactive COc1cc(OC)c([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1CCl ZINC000587375595 GI Annotated Reactive COc1cc(OC)c([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Br ZINC000587375669 GI Annotated Anodyne COc1cc(OC)c([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Br ZINC000587375671 GI Annotated Anodyne COc1cc(Br)c([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587375694 GI Annotated Anodyne COc1cc(Br)c([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587375697 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(Cl)ccc1OC[C@H]1CCCO1)O2 ZINC000587375867 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(Cl)ccc1OC[C@@H]1CCCO1)O2 ZINC000587375870 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(Cl)ccc1OC[C@H]1CCCO1)O2 ZINC000587375872 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(Cl)ccc1OC[C@@H]1CCCO1)O2 ZINC000587375874 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(OCCCBr)cc1)O2 ZINC000587375986 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(OCCCBr)cc1)O2 ZINC000587375988 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](/C(C#N)=C\N(C)C)(c1ccccc1Cl)O2 ZINC000587376006 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(-n3cccn3)c(Br)c1)O2 ZINC000587376007 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(-n3cccn3)c(Br)c1)O2 ZINC000587376008 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](/C(C#N)=C\N(C)C)(c1ccccc1Cl)O2 ZINC000587376012 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](/C(C#N)=C/N(C)C)(c1ccccc1Cl)O2 ZINC000587376014 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](/C(C#N)=C/N(C)C)(c1ccccc1Cl)O2 ZINC000587376016 GI Annotated Reactive COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc(Br)c1OC ZINC000587376113 GI Annotated Anodyne COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc(Br)c1OC ZINC000587376114 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(N(C)C)c(Br)c1)O2 ZINC000587376126 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N(C)C)c(Br)c1)O2 ZINC000587376129 GI Annotated Anodyne COc1ccc(Br)c([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587376134 GI Annotated Anodyne COc1ccc(Br)c([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587376136 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(Cl)c(O)c(Br)c1)O2 ZINC000587376149 GI Annotated Anodyne COc1c([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc(Cl)c(C)c1[N+](=O)[O-] ZINC000587376155 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(Cl)c(O)c(Br)c1)O2 ZINC000587376157 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(Br)cc1[N+](=O)[O-])O2 ZINC000587376162 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(Br)cc1[N+](=O)[O-])O2 ZINC000587376164 GI Annotated Bother COc1c([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc(Cl)c(C)c1[N+](=O)[O-] ZINC000587376167 GI Annotated Bother COc1cc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1OCCCCl ZINC000587376315 GI Annotated Reactive COc1cc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1OCCCCl ZINC000587376317 GI Annotated Reactive C#CCOc1ccc(Br)cc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587376480 GI Annotated Mild C#CCOc1ccc(Br)cc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587376483 GI Annotated Mild COc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1Br ZINC000587376585 GI Annotated Anodyne COc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1Br ZINC000587376587 GI Annotated Anodyne COc1cc(Br)ccc1[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587376670 GI Annotated Anodyne COc1cc(Br)ccc1[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587376671 GI Annotated Anodyne COc1c(Br)cccc1[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587376688 GI Annotated Anodyne COc1c(Br)cccc1[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587376690 GI Annotated Anodyne CC[C@@H](Br)[C@@]1(c2ccccn2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587376707 GI Annotated Reactive COc1cc(Br)cc(OC)c1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587376721 GI Annotated Anodyne COc1cc(Br)cc(OC)c1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587376722 GI Annotated Anodyne CC[C@H](Br)[C@@]1(c2ccccn2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587376725 GI Annotated Reactive CC[C@@H](Br)[C@]1(c2ccccn2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587376727 GI Annotated Reactive CC[C@H](Br)[C@]1(c2ccccn2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587376730 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1nnn(-c3cccc(Cl)c3)c1C)O2 ZINC000587376929 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1nnn(-c3cccc(Cl)c3)c1C)O2 ZINC000587376932 GI Annotated Anodyne CCOC(=O)C[C@]1(Cc2ccccc2Cl)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587376954 GI Annotated Anodyne CCOC(=O)C[C@@]1(Cc2ccccc2Cl)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587376956 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(C)nn(Cc3ccc(Cl)cc3)c1O)O2 ZINC000587377003 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(C)nn(Cc3ccc(Cl)cc3)c1O)O2 ZINC000587377004 GI Annotated Anodyne NC(=S)[C@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587377048 GI Annotated Anodyne NC(=S)[C@@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587377053 GI Annotated Anodyne NC(=S)[C@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587377055 GI Annotated Anodyne NC(=S)[C@@]1(c2ccccc2)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587377057 GI Annotated Anodyne CCOc1ccc(Br)cc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587377089 GI Annotated Anodyne CCOc1ccc(Br)cc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587377090 GI Annotated Anodyne CCOc1cc(Br)cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1O ZINC000587377136 GI Annotated Anodyne CCOc1cc(Br)cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1O ZINC000587377140 GI Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(Cl)c(Cl)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587377185 GI Annotated Anodyne CCOC(=O)[C@]1(c2ccc(Cl)c(Cl)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587377187 GI Annotated Anodyne COc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OCCCCl ZINC000587377258 GI Annotated Reactive COc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OCCCCl ZINC000587377261 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(OCCn3ccnc3)c(Cl)c1)O2 ZINC000587377308 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(OCCn3ccnc3)c(Cl)c1)O2 ZINC000587377311 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1nnn(Cc3ccc(Cl)cc3)c1C)O2 ZINC000587377492 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1nnn(Cc3ccc(Cl)cc3)c1C)O2 ZINC000587377500 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(Br)ccc1N(C)C)O2 ZINC000587377563 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(Br)ccc1N(C)C)O2 ZINC000587377564 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(NC(=O)CCCCl)cc1)O2 ZINC000587377586 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(NC(=O)CCCCl)cc1)O2 ZINC000587377587 GI Annotated Reactive CCOc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc(Br)c1O ZINC000587377614 GI Annotated Anodyne CCOc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc(Br)c1O ZINC000587377616 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cn(-c3ccc(Cl)cc3Cl)nn1)O2 ZINC000587377633 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cn(-c3ccc(Cl)cc3Cl)nn1)O2 ZINC000587377640 GI Annotated Anodyne CCOc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Br ZINC000587377710 GI Annotated Anodyne CCOc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Br ZINC000587377712 GI Annotated Anodyne CCN1CCN(c2ccc([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)c(Cl)c2)CC1 ZINC000587377762 GI Annotated Anodyne CCN1CCN(c2ccc([C@H]3CC(=O)c4cc(C)cc(N)c4O3)c(Cl)c2)CC1 ZINC000587377763 GI Annotated Anodyne CCOc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc(Cl)c1OC(C)=O ZINC000587377770 GI Annotated Anodyne CCOc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc(Cl)c1OC(C)=O ZINC000587377771 GI Annotated Anodyne COc1c([N+](=O)[O-])cc(Cl)cc1[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587377782 GI Annotated Bother COc1c([N+](=O)[O-])cc(Cl)cc1[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587377785 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cn(-c3ccc(Cl)c(Cl)c3)nn1)O2 ZINC000587377856 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cn(-c3ccc(Cl)c(Cl)c3)nn1)O2 ZINC000587377858 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](/C(C#N)=C/N(C)C)(c1ccc(Cl)cc1)O2 ZINC000587377947 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](/C(C#N)=C\N(C)C)(c1ccc(Cl)cc1)O2 ZINC000587377949 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](/C(C#N)=C/N(C)C)(c1ccc(Cl)cc1)O2 ZINC000587377951 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](/C(C#N)=C\N(C)C)(c1ccc(Cl)cc1)O2 ZINC000587377953 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(Br)cc1N(C)C)O2 ZINC000587378033 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(Br)cc1N(C)C)O2 ZINC000587378036 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cccc(Br)c1[N+](=O)[O-])O2 ZINC000587378047 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cccc(Br)c1[N+](=O)[O-])O2 ZINC000587378049 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@H](C#N)c1cccc(Br)c1)O2 ZINC000587378147 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@H](C#N)c1cccc(Br)c1)O2 ZINC000587378149 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@@H](C#N)c1cccc(Br)c1)O2 ZINC000587378151 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@@H](C#N)c1cccc(Br)c1)O2 ZINC000587378153 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(NC(=O)C(C)(C)C)ccnc1Cl)O2 ZINC000587378188 GI Annotated Anodyne COc1cc(Br)c([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c(OC)c1 ZINC000587378191 GI Annotated Anodyne COc1cc(Br)c([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c(OC)c1 ZINC000587378193 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(NC(=O)C(C)(C)C)ccnc1Cl)O2 ZINC000587378195 GI Annotated Anodyne COc1cc(Br)cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1OC ZINC000587378216 GI Annotated Anodyne COc1cc(Br)cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1OC ZINC000587378218 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(CCC(=O)O)=COc2ccc(Cl)cc21 ZINC000587378233 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(CCC(=O)O)=COc2ccc(Cl)cc21 ZINC000587378242 GI Annotated Anodyne COc1cccc(Br)c1[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587378261 GI Annotated Anodyne COc1cccc(Br)c1[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587378262 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(Br)cccc1N(C)C)O2 ZINC000587378297 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(Br)cccc1N(C)C)O2 ZINC000587378299 GI Annotated Anodyne Cc1nc(O)sc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587378518 GI Annotated Anodyne Cc1nc(O)sc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@@H]1c1ccc(F)cc1 ZINC000587378519 GI Annotated Anodyne Cc1nc(O)sc1[C@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587378520 GI Annotated Anodyne Cc1nc(O)sc1[C@@]1(C)Oc2cc(O)ccc2C(=O)[C@H]1c1ccc(F)cc1 ZINC000587378521 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c([N+](=O)[O-])ccc(Br)c1C)O2 ZINC000587378599 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c([N+](=O)[O-])ccc(Br)c1C)O2 ZINC000587378603 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(Cl)cc1)(c1c[nH]c(C(=O)O)c1)O2 ZINC000587378618 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(Cl)cc1)(c1c[nH]c(C(=O)O)c1)O2 ZINC000587378644 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cccc(Cl)c1)(c1cc(C=O)n(C)c1)O2 ZINC000587378659 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1cccc(Cl)c1)(c1cc(C=O)n(C)c1)O2 ZINC000587378676 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cn(-c3cccc(Cl)c3Cl)nn1)O2 ZINC000587378733 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cn(-c3cccc(Cl)c3Cl)nn1)O2 ZINC000587378735 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cc(Br)ccc1[N+](=O)[O-])O2 ZINC000587378941 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cc(Br)ccc1[N+](=O)[O-])O2 ZINC000587378942 GI Annotated Bother COc1ccc(Br)cc1[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587378979 GI Annotated Anodyne COc1ccc(Br)cc1[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587378980 GI Annotated Anodyne CCOc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c(Br)cc1O ZINC000587378981 GI Annotated Anodyne CCOc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c(Br)cc1O ZINC000587378982 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(Br)c([N+](=O)[O-])c1)O2 ZINC000587378985 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(Br)c([N+](=O)[O-])c1)O2 ZINC000587378986 GI Annotated Bother CCOc1cc(Br)ccc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587379000 GI Annotated Anodyne CCOc1cc(Br)ccc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587379001 GI Annotated Anodyne COc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c(Br)c1 ZINC000587379004 GI Annotated Anodyne COc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c(Br)c1 ZINC000587379005 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ncc(Cl)cc1Br)O2 ZINC000587379014 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ncc(Cl)cc1Br)O2 ZINC000587379015 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(Cl)cc(Br)c1O)O2 ZINC000587379019 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(Cl)cc(Br)c1O)O2 ZINC000587379020 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CC(=O)Oc3c(Cl)cc(Cl)cc31)O2 ZINC000587379036 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CC(=O)Oc3c(Cl)cc(Cl)cc31)O2 ZINC000587379047 GI Annotated Anodyne COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c(OC)cc1Br ZINC000587379188 GI Annotated Anodyne COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c(OC)cc1Br ZINC000587379191 GI Annotated Anodyne CSc1nccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)n1 ZINC000587379334 GI Annotated Anodyne CSc1nccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)n1 ZINC000587379336 GI Annotated Anodyne CSc1nccc([C@]2(C)Oc3cc(O)ccc3C(=O)[C@@H]2c2ccc(F)cc2)n1 ZINC000587379339 GI Annotated Anodyne CSc1nccc([C@@]2(C)Oc3cc(O)ccc3C(=O)[C@H]2c2ccc(F)cc2)n1 ZINC000587379340 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CC(=O)N(C)Cc1ccccc1Cl)O2 ZINC000587379355 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CC(=O)N(C)Cc1ccccc1Cl)O2 ZINC000587379356 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cccc(O)c1)(c1cc(Cl)ccc1N)O2 ZINC000587379470 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1cccc(O)c1)(c1cc(Cl)ccc1N)O2 ZINC000587379472 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc3cc4c(cc3nc1Cl)OCO4)O2 ZINC000587379545 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc3cc4c(cc3nc1Cl)OCO4)O2 ZINC000587379549 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CC(=O)N(C)Cc1cccc(Cl)c1)O2 ZINC000587379556 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CC(=O)N(C)Cc1cccc(Cl)c1)O2 ZINC000587379557 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(NC(=O)C(C)(C)C)c(Cl)n1)O2 ZINC000587379852 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(NC(=O)C(C)(C)C)c(Cl)n1)O2 ZINC000587379854 GI Annotated Anodyne COc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Cn1cc(Cl)cn1 ZINC000587379916 GI Annotated Anodyne COc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Cn1cc(Cl)cn1 ZINC000587379917 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(CCN(c3nc4cc(Cl)ccc4o3)CC1)O2 ZINC000587380053 GI Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(C(F)(F)F)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587380122 GI Annotated Anodyne CCOC(=O)[C@]1(c2ccc(C(F)(F)F)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587380123 GI Annotated Anodyne Cc1ccc([C@@]2(COCC(F)(F)F)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587380206 GI Annotated Anodyne Cc1ccc([C@]2(COCC(F)(F)F)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587380209 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccccc1C#N)(c1cccnc1Cl)O2 ZINC000587380253 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1C#N)(c1cccnc1Cl)O2 ZINC000587380254 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1nnn(-c3ccc(Cl)cc3)c1C)O2 ZINC000587380257 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1nnn(-c3ccc(Cl)cc3)c1C)O2 ZINC000587380258 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc3cc4c(cc3nc1Cl)OCCO4)O2 ZINC000587380281 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc3cc4c(cc3nc1Cl)OCCO4)O2 ZINC000587380311 GI Annotated Anodyne COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OCC(F)(F)F ZINC000587380454 GI Annotated Anodyne COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OCC(F)(F)F ZINC000587380457 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1ccc(F)c(F)c1)O2 ZINC000587380492 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1ccc(F)c(F)c1)O2 ZINC000587380503 GI Annotated Reactive CCOC(=O)C[C@]1(c2ccc(F)c(Cl)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587380554 GI Annotated Anodyne CCOC(=O)C[C@@]1(c2ccc(F)c(Cl)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587380565 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(/C=C\C(=O)O)=COc2ccc(Cl)cc21 ZINC000587380592 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(/C=C/C(=O)O)=COc2ccc(Cl)cc21 ZINC000587380598 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(/C=C\C(=O)O)=COc2ccc(Cl)cc21 ZINC000587380603 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(/C=C/C(=O)O)=COc2ccc(Cl)cc21 ZINC000587380606 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(Cl)nc1NC(=O)C(C)(C)C)O2 ZINC000587380611 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(Cl)nc1NC(=O)C(C)(C)C)O2 ZINC000587380613 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CC#N)(c1ccc(Br)cc1F)O2 ZINC000587380722 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](CC#N)(c1ccc(Br)cc1F)O2 ZINC000587380724 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](CC#N)(c1ccccc1OC(F)(F)F)O2 ZINC000587380778 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](CC#N)(c1ccccc1OC(F)(F)F)O2 ZINC000587380779 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc([N+](=O)[O-])c(Br)cc1F)O2 ZINC000587380907 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc([N+](=O)[O-])c(Br)cc1F)O2 ZINC000587380917 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1nc(N(C)C)n(-c3ccccc3)c1Cl)O2 ZINC000587380953 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1nc(N(C)C)n(-c3ccccc3)c1Cl)O2 ZINC000587380955 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cc(F)ccc1F)([C@@H](C)Br)O2 ZINC000587380984 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](c1cc(F)ccc1F)([C@@H](C)Br)O2 ZINC000587380985 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](c1cc(F)ccc1F)([C@H](C)Br)O2 ZINC000587380987 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cc(F)ccc1F)([C@H](C)Br)O2 ZINC000587380989 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cnn(-c3ccc(Cl)cn3)c1C)O2 ZINC000587381000 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cnn(-c3ccc(Cl)cn3)c1C)O2 ZINC000587381003 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(Br)cc(F)c(F)c1F)O2 ZINC000587381011 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(Br)cc(F)c(F)c1F)O2 ZINC000587381015 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(F)ccc(C3OCCO3)c1Cl)O2 ZINC000587381034 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(F)ccc(C3OCCO3)c1Cl)O2 ZINC000587381035 GI Annotated Anodyne COC(=O)C[C@]1(c2ccc(C(F)(F)F)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587381123 GI Annotated Anodyne COC(=O)C[C@@]1(c2ccc(C(F)(F)F)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587381124 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(-n3ccc(C(F)(F)F)n3)cc1)O2 ZINC000587381198 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(-n3ccc(C(F)(F)F)n3)cc1)O2 ZINC000587381202 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc3c(C(F)(F)F)nn(C)c3s1)O2 ZINC000587381214 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc3c(C(F)(F)F)nn(C)c3s1)O2 ZINC000587381221 GI Annotated Anodyne COc1cc(Br)cc(F)c1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587381277 GI Annotated Anodyne COc1cc(Br)cc(F)c1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587381281 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1c(F)cccc1F)O2 ZINC000587381300 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1c(F)cccc1F)O2 ZINC000587381302 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1ccc(F)c(C)c1)O2 ZINC000587381357 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1ccc(F)c(C)c1)O2 ZINC000587381358 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(Br)c(F)cc1[N+](=O)[O-])O2 ZINC000587381369 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(Br)c(F)cc1[N+](=O)[O-])O2 ZINC000587381370 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@](CCC(=O)O)(c1ccc(F)c(Cl)c1)O2 ZINC000587381574 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCC(=O)O)(c1ccc(F)c(Cl)c1)O2 ZINC000587381576 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1ccc(C)c(F)c1)O2 ZINC000587381658 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1ccc(C)c(F)c1)O2 ZINC000587381660 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(F)cc(Br)c(F)c1F)O2 ZINC000587381668 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(F)cc(Br)c(F)c1F)O2 ZINC000587381669 GI Annotated Anodyne COc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c(C(F)(F)F)c1OC ZINC000587381694 GI Annotated Anodyne COc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c(C(F)(F)F)c1OC ZINC000587381695 GI Annotated Anodyne COC(=O)C[C@]1(c2ccccc2C(F)(F)F)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587381742 GI Annotated Anodyne COC(=O)C[C@@]1(c2ccccc2C(F)(F)F)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587381743 GI Annotated Anodyne COC(=O)C[C@]1(c2cccc(C(F)(F)F)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587381744 GI Annotated Anodyne COC(=O)C[C@@]1(c2cccc(C(F)(F)F)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587381745 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CC(=O)Nc1cccc(C(F)(F)F)c1)O2 ZINC000587381769 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CC(=O)Nc1cccc(C(F)(F)F)c1)O2 ZINC000587381770 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(F)c(Br)c1F)O2 ZINC000587381835 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(F)c(Br)c1F)O2 ZINC000587381838 GI Annotated Anodyne COc1cc(F)c([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Br ZINC000587381853 GI Annotated Anodyne COc1cc(F)c([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Br ZINC000587381855 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cc(Br)c(F)cc1F)O2 ZINC000587381915 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cc(Br)c(F)cc1F)O2 ZINC000587381916 GI Annotated Anodyne COc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1COCC(F)(F)F ZINC000587382009 GI Annotated Anodyne COc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1COCC(F)(F)F ZINC000587382010 GI Annotated Anodyne COc1c(Br)ccc(F)c1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587382045 GI Annotated Anodyne COc1c(Br)ccc(F)c1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587382047 GI Annotated Anodyne COc1ccc(Br)c([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1F ZINC000587382049 GI Annotated Anodyne COc1ccc(Br)c([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1F ZINC000587382050 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1nc3cc(C(F)(F)F)ccc3n1C)O2 ZINC000587382231 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1nc3cc(C(F)(F)F)ccc3n1C)O2 ZINC000587382232 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CCC(=O)O)(c1ccc(Cl)c(F)c1)O2 ZINC000587382327 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCC(=O)O)(c1ccc(Cl)c(F)c1)O2 ZINC000587382328 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CC#N)(c1ccc(OC(F)(F)F)cc1)O2 ZINC000587382341 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](CC#N)(c1ccc(OC(F)(F)F)cc1)O2 ZINC000587382342 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1cc(F)ccc1F)O2 ZINC000587382361 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1cc(F)ccc1F)O2 ZINC000587382363 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(Cl)c(=O)n(Cc3ccccc3)c1)O2 ZINC000587382418 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(Cl)c(=O)n(Cc3ccccc3)c1)O2 ZINC000587382421 GI Annotated Anodyne CCOC(=O)[C@@]1(c2cccc(C(F)(F)F)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587382430 GI Annotated Anodyne CCOC(=O)[C@]1(c2cccc(C(F)(F)F)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587382431 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1cccnc1)(c1c(F)cc(F)cc1F)O2 ZINC000587382442 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cccnc1)(c1c(F)cc(F)cc1F)O2 ZINC000587382449 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1c(F)cc(Br)cc1F)O2 ZINC000587382481 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1c(F)cc(Br)cc1F)O2 ZINC000587382482 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CC#N)(c1cc(C)n(CC(F)(F)F)c1C)O2 ZINC000587382628 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](CC#N)(c1cc(C)n(CC(F)(F)F)c1C)O2 ZINC000587382636 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C/N(C)C)(c1cccc(OC(F)F)c1)O2 ZINC000587382659 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C\N(C)C)(c1cccc(OC(F)F)c1)O2 ZINC000587382666 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C\N(C)C)(c1cccc(OC(F)F)c1)O2 ZINC000587382668 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C/N(C)C)(c1cccc(OC(F)F)c1)O2 ZINC000587382672 GI Annotated Anodyne COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c(Br)cc1F ZINC000587382689 GI Annotated Anodyne COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c(Br)cc1F ZINC000587382690 GI Annotated Anodyne COC(=O)[C@]1(c2c(Cl)ccc(F)c2Cl)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587382701 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)Nc2c(C(F)(F)F)cc(Cl)cc21 ZINC000587382703 GI Annotated Anodyne COC(=O)[C@@]1(c2c(Cl)ccc(F)c2Cl)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587382704 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)Nc2c(C(F)(F)F)cc(Cl)cc21 ZINC000587382708 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](C(F)(F)C(F)(F)C(F)(F)C(F)F)O2 ZINC000587382785 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@H](C(F)(F)C(F)(F)C(F)(F)C(F)F)O2 ZINC000587382786 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cnn(-c3ccc(C(F)(F)F)cc3)c1)O2 ZINC000587382788 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cnn(-c3ccc(C(F)(F)F)cc3)c1)O2 ZINC000587382789 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(Br)c(F)c(F)c1O)O2 ZINC000587382897 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(Br)c(F)c(F)c1O)O2 ZINC000587382913 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C\N(C)C)(c1ccc(OC(F)F)cc1)O2 ZINC000587382927 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C\N(C)C)(c1ccc(OC(F)F)cc1)O2 ZINC000587382929 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](/C=C/N(C)C)(c1ccc(OC(F)F)cc1)O2 ZINC000587382931 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](/C=C/N(C)C)(c1ccc(OC(F)F)cc1)O2 ZINC000587382933 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(CCN(Cc3c(F)cccc3Cl)CC1)O2 ZINC000587382971 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(Cc1ccc(Br)cc1F)O2 ZINC000587383104 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(Cc1ccc(Br)cc1F)O2 ZINC000587383105 GI Annotated Anodyne COc1c(Br)ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1F ZINC000587383219 GI Annotated Anodyne COc1c(Br)ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1F ZINC000587383221 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(F)cc1)([C@H]1CCC[C@@H](C(=O)O)C1)O2 ZINC000587383245 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(F)cc1)([C@H]1CCC[C@@H](C(=O)O)C1)O2 ZINC000587383248 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(Cn1nc(C(F)(F)F)cc1C1CC1)O2 ZINC000587383256 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(Cn1nc(C(F)(F)F)cc1C1CC1)O2 ZINC000587383260 GI Annotated Anodyne COC(=O)C1(c2ccc(F)cc2)CCC2(CC1)CC(=O)c1cc(C)cc(N)c1O2 ZINC000587383362 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(OC(F)F)c(OC(F)F)c1)O2 ZINC000587383526 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(OC(F)F)c(OC(F)F)c1)O2 ZINC000587383527 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])O2 ZINC000587383547 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](C)(Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])O2 ZINC000587383548 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cnn(-c3cccc(C(F)(F)F)c3)c1)O2 ZINC000587383576 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cnn(-c3cccc(C(F)(F)F)c3)c1)O2 ZINC000587383583 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CC(=O)Nc1ccccc1C(F)(F)F)O2 ZINC000587383584 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CC(=O)Nc1ccccc1C(F)(F)F)O2 ZINC000587383585 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(C(F)(F)F)nn1[C@H]1CCCCO1)O2 ZINC000587383635 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(C(F)(F)F)nn1[C@H]1CCCCO1)O2 ZINC000587383637 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(C(F)(F)F)nn1[C@@H]1CCCCO1)O2 ZINC000587383640 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(C(F)(F)F)nn1[C@@H]1CCCCO1)O2 ZINC000587383641 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(-n3cc(C(F)(F)F)cn3)cc1)O2 ZINC000587383650 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(-n3cc(C(F)(F)F)cn3)cc1)O2 ZINC000587383651 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(Br)=COc2ccc(F)cc21 ZINC000587383658 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(Br)=COc2ccc(F)cc21 ZINC000587383672 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1cccc(C(F)(F)F)c1)([C@H](F)C#N)O2 ZINC000587383691 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cccc(C(F)(F)F)c1)([C@@H](F)C#N)O2 ZINC000587383694 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cccc(C(F)(F)F)c1)([C@H](F)C#N)O2 ZINC000587383697 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](c1cccc(C(F)(F)F)c1)([C@@H](F)C#N)O2 ZINC000587383700 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1nc3cc(C(F)(F)F)ccc3n1C)O2 ZINC000587383815 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1nc3cc(C(F)(F)F)ccc3n1C)O2 ZINC000587383816 GI Annotated Anodyne COc1cc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1OCC(F)F ZINC000587383831 GI Annotated Anodyne COc1cc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1OCC(F)F ZINC000587383832 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCBr)(c1ccc(F)cc1)O2 ZINC000587383845 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCBr)(c1ccc(F)cc1)O2 ZINC000587383849 GI Annotated Reactive CCOC(=O)c1[nH]c2ccc(F)cc2c1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587383937 GI Annotated Anodyne CCOC(=O)c1[nH]c2ccc(F)cc2c1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587383940 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(F)cc1)([C@H]1CC[C@@H](C(=O)O)C1)O2 ZINC000587383963 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(F)cc1)([C@H]1CC[C@@H](C(=O)O)C1)O2 ZINC000587383965 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(-c3ccc(F)cc3)nc3ncccn13)O2 ZINC000587384020 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(-c3ccc(F)cc3)nc3ncccn13)O2 ZINC000587384021 GI Annotated Anodyne COc1ccc2c(c1)OC(C(F)(F)F)=C[C@@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587384161 GI Annotated Anodyne COc1ccc2c(c1)OC(C(F)(F)F)=C[C@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587384166 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(Cc1ccc(F)cc1Br)O2 ZINC000587384239 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(Cc1ccc(F)cc1Br)O2 ZINC000587384241 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CC(C)(C)Cc3[nH]nc(C(F)(F)F)c31)O2 ZINC000587384288 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CC(C)(C)Cc3[nH]nc(C(F)(F)F)c31)O2 ZINC000587384289 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cn(CCC#N)nc1-c1ccc(F)cc1)O2 ZINC000587384376 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cn(CCC#N)nc1-c1ccc(F)cc1)O2 ZINC000587384377 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1cccc(F)c1F)O2 ZINC000587384419 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1cccc(F)c1F)O2 ZINC000587384420 GI Annotated Reactive CCOc1ccc(-c2n[nH]cc2[C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1F ZINC000587384665 GI Annotated Anodyne CCOc1ccc(-c2n[nH]cc2[C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1F ZINC000587384666 GI Annotated Anodyne CCOC(=O)CCC[C@]1(c2ccc(F)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587384747 GI Annotated Anodyne CCOC(=O)CCC[C@@]1(c2ccc(F)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587384748 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCc3cc(F)c(Br)cc31)O2 ZINC000587384775 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCc3cc(F)c(Br)cc31)O2 ZINC000587384776 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](Cc1ncc[nH]1)(c1ccc(Cl)cc1F)O2 ZINC000587384789 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](Cc1ncc[nH]1)(c1ccc(Cl)cc1F)O2 ZINC000587384791 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1F)([C@@H](C)Br)O2 ZINC000587384798 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1F)([C@H](C)Br)O2 ZINC000587384799 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccccc1F)([C@H](C)Br)O2 ZINC000587384800 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccccc1F)([C@@H](C)Br)O2 ZINC000587384802 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](COC(=O)c1ccccc1F)(C(C)(C)C)O2 ZINC000587384827 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](COC(=O)c1ccccc1F)(C(C)(C)C)O2 ZINC000587384832 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(F)ccc1N1C[C@H](C)O[C@H](C)C1)O2 ZINC000587384892 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(F)ccc1N1C[C@H](C)O[C@H](C)C1)O2 ZINC000587384893 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(F)cc1F)([C@@H](C)Br)O2 ZINC000587384894 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(F)cc1F)([C@@H](C)Br)O2 ZINC000587384895 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(F)cc1F)([C@H](C)Br)O2 ZINC000587384896 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(F)cc1F)([C@H](C)Br)O2 ZINC000587384897 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCc3c(Br)cc(F)cc31)O2 ZINC000587384936 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCc3c(Br)cc(F)cc31)O2 ZINC000587384938 GI Annotated Anodyne C=C(C)COCCNc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587384984 GI Annotated Mild C=C(C)COCCNc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587384995 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(Cc1cc(F)ccc1Br)O2 ZINC000587385000 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(Cc1cc(F)ccc1Br)O2 ZINC000587385001 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(Br)=COc2cc(F)ccc21 ZINC000587385049 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(Br)=COc2cc(F)ccc21 ZINC000587385051 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCc3c1cnn3-c1ccc(F)cc1)O2 ZINC000587385052 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCc3c1cnn3-c1ccc(F)cc1)O2 ZINC000587385056 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@@H](Br)Cc1ccccc1F)O2 ZINC000587385119 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@H](Br)Cc1ccccc1F)O2 ZINC000587385123 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](C)([C@H](Br)Cc1ccccc1F)O2 ZINC000587385128 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(F)cc1)(c1ccccc1C(=O)O)O2 ZINC000587385129 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)([C@@H](Br)Cc1ccccc1F)O2 ZINC000587385130 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(F)cc1)(c1ccccc1C(=O)O)O2 ZINC000587385133 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1cc(F)cc(F)c1)O2 ZINC000587385350 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1cc(F)cc(F)c1)O2 ZINC000587385351 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(F)cc1)([C@@H]1CC[C@@H](C(=O)O)CC1)O2 ZINC000587385444 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(F)cc1)([C@@H]1CC[C@@H](C(=O)O)CC1)O2 ZINC000587385445 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(F)c(I)c1)O2 ZINC000587385490 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(F)c(I)c1)O2 ZINC000587385498 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(Cc1ccc(Br)c(F)c1)O2 ZINC000587385536 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(Cc1ccc(Br)c(F)c1)O2 ZINC000587385539 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(F)cc1)([C@@H](C)Br)O2 ZINC000587385584 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(F)cc1)([C@H](C)Br)O2 ZINC000587385585 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(F)cc1)([C@H](C)Br)O2 ZINC000587385586 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(F)cc1)([C@@H](C)Br)O2 ZINC000587385587 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccccc1I)O2 ZINC000587385633 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccccc1I)O2 ZINC000587385634 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2ccccc2C(=O)c2c(F)ccc(F)c21 ZINC000587385651 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2ccccc2C(=O)c2c(F)ccc(F)c21 ZINC000587385652 GI Annotated Anodyne CCN(CC)Cc1cc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1OC ZINC000587385669 GI Annotated Anodyne CCN(CC)Cc1cc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)ccc1OC ZINC000587385676 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(I)s1)O2 ZINC000587385686 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(I)s1)O2 ZINC000587385690 GI Annotated Anodyne CNc1cccc2c1[C@]1(CC(=O)c3cc(C)cc(N)c3O1)c1ccccc1C2=O ZINC000587385696 GI Annotated Anodyne CNc1cccc2c1[C@@]1(CC(=O)c3cc(C)cc(N)c3O1)c1ccccc1C2=O ZINC000587385697 GI Annotated Anodyne CCOC(=O)C[C@]1(c2ccc(Cl)cc2F)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587385749 GI Annotated Anodyne CCOC(=O)C[C@@]1(c2ccc(Cl)cc2F)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587385752 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(C)nn(-c3ccc(F)cc3F)c1C)O2 ZINC000587385768 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(C)nn(-c3ccc(F)cc3F)c1C)O2 ZINC000587385769 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCc3cc(Br)cc(F)c31)O2 ZINC000587385836 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCc3cc(Br)cc(F)c31)O2 ZINC000587385839 GI Annotated Anodyne COC(C)(Cc1cccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c1F)OC ZINC000587386190 GI Annotated Anodyne COC(C)(Cc1cccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c1F)OC ZINC000587386193 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCOc3c(F)cc(Br)cc31)O2 ZINC000587386278 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCc3cc(F)cc(Br)c31)O2 ZINC000587386283 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCc3cc(F)cc(Br)c31)O2 ZINC000587386284 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCOc3c(F)cc(Br)cc31)O2 ZINC000587386288 GI Annotated Anodyne COC(=O)CCCC[C@]1(c2ccc(F)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587386298 GI Annotated Anodyne COC(=O)CCCC[C@@]1(c2ccc(F)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587386299 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(F)cc(I)c1)O2 ZINC000587386301 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(F)cc(I)c1)O2 ZINC000587386303 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CBr)(c1ccc(F)cc1F)O2 ZINC000587386613 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CBr)(c1ccc(F)cc1F)O2 ZINC000587386614 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2ccccc2C(=O)c2cc(CC#N)ccc21 ZINC000587386617 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2ccccc2C(=O)c2cc(CC#N)ccc21 ZINC000587386618 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCCC[C@@H]1CNC(=O)OC(C)(C)C)O2 ZINC000587386854 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCCC[C@H]1CNC(=O)OC(C)(C)C)O2 ZINC000587386855 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCCC[C@H]1CNC(=O)OC(C)(C)C)O2 ZINC000587386856 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCCC[C@@H]1CNC(=O)OC(C)(C)C)O2 ZINC000587386857 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(I)ccc1F)O2 ZINC000587386935 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(I)ccc1F)O2 ZINC000587386937 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(I)cc1)O2 ZINC000587386949 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(I)cc1)O2 ZINC000587386950 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](CCc1cc(F)ccc1Br)O2 ZINC000587387005 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](CCc1cc(F)ccc1Br)O2 ZINC000587387007 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(CNC(=O)OC(C)(C)C)c1)O2 ZINC000587387194 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(CNC(=O)OC(C)(C)C)c1)O2 ZINC000587387195 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(F)ccc1I)O2 ZINC000587387260 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(F)ccc1I)O2 ZINC000587387261 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(I)cc1F)O2 ZINC000587387277 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(I)cc1F)O2 ZINC000587387278 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCc3c(Br)ccc(F)c31)O2 ZINC000587387287 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCc3c(Br)ccc(F)c31)O2 ZINC000587387288 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(CCNC(=O)OC(C)(C)C)cc1)O2 ZINC000587387352 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(CCNC(=O)OC(C)(C)C)cc1)O2 ZINC000587387353 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(CNC(=O)OC(C)(C)C)cc1)O2 ZINC000587387356 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(CNC(=O)OC(C)(C)C)cc1)O2 ZINC000587387357 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(I)c(F)c1)O2 ZINC000587387376 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(I)c(F)c1)O2 ZINC000587387377 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(F)c1I)O2 ZINC000587387378 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(F)c1I)O2 ZINC000587387379 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cccc(I)c1)O2 ZINC000587387503 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cccc(I)c1)O2 ZINC000587387504 GI Annotated Anodyne COc1ccc([C@@]2(c3ccc(C#N)cc3)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587387637 GI Annotated Mild COc1ccc([C@]2(c3ccc(C#N)cc3)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587387639 GI Annotated Mild C=CCN(CC=C)Cc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OC ZINC000587387650 GI Annotated Mild C=CCN(CC=C)Cc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OC ZINC000587387653 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(F)cccc1I)O2 ZINC000587387761 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(F)cccc1I)O2 ZINC000587387762 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1c(C)cccc1I)O2 ZINC000587387775 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1c(C)cccc1I)O2 ZINC000587387776 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCc3c(F)ccc(Br)c31)O2 ZINC000587387982 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCc3c(F)ccc(Br)c31)O2 ZINC000587387983 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCc3c(F)cc(Br)cc31)O2 ZINC000587387986 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCc3c(F)cc(Br)cc31)O2 ZINC000587387987 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2ccccc2C(=O)c2ccc(CC#N)cc21 ZINC000587388030 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2ccccc2C(=O)c2ccc(CC#N)cc21 ZINC000587388031 GI Annotated Mild CNc1cccc2c1C(=O)c1ccccc1[C@@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587388069 GI Annotated Clean CNc1cccc2c1C(=O)c1ccccc1[C@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587388070 GI Annotated Clean COc1cccc(NC(=O)C(C)(C)C)c1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587388093 GI Annotated Anodyne COc1cccc(NC(=O)C(C)(C)C)c1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587388094 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](C[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1)O2 ZINC000587388226 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](C[C@@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1)O2 ZINC000587388227 GI Annotated Anodyne CCN(CC)C(=O)Nc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587388242 GI Annotated Anodyne CCN(CC)C(=O)Nc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587388243 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(-c3ccc([N+](=O)[O-])cn3)cc1)O2 ZINC000587388413 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(-c3ccc([N+](=O)[O-])cn3)cc1)O2 ZINC000587388416 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccccc1)(c1ccc3oc(=N)[nH]c3c1)O2 ZINC000587388504 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1)(c1ccc3oc(=N)[nH]c3c1)O2 ZINC000587388505 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc3nccc(NC(=O)C(C)(C)C)c3o1)O2 ZINC000587388518 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc3nccc(NC(=O)C(C)(C)C)c3o1)O2 ZINC000587388519 GI Annotated Anodyne COc1cc([N+](=O)[O-])ccc1-c1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)o1 ZINC000587388567 GI Annotated Bother COc1cc([N+](=O)[O-])ccc1-c1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)o1 ZINC000587388568 GI Annotated Bother CCN1CCC[C@H]1Cn1c(C)cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587388645 GI Annotated Anodyne CCN1CCC[C@H]1Cn1c(C)cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587388647 GI Annotated Anodyne CCN1CCC[C@@H]1Cn1c(C)cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587388648 GI Annotated Anodyne CCN1CCC[C@@H]1Cn1c(C)cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1C ZINC000587388649 GI Annotated Anodyne CCc1cccc2c([C@@]3(C)CC(=O)c4cc(C)cc(N)c4O3)cn(CC(=O)O)c12 ZINC000587388794 GI Annotated Anodyne CCc1cccc2c([C@]3(C)CC(=O)c4cc(C)cc(N)c4O3)cn(CC(=O)O)c12 ZINC000587388797 GI Annotated Anodyne COc1ccc(Cn2nc(C)c([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)c2C)cc1 ZINC000587388818 GI Annotated Anodyne COc1ccc(Cn2nc(C)c([C@H]3CC(=O)c4cc(C)cc(N)c4O3)c2C)cc1 ZINC000587388825 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccn1-c1cccc([N+](=O)[O-])c1C)O2 ZINC000587388830 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccn1-c1cccc([N+](=O)[O-])c1C)O2 ZINC000587388841 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cn([C@H](C)C(=O)O)c3ccccc13)O2 ZINC000587388850 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cn([C@H](C)C(=O)O)c3ccccc13)O2 ZINC000587388853 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cn([C@@H](C)C(=O)O)c3ccccc13)O2 ZINC000587388856 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cn([C@@H](C)C(=O)O)c3ccccc13)O2 ZINC000587388857 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccnc1-c1cccc([N+](=O)[O-])c1)O2 ZINC000587388883 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccnc1-c1cccc([N+](=O)[O-])c1)O2 ZINC000587388884 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc([N+](=O)[O-])ccc1N1CCCCC1)O2 ZINC000587388918 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc([N+](=O)[O-])ccc1N1CCCCC1)O2 ZINC000587388920 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C=C(c3ccccc3)Oc3ccc(N)cc31)O2 ZINC000587389029 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C=C(c3ccccc3)Oc3ccc(N)cc31)O2 ZINC000587389032 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(C)n(-c3ccc4c(c3)OCO4)c1C)O2 ZINC000587389039 GI Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(C)n(-c3ccc4c(c3)OCO4)c1C)O2 ZINC000587389041 GI Annotated Clean COc1ccc([N+](=O)[O-])cc1-c1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)o1 ZINC000587389100 GI Annotated Bother COc1ccc([N+](=O)[O-])cc1-c1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)o1 ZINC000587389103 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccn1-c1ccc([N+](=O)[O-])cc1C)O2 ZINC000587389145 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccn1-c1ccc([N+](=O)[O-])cc1C)O2 ZINC000587389148 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccn1-c1cc([N+](=O)[O-])ccc1C)O2 ZINC000587389219 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccn1-c1cc([N+](=O)[O-])ccc1C)O2 ZINC000587389221 GI Annotated Bother Cc1ccc(Cn2nc(C)c([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)c2C)cc1 ZINC000587389296 GI Annotated Anodyne Cc1ccc(Cn2nc(C)c([C@H]3CC(=O)c4cc(C)cc(N)c4O3)c2C)cc1 ZINC000587389297 GI Annotated Anodyne CCOC(=O)[C@H](CC(C)C)n1cccc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587389306 GI Annotated Anodyne CCOC(=O)[C@H](CC(C)C)n1cccc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587389307 GI Annotated Anodyne CC[C@@H](C(=O)O)n1cc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c2ccccc21 ZINC000587389405 GI Annotated Anodyne CC[C@H](C(=O)O)n1cc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c2ccccc21 ZINC000587389406 GI Annotated Anodyne CC[C@@H](C(=O)O)n1cc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c2ccccc21 ZINC000587389407 GI Annotated Anodyne CC[C@H](C(=O)O)n1cc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c2ccccc21 ZINC000587389409 GI Annotated Anodyne COc1ccc(-c2ccc([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)o2)c([N+](=O)[O-])c1 ZINC000587389591 GI Annotated Bother COc1ccc(-c2ccc([C@H]3CC(=O)c4cc(C)cc(N)c4O3)o2)c([N+](=O)[O-])c1 ZINC000587389592 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(N3CCCCC3)c([N+](=O)[O-])c1)O2 ZINC000587389599 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(N3CCCCC3)c([N+](=O)[O-])c1)O2 ZINC000587389600 GI Annotated Bother CCC[C@]1(c2cn(CC(=O)O)c3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587389700 GI Annotated Anodyne CCC[C@@]1(c2cn(CC(=O)O)c3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587389701 GI Annotated Anodyne CCOC(=O)Cn1c(C)c([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c2ccccc21 ZINC000587389730 GI Annotated Clean CCOC(=O)Cn1c(C)c([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c2ccccc21 ZINC000587389731 GI Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@](c1cn(CC(=O)O)c3ccccc13)(C(C)C)O2 ZINC000587389792 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cn(CC(=O)O)c3ccccc13)(C(C)C)O2 ZINC000587389793 GI Annotated Anodyne CC[C@]1(c2c(C)n(CC(=O)O)c3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587389870 GI Annotated Anodyne CC[C@@]1(c2c(C)n(CC(=O)O)c3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587389876 GI Annotated Anodyne CCOC(=O)c1ccc(-n2cccc2[C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587389883 GI Annotated Anodyne CCOC(=O)c1ccc(-n2cccc2[C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587389884 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc3c1cnn3[C@H]1CCCCO1)O2 ZINC000587389986 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc3c1cnn3[C@H]1CCCCO1)O2 ZINC000587389991 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc3c1cnn3[C@@H]1CCCCO1)O2 ZINC000587389993 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc3c1cnn3[C@@H]1CCCCO1)O2 ZINC000587389995 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cccc(NC(=O)c3cc(C)on3)c1)O2 ZINC000587390012 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cccc(NC(=O)c3cc(C)on3)c1)O2 ZINC000587390017 GI Annotated Anodyne CCc1nccn1Cc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OC ZINC000587390320 GI Annotated Anodyne CCc1nccn1Cc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OC ZINC000587390326 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(-c3cccc([N+](=O)[O-])c3)n1)O2 ZINC000587390536 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(-c3cccc([N+](=O)[O-])c3)n1)O2 ZINC000587390537 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(N3CCCCC3)c([N+](=O)[O-])c1)O2 ZINC000587390844 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(N3CCCCC3)c([N+](=O)[O-])c1)O2 ZINC000587390845 GI Annotated Bother COc1cccc(OCCn2cccc2[C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587390917 GI Annotated Anodyne COc1cccc(OCCn2cccc2[C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587390919 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(COc3ccc([N+](=O)[O-])cc3)o1)O2 ZINC000587390958 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(COc3ccc([N+](=O)[O-])cc3)o1)O2 ZINC000587390959 GI Annotated Bother COc1cncc(NC(=O)OC(C)(C)C)c1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587391033 GI Annotated Anodyne COc1cncc(NC(=O)OC(C)(C)C)c1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587391034 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CC(C)C)([C@H](C)NC(=O)OC(C)(C)C)O2 ZINC000587391164 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CC(C)C)([C@H](C)NC(=O)OC(C)(C)C)O2 ZINC000587391173 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccn1-c1ccc(C)cc1[N+](=O)[O-])O2 ZINC000587391252 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccn1-c1ccc(C)cc1[N+](=O)[O-])O2 ZINC000587391254 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(-c3ncccc3[N+](=O)[O-])cc1)O2 ZINC000587391361 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(-c3ncccc3[N+](=O)[O-])cc1)O2 ZINC000587391362 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cn(CC(=O)OC(C)C)c3ccccc13)O2 ZINC000587391446 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cn(CC(=O)OC(C)C)c3ccccc13)O2 ZINC000587391452 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1c[nH]c3ccc([N+](=O)[O-])cc13)(C1CC1)O2 ZINC000587391733 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@](c1c[nH]c3ccc([N+](=O)[O-])cc13)(C1CC1)O2 ZINC000587391734 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(COc3ccccc3[N+](=O)[O-])o1)O2 ZINC000587391765 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(COc3ccccc3[N+](=O)[O-])o1)O2 ZINC000587391766 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cn(C(=O)OC(C)(C)C)c3ncccc13)O2 ZINC000587391862 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(C)n(-c3ccc(C(=O)O)cc3)c1C)O2 ZINC000587391866 GI Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cn(C(=O)OC(C)(C)C)c3ncccc13)O2 ZINC000587391868 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(C)n(-c3ccc(C(=O)O)cc3)c1C)O2 ZINC000587391874 GI Annotated Clean Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cc3ccccc3[nH]c1=N)(C(C)(C)C)O2 ZINC000587392024 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1cc3ccccc3[nH]c1=N)(C(C)(C)C)O2 ZINC000587392027 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C=C(c3ccccc3)Oc3cc(N)ccc31)O2 ZINC000587392032 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C=C(c3ccccc3)Oc3cc(N)ccc31)O2 ZINC000587392035 GI Annotated Anodyne COc1ccc(OCCn2cccc2[C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587392404 GI Annotated Anodyne COc1ccc(OCCn2cccc2[C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587392405 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C[C@H](NC(=O)OC(C)(C)C)c3ccccc31)O2 ZINC000587392447 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@@H](NC(=O)OC(C)(C)C)c3ccccc31)O2 ZINC000587392449 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@H](NC(=O)OC(C)(C)C)c3ccccc31)O2 ZINC000587392451 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C[C@@H](NC(=O)OC(C)(C)C)c3ccccc31)O2 ZINC000587392453 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cc(N3CCC(C)CC3)ccc1N)O2 ZINC000587392844 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cc(N3CCC(C)CC3)ccc1N)O2 ZINC000587392845 GI Annotated Anodyne COc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Cn1nc(C)cc1C ZINC000587392911 GI Annotated Anodyne COc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1Cn1nc(C)cc1C ZINC000587392912 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(N3C(=O)c4ccccc4C3=O)c1)O2 ZINC000587392923 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(N3C(=O)c4ccccc4C3=O)c1)O2 ZINC000587392924 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(C)n(-c3ccnn3C(C)C)c1C)O2 ZINC000587392927 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(C)n(-c3ccnn3C(C)C)c1C)O2 ZINC000587392928 GI Annotated Anodyne COC(=O)c1ccc(-c2ncccc2[C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587393330 GI Annotated Anodyne COC(=O)c1ccc(-c2ncccc2[C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587393331 GI Annotated Anodyne C=CN1CCCC[C@H]([C@@]2(c3ccccc3)CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587393357 GI Annotated Anodyne C=CN1CCCC[C@@H]([C@@]2(c3ccccc3)CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587393358 GI Annotated Anodyne C=CN1CCCC[C@@H]([C@]2(c3ccccc3)CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587393359 GI Annotated Anodyne C=CN1CCCC[C@H]([C@]2(c3ccccc3)CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587393360 GI Annotated Anodyne CCn1cc(-c2cc3ccccn3c2[C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cn1 ZINC000587393828 GI Annotated Anodyne CCn1cc(-c2cc3ccccn3c2[C@H]2CC(=O)c3cc(C)cc(N)c3O2)cn1 ZINC000587393829 GI Annotated Anodyne COC(=O)c1cccc(-c2cccc([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)n2)c1 ZINC000587394055 GI Annotated Anodyne COC(=O)c1cccc(-c2cccc([C@H]3CC(=O)c4cc(C)cc(N)c4O3)n2)c1 ZINC000587394056 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CCc1c(C)[nH]c3c(C)cccc3c1=O)O2 ZINC000587394349 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CCc1c(C)[nH]c3c(C)cccc3c1=O)O2 ZINC000587394351 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(OCc3c(C)noc3C)cc1)O2 ZINC000587394406 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(OCc3c(C)noc3C)cc1)O2 ZINC000587394407 GI Annotated Anodyne COC(=O)c1ccc(-c2cccc([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)n2)cc1 ZINC000587394472 GI Annotated Anodyne COC(=O)c1ccc(-c2cccc([C@H]3CC(=O)c4cc(C)cc(N)c4O3)n2)cc1 ZINC000587394473 GI Annotated Anodyne Cc1ccc(-c2nc3ncccn3c2[C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587394492 GI Annotated Anodyne Cc1ccc(-c2nc3ncccn3c2[C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587394493 GI Annotated Anodyne COC(=O)c1ccc(-c2ccc([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)cn2)cc1 ZINC000587394518 GI Annotated Anodyne COC(=O)c1ccc(-c2ccc([C@H]3CC(=O)c4cc(C)cc(N)c4O3)cn2)cc1 ZINC000587394519 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(OCc3c(C)noc3C)c1)O2 ZINC000587394563 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(OCc3c(C)noc3C)c1)O2 ZINC000587394564 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccco1)(c1cc3ccccc3nc1C=O)O2 ZINC000587394593 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccco1)(c1cc3ccccc3nc1C=O)O2 ZINC000587394594 GI Annotated Anodyne COc1ccc(OCc2ccccn2)c([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587394652 GI Annotated Anodyne COc1ccc(OCc2ccccn2)c([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587394653 GI Annotated Anodyne COc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OCc1cccnc1 ZINC000587394818 GI Annotated Anodyne COc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OCc1cccnc1 ZINC000587394819 GI Annotated Anodyne COc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c(OCc2cccnc2)c1 ZINC000587394866 GI Annotated Anodyne COc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c(OCc2cccnc2)c1 ZINC000587394868 GI Annotated Anodyne CC[C@@]1([C@@H]2CCCCN2C(=O)OC(C)(C)C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587395167 GI Annotated Anodyne CC[C@@]1([C@H]2CCCCN2C(=O)OC(C)(C)C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587395168 GI Annotated Anodyne CC[C@]1([C@@H]2CCCCN2C(=O)OC(C)(C)C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587395169 GI Annotated Anodyne CC[C@]1([C@H]2CCCCN2C(=O)OC(C)(C)C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587395170 GI Annotated Anodyne CCC[C@@H]1C(=O)N2CCCc3cccc(c32)[C@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587395570 GI Annotated Anodyne CCC[C@@H]1C(=O)N2CCCc3cccc(c32)[C@@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587395571 GI Annotated Anodyne CCC[C@H]1C(=O)N2CCCc3cccc(c32)[C@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587395572 GI Annotated Anodyne CCC[C@H]1C(=O)N2CCCc3cccc(c32)[C@@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587395573 GI Annotated Anodyne COc1ccccc1/C=C1/N2CCC(CC2)[C@@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587395621 GI Annotated Anodyne COc1ccccc1/C=C1/N2CCC(CC2)[C@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587395622 GI Annotated Anodyne COc1ccccc1/C=C1\N2CCC(CC2)[C@@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587395623 GI Annotated Anodyne COc1ccccc1/C=C1\N2CCC(CC2)[C@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587395624 GI Annotated Anodyne COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OCc1ccncc1 ZINC000587395635 GI Annotated Anodyne COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OCc1ccncc1 ZINC000587395636 GI Annotated Anodyne COC(=O)c1cc([C@]2(C3CCCCC3)CC(=O)c3cc(C)cc(N)c3O2)c[nH]1 ZINC000587395679 GI Annotated Anodyne COC(=O)c1cc([C@@]2(C3CCCCC3)CC(=O)c3cc(C)cc(N)c3O2)c[nH]1 ZINC000587395680 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1c(C)nc3ccccc3c1C(=O)O)O2 ZINC000587395883 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1c(C)nc3ccccc3c1C(=O)O)O2 ZINC000587395885 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CCc1c(C)[nH]c3ccccc3c1=O)O2 ZINC000587395905 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CCc1c(C)[nH]c3ccccc3c1=O)O2 ZINC000587395906 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccccc1OCc1c(C)noc1C)O2 ZINC000587395926 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccccc1OCc1c(C)noc1C)O2 ZINC000587395927 GI Annotated Anodyne COC(=O)c1cncc(-c2ccc([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)cc2)c1 ZINC000587395928 GI Annotated Anodyne COC(=O)c1cncc(-c2ccc([C@H]3CC(=O)c4cc(C)cc(N)c4O3)cc2)c1 ZINC000587395930 GI Annotated Anodyne CCOC(=O)c1[nH]c2c(c1C)[C@@]1(CC(=O)c3cc(C)cc(N)c3O1)CC(C)(C)C2 ZINC000587396031 GI Annotated Anodyne CCOC(=O)c1[nH]c2c(c1C)[C@]1(CC(=O)c3cc(C)cc(N)c3O1)CC(C)(C)C2 ZINC000587396032 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cc(N3CCC[C@@H](C)C3)ccc1N)O2 ZINC000587396508 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cc(N3CCC[C@H](C)C3)ccc1N)O2 ZINC000587396509 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cc(N3CCC[C@H](C)C3)ccc1N)O2 ZINC000587396510 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cc(N3CCC[C@@H](C)C3)ccc1N)O2 ZINC000587396511 GI Annotated Anodyne CC[C@]1(C2CCN(C(=O)OC(C)(C)C)CC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587396528 GI Annotated Anodyne CC[C@@]1(C2CCN(C(=O)OC(C)(C)C)CC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587396529 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCN(C(=O)OC(C)(C)C)[C@H](C(C)C)C1)O2 ZINC000587396531 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCN(C(=O)OC(C)(C)C)[C@H](C(C)C)C1)O2 ZINC000587396532 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCN(C(=O)OC(C)(C)C)[C@@H](C(C)C)C1)O2 ZINC000587396533 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCN(C(=O)OC(C)(C)C)[C@@H](C(C)C)C1)O2 ZINC000587396534 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cc(C34CC5CC(CC(C5)C3)C4)n[nH]1)O2 ZINC000587396653 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cc(C34CC5CC(CC(C5)C3)C4)n[nH]1)O2 ZINC000587396656 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ncc(-c3ccco3)[nH]1)(c1ccco1)O2 ZINC000587396683 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ncc(-c3ccco3)[nH]1)(c1ccco1)O2 ZINC000587396686 GI Annotated Anodyne CCOC(=O)c1[nH]c2ccc(C)cc2c1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587396779 GI Annotated Anodyne CCOC(=O)c1[nH]c2ccc(C)cc2c1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587396781 GI Annotated Anodyne COc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1CN1CCCC1 ZINC000587396869 GI Annotated Anodyne COc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1CN1CCCC1 ZINC000587396871 GI Annotated Anodyne COc1cccc([C@]2(c3c[nH]c4ncccc34)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587397135 GI Annotated Anodyne COc1cccc([C@@]2(c3c[nH]c4ncccc34)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587397136 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(CN(C(c3ccccc3)c3ccccc3)C1)O2 ZINC000587397268 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@@H]3CCC[C@H](C1)N3C(=O)OC(C)(C)C)O2 ZINC000587397524 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(C[C@@H]3CCC[C@H](C1)N3C(=O)OC(C)(C)C)O2 ZINC000587397525 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C[C@@H]3CCC[C@H](C1)N3C(=O)OC(C)(C)C)O2 ZINC000587397526 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1c(C)[nH]c(C(=O)OC(C)(C)C)c1C)O2 ZINC000587397592 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1c(C)[nH]c(C(=O)OC(C)(C)C)c1C)O2 ZINC000587397593 GI Annotated Anodyne CCOC(=O)C[C@@]1(C23CC4CC(CC(C4)C2)C3)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587397774 GI Annotated Anodyne CCOC(=O)C[C@]1(C23CC4CC(CC(C4)C2)C3)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587397788 GI Annotated Anodyne COC(=O)C[C@@]1(c2cccc3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587397842 GI Annotated Anodyne COC(=O)C[C@]1(c2cccc3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587397845 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CC[C@H]3CN(Cc4ccccc4)C[C@@H]3C1)O2 ZINC000587397931 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CC[C@@H]3CN(Cc4ccccc4)C[C@H]3C1)O2 ZINC000587397932 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CC[C@H]3CN(Cc4ccccc4)C[C@H]3C1)O2 ZINC000587397933 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CC[C@@H]3CN(Cc4ccccc4)C[C@@H]3C1)O2 ZINC000587397934 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCN(C(=O)OC(C)(C)C)C3(CCC3)C1)O2 ZINC000587398023 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCN(C(=O)OC(C)(C)C)C3(CCC3)C1)O2 ZINC000587398025 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(OCC(=O)OC(C)(C)C)cc1)O2 ZINC000587398107 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(OCC(=O)OC(C)(C)C)cc1)O2 ZINC000587398108 GI Annotated Anodyne C#CCOc1c(CC=C)cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OCC ZINC000587398176 GI Annotated Mild C#CCOc1c(CC=C)cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OCC ZINC000587398178 GI Annotated Mild CCOC(=O)[C@]1(c2ccc3ccccc3c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398242 GI Annotated Anodyne CCOC(=O)[C@@]1(c2ccc3ccccc3c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398244 GI Annotated Anodyne COc1ccc([C@]2(c3ccccc3)CC(=O)c3cc(C)cc(N)c3O2)c(O)c1 ZINC000587398281 GI Annotated Anodyne COc1ccc([C@@]2(c3ccccc3)CC(=O)c3cc(C)cc(N)c3O2)c(O)c1 ZINC000587398282 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@@H](c2ccccc2)[C@@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587398295 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@H](c2ccccc2)[C@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587398304 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@@H](c2ccccc2)[C@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587398306 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@H](c2ccccc2)[C@@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587398308 GI Annotated Anodyne COc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1CN1CCCCC1 ZINC000587398407 GI Annotated Anodyne COc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1CN1CCCCC1 ZINC000587398411 GI Annotated Anodyne CCOC(COc1ccccc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1)OCC ZINC000587398487 GI Annotated Anodyne CCOC(COc1ccccc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1)OCC ZINC000587398488 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCc3cc(OC(C)(C)C(=O)O)ccc31)O2 ZINC000587398509 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCc3cc(OC(C)(C)C(=O)O)ccc31)O2 ZINC000587398510 GI Annotated Anodyne CCOC(=O)[C@H](CC)[C@]1(c2cccc(OC)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398731 GI Annotated Anodyne CCOC(=O)[C@@H](CC)[C@@]1(c2cccc(OC)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398732 GI Annotated Anodyne CCOC(=O)[C@H](CC)[C@@]1(c2cccc(OC)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398733 GI Annotated Anodyne CCOC(=O)[C@@H](CC)[C@]1(c2cccc(OC)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398734 GI Annotated Anodyne COC(=O)C[C@@]1(c2ccc(C(C)(C)C)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398743 GI Annotated Anodyne COC(=O)C[C@]1(c2ccc(C(C)(C)C)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587398744 GI Annotated Anodyne COC(=O)c1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1N1CCCCC1 ZINC000587398829 GI Annotated Anodyne COC(=O)c1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1N1CCCCC1 ZINC000587398832 GI Annotated Anodyne COC(=O)c1ccc(OC(C)C)c([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587398858 GI Annotated Anodyne COC(=O)c1ccc(OC(C)C)c([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587398865 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(O2)c2ccccc2N(C[C@H]2CO2)c2ccccc21 ZINC000587398897 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(O2)c2ccccc2N(C[C@@H]2CO2)c2ccccc21 ZINC000587398898 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCC[C@@H]3CN(Cc4ccccc4)C[C@H]31)O2 ZINC000587398934 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCC[C@H]3CN(Cc4ccccc4)C[C@H]31)O2 ZINC000587398935 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCC[C@@H]3CN(Cc4ccccc4)C[C@@H]31)O2 ZINC000587398937 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCC[C@H]3CN(Cc4ccccc4)C[C@@H]31)O2 ZINC000587398939 GI Annotated Anodyne CCOC(=O)[C@H](Cc1ccc(C)cc1)[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399096 GI Annotated Anodyne CCOC(=O)[C@@H](Cc1ccc(C)cc1)[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399100 GI Annotated Anodyne CCOC(=O)[C@H](Cc1ccc(C)cc1)[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399101 GI Annotated Anodyne CCOC(=O)[C@@H](Cc1ccc(C)cc1)[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399102 GI Annotated Anodyne CCOC(=O)[C@H](Cc1ccccc1C)[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399137 GI Annotated Anodyne CCOC(=O)[C@@H](Cc1ccccc1C)[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399138 GI Annotated Anodyne CCOC(=O)[C@H](Cc1ccccc1C)[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399140 GI Annotated Anodyne CCOC(=O)[C@@H](Cc1ccccc1C)[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399142 GI Annotated Anodyne CCOC(=O)C[C@@]1(Cc2cc(C)cc(C)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399144 GI Annotated Anodyne CCOC(=O)C[C@]1(Cc2cc(C)cc(C)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399147 GI Annotated Anodyne CCOC(=O)[C@@H](C(C)C)[C@]1(Cc2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399402 GI Annotated Anodyne CCOC(=O)[C@H](C(C)C)[C@]1(Cc2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399403 GI Annotated Anodyne CCOC(=O)[C@H](C(C)C)[C@@]1(Cc2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399405 GI Annotated Anodyne CCOC(=O)[C@@H](C(C)C)[C@@]1(Cc2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399407 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(CC3(CCCN(C(=O)OC(C)(C)C)C3)C1)O2 ZINC000587399586 GI Annotated Anodyne Cc1ccc(CN2C(=O)[C@@]3(CC(=O)c4cc(C)cc(N)c4O3)c3ccccc32)cc1 ZINC000587399611 GI Annotated Anodyne Cc1ccc(CN2C(=O)[C@]3(CC(=O)c4cc(C)cc(N)c4O3)c3ccccc32)cc1 ZINC000587399612 GI Annotated Anodyne CCOC(=O)C[C@]1(c2ccc3c(c2)CCCC3)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399753 GI Annotated Anodyne CCOC(=O)C[C@@]1(c2ccc3c(c2)CCCC3)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399756 GI Annotated Anodyne CCOC(=O)[C@H](Cc1cccc(C)c1)[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399782 GI Annotated Anodyne CCOC(=O)[C@@H](Cc1cccc(C)c1)[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399785 GI Annotated Anodyne CCOC(=O)[C@H](Cc1cccc(C)c1)[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399790 GI Annotated Anodyne CCOC(=O)[C@@H](Cc1cccc(C)c1)[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399793 GI Annotated Anodyne CCOc1ccc([C@@]2(CCCC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587399822 GI Annotated Anodyne CCOc1ccc([C@]2(CCCC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587399843 GI Annotated Anodyne CCOC(=O)[C@]1(c2ccc(C(C)(C)C)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399857 GI Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(C(C)(C)C)cc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587399859 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(O2)[C@H]2CCC[C@H]1CN(Cc1ccccc1)C2 ZINC000587400041 GI Annotated Anodyne CCOC(=O)[C@]1(c2cccc3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400130 GI Annotated Anodyne CCOC(=O)[C@@]1(c2cccc3ccccc23)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400131 GI Annotated Anodyne CCOC(=O)C[C@@]1(c2ccc(OCC)c(C)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400156 GI Annotated Anodyne CCOC(=O)C[C@]1(c2ccc(OCC)c(C)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400158 GI Annotated Anodyne CCOC(=O)[C@H](CC)Oc1ccccc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400236 GI Annotated Anodyne CCOC(=O)[C@H](CC)Oc1ccccc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400238 GI Annotated Anodyne CCOC(=O)[C@@H](CC)Oc1ccccc1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400241 GI Annotated Anodyne CCOC(=O)[C@@H](CC)Oc1ccccc1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400243 GI Annotated Anodyne COC(=O)c1ccccc1[C@@]1(c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400362 GI Annotated Anodyne COC(=O)c1ccccc1[C@]1(c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400366 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CC#N)(c1ccc(N3CCCCC3)cc1)O2 ZINC000587400446 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](CC#N)(c1ccc(N3CCCCC3)cc1)O2 ZINC000587400447 GI Annotated Mild CCOc1cc(OCC)c([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c(OCC)c1 ZINC000587400481 GI Annotated Anodyne CCOc1cc(OCC)c([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c(OCC)c1 ZINC000587400484 GI Annotated Anodyne CCCCc1ccc([C@@]2(C(=O)OCC)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587400529 GI Annotated Anodyne CCCCc1ccc([C@]2(C(=O)OCC)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587400531 GI Annotated Anodyne CCC[C@@]1(C2(c3ccccc3)CCNCC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400773 GI Annotated Anodyne CCC[C@]1(C2(c3ccccc3)CCNCC2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400776 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(Cc3ccccc3N(C(N)=O)c3ccccc31)O2 ZINC000587400905 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(Cc3ccccc3N(C(N)=O)c3ccccc31)O2 ZINC000587400912 GI Annotated Anodyne COCCOCCCc1ccccc1[C@@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400929 GI Annotated Anodyne COCCOCCCc1ccccc1[C@]1(C)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587400931 GI Annotated Anodyne CCOc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OCCCOC ZINC000587401012 GI Annotated Anodyne CCOc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OCCCOC ZINC000587401014 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(CCC3(CC1)CN(C(=O)OC(C)(C)C)C3)O2 ZINC000587401111 GI Annotated Anodyne C#CCOc1c(CC=C)cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587401123 GI Annotated Mild C#CCOc1c(CC=C)cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587401128 GI Annotated Mild COc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1CN1CCCCC1 ZINC000587401175 GI Annotated Anodyne COc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1CN1CCCCC1 ZINC000587401176 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCC13CCN(C(=O)OC(C)(C)C)CC3)O2 ZINC000587401183 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCC13CCN(C(=O)OC(C)(C)C)CC3)O2 ZINC000587401184 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)[C@@H](c2ccccc2)Nc2ccccc21 ZINC000587401195 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)[C@H](c2ccccc2)Nc2ccccc21 ZINC000587401196 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)[C@H](c2ccccc2)Nc2ccccc21 ZINC000587401197 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)[C@@H](c2ccccc2)Nc2ccccc21 ZINC000587401198 GI Annotated Anodyne CCOC(=O)[C@H](CC)[C@]1(c2cccc(C)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587401284 GI Annotated Anodyne CCOC(=O)[C@@H](CC)[C@@]1(c2cccc(C)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587401290 GI Annotated Anodyne CCOC(=O)[C@H](CC)[C@@]1(c2cccc(C)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587401292 GI Annotated Anodyne CCOC(=O)[C@@H](CC)[C@]1(c2cccc(C)c2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587401298 GI Annotated Anodyne CCCOc1ccc([C@@]2(CCC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587401360 GI Annotated Anodyne CCCOc1ccc([C@]2(CCC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587401362 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccccc1)(c1ccc3c(c1)CCC(=O)N3)O2 ZINC000587401408 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1)(c1ccc3c(c1)CCC(=O)N3)O2 ZINC000587401411 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@@H]3CCC[C@H](C1)N3Cc1ccccc1)O2 ZINC000587401615 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C[C@@H]3CCC[C@H](C1)N3Cc1ccccc1)O2 ZINC000587401616 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(C[C@@H]3CCC[C@@H](C1)N3Cc1ccccc1)O2 ZINC000587401617 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(C[C@@H]3CCC[C@H](C1)N3Cc1ccccc1)O2 ZINC000587401618 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C1)O2 ZINC000587401686 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C1)O2 ZINC000587401687 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CC[C@]3(CCN(C(=O)OC(C)(C)C)C3)C1)O2 ZINC000587401689 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CC[C@@]3(CCN(C(=O)OC(C)(C)C)C3)C1)O2 ZINC000587401690 GI Annotated Anodyne CCOc1ccc([C@@]2(CCC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1C ZINC000587401751 GI Annotated Anodyne CCOc1ccc([C@]2(CCC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1C ZINC000587401753 GI Annotated Anodyne CCOC(=O)[C@@H](C(C)C)[C@]1(c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587401760 GI Annotated Anodyne CCOC(=O)[C@H](C(C)C)[C@]1(c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587401761 GI Annotated Anodyne CCOC(=O)[C@@H](C(C)C)[C@@]1(c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587401762 GI Annotated Anodyne CCOC(=O)[C@H](C(C)C)[C@@]1(c2ccccc2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587401763 GI Annotated Anodyne COc1ccc(O)c([C@]2(c3ccccc3)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587401776 GI Annotated Anodyne COc1ccc(O)c([C@@]2(c3ccccc3)CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587401778 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@@H](c2ccccc2)CC[C@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587401782 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](c2ccccc2)CC[C@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587401786 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@@H](c2ccccc2)CC[C@@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587401790 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](c2ccccc2)CC[C@@]12CC(=O)c1cc(C)cc(N)c1O2 ZINC000587401792 GI Annotated Anodyne CCOC(=O)CCCOc1ccc([C@@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587401988 GI Annotated Anodyne CCOC(=O)CCCOc1ccc([C@]2(C)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587401989 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(CC3(CCN(C(=O)OC(C)(C)C)CC3)C1)O2 ZINC000587402097 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)c2ccccc2N[C@@H]1c1ccccc1 ZINC000587402170 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)c2ccccc2N[C@H]1c1ccccc1 ZINC000587402172 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)c2ccccc2N[C@H]1c1ccccc1 ZINC000587402175 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)c2ccccc2N[C@@H]1c1ccccc1 ZINC000587402179 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](COc1ccc(C=O)cc1)(c1ccccc1)O2 ZINC000587402318 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](COc1ccc(C=O)cc1)(c1ccccc1)O2 ZINC000587402319 GI Annotated Anodyne COc1ccc([C@@]2(CCCCC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587402322 GI Annotated Anodyne COc1ccc([C@]2(CCCCC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587402324 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCC[C@@H]3[C@@H]1CCN3C(=O)OC(C)(C)C)O2 ZINC000587402369 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCC[C@@H]3[C@H]1CCN3C(=O)OC(C)(C)C)O2 ZINC000587402370 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCC[C@H]3[C@@H]1CCN3C(=O)OC(C)(C)C)O2 ZINC000587402371 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCC[C@H]3[C@H]1CCN3C(=O)OC(C)(C)C)O2 ZINC000587402372 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CN1CCCCC1)(c1cc(C)c(O)c(C)c1)O2 ZINC000587402390 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CN1CCCCC1)(c1cc(C)c(O)c(C)c1)O2 ZINC000587402391 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(OCc3occc3C(=O)O)c1)O2 ZINC000587402797 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(OCc3occc3C(=O)O)c1)O2 ZINC000587402801 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(-c3ccc(C(=O)O)o3)cc1)O2 ZINC000587403065 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(-c3ccc(C(=O)O)o3)cc1)O2 ZINC000587403066 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1)([C@H]1CCCC[C@@H]1C(=O)O)O2 ZINC000587403330 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1)([C@H]1CCCC[C@H]1C(=O)O)O2 ZINC000587403331 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1)([C@@H]1CCCC[C@H]1C(=O)O)O2 ZINC000587403332 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1)([C@@H]1CCCC[C@@H]1C(=O)O)O2 ZINC000587403333 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(OCc3occc3C(=O)O)cc1)O2 ZINC000587403592 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(OCc3occc3C(=O)O)cc1)O2 ZINC000587403594 GI Annotated Anodyne COc1ccc([C@]2(CC(C)(C)CC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587403675 GI Annotated Anodyne COc1ccc([C@@]2(CC(C)(C)CC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587403676 GI Annotated Anodyne COc1ccc([C@@]2(CCCCCC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587403833 GI Annotated Anodyne COc1ccc([C@]2(CCCCCC(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587403834 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccccc1OCc1ccc(C(=O)O)o1)O2 ZINC000587404175 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccccc1OCc1ccc(C(=O)O)o1)O2 ZINC000587404176 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C#CC(=O)c1ccccc1)(c1ccccc1)O2 ZINC000587404236 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](C#CC(=O)c1ccccc1)(c1ccccc1)O2 ZINC000587404239 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(OCc3ccc(C(=O)O)o3)cc1)O2 ZINC000587404843 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(OCc3ccc(C(=O)O)o3)cc1)O2 ZINC000587404844 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC(C(=O)c1ccccc1)(C(=O)c1ccccc1)O2 ZINC000587405080 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(OCc3ccc(C(=O)O)o3)c1)O2 ZINC000587405193 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(OCc3ccc(C(=O)O)o3)c1)O2 ZINC000587405194 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1)([C@H]1CC=CC[C@@H]1C(=O)O)O2 ZINC000587405540 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1)([C@H]1CC=CC[C@H]1C(=O)O)O2 ZINC000587405541 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1)([C@@H]1CC=CC[C@H]1C(=O)O)O2 ZINC000587405543 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1)([C@@H]1CC=CC[C@@H]1C(=O)O)O2 ZINC000587405546 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](Cc1ccccc1C(=O)O)(c1ccccc1)O2 ZINC000587406090 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](Cc1ccccc1C(=O)O)(c1ccccc1)O2 ZINC000587406091 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1)(c1cccc(CC(=O)O)c1)O2 ZINC000587406294 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccccc1)(c1cccc(CC(=O)O)c1)O2 ZINC000587406295 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](C1(c3ccccc3)CCC3(CC1)OCCO3)O2 ZINC000587406360 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](C1(c3ccccc3)CCC3(CC1)OCCO3)O2 ZINC000587406362 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccccc1)([C@@H]1CCCC[C@H]1C(=O)O)O2 ZINC000587406374 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H]([C@@]13C[C@]1(C)[C@H]1CC(C)(C)C[C@H]1C=C3C=O)O2 ZINC000587406595 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@H]([C@@]13C[C@]1(C)[C@H]1CC(C)(C)C[C@H]1C=C3C=O)O2 ZINC000587406598 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2cccc(C)c2Oc2cc(O)cc(O)c21 ZINC000587406684 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2cccc(C)c2Oc2cc(O)cc(O)c21 ZINC000587406687 GI Annotated Anodyne COc1ccc(OCc2ccc([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)o2)cc1 ZINC000587407239 GI Annotated Anodyne COc1ccc(OCc2ccc([C@H]3CC(=O)c4cc(C)cc(N)c4O3)o2)cc1 ZINC000587407241 GI Annotated Anodyne CC(C)=CC[C@H]1C(=O)c2ccccc2[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587407292 GI Annotated Anodyne CC(C)=CC[C@@H]1C(=O)c2ccccc2[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587407295 GI Annotated Anodyne CC(C)=CC[C@H]1C(=O)c2ccccc2[C@]2(CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587407296 GI Annotated Anodyne CC(C)=CC[C@@H]1C(=O)c2ccccc2[C@]2(CC(=O)c3cc(C)cc(N)c3O2)C1=O ZINC000587407298 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(O2)c2ccc(O)cc2Oc2cc(O)ccc21 ZINC000587407495 GI Annotated Anodyne CCCCCS(=O)(=O)c1cccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587407553 GI Annotated Anodyne CCCCCS(=O)(=O)c1cccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1 ZINC000587407558 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccc(S(=O)(=O)Cl)cc1)(C(C)C)O2 ZINC000587407689 GI Annotated Unstable Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccc(S(=O)(=O)Cl)cc1)(C(C)C)O2 ZINC000587407690 GI Annotated Unstable C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@@]4(C)CC(=O)c5cc(C)cc(N)c5O4)[C@@H]3C[C@H]12 ZINC000587408010 GI Annotated Mild C=C1C(=O)O[C@@H]2C[C@]3(C)[C@@H](CC[C@]4(C)CC(=O)c5cc(C)cc(N)c5O4)[C@@H]3C[C@H]12 ZINC000587408014 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1)([C@H]1CCC[C@@H](C(=O)O)C1)O2 ZINC000587408119 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccccc1)([C@H]1CCC[C@@H](C(=O)O)C1)O2 ZINC000587408120 GI Annotated Anodyne Cc1ccc([C@]2(c3ccccc3C(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587408210 GI Annotated Anodyne Cc1ccc([C@@]2(c3ccccc3C(=O)O)CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587408213 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cccc(S(=O)(=O)CC3CCCC3)c1)O2 ZINC000587408327 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cccc(S(=O)(=O)CC3CCCC3)c1)O2 ZINC000587408332 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2ccccc2Oc2ccc(C(=O)O)cc21 ZINC000587408395 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2ccccc2Oc2ccc(C(=O)O)cc21 ZINC000587408398 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCC(=O)O)(c1cccc3ccccc13)O2 ZINC000587408593 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CCC(=O)O)(c1cccc3ccccc13)O2 ZINC000587408594 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)[C@H](CC(=O)O)CCC[C@H]1c1ccccc1 ZINC000587408603 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)[C@H](c2ccccc2)CCC[C@@H]1CC(=O)O ZINC000587408604 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)[C@@H](CC(=O)O)CCC[C@@H]1c1ccccc1 ZINC000587408605 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)[C@H](CC(=O)O)CCC[C@@H]1c1ccccc1 ZINC000587408606 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCC(=O)O)(c1ccc3c(c1)CCCC3)O2 ZINC000587408611 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CCC(=O)O)(c1ccc3c(c1)CCCC3)O2 ZINC000587408612 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(S(=O)(=O)c3ccccc3)cc1)O2 ZINC000587408739 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(S(=O)(=O)c3ccccc3)cc1)O2 ZINC000587408741 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CC#N)(c1ccc(Br)s1)O2 ZINC000587408819 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@](CC#N)(c1ccc(Br)s1)O2 ZINC000587408832 GI Annotated Mild CC[C@]1(CC(=O)O)Cc2ccccc2[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)C1 ZINC000587409006 GI Annotated Anodyne CC[C@@]1(CC(=O)O)Cc2ccccc2[C@]2(CC(=O)c3cc(C)cc(N)c3O2)C1 ZINC000587409007 GI Annotated Anodyne CC[C@]1(CC(=O)O)Cc2ccccc2[C@]2(CC(=O)c3cc(C)cc(N)c3O2)C1 ZINC000587409008 GI Annotated Anodyne CC[C@@]1(CC(=O)O)Cc2ccccc2[C@@]2(CC(=O)c3cc(C)cc(N)c3O2)C1 ZINC000587409009 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2cc(O)ccc2Oc2cccc(O)c21 ZINC000587409196 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2cc(O)ccc2Oc2cccc(O)c21 ZINC000587409197 GI Annotated Anodyne Cc1ccc2c(c1)Oc1cc(O)cc(O)c1[C@@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587409228 GI Annotated Anodyne Cc1ccc2c(c1)Oc1cc(O)cc(O)c1[C@]21CC(=O)c2cc(C)cc(N)c2O1 ZINC000587409231 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C[C@H]1CC[C@@H](C(=O)O)C1)(c1ccccc1)O2 ZINC000587409440 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C[C@H]1CC[C@@H](C(=O)O)C1)(c1ccccc1)O2 ZINC000587409441 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1c(C)[nH]c(-c3ccco3)nc1=S)O2 ZINC000587409631 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1c(C)[nH]c(-c3ccco3)nc1=S)O2 ZINC000587409638 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)CC1(CCC(C3CCC4(CC3)OCCO4)CC1)O2 ZINC000587409820 GI Annotated Anodyne CSc1sc(SC)c([C@H]2CC(=O)c3cc(C)cc(N)c3O2)c1CO ZINC000587409851 GI Annotated Anodyne CSc1sc(SC)c([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)c1CO ZINC000587409853 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCCC(=O)O)(c1ccc(Cl)s1)O2 ZINC000587409856 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CCCC(=O)O)(c1ccc(Cl)s1)O2 ZINC000587409864 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(S(=O)(=O)CC3CCCC3)cc1)O2 ZINC000587410088 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(S(=O)(=O)CC3CCCC3)cc1)O2 ZINC000587410090 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cnc(SCc3ccccc3)nc1)O2 ZINC000587410392 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cnc(SCc3ccccc3)nc1)O2 ZINC000587410393 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CSc1nc3ccccc3[nH]1)(C1CC1)O2 ZINC000587410434 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](CSc1nc3ccccc3[nH]1)(C1CC1)O2 ZINC000587410438 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(S(=O)(=O)C3CCCC3)cc1)O2 ZINC000587410641 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(S(=O)(=O)C3CCCC3)cc1)O2 ZINC000587410642 GI Annotated Anodyne CCCCCS(=O)(=O)c1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587410654 GI Annotated Anodyne CCCCCS(=O)(=O)c1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587410655 GI Annotated Anodyne Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@@]23CC(=O)c2cc(C)cc(N)c2O3)cc1 ZINC000587410668 GI Annotated Anodyne Cc1ccc(S(=O)(=O)[C@@H]2CCCC[C@]23CC(=O)c2cc(C)cc(N)c2O3)cc1 ZINC000587410669 GI Annotated Anodyne Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@@]23CC(=O)c2cc(C)cc(N)c2O3)cc1 ZINC000587410670 GI Annotated Anodyne Cc1ccc(S(=O)(=O)[C@H]2CCCC[C@]23CC(=O)c2cc(C)cc(N)c2O3)cc1 ZINC000587410671 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(S(=O)(=O)CCC(C)C)cc1)O2 ZINC000587410698 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(S(=O)(=O)CCC(C)C)cc1)O2 ZINC000587410699 GI Annotated Anodyne CCOP(=O)(OCC)c1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587410810 GI Annotated Anodyne CCOP(=O)(OCC)c1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1 ZINC000587410812 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2ccccc2Oc2cc(O)cc(O)c21 ZINC000587410821 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2ccccc2Oc2cc(O)cc(O)c21 ZINC000587410824 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)c2ccccc2C2=C1CCC(C)(C)O2 ZINC000587410914 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)c2ccccc2C2=C1CCC(C)(C)O2 ZINC000587410915 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1nc4ccccc4cc1Br)[C@@H](C2)C3=O ZINC000587410930 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1nc4ccccc4cc1Br)[C@@H](C2)C3=O ZINC000587410932 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CBr)(c1ccc4c(c1)CCC4)[C@@H](C2)C3=O ZINC000587410978 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1ccc4c(c1)CCC4)[C@@H](C2)C3=O ZINC000587410990 GI Annotated Reactive CCc1ccc([C@@]2(CBr)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587411022 GI Annotated Reactive CCc1ccc([C@]2(CBr)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587411025 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1cc4ccccc4o1)[C@@H](C2)C3=O ZINC000587411255 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CBr)(c1cc4ccccc4o1)[C@@H](C2)C3=O ZINC000587411260 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1csc(-c3cccc([N+](=O)[O-])c3)n1)O2 ZINC000587411279 GI Annotated Bother Cc1cc(N)c2c(c1)C(=O)C[C@H](c1csc(-c3cccc([N+](=O)[O-])c3)n1)O2 ZINC000587411291 GI Annotated Bother COc1cc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OC(=O)c1ccco1 ZINC000587411383 GI Annotated Anodyne COc1cc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)ccc1OC(=O)c1ccco1 ZINC000587411385 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(-c3ccc4c(c3)C(=O)OC4)o1)O2 ZINC000587411492 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(-c3ccc4c(c3)C(=O)OC4)o1)O2 ZINC000587411493 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N(C)C)c(Br)c1)[C@@H](C2)C3=O ZINC000587411520 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(N(C)C)c(Br)c1)[C@@H](C2)C3=O ZINC000587411522 GI Annotated Anodyne CCOC(=O)c1sc2ccc([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)cc2c1N ZINC000587411593 GI Annotated Anodyne CCOC(=O)c1sc2ccc([C@H]3CC(=O)c4cc(C)cc(N)c4O3)cc2c1N ZINC000587411595 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1sc(Nc3cccnc3)nc1C)O2 ZINC000587411676 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1sc(Nc3cccnc3)nc1C)O2 ZINC000587411682 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1([C@@H](Br)[C@H]4CC[C@]1(C)C4(C)C)[C@@H](C2)C3=O ZINC000587411686 GI Annotated Reactive COc1cc2c3c(c1)O[C@]1([C@@H](Br)[C@H]4CC[C@]1(C)C4(C)C)[C@@H](C2)C3=O ZINC000587411693 GI Annotated Reactive COC(=O)c1sccc1-c1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)o1 ZINC000587411721 GI Annotated Anodyne COC(=O)c1sccc1-c1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)o1 ZINC000587411722 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccc1)(c1ccsc1C(=O)O)O2 ZINC000587411751 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccccc1)(c1ccsc1C(=O)O)O2 ZINC000587411755 GI Annotated Anodyne COC(=O)c1ccc(-c2ccc([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)o2)cc1 ZINC000587411792 GI Annotated Anodyne COC(=O)c1ccc(-c2ccc([C@H]3CC(=O)c4cc(C)cc(N)c4O3)o2)cc1 ZINC000587411793 GI Annotated Anodyne COc1cc2c(cc1OC)[C@@]1(CC(=O)c3cc(C)cc(N)c3O1)CC(C)(C)O2 ZINC000587411855 GI Annotated Anodyne COc1cc2c(cc1OC)[C@]1(CC(=O)c3cc(C)cc(N)c3O1)CC(C)(C)O2 ZINC000587411856 GI Annotated Anodyne COc1ccccc1OCc1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)o1 ZINC000587412089 GI Annotated Anodyne COc1ccccc1OCc1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)o1 ZINC000587412090 GI Annotated Anodyne CCOC(=O)C[C@@]1(c2ccc(Cl)s2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587412148 GI Annotated Anodyne CCOC(=O)C[C@]1(c2ccc(Cl)s2)CC(=O)c2cc(C)cc(N)c2O1 ZINC000587412152 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccc(C)c1)([C@@H](C)Br)[C@@H](C2)C3=O ZINC000587412325 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1cccc(C)c1)([C@H](C)Br)[C@@H](C2)C3=O ZINC000587412328 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1cccc(C)c1)([C@@H](C)Br)[C@@H](C2)C3=O ZINC000587412330 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](c1cccc(C)c1)([C@H](C)Br)[C@@H](C2)C3=O ZINC000587412331 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccncc1)(c1c(N)sc3c1CCC3)O2 ZINC000587412392 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccncc1)(c1c(N)sc3c1CCC3)O2 ZINC000587412393 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1([C@H]4C[C@H]5C[C@@H]1C[C@@](Br)(C5)C4)[C@@H](C2)C3=O ZINC000587412522 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1([C@H]4C[C@H]5C[C@@H]1C[C@@](Br)(C5)C4)[C@@H](C2)C3=O ZINC000587412523 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cnc(NC(=O)OC(C)(C)C)s1)O2 ZINC000587412586 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cnc(NC(=O)OC(C)(C)C)s1)O2 ZINC000587412588 GI Annotated Anodyne CCOc1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1Br ZINC000587412600 GI Annotated Anodyne CCOc1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1Br ZINC000587412601 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(Cl)c(O)c(Br)c1)[C@@H](C2)C3=O ZINC000587412630 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(Cl)c(O)c(Br)c1)[C@@H](C2)C3=O ZINC000587412633 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CC#N)(c1ccccc1Br)[C@@H](C2)C3=O ZINC000587412634 GI Annotated Mild COc1cc2c3c(c1)O[C@@](CC#N)(c1ccccc1Br)[C@@H](C2)C3=O ZINC000587412637 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1nc(-c3ccc4c(c3)OCCO4)cs1)O2 ZINC000587412662 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1nc(-c3ccc4c(c3)OCCO4)cs1)O2 ZINC000587412678 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)[C@@H](c2ccccc2)Oc2ccccc21 ZINC000587412681 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)[C@H](c2ccccc2)Oc2ccccc21 ZINC000587412685 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)[C@H](c2ccccc2)Oc2ccccc21 ZINC000587412687 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)[C@@H](c2ccccc2)Oc2ccccc21 ZINC000587412688 GI Annotated Anodyne COC(OC)c1oc2ccc(O)cc2c1[C@@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587412767 GI Annotated Anodyne COC(OC)c1oc2ccc(O)cc2c1[C@H]1CC(=O)c2cc(C)cc(N)c2O1 ZINC000587412768 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CBr)(C1(c4ccccc4)CC1)[C@@H](C2)C3=O ZINC000587412825 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CBr)(C1(c4ccccc4)CC1)[C@@H](C2)C3=O ZINC000587412826 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@H](c1ccc(Br)c3nsnc13)O2 ZINC000587412879 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1ccc(Br)c3nsnc13)O2 ZINC000587412884 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CBr)(c1ccccc1Cl)[C@@H](C2)C3=O ZINC000587412947 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1ccccc1Cl)[C@@H](C2)C3=O ZINC000587412948 GI Annotated Reactive CCOc1cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)ccc1Br ZINC000587412958 GI Annotated Anodyne CCOc1cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)ccc1Br ZINC000587412959 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1cn(CCC#N)nc1-c1cccs1)O2 ZINC000587413040 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@H](c1cn(CCC#N)nc1-c1cccs1)O2 ZINC000587413041 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@@](c1c[nH]c(=N)s1)(c1ccccc1Cl)O2 ZINC000587413058 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1c[nH]c(=N)s1)(c1ccccc1Cl)O2 ZINC000587413059 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1csc(-c3ccc4c(c3)OCO4)n1)O2 ZINC000587413060 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1csc(-c3ccc4c(c3)OCO4)n1)O2 ZINC000587413065 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1sc(N3CCCCC3)nc1Cl)O2 ZINC000587413108 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1sc(N3CCCCC3)nc1Cl)O2 ZINC000587413109 GI Annotated Anodyne COc1cc(C2CCOCC2)c([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587413133 GI Annotated Anodyne COc1cc(C2CCOCC2)c([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cc1OC ZINC000587413138 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)C2=C(OC(C)(C)CC2)c2ccccc21 ZINC000587413165 GI Annotated Mild Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)C2=C(OC(C)(C)CC2)c2ccccc21 ZINC000587413167 GI Annotated Mild COc1cc2c3c(c1)O[C@](CBr)(CCc1ccccc1)[C@@H](C2)C3=O ZINC000587413296 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(CCc1ccccc1)[C@@H](C2)C3=O ZINC000587413297 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](C)(c1cccc(Br)c1OC)[C@@H](C2)C3=O ZINC000587413318 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cccc(Br)c1OC)[C@@H](C2)C3=O ZINC000587413320 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(OC)ccc1Br)[C@@H](C2)C3=O ZINC000587413370 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(OC)ccc1Br)[C@@H](C2)C3=O ZINC000587413371 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(Br)cccc1N(C)C)[C@@H](C2)C3=O ZINC000587413391 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(Br)cccc1N(C)C)[C@@H](C2)C3=O ZINC000587413392 GI Annotated Anodyne COc1ccc(OCc2nc([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)cs2)cc1 ZINC000587413413 GI Annotated Anodyne COc1ccc(OCc2nc([C@H]3CC(=O)c4cc(C)cc(N)c4O3)cs2)cc1 ZINC000587413414 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1nc(-c3ccc4c(c3)OCO4)cs1)O2 ZINC000587413467 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1nc(-c3ccc4c(c3)OCO4)cs1)O2 ZINC000587413468 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(C)cc1C)[C@@H](C2)C3=O ZINC000587413605 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CBr)(c1ccc(C)cc1C)[C@@H](C2)C3=O ZINC000587413606 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1cnc3sc(C(=O)O)c(C)c3c1)O2 ZINC000587413708 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1cnc3sc(C(=O)O)c(C)c3c1)O2 ZINC000587413710 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(Cl)cc(Br)c1O)[C@@H](C2)C3=O ZINC000587413735 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(Cl)cc(Br)c1O)[C@@H](C2)C3=O ZINC000587413736 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(CCBr)cc1)[C@@H](C2)C3=O ZINC000587413738 GI Annotated Reactive COc1cc2c3c(c1)O[C@](C)(c1ccc(CCBr)cc1)[C@@H](C2)C3=O ZINC000587413740 GI Annotated Reactive COc1cc2c3c(c1)O[C@H](c1ccc(Br)cc1N(C)C)[C@@H](C2)C3=O ZINC000587413754 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(Br)cc1N(C)C)[C@@H](C2)C3=O ZINC000587413756 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(OC)c(Br)c1)[C@@H](C2)C3=O ZINC000587413784 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(OC)c(Br)c1)[C@@H](C2)C3=O ZINC000587413785 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1sc(N(C)C)nc1-c1ccccc1)O2 ZINC000587413856 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1sc(N(C)C)nc1-c1ccccc1)O2 ZINC000587413857 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ncc(Cl)cc1Br)[C@@H](C2)C3=O ZINC000587414080 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ncc(Cl)cc1Br)[C@@H](C2)C3=O ZINC000587414081 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(CC(=O)Nc1ccc3nc(C)sc3c1)O2 ZINC000587414114 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(CC(=O)Nc1ccc3nc(C)sc3c1)O2 ZINC000587414124 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@H](c1csc(NC(=O)OC(C)(C)C)n1)O2 ZINC000587414226 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@H](c1csc(NC(=O)OC(C)(C)C)n1)O2 ZINC000587414227 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1c(Br)cccc1OC)[C@@H](C2)C3=O ZINC000587414346 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1c(Br)cccc1OC)[C@@H](C2)C3=O ZINC000587414347 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@H]4CC[C@@]1(CBr)C4(C)C)[C@@H](C2)C3=O ZINC000587414397 GI Annotated Reactive COc1cc2c3c(c1)O[C@@]1(C[C@H]4CC[C@@]1(CBr)C4(C)C)[C@@H](C2)C3=O ZINC000587414398 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1coc4ccccc14)[C@@H](C2)C3=O ZINC000587414411 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CBr)(c1coc4ccccc14)[C@@H](C2)C3=O ZINC000587414412 GI Annotated Reactive COc1ccc([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(Br)c1 ZINC000587414414 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(Br)c1 ZINC000587414416 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)c2ccccc2O[C@H]1c1ccccc1 ZINC000587414492 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)C(=O)c2ccccc2O[C@@H]1c1ccccc1 ZINC000587414493 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)c2ccccc2O[C@@H]1c1ccccc1 ZINC000587414495 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)C(=O)c2ccccc2O[C@H]1c1ccccc1 ZINC000587414500 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2ccsc2CC[C@@H]1Br ZINC000587414556 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@]1(O2)c2ccsc2CC[C@H]1Br ZINC000587414559 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2ccsc2CC[C@@H]1Br ZINC000587414561 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@]1(O2)c2ccsc2CC[C@H]1Br ZINC000587414563 GI Annotated Reactive COc1cc2c3c(c1)O[C@](C)(c1ccc(Br)cc1OC)[C@@H](C2)C3=O ZINC000587414583 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(Br)cc1OC)[C@@H](C2)C3=O ZINC000587414585 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CBr)(c1cc(C)ccc1C)[C@@H](C2)C3=O ZINC000587414628 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CBr)(c1cc(C)ccc1C)[C@@H](C2)C3=O ZINC000587414629 GI Annotated Reactive COC(=O)c1ccccc1-c1ccc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)o1 ZINC000587414670 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(Br)c(OC)c1)[C@@H](C2)C3=O ZINC000587414718 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(Br)c(OC)c1)[C@@H](C2)C3=O ZINC000587414720 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cccs1)(c1ccccc1C(=O)O)O2 ZINC000587414807 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1cccs1)(c1ccccc1C(=O)O)O2 ZINC000587414809 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CBr)(c1cccc(Cl)c1)[C@@H](C2)C3=O ZINC000587414873 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1cccc(Cl)c1)[C@@H](C2)C3=O ZINC000587414875 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@]1(CCCc3nc(-c4cccnc4)sc31)O2 ZINC000587414886 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(CCCc3nc(-c4cccnc4)sc31)O2 ZINC000587414889 GI Annotated Anodyne COC(=O)c1ccccc1-c1ccc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)o1 ZINC000587414965 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)(c1cnc(N3CCCCC3)s1)O2 ZINC000587415161 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)(c1cnc(N3CCCCC3)s1)O2 ZINC000587415163 GI Annotated Reactive COC(=O)c1sc2ncc([C@]3(C)CC(=O)c4cc(C)cc(N)c4O3)cc2c1C ZINC000587415238 GI Annotated Anodyne COC(=O)c1sc2ncc([C@@]3(C)CC(=O)c4cc(C)cc(N)c4O3)cc2c1C ZINC000587415244 GI Annotated Anodyne COc1ccc(-c2ncc([C@H]3CC(=O)c4cc(C)cc(N)c4O3)s2)cc1OC ZINC000587415392 GI Annotated Anodyne COc1ccc(-c2ncc([C@@H]3CC(=O)c4cc(C)cc(N)c4O3)s2)cc1OC ZINC000587415393 GI Annotated Anodyne CC(=O)N(c1ccccc1)c1nc([C@@H]2CC(=O)c3cc(C)cc(N)c3O2)cs1 ZINC000587415402 GI Annotated Anodyne CC(=O)N(c1ccccc1)c1nc([C@H]2CC(=O)c3cc(C)cc(N)c3O2)cs1 ZINC000587415403 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@](c1cccnc1)(c1c(N)sc3c1CCC3)O2 ZINC000587415462 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1cccnc1)(c1c(N)sc3c1CCC3)O2 ZINC000587415463 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(C)cc1)([C@@H](C)Br)[C@@H](C2)C3=O ZINC000587415523 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1ccc(C)cc1)([C@H](C)Br)[C@@H](C2)C3=O ZINC000587415524 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1ccc(C)cc1)([C@@H](C)Br)[C@@H](C2)C3=O ZINC000587415525 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](c1ccc(C)cc1)([C@H](C)Br)[C@@H](C2)C3=O ZINC000587415526 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](c1ccccn1)(c1c(N)sc3c1CCC3)O2 ZINC000587415576 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](c1ccccn1)(c1c(N)sc3c1CCC3)O2 ZINC000587415577 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@@H](c3ccccc3)Cc3[nH]c(=N)sc31)O2 ZINC000587415740 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C[C@H](c3ccccc3)Cc3[nH]c(=N)sc31)O2 ZINC000587415741 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@]1(C[C@H](c3ccccc3)Cc3[nH]c(=N)sc31)O2 ZINC000587415742 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@@]1(C[C@@H](c3ccccc3)Cc3[nH]c(=N)sc31)O2 ZINC000587415743 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)([C@@H](C#N)c1nc3ccccc3s1)O2 ZINC000587415756 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)([C@@H](C#N)c1nc3ccccc3s1)O2 ZINC000587415757 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@](CCl)([C@H](C#N)c1nc3ccccc3s1)O2 ZINC000587415758 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](CCl)([C@H](C#N)c1nc3ccccc3s1)O2 ZINC000587415759 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(C)c(C)c1)[C@@H](C2)C3=O ZINC000587415760 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CBr)(c1ccc(C)c(C)c1)[C@@H](C2)C3=O ZINC000587415761 GI Annotated Reactive Cc1cc(N)c2c(c1)C(=O)C[C@@](C)(c1ccc(NC3=NCCCS3)cc1)O2 ZINC000587415960 GI Annotated Anodyne Cc1cc(N)c2c(c1)C(=O)C[C@](C)(c1ccc(NC3=NCCCS3)cc1)O2 ZINC000587415965 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4cc(Br)ccc4[nH]1)[C@@H](C2)C3=O ZINC000587416446 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4cc(Br)ccc4[nH]1)[C@@H](C2)C3=O ZINC000587416447 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C=COc4cc(Br)ccc41)[C@@H](C2)C3=O ZINC000587416459 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C=COc4cc(Br)ccc41)[C@@H](C2)C3=O ZINC000587416460 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCc4cc(Br)cc(C)c41)[C@@H](C2)C3=O ZINC000587416499 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCc4cc(Br)cc(C)c41)[C@@H](C2)C3=O ZINC000587416506 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4ccc(Br)cc41)[C@@H](C2)C3=O ZINC000587416607 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4ccc(Br)cc41)[C@@H](C2)C3=O ZINC000587416611 GI Annotated Anodyne CCOc1cc(Br)ccc1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587416669 GI Annotated Anodyne CCOc1cc(Br)ccc1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587416670 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4ncc(Br)cc4o1)[C@@H](C2)C3=O ZINC000587416682 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4ncc(Br)cc4o1)[C@@H](C2)C3=O ZINC000587416683 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc4cc(Br)cnc4c1)[C@@H](C2)C3=O ZINC000587416758 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc4cc(Br)cnc4c1)[C@@H](C2)C3=O ZINC000587416759 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c[nH]c4cc(Br)ccc14)[C@@H](C2)C3=O ZINC000587416795 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c[nH]c4cc(Br)ccc14)[C@@H](C2)C3=O ZINC000587416796 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(Br)ccc1N(C)C)[C@@H](C2)C3=O ZINC000587416838 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(Br)ccc1N(C)C)[C@@H](C2)C3=O ZINC000587416839 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CC#N)(c1cccc(Br)c1)[C@@H](C2)C3=O ZINC000587416840 GI Annotated Mild COc1cc2c3c(c1)O[C@@](CC#N)(c1cccc(Br)c1)[C@@H](C2)C3=O ZINC000587416841 GI Annotated Mild COc1cc2c3c(c1)O[C@]1([C@@H](C2)C3=O)[C@H](Br)[C@H]2CC[C@@]1(C)C2(C)C ZINC000587416890 GI Annotated Reactive COc1cc2c3c(c1)O[C@@]1([C@@H](C2)C3=O)[C@H](Br)[C@H]2CC[C@@]1(C)C2(C)C ZINC000587416893 GI Annotated Reactive COc1cc2c3c(c1)O[C@@]1([C@@H](Br)[C@H]4CC[C@@]1(C)C4(C)C)[C@@H](C2)C3=O ZINC000587416895 GI Annotated Reactive COc1cc2c3c(c1)O[C@]1([C@@H](Br)[C@H]4CC[C@@]1(C)C4(C)C)[C@@H](C2)C3=O ZINC000587416898 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1c[nH]c4cccc(Br)c14)[C@@H](C2)C3=O ZINC000587416982 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c[nH]c4cccc(Br)c14)[C@@H](C2)C3=O ZINC000587416983 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccnc4c(Br)cccc14)[C@@H](C2)C3=O ZINC000587417032 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccnc4c(Br)cccc14)[C@@H](C2)C3=O ZINC000587417034 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(Cl)cc1)([C@@H](Cl)N=O)[C@@H](C2)C3=O ZINC000587417048 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1ccc(Cl)cc1)([C@@H](Cl)N=O)[C@@H](C2)C3=O ZINC000587417050 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](c1ccc(Cl)cc1)([C@H](Cl)N=O)[C@@H](C2)C3=O ZINC000587417051 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1ccc(Cl)cc1)([C@H](Cl)N=O)[C@@H](C2)C3=O ZINC000587417052 GI Annotated Reactive COc1cc2c3c(c1)O[C@]1(CCCc4cccc(Br)c41)[C@@H](C2)C3=O ZINC000587417071 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4cccc(Br)c41)[C@@H](C2)C3=O ZINC000587417074 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C=COc4ccc(Br)cc41)[C@@H](C2)C3=O ZINC000587417117 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C=COc4ccc(Br)cc41)[C@@H](C2)C3=O ZINC000587417118 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCc4cc(Br)ccc4C1)[C@@H](C2)C3=O ZINC000587417139 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCc4cc(Br)ccc4C1)[C@@H](C2)C3=O ZINC000587417140 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CC#N)(c1ccc(Br)cc1)[C@@H](C2)C3=O ZINC000587417165 GI Annotated Mild COc1cc2c3c(c1)O[C@@](CC#N)(c1ccc(Br)cc1)[C@@H](C2)C3=O ZINC000587417166 GI Annotated Mild COc1cc2c3c(c1)O[C@@](c1ccccn1)(c1ccccc1Cl)[C@@H](C2)C3=O ZINC000587417223 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccn1)(c1ccccc1Cl)[C@@H](C2)C3=O ZINC000587417226 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccc(Cl)c1)(c1ccccn1)[C@@H](C2)C3=O ZINC000587417336 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccc(Cl)c1)(c1ccccn1)[C@@H](C2)C3=O ZINC000587417337 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCl)(c1ccc(OC)c(Cl)c1)[C@@H](C2)C3=O ZINC000587417344 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CCl)(c1ccc(OC)c(Cl)c1)[C@@H](C2)C3=O ZINC000587417347 GI Annotated Reactive COc1cc2c3c(c1)O[C@@]1(CCCc4c(Br)cccc41)[C@@H](C2)C3=O ZINC000587417349 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4c(Br)cccc41)[C@@H](C2)C3=O ZINC000587417351 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCl)(c1ccc(NC(=O)C(C)C)cc1)[C@@H](C2)C3=O ZINC000587417352 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CCl)(c1ccc(NC(=O)C(C)C)cc1)[C@@H](C2)C3=O ZINC000587417353 GI Annotated Reactive COc1cc2c3c(c1)OC1(CCN(Cc4ccccc4Cl)CC1)[C@@H](C2)C3=O ZINC000587417361 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(Br)cnc1Cl)[C@@H](C2)C3=O ZINC000587417397 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(Br)cnc1Cl)[C@@H](C2)C3=O ZINC000587417399 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc4ccc(Br)cc4n1)[C@@H](C2)C3=O ZINC000587417467 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc4ccc(Br)cc4n1)[C@@H](C2)C3=O ZINC000587417469 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccccc4CC[C@@H]1Br)[C@@H](C2)C3=O ZINC000587417534 GI Annotated Reactive COc1cc2c3c(c1)O[C@]1(c4ccccc4CC[C@@H]1Br)[C@@H](C2)C3=O ZINC000587417535 GI Annotated Reactive COc1cc2c3c(c1)O[C@@]1(c4ccccc4CC[C@H]1Br)[C@@H](C2)C3=O ZINC000587417536 GI Annotated Reactive COc1cc2c3c(c1)O[C@]1(c4ccccc4CC[C@H]1Br)[C@@H](C2)C3=O ZINC000587417537 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1ccc4cc(Br)ccc4n1)[C@@H](C2)C3=O ZINC000587417553 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc4cc(Br)ccc4n1)[C@@H](C2)C3=O ZINC000587417554 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cn(C)nc1-c1ccccc1Cl)[C@@H](C2)C3=O ZINC000587417656 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cn(C)nc1-c1ccccc1Cl)[C@@H](C2)C3=O ZINC000587417657 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cnn(-c4ccccc4Cl)c1)[C@@H](C2)C3=O ZINC000587417676 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cnn(-c4ccccc4Cl)c1)[C@@H](C2)C3=O ZINC000587417677 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1[nH]c(C)c(C(C)=O)c1C)([C@H](C)Cl)[C@@H](C2)C3=O ZINC000587417682 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1[nH]c(C)c(C(C)=O)c1C)([C@@H](C)Cl)[C@@H](C2)C3=O ZINC000587417683 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](c1[nH]c(C)c(C(C)=O)c1C)([C@H](C)Cl)[C@@H](C2)C3=O ZINC000587417684 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](c1[nH]c(C)c(C(C)=O)c1C)([C@@H](C)Cl)[C@@H](C2)C3=O ZINC000587417685 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1c(Br)[nH]c4ccccc14)[C@@H](C2)C3=O ZINC000587417686 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(Br)[nH]c4ccccc14)[C@@H](C2)C3=O ZINC000587417687 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1c(C)[nH]c(C(=O)[C@H](C)Cl)c1C)[C@@H](C2)C3=O ZINC000587417692 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](C)(c1c(C)[nH]c(C(=O)[C@@H](C)Cl)c1C)[C@@H](C2)C3=O ZINC000587417693 GI Annotated Reactive COc1cc2c3c(c1)O[C@](C)(c1c(C)[nH]c(C(=O)[C@@H](C)Cl)c1C)[C@@H](C2)C3=O ZINC000587417694 GI Annotated Reactive COc1cc2c3c(c1)O[C@](C)(c1c(C)[nH]c(C(=O)[C@H](C)Cl)c1C)[C@@H](C2)C3=O ZINC000587417695 GI Annotated Reactive COc1cc2c3c(c1)O[C@H](c1ccc4cccc(Br)c4n1)[C@@H](C2)C3=O ZINC000587417732 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc4cccc(Br)c4n1)[C@@H](C2)C3=O ZINC000587417733 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4cc(Br)ccc41)[C@@H](C2)C3=O ZINC000587417815 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4cc(Br)ccc41)[C@@H](C2)C3=O ZINC000587417816 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCc4c(Br)ccc(C)c41)[C@@H](C2)C3=O ZINC000587418008 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCc4c(Br)ccc(C)c41)[C@@H](C2)C3=O ZINC000587418011 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](C1(c4ccccc4Cl)CCOCC1)[C@@H](C2)C3=O ZINC000587418035 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](C1(c4ccccc4Cl)CCOCC1)[C@@H](C2)C3=O ZINC000587418037 GI Annotated Anodyne COC[C@@]1(c2cccc(C(F)(F)F)c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587418180 GI Annotated Anodyne COC[C@]1(c2cccc(C(F)(F)F)c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587418181 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OCC(F)(F)F)c(F)c1)[C@@H](C2)C3=O ZINC000587418229 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OCC(F)(F)F)c(F)c1)[C@@H](C2)C3=O ZINC000587418235 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c[nH]c4ccc(Br)cc14)[C@@H](C2)C3=O ZINC000587418248 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c[nH]c4ccc(Br)cc14)[C@@H](C2)C3=O ZINC000587418252 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C=C(C)Oc4ccc(Br)cc41)[C@@H](C2)C3=O ZINC000587418303 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C=C(C)Oc4ccc(Br)cc41)[C@@H](C2)C3=O ZINC000587418304 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1coc4cc(C)c(Cl)cc4c1=O)[C@@H](C2)C3=O ZINC000587418320 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1coc4cc(C)c(Cl)cc4c1=O)[C@@H](C2)C3=O ZINC000587418322 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ncc(Br)cc1Cl)[C@@H](C2)C3=O ZINC000587418338 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ncc(Br)cc1Cl)[C@@H](C2)C3=O ZINC000587418339 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(Cl)n(C)c4ccc(C=O)cc14)[C@@H](C2)C3=O ZINC000587418368 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(Cl)n(C)c4ccc(C=O)cc14)[C@@H](C2)C3=O ZINC000587418369 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C)nn(-c4ccccc4)c1Cl)[C@@H](C2)C3=O ZINC000587418370 GI Annotated Anodyne COc1ccc([C@H](C#N)[C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(Cl)c1 ZINC000587418372 GI Annotated Mild COc1cc2c3c(c1)O[C@H](c1c(C)nn(-c4ccccc4)c1Cl)[C@@H](C2)C3=O ZINC000587418373 GI Annotated Anodyne COc1ccc([C@@H](C#N)[C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(Cl)c1 ZINC000587418384 GI Annotated Mild COc1ccc([C@H](C#N)[C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(Cl)c1 ZINC000587418385 GI Annotated Mild COc1ccc([C@@H](C#N)[C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(Cl)c1 ZINC000587418388 GI Annotated Mild COc1cc2c3c(c1)O[C@](C)([C@@H](C#N)c1ccc(Br)cc1)[C@@H](C2)C3=O ZINC000587418477 GI Annotated Mild COc1cc2c3c(c1)O[C@](C[C@@H](C)C(=O)O)(c1ccc(Cl)cc1)[C@@H](C2)C3=O ZINC000587418478 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C[C@@H](C)C(=O)O)(c1ccc(Cl)cc1)[C@@H](C2)C3=O ZINC000587418479 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)([C@H](C#N)c1ccc(Br)cc1)[C@@H](C2)C3=O ZINC000587418480 GI Annotated Mild COc1cc2c3c(c1)O[C@](C[C@H](C)C(=O)O)(c1ccc(Cl)cc1)[C@@H](C2)C3=O ZINC000587418481 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)([C@@H](C#N)c1ccc(Br)cc1)[C@@H](C2)C3=O ZINC000587418482 GI Annotated Mild COc1cc2c3c(c1)O[C@@](C[C@H](C)C(=O)O)(c1ccc(Cl)cc1)[C@@H](C2)C3=O ZINC000587418483 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c[nH]c4c(Br)cccc14)[C@@H](C2)C3=O ZINC000587418668 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c[nH]c4c(Br)cccc14)[C@@H](C2)C3=O ZINC000587418670 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc4c(Br)c[nH]c4c1)[C@@H](C2)C3=O ZINC000587418705 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc4c(Br)c[nH]c4c1)[C@@H](C2)C3=O ZINC000587418707 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(OC)cc1C(F)(F)F)[C@@H](C2)C3=O ZINC000587418781 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(OC)cc1C(F)(F)F)[C@@H](C2)C3=O ZINC000587418782 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(Cl)c(N)c(C(F)(F)F)c1)[C@@H](C2)C3=O ZINC000587418873 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(Cl)c(N)c(C(F)(F)F)c1)[C@@H](C2)C3=O ZINC000587418875 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4c(C(F)(F)F)nn(C)c4s1)[C@@H](C2)C3=O ZINC000587418900 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4c(C(F)(F)F)nn(C)c4s1)[C@@H](C2)C3=O ZINC000587418911 GI Annotated Anodyne C=CCOc1c(Cl)cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1OC ZINC000587418963 GI Annotated Mild C=CCOc1c(Cl)cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1OC ZINC000587418967 GI Annotated Mild COc1cc2c3c(c1)O[C@](C)([C@H](C#N)c1ccc(Br)cc1)[C@@H](C2)C3=O ZINC000587418990 GI Annotated Mild COc1cc2c3c(c1)O[C@@]1(c4cc(Br)ccc4C[C@@H]1C)[C@@H](C2)C3=O ZINC000587419001 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4cc(Br)ccc4C[C@@H]1C)[C@@H](C2)C3=O ZINC000587419002 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4cc(Br)ccc4C[C@H]1C)[C@@H](C2)C3=O ZINC000587419003 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4cc(Br)ccc4C[C@H]1C)[C@@H](C2)C3=O ZINC000587419006 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccnc4cc(Br)ccc14)[C@@H](C2)C3=O ZINC000587419008 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccnc4cc(Br)ccc14)[C@@H](C2)C3=O ZINC000587419010 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCl)(c1ccc(Br)cc1)[C@@H](C2)C3=O ZINC000587419022 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CCl)(c1ccc(Br)cc1)[C@@H](C2)C3=O ZINC000587419024 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CCC#N)(c1ccc(Br)cc1)[C@@H](C2)C3=O ZINC000587419045 GI Annotated Mild COc1cc2c3c(c1)O[C@](CCC#N)(c1ccc(Br)cc1)[C@@H](C2)C3=O ZINC000587419048 GI Annotated Mild COc1cc2c3c(c1)O[C@@](C)(/C(=C\N(C)C)c1ccc(Cl)cc1)[C@@H](C2)C3=O ZINC000587419078 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)Nc1ccc(Cl)cc1C)[C@@H](C2)C3=O ZINC000587419080 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(/C(=C/N(C)C)c1ccc(Cl)cc1)[C@@H](C2)C3=O ZINC000587419081 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(/C(=C/N(C)C)c1ccc(Cl)cc1)[C@@H](C2)C3=O ZINC000587419083 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(/C(=C\N(C)C)c1ccc(Cl)cc1)[C@@H](C2)C3=O ZINC000587419088 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)Nc1ccc(Cl)cc1C)[C@@H](C2)C3=O ZINC000587419093 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(Br)c4cccnc14)[C@@H](C2)C3=O ZINC000587419099 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cn(C)c4ccc(Br)cc14)[C@@H](C2)C3=O ZINC000587419101 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(Br)c4cccnc14)[C@@H](C2)C3=O ZINC000587419102 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cn(C)c4ccc(Br)cc14)[C@@H](C2)C3=O ZINC000587419108 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4cc(Br)cnc4o1)[C@@H](C2)C3=O ZINC000587419110 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4cc(Br)cnc4o1)[C@@H](C2)C3=O ZINC000587419114 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](C1(c4cccc(Cl)c4)CCOCC1)[C@@H](C2)C3=O ZINC000587419226 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](C1(c4cccc(Cl)c4)CCOCC1)[C@@H](C2)C3=O ZINC000587419228 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4cccc(Br)c4C[C@@H]1C)[C@@H](C2)C3=O ZINC000587419242 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4cccc(Br)c4C[C@H]1C)[C@@H](C2)C3=O ZINC000587419246 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4cccc(Br)c4C[C@@H]1C)[C@@H](C2)C3=O ZINC000587419249 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4cccc(Br)c4C[C@H]1C)[C@@H](C2)C3=O ZINC000587419251 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1nccnc1-c1ccc(Cl)cc1)[C@@H](C2)C3=O ZINC000587419356 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCl)(c1c[nH]c4nccc(Cl)c14)[C@@H](C2)C3=O ZINC000587419364 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CCl)(c1c[nH]c4nccc(Cl)c14)[C@@H](C2)C3=O ZINC000587419367 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1cccc(C(F)(F)F)c1)([C@H](F)C#N)[C@@H](C2)C3=O ZINC000587419368 GI Annotated Mild COc1cc2c3c(c1)O[C@@H](c1nccnc1-c1ccc(Cl)cc1)[C@@H](C2)C3=O ZINC000587419372 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccc(C(F)(F)F)c1)([C@@H](F)C#N)[C@@H](C2)C3=O ZINC000587419397 GI Annotated Mild COc1cc2c3c(c1)O[C@@](c1cccc(C(F)(F)F)c1)([C@@H](F)C#N)[C@@H](C2)C3=O ZINC000587419401 GI Annotated Mild COc1cc2c3c(c1)O[C@@](c1cccc(C(F)(F)F)c1)([C@H](F)C#N)[C@@H](C2)C3=O ZINC000587419404 GI Annotated Mild COc1cc2c3c(c1)O[C@H](c1cc(OC(F)(F)F)ccc1OC)[C@@H](C2)C3=O ZINC000587419459 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(Cl)cc1)(c1cccnc1)[C@@H](C2)C3=O ZINC000587419467 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(Cl)cc1)(c1cccnc1)[C@@H](C2)C3=O ZINC000587419469 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(OC(F)(F)F)ccc1OC)[C@@H](C2)C3=O ZINC000587419472 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(OCC(F)F)c(OC)c1)[C@@H](C2)C3=O ZINC000587419474 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(OCC(F)F)c(OC)c1)[C@@H](C2)C3=O ZINC000587419475 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(NC(=O)CCCCl)cc1)[C@@H](C2)C3=O ZINC000587419585 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](C)(c1ccc(NC(=O)CCCCl)cc1)[C@@H](C2)C3=O ZINC000587419586 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1ccccc1OC(F)(F)C(F)F)[C@@H](C2)C3=O ZINC000587419593 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccccc1OC(F)(F)C(F)F)[C@@H](C2)C3=O ZINC000587419603 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(CCl)c(OC)cc1OC)[C@@H](C2)C3=O ZINC000587419617 GI Annotated Reactive COc1cc2c3c(c1)O[C@](C)(c1cc(CCl)c(OC)cc1OC)[C@@H](C2)C3=O ZINC000587419621 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1cc4cnn(C(C)C)c4nc1Cl)[C@@H](C2)C3=O ZINC000587419654 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4cnn(C(C)C)c4nc1Cl)[C@@H](C2)C3=O ZINC000587419661 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cnn(-c4cccc(Cl)c4)c1)[C@@H](C2)C3=O ZINC000587419810 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cnn(-c4cccc(Cl)c4)c1)[C@@H](C2)C3=O ZINC000587419812 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4ccc(Br)cc4[nH]1)[C@@H](C2)C3=O ZINC000587419843 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4ccc(Br)cc4[nH]1)[C@@H](C2)C3=O ZINC000587419845 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(C(=O)O)[nH]c4ccc(Cl)cc14)[C@@H](C2)C3=O ZINC000587419875 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C(=O)O)[nH]c4ccc(Cl)cc14)[C@@H](C2)C3=O ZINC000587419879 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4cc(Br)ccc4NC14CC4)[C@@H](C2)C3=O ZINC000587419935 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4cc(Br)ccc4NC14CC4)[C@@H](C2)C3=O ZINC000587419937 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC)c(OCCCCl)c1)[C@@H](C2)C3=O ZINC000587420044 GI Annotated Reactive COc1cc2c3c(c1)O[C@H](c1ccc(OC)c(OCCCCl)c1)[C@@H](C2)C3=O ZINC000587420047 GI Annotated Reactive COc1cc2c3c(c1)O[C@](C)([C@@H](C#N)c1cccc(Br)c1)[C@@H](C2)C3=O ZINC000587420057 GI Annotated Mild COc1cc2c3c(c1)O[C@@](C)([C@H](C#N)c1cccc(Br)c1)[C@@H](C2)C3=O ZINC000587420058 GI Annotated Mild COc1cc2c3c(c1)O[C@@](C)([C@@H](C#N)c1cccc(Br)c1)[C@@H](C2)C3=O ZINC000587420059 GI Annotated Mild COc1cc2c3c(c1)O[C@](C)([C@H](C#N)c1cccc(Br)c1)[C@@H](C2)C3=O ZINC000587420061 GI Annotated Mild COc1cc2c3c(c1)O[C@@]1(CCOc4cc(Cl)cc(Cl)c41)[C@@H](C2)C3=O ZINC000587420081 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCOc4cc(Cl)cc(Cl)c41)[C@@H](C2)C3=O ZINC000587420106 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(Cl)cc(OC(C)=O)cc1Cl)[C@@H](C2)C3=O ZINC000587420219 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(Cl)cc(OC(C)=O)cc1Cl)[C@@H](C2)C3=O ZINC000587420221 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC(F)(F)C(F)F)cc1)[C@@H](C2)C3=O ZINC000587420291 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OC(F)(F)C(F)F)cc1)[C@@H](C2)C3=O ZINC000587420293 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4ccc(OC)cc4nc1Cl)[C@@H](C2)C3=O ZINC000587420331 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4ccc(OC)cc4nc1Cl)[C@@H](C2)C3=O ZINC000587420334 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OC(F)F)c(OC(F)F)c1)[C@@H](C2)C3=O ZINC000587420386 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC(F)F)c(OC(F)F)c1)[C@@H](C2)C3=O ZINC000587420388 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4ccc(Br)cc4n1C)[C@@H](C2)C3=O ZINC000587420423 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4ccc(Br)cc4n1C)[C@@H](C2)C3=O ZINC000587420425 GI Annotated Anodyne CCOc1ccc(Br)cc1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587420529 GI Annotated Anodyne CCOc1ccc(Br)cc1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587420533 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CC#N)(c1ccc(F)c(C(F)(F)F)c1)[C@@H](C2)C3=O ZINC000587420536 GI Annotated Mild COc1cc2c3c(c1)O[C@@](CC#N)(c1ccc(F)c(C(F)(F)F)c1)[C@@H](C2)C3=O ZINC000587420539 GI Annotated Mild COc1cc2c3c(c1)O[C@@](C)(C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](C2)C3=O ZINC000587420713 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(C(=O)c1cc(Cl)cc(Cl)c1)[C@@H](C2)C3=O ZINC000587420715 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccnc1)(c1ccccc1Cl)[C@@H](C2)C3=O ZINC000587420743 GI Annotated Anodyne COc1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(OC(F)(F)F)c1 ZINC000587420747 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccnc1)(c1ccccc1Cl)[C@@H](C2)C3=O ZINC000587420748 GI Annotated Anodyne COc1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(OC(F)(F)F)c1 ZINC000587420752 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(Cl)cc1)(c1ccccn1)[C@@H](C2)C3=O ZINC000587420781 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(Cl)cc1)(c1ccccn1)[C@@H](C2)C3=O ZINC000587420785 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](CCc1ccc(F)c(OC(F)F)c1)[C@@H](C2)C3=O ZINC000587420787 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](CCc1ccc(F)c(OC(F)F)c1)[C@@H](C2)C3=O ZINC000587420796 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CC#N)(c1ccccc1OC(F)(F)F)[C@@H](C2)C3=O ZINC000587420797 GI Annotated Mild COc1cc2c3c(c1)O[C@@](CC#N)(c1ccccc1OC(F)(F)F)[C@@H](C2)C3=O ZINC000587420806 GI Annotated Mild COc1cc2c3c(c1)O[C@](c1ccncc1)(c1ccc(Cl)cc1)[C@@H](C2)C3=O ZINC000587420876 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccncc1)(c1ccc(Cl)cc1)[C@@H](C2)C3=O ZINC000587420879 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)Nc1cccc(Cl)c1C)[C@@H](C2)C3=O ZINC000587420898 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)Nc1cccc(Cl)c1C)[C@@H](C2)C3=O ZINC000587420902 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnc(-c4ccc(Cl)cc4)nc1)[C@@H](C2)C3=O ZINC000587420938 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnc(-c4ccc(Cl)cc4)nc1)[C@@H](C2)C3=O ZINC000587420942 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CC#N)(c1ccc(OC(F)(F)F)cc1)[C@@H](C2)C3=O ZINC000587420997 GI Annotated Mild COc1cc2c3c(c1)O[C@@](CC#N)(c1ccc(OC(F)(F)F)cc1)[C@@H](C2)C3=O ZINC000587420998 GI Annotated Mild COc1cc2c3c(c1)O[C@](C)(c1cc(Br)ccc1OC)[C@@H](C2)C3=O ZINC000587421024 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(Br)ccc1OC)[C@@H](C2)C3=O ZINC000587421025 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C(C)=O)(c1cc(Cl)cc(Cl)c1)[C@@H](C2)C3=O ZINC000587421074 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C(C)=O)(c1cc(Cl)cc(Cl)c1)[C@@H](C2)C3=O ZINC000587421075 GI Annotated Anodyne COc1cc2c3c(c1)OC1(CCN(c4ccc(C)c(Cl)c4)CC1)[C@@H](C2)C3=O ZINC000587421147 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(-c4ccc(Cl)nn4)cc1)[C@@H](C2)C3=O ZINC000587421159 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(-c4ccc(Cl)nn4)cc1)[C@@H](C2)C3=O ZINC000587421162 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@H](C2)C3=O ZINC000587421164 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1ccc([N+](=O)[O-])c(C(F)(F)F)c1)[C@@H](C2)C3=O ZINC000587421167 GI Annotated Bother COc1cc2c3c(c1)O[C@@](CC#N)(c1c[nH]c4cccc(Cl)c14)[C@@H](C2)C3=O ZINC000587421206 GI Annotated Mild COc1cc2c3c(c1)O[C@@](c1ccc(Cl)cc1)([C@H](C)CC(=O)O)[C@@H](C2)C3=O ZINC000587421209 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CC#N)(c1c[nH]c4cccc(Cl)c14)[C@@H](C2)C3=O ZINC000587421210 GI Annotated Mild COc1cc2c3c(c1)O[C@](c1ccc(Cl)cc1)([C@H](C)CC(=O)O)[C@@H](C2)C3=O ZINC000587421213 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(Cl)cc1)([C@@H](C)CC(=O)O)[C@@H](C2)C3=O ZINC000587421214 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(Cl)cc1)([C@@H](C)CC(=O)O)[C@@H](C2)C3=O ZINC000587421216 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)Nc1ccc(C)c(Cl)c1)[C@@H](C2)C3=O ZINC000587421217 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)Nc1ccc(C)c(Cl)c1)[C@@H](C2)C3=O ZINC000587421218 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccccc4-c4ccnc(Cl)c41)[C@@H](C2)C3=O ZINC000587421249 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4ccccc4-c4ccnc(Cl)c41)[C@@H](C2)C3=O ZINC000587421257 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(N(C)C)cc1C(F)(F)F)[C@@H](C2)C3=O ZINC000587421258 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N(C)C)cc1C(F)(F)F)[C@@H](C2)C3=O ZINC000587421259 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4cc(OC)ccc4nc1Cl)[C@@H](C2)C3=O ZINC000587421335 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4cc(OC)ccc4nc1Cl)[C@@H](C2)C3=O ZINC000587421339 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OCC(F)(F)F)c(OC)c1)[C@@H](C2)C3=O ZINC000587421346 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OCC(F)(F)F)c(OC)c1)[C@@H](C2)C3=O ZINC000587421348 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587421350 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1ccc(C(F)(F)F)cc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587421352 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H](C2)C3=O ZINC000587421366 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H](C2)C3=O ZINC000587421368 GI Annotated Bother COc1cc2c3c(c1)O[C@@](CC#N)(c1cc(C)oc1C(F)(F)F)[C@@H](C2)C3=O ZINC000587421405 GI Annotated Mild COc1cc2c3c(c1)O[C@](CC#N)(c1cc(C)oc1C(F)(F)F)[C@@H](C2)C3=O ZINC000587421412 GI Annotated Mild COc1cc2c3c(c1)O[C@]1(CCOc4c(Cl)ccc(Cl)c41)[C@@H](C2)C3=O ZINC000587421432 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCOc4c(Cl)ccc(Cl)c41)[C@@H](C2)C3=O ZINC000587421435 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(CCl)c(C#N)c4ccccn14)[C@@H](C2)C3=O ZINC000587421444 GI Annotated Reactive COc1cc2c3c(c1)O[C@H](c1c(CCl)c(C#N)c4ccccn14)[C@@H](C2)C3=O ZINC000587421448 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CC#N)(c1c[nH]c4cc(Cl)ccc14)[C@@H](C2)C3=O ZINC000587421497 GI Annotated Mild COc1cc2c3c(c1)O[C@@](CC#N)(c1c[nH]c4cc(Cl)ccc14)[C@@H](C2)C3=O ZINC000587421498 GI Annotated Mild COc1cc2c3c(c1)O[C@](C)(c1cccc(OC(F)(F)F)c1F)[C@@H](C2)C3=O ZINC000587421524 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cccc(OC(F)(F)F)c1F)[C@@H](C2)C3=O ZINC000587421526 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4nc(Cl)cc(Cl)c41)[C@@H](C2)C3=O ZINC000587421552 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4nc(Cl)cc(Cl)c41)[C@@H](C2)C3=O ZINC000587421553 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccncc1)(c1cccc(Cl)c1)[C@@H](C2)C3=O ZINC000587421620 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccncc1)(c1cccc(Cl)c1)[C@@H](C2)C3=O ZINC000587421622 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccnc1)(c1cccc(Cl)c1)[C@@H](C2)C3=O ZINC000587421683 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccnc1)(c1cccc(Cl)c1)[C@@H](C2)C3=O ZINC000587421685 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(OCC(F)(F)F)cc1)[C@@H](C2)C3=O ZINC000587421771 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(OCC(F)(F)F)cc1)[C@@H](C2)C3=O ZINC000587421776 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4cc5c(cc4nc1Cl)OCO5)[C@@H](C2)C3=O ZINC000587421793 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(C(=O)c1ccc(C(F)(F)F)cc1)[C@@H](C2)C3=O ZINC000587421800 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(C(=O)c1ccc(C(F)(F)F)cc1)[C@@H](C2)C3=O ZINC000587421804 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4cc5c(cc4nc1Cl)OCO5)[C@@H](C2)C3=O ZINC000587421808 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(F)ccc(C4OCCO4)c1Cl)[C@@H](C2)C3=O ZINC000587421815 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(F)ccc(C4OCCO4)c1Cl)[C@@H](C2)C3=O ZINC000587421823 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(Cl)ccc([N+](=O)[O-])c1Cl)[C@@H](C2)C3=O ZINC000587421846 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1c(Cl)ccc([N+](=O)[O-])c1Cl)[C@@H](C2)C3=O ZINC000587421848 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1c(F)cc(Br)c(F)c1F)[C@@H](C2)C3=O ZINC000587421852 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCOc4c(Cl)cc(Cl)cc41)[C@@H](C2)C3=O ZINC000587421858 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(F)cc(Br)c(F)c1F)[C@@H](C2)C3=O ZINC000587421860 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCOc4c(Cl)cc(Cl)cc41)[C@@H](C2)C3=O ZINC000587421861 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CBr)(c1ccc(F)c(C)c1)[C@@H](C2)C3=O ZINC000587421896 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(F)c(C)c1)[C@@H](C2)C3=O ZINC000587421902 GI Annotated Reactive COc1cc2c3c(c1)O[C@](C)(c1cnn(-c4ccc(Cl)cc4)c1)[C@@H](C2)C3=O ZINC000587421932 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cnn(-c4ccc(Cl)cc4)c1)[C@@H](C2)C3=O ZINC000587421935 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(OC(F)(F)C(F)F)c1)[C@@H](C2)C3=O ZINC000587421946 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(OC(F)(F)C(F)F)c1)[C@@H](C2)C3=O ZINC000587421947 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(F)cc(Br)cc1F)[C@@H](C2)C3=O ZINC000587422030 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(F)cc(Br)cc1F)[C@@H](C2)C3=O ZINC000587422035 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccnc1)(c1ccc(F)c(C)c1)[C@@H](C2)C3=O ZINC000587422050 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccnc1)(c1ccc(F)c(C)c1)[C@@H](C2)C3=O ZINC000587422052 GI Annotated Anodyne C=CCOc1cc(Cl)c([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1OC ZINC000587422101 GI Annotated Mild C=CCOc1cc(Cl)c([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1OC ZINC000587422103 GI Annotated Mild COc1cc2c3c(c1)O[C@H](c1ccc(OC)c(OC(F)(F)F)c1)[C@@H](C2)C3=O ZINC000587422141 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC)c(OC(F)(F)F)c1)[C@@H](C2)C3=O ZINC000587422142 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587422204 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1cc(C(F)(F)F)ccc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587422206 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1cc(F)c(C)cc1Br)[C@@H](C2)C3=O ZINC000587422214 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(F)c(C)cc1Br)[C@@H](C2)C3=O ZINC000587422216 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(Cl)nc4cc(Cl)ccn14)[C@@H](C2)C3=O ZINC000587422219 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(Cl)nc4cc(Cl)ccn14)[C@@H](C2)C3=O ZINC000587422231 GI Annotated Anodyne COc1cc2c3c(c1)OC1(CCC(O)(c4cccc(Cl)c4)CC1)[C@@H](C2)C3=O ZINC000587422244 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(Br)c(C)cc1F)[C@@H](C2)C3=O ZINC000587422247 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(Br)c(C)cc1F)[C@@H](C2)C3=O ZINC000587422248 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccnc1)(c1c(F)cc(F)cc1F)[C@@H](C2)C3=O ZINC000587422249 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccnc1)(c1c(F)cc(F)cc1F)[C@@H](C2)C3=O ZINC000587422254 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(F)c(Br)c1F)[C@@H](C2)C3=O ZINC000587422268 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(F)c(Br)c1F)[C@@H](C2)C3=O ZINC000587422272 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(C(=O)c1cccc(C(F)(F)F)c1)[C@@H](C2)C3=O ZINC000587422366 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(C(=O)c1cccc(C(F)(F)F)c1)[C@@H](C2)C3=O ZINC000587422369 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OC)c(OC)c1C(F)(F)F)[C@@H](C2)C3=O ZINC000587422388 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc4c(c1)c(C=O)c(Cl)n4C)[C@@H](C2)C3=O ZINC000587422392 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc4c(c1)c(C=O)c(Cl)n4C)[C@@H](C2)C3=O ZINC000587422394 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(F)c(Br)c1)[C@@H](C2)C3=O ZINC000587422398 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC)c(OC)c1C(F)(F)F)[C@@H](C2)C3=O ZINC000587422401 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(F)c(Br)c1)[C@@H](C2)C3=O ZINC000587422408 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc([N+](=O)[O-])cc1C(F)(F)F)[C@@H](C2)C3=O ZINC000587422449 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1ccc([N+](=O)[O-])cc1C(F)(F)F)[C@@H](C2)C3=O ZINC000587422452 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1cc([N+](=O)[O-])c(Cl)cc1Cl)[C@@H](C2)C3=O ZINC000587422478 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1cc([N+](=O)[O-])c(Cl)cc1Cl)[C@@H](C2)C3=O ZINC000587422481 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1c(-c4ccccc4)nn(C)c1Cl)[C@@H](C2)C3=O ZINC000587422508 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(-c4ccccc4)nn(C)c1Cl)[C@@H](C2)C3=O ZINC000587422511 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(F)c(Br)c1F)[C@@H](C2)C3=O ZINC000587422542 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(F)c(Br)c1F)[C@@H](C2)C3=O ZINC000587422546 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCc4ccc(OC(F)(F)F)cc41)[C@@H](C2)C3=O ZINC000587422636 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCc4ccc(OC(F)(F)F)cc41)[C@@H](C2)C3=O ZINC000587422643 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(C(F)(F)F)c([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587422865 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1ccc(C(F)(F)F)c([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587422866 GI Annotated Bother COc1cc2c3c(c1)O[C@@](COCC(F)(F)F)(c1ccc(C)cc1)[C@@H](C2)C3=O ZINC000587422877 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](COCC(F)(F)F)(c1ccc(C)cc1)[C@@H](C2)C3=O ZINC000587422881 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(F)ccc(C)c1Br)[C@@H](C2)C3=O ZINC000587422887 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(F)ccc(C)c1Br)[C@@H](C2)C3=O ZINC000587422888 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(Cl)cc1)(C1CCOCC1)[C@@H](C2)C3=O ZINC000587422994 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(Cl)cc1)(C1CCOCC1)[C@@H](C2)C3=O ZINC000587422995 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCl)(c1c[nH]c4cc(OC)ccc14)[C@@H](C2)C3=O ZINC000587423080 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CCl)(c1c[nH]c4cc(OC)ccc14)[C@@H](C2)C3=O ZINC000587423082 GI Annotated Reactive COc1cc2c3c(c1)O[C@]1(CCOc4c1ccc(Cl)c4Cl)[C@@H](C2)C3=O ZINC000587423105 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCOc4c1ccc(Cl)c4Cl)[C@@H](C2)C3=O ZINC000587423109 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccccc1NC(=O)CCCCl)[C@@H](C2)C3=O ZINC000587423110 GI Annotated Reactive COc1cc2c3c(c1)O[C@](C)(c1ccccc1NC(=O)CCCCl)[C@@H](C2)C3=O ZINC000587423111 GI Annotated Reactive CCCCn1nc(C(F)(F)F)cc1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587423125 GI Annotated Anodyne CCCCn1nc(C(F)(F)F)cc1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587423130 GI Annotated Anodyne CCOc1cccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1OC(F)F ZINC000587423157 GI Annotated Anodyne CCOc1cccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1OC(F)F ZINC000587423159 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)Nc1ccc(C)cc1Cl)[C@@H](C2)C3=O ZINC000587423214 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)Nc1ccc(C)cc1Cl)[C@@H](C2)C3=O ZINC000587423216 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](CCc1ccc(OC(F)F)c(F)c1)[C@@H](C2)C3=O ZINC000587423228 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](CCc1ccc(OC(F)F)c(F)c1)[C@@H](C2)C3=O ZINC000587423229 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4ncc(C(F)(F)F)cc41)[C@@H](C2)C3=O ZINC000587423276 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4ncc(C(F)(F)F)cc41)[C@@H](C2)C3=O ZINC000587423277 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(OC)c(C(F)(F)F)c1)[C@@H](C2)C3=O ZINC000587423337 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(OC)c(C(F)(F)F)c1)[C@@H](C2)C3=O ZINC000587423338 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1c(F)cccc1Br)[C@@H](C2)C3=O ZINC000587423367 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1c(F)cccc1Br)[C@@H](C2)C3=O ZINC000587423369 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(Br)cc(C)c1F)[C@@H](C2)C3=O ZINC000587423375 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(Br)cc(C)c1F)[C@@H](C2)C3=O ZINC000587423376 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cn(-c4ccc(Cl)cc4)nc1C)[C@@H](C2)C3=O ZINC000587423493 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cn(-c4ccc(Cl)cc4)nc1C)[C@@H](C2)C3=O ZINC000587423495 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1nc4cc(C(F)(F)F)ccc4n1C)[C@@H](C2)C3=O ZINC000587423615 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1nc4cc(C(F)(F)F)ccc4n1C)[C@@H](C2)C3=O ZINC000587423622 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OCCCCl)c(OC)c1)[C@@H](C2)C3=O ZINC000587423637 GI Annotated Reactive COc1cc2c3c(c1)O[C@H](c1ccc(OCCCCl)c(OC)c1)[C@@H](C2)C3=O ZINC000587423640 GI Annotated Reactive COc1cc2c3c(c1)O[C@]1(CC(C)(C)Cc4[nH]nc(C(F)(F)F)c41)[C@@H](C2)C3=O ZINC000587423867 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC(C)(C)Cc4[nH]nc(C(F)(F)F)c41)[C@@H](C2)C3=O ZINC000587423869 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(F)c(CBr)c1)[C@@H](C2)C3=O ZINC000587423913 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1ccc(F)c(CBr)c1)[C@@H](C2)C3=O ZINC000587423914 GI Annotated Reactive COc1cc2c3c(c1)O[C@H](c1cccc(F)c1CBr)[C@@H](C2)C3=O ZINC000587423947 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1cccc(F)c1CBr)[C@@H](C2)C3=O ZINC000587423948 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](C)(c1c(F)cc(Br)cc1F)[C@@H](C2)C3=O ZINC000587423969 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1c(F)cc(Br)cc1F)[C@@H](C2)C3=O ZINC000587423970 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](CCc1ccc(OC(F)(F)F)cc1)[C@@H](C2)C3=O ZINC000587424057 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](CCc1ccc(OC(F)(F)F)cc1)[C@@H](C2)C3=O ZINC000587424059 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ncc(C(F)(F)F)cc1Cl)[C@@H](C2)C3=O ZINC000587424074 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ncc(C(F)(F)F)cc1Cl)[C@@H](C2)C3=O ZINC000587424081 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)Nc1c(C)cccc1Cl)[C@@H](C2)C3=O ZINC000587424103 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)Nc1c(C)cccc1Cl)[C@@H](C2)C3=O ZINC000587424105 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCCC(=O)O)(c1ccc(Cl)cc1)[C@@H](C2)C3=O ZINC000587424287 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCCC(=O)O)(c1ccc(Cl)cc1)[C@@H](C2)C3=O ZINC000587424288 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(C)cc(Br)c1F)[C@@H](C2)C3=O ZINC000587424356 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(C)cc(Br)c1F)[C@@H](C2)C3=O ZINC000587424359 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCl)(Cc1c(F)cccc1Cl)[C@@H](C2)C3=O ZINC000587424361 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CCl)(Cc1c(F)cccc1Cl)[C@@H](C2)C3=O ZINC000587424364 GI Annotated Reactive CCOc1cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)ccc1OC(F)F ZINC000587424467 GI Annotated Anodyne CCOc1cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)ccc1OC(F)F ZINC000587424470 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(Cl)c(OC(F)F)c(OC)c1)[C@@H](C2)C3=O ZINC000587424483 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(Cl)c(OC(F)F)c(OC)c1)[C@@H](C2)C3=O ZINC000587424490 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(F)c(C)c(Br)c1)[C@@H](C2)C3=O ZINC000587424517 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(F)c(C)c(Br)c1)[C@@H](C2)C3=O ZINC000587424519 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(CBr)ccc1F)[C@@H](C2)C3=O ZINC000587424562 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1cc(CBr)ccc1F)[C@@H](C2)C3=O ZINC000587424563 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1ccncc1)(c1cc(F)ccc1F)[C@@H](C2)C3=O ZINC000587424593 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccncc1)(c1cc(F)ccc1F)[C@@H](C2)C3=O ZINC000587424594 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(C)c(Br)cc1F)[C@@H](C2)C3=O ZINC000587424615 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(C)c(Br)cc1F)[C@@H](C2)C3=O ZINC000587424616 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(F)c(Br)cc1F)[C@@H](C2)C3=O ZINC000587424627 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(F)c(Br)cc1F)[C@@H](C2)C3=O ZINC000587424628 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(Br)c(F)cc1F)[C@@H](C2)C3=O ZINC000587424631 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(Br)c(F)cc1F)[C@@H](C2)C3=O ZINC000587424632 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(F)ccc(Br)c1OC)[C@@H](C2)C3=O ZINC000587424641 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(F)ccc(Br)c1OC)[C@@H](C2)C3=O ZINC000587424642 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCF)(c1ccccc1Br)[C@@H](C2)C3=O ZINC000587424675 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCF)(c1ccccc1Br)[C@@H](C2)C3=O ZINC000587424676 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cccc(F)c1Br)[C@@H](C2)C3=O ZINC000587424693 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cccc(F)c1Br)[C@@H](C2)C3=O ZINC000587424694 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(OC)c(F)cc1Br)[C@@H](C2)C3=O ZINC000587424721 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(OC)c(F)cc1Br)[C@@H](C2)C3=O ZINC000587424722 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC[C@H](OCc4ccccc4)C[C@@H]1F)[C@@H](C2)C3=O ZINC000587424725 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CC[C@H](OCc4ccccc4)C[C@@H]1F)[C@@H](C2)C3=O ZINC000587424726 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC[C@H](OCc4ccccc4)C[C@H]1F)[C@@H](C2)C3=O ZINC000587424727 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CC[C@H](OCc4ccccc4)C[C@H]1F)[C@@H](C2)C3=O ZINC000587424728 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(F)c(F)cc1Br)[C@@H](C2)C3=O ZINC000587424739 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(F)c(F)cc1Br)[C@@H](C2)C3=O ZINC000587424740 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(Br)cc(F)c(F)c1F)[C@@H](C2)C3=O ZINC000587424751 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(Br)cc(F)c(F)c1F)[C@@H](C2)C3=O ZINC000587424752 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(Br)c(F)cc1F)[C@@H](C2)C3=O ZINC000587424753 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(Br)c(F)cc1F)[C@@H](C2)C3=O ZINC000587424754 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(F)cc(C)cc1Br)[C@@H](C2)C3=O ZINC000587424761 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(F)cc(C)cc1Br)[C@@H](C2)C3=O ZINC000587424762 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(F)c(Br)cc1C)[C@@H](C2)C3=O ZINC000587424825 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(F)c(Br)cc1C)[C@@H](C2)C3=O ZINC000587424826 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(F)cc(Br)cc1OC)[C@@H](C2)C3=O ZINC000587424831 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(F)cc(Br)cc1OC)[C@@H](C2)C3=O ZINC000587424832 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(Br)ccc1F)[C@@H](C2)C3=O ZINC000587424835 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(Br)ccc1F)[C@@H](C2)C3=O ZINC000587424836 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(Br)c(OC)cc1F)[C@@H](C2)C3=O ZINC000587424841 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(Br)c(OC)cc1F)[C@@H](C2)C3=O ZINC000587424842 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(Br)c(F)c1F)[C@@H](C2)C3=O ZINC000587424868 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(Br)c(F)c1F)[C@@H](C2)C3=O ZINC000587424869 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(F)ccc(F)c1Br)[C@@H](C2)C3=O ZINC000587424943 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(F)ccc(F)c1Br)[C@@H](C2)C3=O ZINC000587424944 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CBr)(c1cc(F)ccc1F)[C@@H](C2)C3=O ZINC000587424993 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1cc(F)ccc1F)[C@@H](C2)C3=O ZINC000587424994 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1c(F)cccc1F)[C@@H](C2)C3=O ZINC000587424997 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CBr)(c1c(F)cccc1F)[C@@H](C2)C3=O ZINC000587424998 GI Annotated Reactive COc1cc2c3c(c1)O[C@H](c1ccc(Br)c(OC)c1F)[C@@H](C2)C3=O ZINC000587425001 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(Br)c(OC)c1F)[C@@H](C2)C3=O ZINC000587425002 GI Annotated Anodyne COc1cc2c3c(c1)OC1(CCC(C#N)(c4ccccc4F)CC1)[C@@H](C2)C3=O ZINC000587425251 GI Annotated Mild COc1cc2c3c(c1)O[C@@](C)(Cc1ccc(Br)c(F)c1)[C@@H](C2)C3=O ZINC000587425304 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(Cc1ccc(Br)c(F)c1)[C@@H](C2)C3=O ZINC000587425305 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(C)nn(-c4ccc(F)cc4F)c1C)[C@@H](C2)C3=O ZINC000587425360 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C)nn(-c4ccc(F)cc4F)c1C)[C@@H](C2)C3=O ZINC000587425365 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(Br)c(F)c1)[C@@H](C2)C3=O ZINC000587425464 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(Br)c(F)c1)[C@@H](C2)C3=O ZINC000587425466 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CBr)(c1ccc(F)c(F)c1)[C@@H](C2)C3=O ZINC000587425480 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(F)c(F)c1)[C@@H](C2)C3=O ZINC000587425482 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1cccnc1)(c1ccc(F)c(F)c1)[C@@H](C2)C3=O ZINC000587425495 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccnc1)(c1ccc(F)c(F)c1)[C@@H](C2)C3=O ZINC000587425496 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CBr)(c1ccc(F)cc1F)[C@@H](C2)C3=O ZINC000587425684 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(F)cc1F)[C@@H](C2)C3=O ZINC000587425685 GI Annotated Reactive COc1cc2c3c(c1)O[C@](C)(Cc1ccc(Br)cc1F)[C@@H](C2)C3=O ZINC000587425728 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(Cc1ccc(Br)cc1F)[C@@H](C2)C3=O ZINC000587425729 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(F)ccc1Br)[C@@H](C2)C3=O ZINC000587425801 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(F)ccc1Br)[C@@H](C2)C3=O ZINC000587425802 GI Annotated Anodyne CCOc1ccc(-c2n[nH]cc2[C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1F ZINC000587425915 GI Annotated Anodyne CCOc1ccc(-c2n[nH]cc2[C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1F ZINC000587425916 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(CBr)c(F)c1)[C@@H](C2)C3=O ZINC000587425917 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1ccc(CBr)c(F)c1)[C@@H](C2)C3=O ZINC000587425918 GI Annotated Reactive COc1cc2c3c(c1)O[C@H](c1ccc(CBr)cc1F)[C@@H](C2)C3=O ZINC000587425953 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1ccc(CBr)cc1F)[C@@H](C2)C3=O ZINC000587425954 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CBr)(c1cccc(F)c1F)[C@@H](C2)C3=O ZINC000587425973 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1cccc(F)c1F)[C@@H](C2)C3=O ZINC000587425974 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CBr)(c1ccc(C)c(F)c1)[C@@H](C2)C3=O ZINC000587426103 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(C)c(F)c1)[C@@H](C2)C3=O ZINC000587426104 GI Annotated Reactive COc1cc2c3c(c1)O[C@](C)(c1cccc(Br)c1F)[C@@H](C2)C3=O ZINC000587426160 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cccc(Br)c1F)[C@@H](C2)C3=O ZINC000587426161 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)(c1cc(F)ccc1N)[C@@H](C2)C3=O ZINC000587426203 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccccc1)(c1cc(F)ccc1N)[C@@H](C2)C3=O ZINC000587426204 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(F)cc1)(c1ccc(C#N)cc1)[C@@H](C2)C3=O ZINC000587426220 GI Annotated Mild COc1cc2c3c(c1)O[C@](c1ccc(F)cc1)(c1ccc(C#N)cc1)[C@@H](C2)C3=O ZINC000587426221 GI Annotated Mild COc1cc2c3c(c1)O[C@@]1(CCc4c(F)cc(Br)cc41)[C@@H](C2)C3=O ZINC000587426271 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCc4c(F)cc(Br)cc41)[C@@H](C2)C3=O ZINC000587426274 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCc4cc(Br)cc(F)c41)[C@@H](C2)C3=O ZINC000587426340 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCc4cc(Br)cc(F)c41)[C@@H](C2)C3=O ZINC000587426341 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCc4c(Br)ccc(F)c41)[C@@H](C2)C3=O ZINC000587426384 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(Br)ccc(F)c1F)[C@@H](C2)C3=O ZINC000587426432 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(Br)ccc(F)c1F)[C@@H](C2)C3=O ZINC000587426433 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(CBr)c1F)[C@@H](C2)C3=O ZINC000587426459 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1cccc(CBr)c1F)[C@@H](C2)C3=O ZINC000587426460 GI Annotated Reactive COc1cc2c3c(c1)O[C@H](c1cc(F)ccc1CBr)[C@@H](C2)C3=O ZINC000587426483 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1cc(F)ccc1CBr)[C@@H](C2)C3=O ZINC000587426484 GI Annotated Reactive COc1cc2c3c(c1)O[C@]1(CCc4c(Br)ccc(F)c41)[C@@H](C2)C3=O ZINC000587426515 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(COc4ccc(F)cc4)o1)[C@@H](C2)C3=O ZINC000587426566 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(COc4ccc(F)cc4)o1)[C@@H](C2)C3=O ZINC000587426568 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(COc4ccc(C#N)cc4)o1)[C@@H](C2)C3=O ZINC000587426647 GI Annotated Mild COc1cc2c3c(c1)O[C@H](c1ccc(COc4ccc(C#N)cc4)o1)[C@@H](C2)C3=O ZINC000587426651 GI Annotated Mild COc1cc2c3c(c1)O[C@](C)(c1ccc(Br)cc1F)[C@@H](C2)C3=O ZINC000587426691 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(Br)cc1F)[C@@H](C2)C3=O ZINC000587426692 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(N4CCCCC4)c(F)c1)[C@@H](C2)C3=O ZINC000587426710 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(N4CCCCC4)c(F)c1)[C@@H](C2)C3=O ZINC000587426714 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1F)([C@H](C)Br)[C@@H](C2)C3=O ZINC000587426746 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](c1ccccc1F)([C@@H](C)Br)[C@@H](C2)C3=O ZINC000587426747 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](c1ccccc1F)([C@H](C)Br)[C@@H](C2)C3=O ZINC000587426748 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1ccccc1F)([C@@H](C)Br)[C@@H](C2)C3=O ZINC000587426749 GI Annotated Reactive COc1cc2c3c(c1)O[C@H](c1cccn1Cc1ccc(F)c(F)c1)[C@@H](C2)C3=O ZINC000587426774 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccn1Cc1ccc(F)c(F)c1)[C@@H](C2)C3=O ZINC000587426775 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](CCc1cc(F)ccc1Br)[C@@H](C2)C3=O ZINC000587426783 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](CCc1cc(F)ccc1Br)[C@@H](C2)C3=O ZINC000587426785 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](/C=C/N(C)C)(c1cc4ccccc4o1)[C@@H](C2)C3=O ZINC000587426873 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](/C=C/N(C)C)(c1cc4ccccc4o1)[C@@H](C2)C3=O ZINC000587426877 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)Nc1c(C)cc(C)cc1C)[C@@H](C2)C3=O ZINC000587426925 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)Nc1c(C)cc(C)cc1C)[C@@H](C2)C3=O ZINC000587426926 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(F)cc(Br)c1)[C@@H](C2)C3=O ZINC000587427010 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(F)cc(Br)c1)[C@@H](C2)C3=O ZINC000587427011 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCc4cc(F)c(Br)cc41)[C@@H](C2)C3=O ZINC000587427033 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCc4cc(F)c(Br)cc41)[C@@H](C2)C3=O ZINC000587427034 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(O)cc1)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587427140 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(O)cc1)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587427144 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4ccc(F)cc4CCc4ncccc41)[C@@H](C2)C3=O ZINC000587427188 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccc(F)cc4CCc4ncccc41)[C@@H](C2)C3=O ZINC000587427189 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c[nH]c4c(F)c(F)c(F)c(F)c14)[C@@H](C2)C3=O ZINC000587427415 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c[nH]c4c(F)c(F)c(F)c(F)c14)[C@@H](C2)C3=O ZINC000587427417 GI Annotated Anodyne CCc1ccc([C@@]2(c3ccc(N)cc3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)o1 ZINC000587427432 GI Annotated Anodyne CCc1ccc([C@]2(c3ccc(N)cc3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)o1 ZINC000587427439 GI Annotated Anodyne COC(=O)CCCC[C@@]1(c2ccc(F)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587427479 GI Annotated Anodyne COC(=O)CCCC[C@]1(c2ccc(F)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587427482 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(F)cc1)([C@H](C)Br)[C@@H](C2)C3=O ZINC000587427507 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](c1ccc(F)cc1)([C@@H](C)Br)[C@@H](C2)C3=O ZINC000587427508 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](c1ccc(F)cc1)([C@H](C)Br)[C@@H](C2)C3=O ZINC000587427509 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1ccc(F)cc1)([C@@H](C)Br)[C@@H](C2)C3=O ZINC000587427510 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1ccc(F)cc1)(c1ccccc1N)[C@@H](C2)C3=O ZINC000587427512 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(F)cc1)(c1ccccc1N)[C@@H](C2)C3=O ZINC000587427513 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)Nc1ccc(C(C)C)cc1)[C@@H](C2)C3=O ZINC000587427580 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)Nc1ccc(C(C)C)cc1)[C@@H](C2)C3=O ZINC000587427587 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCBr)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587427604 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CCBr)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587427606 GI Annotated Reactive CCN(CC)Cc1cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)ccc1OC ZINC000587427661 GI Annotated Anodyne CCN(CC)Cc1cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)ccc1OC ZINC000587427663 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(Cc1cc(F)ccc1Br)[C@@H](C2)C3=O ZINC000587427754 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(Cc1cc(F)ccc1Br)[C@@H](C2)C3=O ZINC000587427756 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(F)ccc(Br)c1F)[C@@H](C2)C3=O ZINC000587427766 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(F)ccc(Br)c1F)[C@@H](C2)C3=O ZINC000587427767 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccnc1)(c1ccc(F)cc1F)[C@@H](C2)C3=O ZINC000587427774 GI Annotated Anodyne CCN(CCC#N)c1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(C)c1 ZINC000587427776 GI Annotated Mild COc1cc2c3c(c1)O[C@@](c1cccnc1)(c1ccc(F)cc1F)[C@@H](C2)C3=O ZINC000587427777 GI Annotated Anodyne CCN(CCC#N)c1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(C)c1 ZINC000587427778 GI Annotated Mild CCN(CC)Cc1cc([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)ccc1OC ZINC000587427796 GI Annotated Anodyne CCN(CC)Cc1cc([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)ccc1OC ZINC000587427799 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(Br)ccc(OC)c1F)[C@@H](C2)C3=O ZINC000587427820 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(Br)ccc(OC)c1F)[C@@H](C2)C3=O ZINC000587427821 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(F)cc1Br)[C@@H](C2)C3=O ZINC000587427834 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(F)cc1Br)[C@@H](C2)C3=O ZINC000587427835 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CBr)(c1cc(F)cc(F)c1)[C@@H](C2)C3=O ZINC000587427910 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CBr)(c1cc(F)cc(F)c1)[C@@H](C2)C3=O ZINC000587427911 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1ccc(N)cc1)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587427912 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(N)cc1)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587427914 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](Cc1ccncc1)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587427951 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](Cc1ccncc1)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587427952 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCC=C(NNc4ccc(F)cc4)C1)[C@@H](C2)C3=O ZINC000587427965 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCC=C(NNc4ccc(F)cc4)C1)[C@@H](C2)C3=O ZINC000587427966 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCc4c(Br)cc(F)cc41)[C@@H](C2)C3=O ZINC000587428062 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCc4c(Br)cc(F)cc41)[C@@H](C2)C3=O ZINC000587428063 GI Annotated Anodyne COc1ccc([C@]2(c3ccc(C#N)cc3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587428091 GI Annotated Mild COc1ccc([C@@]2(c3ccc(C#N)cc3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587428092 GI Annotated Mild COc1cc2c3c(c1)O[C@@](Cc1ncc[nH]1)(c1ccc(Cl)cc1F)[C@@H](C2)C3=O ZINC000587428221 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](Cc1ncc[nH]1)(c1ccc(Cl)cc1F)[C@@H](C2)C3=O ZINC000587428224 GI Annotated Anodyne CCOC(=O)CCC[C@@]1(c2ccc(F)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587428346 GI Annotated Anodyne CCOC(=O)CCC[C@]1(c2ccc(F)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587428347 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](COC(=O)c1ccccc1F)(C(C)(C)C)[C@@H](C2)C3=O ZINC000587428495 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](COC(=O)c1ccccc1F)(C(C)(C)C)[C@@H](C2)C3=O ZINC000587428503 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCc4c(F)ccc(Br)c41)[C@@H](C2)C3=O ZINC000587428512 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCc4c(F)ccc(Br)c41)[C@@H](C2)C3=O ZINC000587428515 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(F)cc(CBr)c1)[C@@H](C2)C3=O ZINC000587428671 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1cc(F)cc(CBr)c1)[C@@H](C2)C3=O ZINC000587428673 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1ccccc1)(c1cc(F)ccc1O)[C@@H](C2)C3=O ZINC000587428808 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccccc1)(c1cc(F)ccc1O)[C@@H](C2)C3=O ZINC000587428809 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCCCC(=O)O)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587428825 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCCCC(=O)O)(c1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587428826 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(C#N)cc1OCC1CC1)[C@@H](C2)C3=O ZINC000587428880 GI Annotated Mild COc1cc2c3c(c1)O[C@@](C)(c1ccc(C#N)cc1OCC1CC1)[C@@H](C2)C3=O ZINC000587428881 GI Annotated Mild CCN(CC)C(=O)Nc1ccc([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587428920 GI Annotated Anodyne CCN(CC)C(=O)Nc1ccc([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587428921 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(Cc1ccc(F)cc1Br)[C@@H](C2)C3=O ZINC000587429038 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(Cc1ccc(F)cc1Br)[C@@H](C2)C3=O ZINC000587429039 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCc4cc(F)cc(Br)c41)[C@@H](C2)C3=O ZINC000587429128 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCc4cc(F)cc(Br)c41)[C@@H](C2)C3=O ZINC000587429129 GI Annotated Anodyne CCN1CCC[C@H]1Cn1c(C)cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C ZINC000587429347 GI Annotated Anodyne CCN1CCC[C@@H]1Cn1c(C)cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C ZINC000587429351 GI Annotated Anodyne CCN1CCC[C@H]1Cn1c(C)cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C ZINC000587429353 GI Annotated Anodyne CCN1CCC[C@@H]1Cn1c(C)cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c1C ZINC000587429355 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1nc4ccc(F)cc4c4ncccc14)[C@@H](C2)C3=O ZINC000587429377 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1nc4ccc(F)cc4c4ncccc14)[C@@H](C2)C3=O ZINC000587429379 GI Annotated Bother COc1cc2c3c(c1)O[C@]1(CCC[C@]1(C#N)Cc1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587429451 GI Annotated Mild COc1cc2c3c(c1)O[C@@]1(CCC[C@]1(C#N)Cc1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587429452 GI Annotated Mild COc1cc2c3c(c1)O[C@]1(CCC[C@@]1(C#N)Cc1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587429453 GI Annotated Mild COc1cc2c3c(c1)O[C@@]1(CCC[C@@]1(C#N)Cc1ccc(F)cc1)[C@@H](C2)C3=O ZINC000587429454 GI Annotated Mild COc1cc2c3c(c1)OC1(CCC(C#N)(c4ccc(F)cc4)CC1)[C@@H](C2)C3=O ZINC000587429513 GI Annotated Mild COc1cc2c3c(c1)O[C@](C)(c1oc(-c4ccc(F)cc4)nc1C)[C@@H](C2)C3=O ZINC000587429538 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1oc(-c4ccc(F)cc4)nc1C)[C@@H](C2)C3=O ZINC000587429539 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(-c4ccc(C#N)c(O)c4)c1)[C@@H](C2)C3=O ZINC000587429567 GI Annotated Mild COc1cc2c3c(c1)O[C@H](c1cccc(-c4ccc(C#N)c(O)c4)c1)[C@@H](C2)C3=O ZINC000587429568 GI Annotated Mild COc1cc2c3c(c1)O[C@]1(c4ccccc4COc4cc(F)ccc41)[C@@H](C2)C3=O ZINC000587429626 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccccc4COc4cc(F)ccc41)[C@@H](C2)C3=O ZINC000587429627 GI Annotated Anodyne CCOc1cc(N(CC)CC)ccc1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587429734 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C)nn(-c4ccc(F)cc4)c1C)[C@@H](C2)C3=O ZINC000587429750 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(C)nn(-c4ccc(F)cc4)c1C)[C@@H](C2)C3=O ZINC000587429759 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(C#N)cc1)(c1cccc(F)c1)[C@@H](C2)C3=O ZINC000587429833 GI Annotated Mild COc1cc2c3c(c1)O[C@@](c1ccc(C#N)cc1)(c1cccc(F)c1)[C@@H](C2)C3=O ZINC000587429835 GI Annotated Mild COc1cc2c3c(c1)O[C@@H](c1cccc4c1cnn4[C@@H]1CCCCO1)[C@@H](C2)C3=O ZINC000587429962 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc4c1cnn4[C@@H]1CCCCO1)[C@@H](C2)C3=O ZINC000587429965 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc4c1cnn4[C@H]1CCCCO1)[C@@H](C2)C3=O ZINC000587429968 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc4c1cnn4[C@H]1CCCCO1)[C@@H](C2)C3=O ZINC000587429971 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C)nn(-c4ccc(F)cc4)c1Cl)[C@@H](C2)C3=O ZINC000587430007 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(C)nn(-c4ccc(F)cc4)c1Cl)[C@@H](C2)C3=O ZINC000587430017 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cn(C)nc1-c1cc4ccccc4o1)[C@@H](C2)C3=O ZINC000587430020 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cn(C)nc1-c1cc4ccccc4o1)[C@@H](C2)C3=O ZINC000587430022 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(F)cc1CBr)[C@@H](C2)C3=O ZINC000587430023 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1ccc(F)cc1CBr)[C@@H](C2)C3=O ZINC000587430025 GI Annotated Reactive CCOc1cc(N(CC)CC)ccc1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587430079 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)(c1ccc(N=C=O)cc1)[C@@H](C2)C3=O ZINC000587430169 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](c1ccccc1)(c1ccc(N=C=O)cc1)[C@@H](C2)C3=O ZINC000587430170 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](/C=C/N(C)C)(C14CC5CC(CC(C5)C1)C4)[C@@H](C2)C3=O ZINC000587430215 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](/C=C/N(C)C)(C14CC5CC(CC(C5)C1)C4)[C@@H](C2)C3=O ZINC000587430217 GI Annotated Anodyne COc1cc2c3c(c1)OC1(CCC(N(C)Cc4ccccc4)CC1)[C@@H](C2)C3=O ZINC000587430502 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(-c4cccc(C#N)c4)c1O)[C@@H](C2)C3=O ZINC000587430505 GI Annotated Mild COc1cc2c3c(c1)O[C@H](c1cccc(-c4cccc(C#N)c4)c1O)[C@@H](C2)C3=O ZINC000587430506 GI Annotated Mild COc1cc2c3c(c1)O[C@@](CCN(C)C)(c1cccc4ccccc14)[C@@H](C2)C3=O ZINC000587430589 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCN(C)C)(c1cccc4ccccc14)[C@@H](C2)C3=O ZINC000587430590 GI Annotated Anodyne CCOc1ccc(-n2cccc2[C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587431070 GI Annotated Anodyne CCOc1ccc(-n2cccc2[C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587431071 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(C(=O)c4ccc(C)cc4)cn1C)[C@@H](C2)C3=O ZINC000587431073 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(C(=O)c4ccc(C)cc4)cn1C)[C@@H](C2)C3=O ZINC000587431077 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4ccccc4-c4ccc(N(C)C)cc41)[C@@H](C2)C3=O ZINC000587431156 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccccc4-c4ccc(N(C)C)cc41)[C@@H](C2)C3=O ZINC000587431158 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccccc1)(c1ccc(N(C)C)cc1)[C@@H](C2)C3=O ZINC000587431201 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)(c1ccc(N(C)C)cc1)[C@@H](C2)C3=O ZINC000587431202 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(C)nn(Cc4ccc(C)cc4)c1C)[C@@H](C2)C3=O ZINC000587431335 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C)nn(Cc4ccc(C)cc4)c1C)[C@@H](C2)C3=O ZINC000587431340 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(-c4cccc([N+](=O)[O-])c4)n1)[C@@H](C2)C3=O ZINC000587431494 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1cccc(-c4cccc([N+](=O)[O-])c4)n1)[C@@H](C2)C3=O ZINC000587431498 GI Annotated Bother COc1cc2c3c(c1)O[C@](C)(c1cccc(NC(=O)C4CCC4)c1)[C@@H](C2)C3=O ZINC000587431567 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cccc(NC(=O)C4CCC4)c1)[C@@H](C2)C3=O ZINC000587431568 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccn1-c1cc([N+](=O)[O-])ccc1C)[C@@H](C2)C3=O ZINC000587431777 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1cccn1-c1cc([N+](=O)[O-])ccc1C)[C@@H](C2)C3=O ZINC000587431778 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1cccn1-c1ccc([N+](=O)[O-])cc1C)[C@@H](C2)C3=O ZINC000587431795 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1cccn1-c1ccc([N+](=O)[O-])cc1C)[C@@H](C2)C3=O ZINC000587431796 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1cc([N+](=O)[O-])ccc1N1CCCCC1)[C@@H](C2)C3=O ZINC000587431875 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1cc([N+](=O)[O-])ccc1N1CCCCC1)[C@@H](C2)C3=O ZINC000587431877 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1ccc(-c4ncccc4[N+](=O)[O-])cc1)[C@@H](C2)C3=O ZINC000587431880 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1ccc(-c4ncccc4[N+](=O)[O-])cc1)[C@@H](C2)C3=O ZINC000587431882 GI Annotated Bother COc1cc2c3c(c1)O[C@]1(c4ccccc4-c4ccc([N+](=O)[O-])cc41)[C@@H](C2)C3=O ZINC000587431918 GI Annotated Bother COc1cc2c3c(c1)O[C@@]1(c4ccccc4-c4ccc([N+](=O)[O-])cc41)[C@@H](C2)C3=O ZINC000587431929 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1c(C)nn(C)c1Oc1ccccc1)[C@@H](C2)C3=O ZINC000587432039 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(C)nn(C)c1Oc1ccccc1)[C@@H](C2)C3=O ZINC000587432041 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@@H](C2)C3=O ZINC000587432057 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(CNC(=O)OC(C)(C)C)cc1)[C@@H](C2)C3=O ZINC000587432067 GI Annotated Anodyne COc1ccc(Cn2cccc2[C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587432223 GI Annotated Anodyne COc1ccc(Cn2cccc2[C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587432225 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccnc1-c1cccc([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587432238 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1cccnc1-c1cccc([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587432239 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1cccn1-c1ccc(C)cc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587432278 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1cccn1-c1ccc(C)cc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587432280 GI Annotated Bother COc1cc2c3c(c1)O[C@](/C=N/Nc1ccccc1)(c1ccccc1)[C@@H](C2)C3=O ZINC000587432358 GI Annotated Mild COc1cc2c3c(c1)O[C@@](/C=N/Nc1ccccc1)(c1ccccc1)[C@@H](C2)C3=O ZINC000587432360 GI Annotated Mild COc1cc2c3c(c1)O[C@@]1(CCC[C@H]1Cc1ccccc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587432402 GI Annotated Bother COc1cc2c3c(c1)O[C@@]1(CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587432404 GI Annotated Bother COc1cc2c3c(c1)O[C@]1(CCC[C@H]1Cc1ccccc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587432406 GI Annotated Bother COc1cc2c3c(c1)O[C@]1(CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])[C@@H](C2)C3=O ZINC000587432409 GI Annotated Bother COc1cc2c3c(c1)O[C@@](C)(CC(=O)Nc1ccc4ccccc4c1)[C@@H](C2)C3=O ZINC000587432410 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(CC(=O)Nc1ccc4ccccc4c1)[C@@H](C2)C3=O ZINC000587432412 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C=C(c4ccccc4)Oc4cc(N)ccc41)[C@@H](C2)C3=O ZINC000587432493 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C=C(c4ccccc4)Oc4cc(N)ccc41)[C@@H](C2)C3=O ZINC000587432496 GI Annotated Anodyne CCOc1ccccc1-n1cccc1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587432637 GI Annotated Anodyne CCOc1ccccc1-n1cccc1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587432638 GI Annotated Anodyne CCOC(=O)[C@H](CC(C)C)n1cccc1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587432669 GI Annotated Anodyne CCOC(=O)[C@H](CC(C)C)n1cccc1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587432670 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccn1Cc1ccccc1OC)[C@@H](C2)C3=O ZINC000587432802 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccn1Cc1ccccc1OC)[C@@H](C2)C3=O ZINC000587432804 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(C)n(-c4ccnn4C(C)C)c1C)[C@@H](C2)C3=O ZINC000587432809 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(C)n(-c4ccnn4C(C)C)c1C)[C@@H](C2)C3=O ZINC000587432816 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cnn(-c4cc(C)ccc4C)c1C)[C@@H](C2)C3=O ZINC000587432972 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cnn(-c4cc(C)ccc4C)c1C)[C@@H](C2)C3=O ZINC000587432973 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(N4CCCCC4)c([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587433082 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1ccc(N4CCCCC4)c([N+](=O)[O-])c1)[C@@H](C2)C3=O ZINC000587433083 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1ccc(-c4nc5ccccc5n4C)o1)[C@@H](C2)C3=O ZINC000587433401 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(-c4nc5ccccc5n4C)o1)[C@@H](C2)C3=O ZINC000587433402 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CC(C)(C)Cc4c1cnn4C(C)(C)C)[C@@H](C2)C3=O ZINC000587433403 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC(C)(C)Cc4c1cnn4C(C)(C)C)[C@@H](C2)C3=O ZINC000587433404 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(NC(=O)C(C)(C)C)cccc1OC)[C@@H](C2)C3=O ZINC000587433587 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(NC(=O)C(C)(C)C)cccc1OC)[C@@H](C2)C3=O ZINC000587433589 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CC(C)C)([C@H](C)NC(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587433645 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CC(C)C)([C@H](C)NC(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587433646 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(CNC(=O)OC(C)(C)C)c1)[C@@H](C2)C3=O ZINC000587433677 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(CNC(=O)OC(C)(C)C)c1)[C@@H](C2)C3=O ZINC000587433678 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CC(=O)Nc1ccccc1)(c1ccccc1)[C@@H](C2)C3=O ZINC000587433699 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CC(=O)Nc1ccccc1)(c1ccccc1)[C@@H](C2)C3=O ZINC000587433700 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCCC[C@@H]1NC(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587433707 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCCC[C@H]1NC(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587433708 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCCC[C@H]1NC(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587433709 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCCC[C@@H]1NC(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587433710 GI Annotated Anodyne C=C(C)COCCNc1ccc([C@@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587433729 GI Annotated Mild C=C(C)COCCNc1ccc([C@]2(C)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587433730 GI Annotated Mild COc1cc2c3c(c1)O[C@](C)(CC(=O)Nc1ccccc1C(C)C)[C@@H](C2)C3=O ZINC000587433735 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(CC(=O)Nc1ccccc1C(C)C)[C@@H](C2)C3=O ZINC000587433736 GI Annotated Anodyne CCCCOc1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1[N+](=O)[O-] ZINC000587434058 GI Annotated Bother CCCCOc1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1[N+](=O)[O-] ZINC000587434059 GI Annotated Bother COc1cc2c3c(c1)O[C@@](c1cc4ccccc4[nH]c1=N)(C(C)(C)C)[C@@H](C2)C3=O ZINC000587434104 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cc4ccccc4[nH]c1=N)(C(C)(C)C)[C@@H](C2)C3=O ZINC000587434105 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccco1)(c1oc4ccccc4c1N)[C@@H](C2)C3=O ZINC000587434112 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccco1)(c1oc4ccccc4c1N)[C@@H](C2)C3=O ZINC000587434113 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C=C(c4ccccc4)Oc4ccc(N)cc41)[C@@H](C2)C3=O ZINC000587434116 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C=C(c4ccccc4)Oc4ccc(N)cc41)[C@@H](C2)C3=O ZINC000587434117 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccccc1)(c1ccc([N+](=O)[O-])cc1)[C@@H](C2)C3=O ZINC000587434239 GI Annotated Bother COc1cc2c3c(c1)O[C@](c1ccccc1)(c1ccc([N+](=O)[O-])cc1)[C@@H](C2)C3=O ZINC000587434240 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1ccc(-c4cccc([N+](=O)[O-])c4)o1)[C@@H](C2)C3=O ZINC000587434241 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1ccc(-c4cccc([N+](=O)[O-])c4)o1)[C@@H](C2)C3=O ZINC000587434245 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1cccn1-c1cccc([N+](=O)[O-])c1C)[C@@H](C2)C3=O ZINC000587434336 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1cccn1-c1cccc([N+](=O)[O-])c1C)[C@@H](C2)C3=O ZINC000587434337 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1ccc(-c4ccc([N+](=O)[O-])cn4)cc1)[C@@H](C2)C3=O ZINC000587434462 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1ccc(-c4ccc([N+](=O)[O-])cn4)cc1)[C@@H](C2)C3=O ZINC000587434463 GI Annotated Bother CC[C@@]1(c2c[nH]c3ccc([N+](=O)[O-])cc23)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587434492 GI Annotated Bother CC[C@]1(c2c[nH]c3ccc([N+](=O)[O-])cc23)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587434493 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1ccc(-c4ccccc4[N+](=O)[O-])o1)[C@@H](C2)C3=O ZINC000587434496 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1ccc(-c4ccccc4[N+](=O)[O-])o1)[C@@H](C2)C3=O ZINC000587434497 GI Annotated Bother COc1cc2c3c(c1)O[C@](C)(c1cc(N4CCC[C@H](C)C4)ccc1N)[C@@H](C2)C3=O ZINC000587434552 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(N4CCC[C@@H](C)C4)ccc1N)[C@@H](C2)C3=O ZINC000587434553 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(N4CCC[C@@H](C)C4)ccc1N)[C@@H](C2)C3=O ZINC000587434554 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(N4CCC[C@H](C)C4)ccc1N)[C@@H](C2)C3=O ZINC000587434555 GI Annotated Anodyne CCn1cc(-c2cc3ccccn3c2[C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cn1 ZINC000587434763 GI Annotated Anodyne CCn1cc(-c2cc3ccccn3c2[C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cn1 ZINC000587434764 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(-c4ccc([N+](=O)[O-])cc4)o1)[C@@H](C2)C3=O ZINC000587434798 GI Annotated Bother COc1cc2c3c(c1)O[C@@H](c1ccc(-c4ccc([N+](=O)[O-])cc4)o1)[C@@H](C2)C3=O ZINC000587434799 GI Annotated Bother COc1cc2c3c(c1)OC1(C[C@@H]4CCC[C@H](C1)N4C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587434849 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CC(=O)N(c4ccccc4)c4ccccc41)[C@@H](C2)C3=O ZINC000587434969 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CC(=O)N(c4ccccc4)c4ccccc41)[C@@H](C2)C3=O ZINC000587434972 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(Oc4ccc(C#N)cc4)nc1)[C@@H](C2)C3=O ZINC000587435117 GI Annotated Mild COc1cc2c3c(c1)O[C@@H](c1ccc(Oc4ccc(C#N)cc4)nc1)[C@@H](C2)C3=O ZINC000587435118 GI Annotated Mild COc1cc2c3c(c1)O[C@@H](c1cccnc1Oc1ccc(C#N)cc1)[C@@H](C2)C3=O ZINC000587435203 GI Annotated Mild COc1cc2c3c(c1)O[C@H](c1cccnc1Oc1ccc(C#N)cc1)[C@@H](C2)C3=O ZINC000587435205 GI Annotated Mild CCCc1nnc(-c2ccc([C@@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)cc2)o1 ZINC000587435299 GI Annotated Anodyne CCCc1nnc(-c2ccc([C@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)cc2)o1 ZINC000587435300 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccnc1)(C(C)(C)c1cccnc1)[C@@H](C2)C3=O ZINC000587435344 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccnc1)(C(C)(C)c1cccnc1)[C@@H](C2)C3=O ZINC000587435346 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnc(OCc4ccccc4)c(C)c1)[C@@H](C2)C3=O ZINC000587435417 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnc(OCc4ccccc4)c(C)c1)[C@@H](C2)C3=O ZINC000587435418 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(-c4ccc(C)cc4)nc4ncccn14)[C@@H](C2)C3=O ZINC000587436023 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(-c4ccc(C)cc4)nc4ncccn14)[C@@H](C2)C3=O ZINC000587436024 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1nc(-c4ccccc4)n4ccccc14)[C@@H](C2)C3=O ZINC000587436057 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1nc(-c4ccccc4)n4ccccc14)[C@@H](C2)C3=O ZINC000587436058 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)N(c4ccccc4)c4ccccc41)[C@@H](C2)C3=O ZINC000587436107 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)N(c4ccccc4)c4ccccc41)[C@@H](C2)C3=O ZINC000587436109 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCN([C@H](C)c4ccccc4)[C@@H](C)C1)[C@@H](C2)C3=O ZINC000587436291 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCN([C@H](C)c4ccccc4)[C@H](C)C1)[C@@H](C2)C3=O ZINC000587436295 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCN([C@@H](C)c4ccccc4)[C@@H](C)C1)[C@@H](C2)C3=O ZINC000587436297 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCN([C@@H](C)c4ccccc4)[C@@H](C)C1)[C@@H](C2)C3=O ZINC000587436300 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCN([C@H](C)c4ccccc4)[C@H](C)C1)[C@@H](C2)C3=O ZINC000587436302 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCN([C@H](C)c4ccccc4)[C@@H](C)C1)[C@@H](C2)C3=O ZINC000587436304 GI Annotated Anodyne COc1ccc(-c2noc(C)c2[C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587436506 GI Annotated Anodyne COc1ccc(-c2noc(C)c2[C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587436510 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@H](C)N(Cc4ccccc4)[C@H](C)C1)[C@@H](C2)C3=O ZINC000587436603 GI Annotated Anodyne COc1cc2c3c(c1)OC1(C[C@@H](C)N(Cc4ccccc4)[C@H](C)C1)[C@@H](C2)C3=O ZINC000587436604 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C[C@H](C)N(Cc4ccccc4)[C@H](C)C1)[C@@H](C2)C3=O ZINC000587436605 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(OCc4c(C)noc4C)c1)[C@@H](C2)C3=O ZINC000587436759 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(OCc4c(C)noc4C)c1)[C@@H](C2)C3=O ZINC000587436764 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccccc1OCc1c(C)noc1C)[C@@H](C2)C3=O ZINC000587436777 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccccc1OCc1c(C)noc1C)[C@@H](C2)C3=O ZINC000587436778 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C=C(c4ccncc4)Oc4ccccc41)[C@@H](C2)C3=O ZINC000587436789 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C=C(c4ccncc4)Oc4ccccc41)[C@@H](C2)C3=O ZINC000587436790 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(Oc4ncccc4C#N)cc1)[C@@H](C2)C3=O ZINC000587436997 GI Annotated Mild COc1cc2c3c(c1)O[C@H](c1ccc(Oc4ncccc4C#N)cc1)[C@@H](C2)C3=O ZINC000587436999 GI Annotated Mild COc1cc2c3c(c1)OC1(C[C@@H]4CCC[C@H](C1)N4Cc1ccccc1)[C@@H](C2)C3=O ZINC000587437005 GI Annotated Anodyne COc1cc2c3c(c1)OC1(C[C@@H]4CC[C@H](C1)N4Cc1ccccc1)[C@@H](C2)C3=O ZINC000587437018 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1c(C)[nH]c(C(=O)OC(C)(C)C)c1C)[C@@H](C2)C3=O ZINC000587437133 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1c(C)[nH]c(C(=O)OC(C)(C)C)c1C)[C@@H](C2)C3=O ZINC000587437134 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)(c1ccc4nc[nH]c4c1)[C@@H](C2)C3=O ZINC000587437139 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccccc1)(c1ccc4nc[nH]c4c1)[C@@H](C2)C3=O ZINC000587437140 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(-c4ccccc4)nc4ccccn14)[C@@H](C2)C3=O ZINC000587437242 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(-c4ccccc4)nc4ccccn14)[C@@H](C2)C3=O ZINC000587437243 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OCc4c(C)noc4C)cc1)[C@@H](C2)C3=O ZINC000587437274 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OCc4c(C)noc4C)cc1)[C@@H](C2)C3=O ZINC000587437276 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccnc1)(c1c[nH]c4ccccc14)[C@@H](C2)C3=O ZINC000587437494 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccnc1)(c1c[nH]c4ccccc14)[C@@H](C2)C3=O ZINC000587437496 GI Annotated Anodyne CCC[C@@]1(C2(c3ccccc3)CCNCC2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587438283 GI Annotated Anodyne CCC[C@]1(C2(c3ccccc3)CCNCC2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587438285 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(N4CCC(C)CC4)ccc1N)[C@@H](C2)C3=O ZINC000587438292 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(N4CCC(C)CC4)ccc1N)[C@@H](C2)C3=O ZINC000587438293 GI Annotated Anodyne CCOC(=O)c1[nH]c2ccc(C)cc2c1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587438437 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(C45CC6CC(CC(C6)C4)C5)n[nH]1)[C@@H](C2)C3=O ZINC000587438439 GI Annotated Anodyne CCOC(=O)c1[nH]c2ccc(C)cc2c1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587438440 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc(C45CC6CC(CC(C6)C4)C5)n[nH]1)[C@@H](C2)C3=O ZINC000587438444 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(C(=O)OC(C)(C)C)cc1)[C@@H](C2)C3=O ZINC000587438840 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(C(=O)OC(C)(C)C)cc1)[C@@H](C2)C3=O ZINC000587438841 GI Annotated Anodyne COc1cc2c3c(c1)OC1(CN(C(c4ccccc4)c4ccccc4)C1)[C@@H](C2)C3=O ZINC000587438870 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4c1[nH]c1ccc(OC)cc41)[C@@H](C2)C3=O ZINC000587439452 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4c1[nH]c1ccc(OC)cc41)[C@@H](C2)C3=O ZINC000587439454 GI Annotated Anodyne CCOC(=O)[C@@]1(c2ccc3ccccc3c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587439765 GI Annotated Anodyne CCOC(=O)[C@]1(c2ccc3ccccc3c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587439766 GI Annotated Anodyne CCCCc1ccc([C@]2(C(=O)OCC)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587439793 GI Annotated Anodyne CCCCc1ccc([C@@]2(C(=O)OCC)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587439794 GI Annotated Anodyne COC(=O)c1cc([C@]2(C3CCCCC3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c[nH]1 ZINC000587439806 GI Annotated Anodyne COC(=O)c1cc([C@@]2(C3CCCCC3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c[nH]1 ZINC000587439811 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCN(Cc4ccccc4)C(C)(C)C1)[C@@H](C2)C3=O ZINC000587439895 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCN(Cc4ccccc4)C(C)(C)C1)[C@@H](C2)C3=O ZINC000587439898 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@@H]4CCC[C@H](C1)N4C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587440546 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C[C@@H]4CCC[C@H](C1)N4C(=O)OC(C)(C)C)[C@@H](C2)C3=O ZINC000587440547 GI Annotated Anodyne CCOC(=O)[C@H](CC)[C@]1(c2cccc(C)c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587440612 GI Annotated Anodyne CCOC(=O)[C@@H](CC)[C@]1(c2cccc(C)c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587440617 GI Annotated Anodyne CCOC(=O)[C@@H](CC)[C@@]1(c2cccc(C)c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587440619 GI Annotated Anodyne CCOC(=O)[C@H](CC)[C@@]1(c2cccc(C)c2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587440621 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)c4ccccc4N[C@@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587440713 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)c4ccccc4N[C@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587440718 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)c4ccccc4N[C@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587440722 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)c4ccccc4N[C@@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587440727 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@H]1N[C@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587440767 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@@H]1N[C@@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587440771 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@@H]1N[C@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587440774 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@H]1N[C@@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587440777 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4c(cc1OCC1CC1)CCC4)[C@@H](C2)C3=O ZINC000587440893 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4c(cc1OCC1CC1)CCC4)[C@@H](C2)C3=O ZINC000587440897 GI Annotated Anodyne C=CCOc1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(OCC=C)c1 ZINC000587441139 GI Annotated Mild C=CCOc1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(OCC=C)c1 ZINC000587441146 GI Annotated Mild C=CCOc1c(CC=C)cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1OC ZINC000587441588 GI Annotated Mild C=CCOc1c(CC=C)cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1OC ZINC000587441591 GI Annotated Mild C=CCc1cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc(OC)c1OCC ZINC000587441756 GI Annotated Mild C=CCc1cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc(OC)c1OCC ZINC000587441767 GI Annotated Mild COc1cc2c3c(c1)O[C@@]1(c4ccccc4-c4n[nH]c5cccc1c45)[C@@H](C2)C3=O ZINC000587441957 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4ccccc4-c4n[nH]c5cccc1c45)[C@@H](C2)C3=O ZINC000587441958 GI Annotated Anodyne CCOC(=O)[C@@H](C(C)C)[C@@]1(c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441996 GI Annotated Anodyne CCOC(=O)[C@@H](C(C)C)[C@]1(c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441998 GI Annotated Anodyne CCOC(=O)[C@H](C(C)C)[C@]1(c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587441999 GI Annotated Anodyne CCOC(=O)[C@H](C(C)C)[C@@]1(c2ccccc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587442001 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC(=O)OC(C)(C)C)cc1)[C@@H](C2)C3=O ZINC000587442426 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OC(=O)OC(C)(C)C)cc1)[C@@H](C2)C3=O ZINC000587442427 GI Annotated Anodyne C=CCc1cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc(OCC)c1OC ZINC000587442559 GI Annotated Mild C=CCc1cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc(OCC)c1OC ZINC000587442560 GI Annotated Mild COC(=O)C[C@]1(c2ccc(C(C)(C)C)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587442675 GI Annotated Anodyne COC(=O)C[C@@]1(c2ccc(C(C)(C)C)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587442676 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C)cc(C)c(COC(C)=O)c1C)[C@@H](C2)C3=O ZINC000587442708 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(C)cc(C)c(COC(C)=O)c1C)[C@@H](C2)C3=O ZINC000587442710 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)[C@@H](c4ccccc4)Nc4ccccc41)[C@@H](C2)C3=O ZINC000587442885 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)[C@H](c4ccccc4)Nc4ccccc41)[C@@H](C2)C3=O ZINC000587442887 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)[C@H](c4ccccc4)Nc4ccccc41)[C@@H](C2)C3=O ZINC000587442889 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)[C@@H](c4ccccc4)Nc4ccccc41)[C@@H](C2)C3=O ZINC000587442892 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c[nH]nc1-c1ccc4c(c1)CCCC4)[C@@H](C2)C3=O ZINC000587442920 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c[nH]nc1-c1ccc4c(c1)CCCC4)[C@@H](C2)C3=O ZINC000587442921 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(OC(=O)c4ccccc4)c1)[C@@H](C2)C3=O ZINC000587442998 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(OC(=O)c4ccccc4)c1)[C@@H](C2)C3=O ZINC000587443000 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)([C@H](C)N1CCCc4cc(C)ccc41)[C@@H](C2)C3=O ZINC000587443207 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)([C@H](C)N1CCCc4cc(C)ccc41)[C@@H](C2)C3=O ZINC000587443210 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)([C@@H](C)N1CCCc4cc(C)ccc41)[C@@H](C2)C3=O ZINC000587443212 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)([C@@H](C)N1CCCc4cc(C)ccc41)[C@@H](C2)C3=O ZINC000587443214 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC)c(CN4CCCCC4)c1)[C@@H](C2)C3=O ZINC000587443229 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OC)c(CN4CCCCC4)c1)[C@@H](C2)C3=O ZINC000587443230 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccccc1)(c1cc(OC)ccc1O)[C@@H](C2)C3=O ZINC000587443385 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)(c1cc(OC)ccc1O)[C@@H](C2)C3=O ZINC000587443386 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC(=O)c4ccccc4)cc1)[C@@H](C2)C3=O ZINC000587443484 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OC(=O)c4ccccc4)cc1)[C@@H](C2)C3=O ZINC000587443490 GI Annotated Anodyne CCOc1cc(OCC)c([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(OCC)c1 ZINC000587443498 GI Annotated Anodyne CCOc1cc(OCC)c([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(OCC)c1 ZINC000587443505 GI Annotated Anodyne CCOC(=O)[C@]1(c2ccc(C(C)(C)C)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587443552 GI Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(C(C)(C)C)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587443554 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C(C)(C)C)CC[C@@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587443696 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@@H](C(C)(C)C)CC[C@@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587443699 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@@H](C(C)(C)C)CC[C@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587443703 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C(C)(C)C)CC[C@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587443708 GI Annotated Anodyne CC/C=C\C[C@@H]1[C@H](CC(=O)OC)CC[C@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587443898 GI Annotated Anodyne CC/C=C/C[C@@H]1[C@H](CC(=O)OC)CC[C@@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587443903 GI Annotated Anodyne CC/C=C\C[C@@H]1[C@H](CC(=O)OC)CC[C@@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587443904 GI Annotated Anodyne CC/C=C/C[C@@H]1[C@H](CC(=O)OC)CC[C@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587443905 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCN(C(=O)OC(C)(C)C)C4(CCC4)C1)[C@@H](C2)C3=O ZINC000587443960 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCN(C(=O)OC(C)(C)C)C4(CCC4)C1)[C@@H](C2)C3=O ZINC000587443961 GI Annotated Anodyne CCCCC[C@@H]1[C@@H](CC(=O)OC)CC[C@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587444167 GI Annotated Anodyne CCCCC[C@@H]1[C@H](CC(=O)OC)CC[C@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587444171 GI Annotated Anodyne CCCCC[C@@H]1[C@@H](CC(=O)OC)CC[C@@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587444174 GI Annotated Anodyne CCCCC[C@@H]1[C@H](CC(=O)OC)CC[C@@]12Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587444177 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC)c4cccc(OC)c14)[C@@H](C2)C3=O ZINC000587444203 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OC)c4cccc(OC)c14)[C@@H](C2)C3=O ZINC000587444207 GI Annotated Anodyne CCOC(=O)[C@@]1(c2cccc3ccccc23)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587444212 GI Annotated Anodyne CCOC(=O)[C@]1(c2cccc3ccccc23)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587444216 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(OC)c(OC)cc4ccccc14)[C@@H](C2)C3=O ZINC000587444357 GI Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(C(C)C)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587444475 GI Annotated Anodyne CCOC(=O)[C@]1(c2ccc(C(C)C)cc2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587444477 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(OC)c(OC)cc4ccccc14)[C@@H](C2)C3=O ZINC000587444518 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H]([C@@]14C[C@]1(C)[C@H]1CC(C)(C)C[C@H]1C=C4C=O)[C@@H](C2)C3=O ZINC000587444596 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H]([C@@]14C[C@]1(C)[C@H]1CC(C)(C)C[C@H]1C=C4C=O)[C@@H](C2)C3=O ZINC000587444599 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CC#N)(c1ccc(N4CCCCC4)cc1)[C@@H](C2)C3=O ZINC000587444827 GI Annotated Mild COc1cc2c3c(c1)O[C@@](CC#N)(c1ccc(N4CCCCC4)cc1)[C@@H](C2)C3=O ZINC000587444830 GI Annotated Mild COc1cc2c3c(c1)O[C@H](c1ccc(OC)c4ccc(OC)cc14)[C@@H](C2)C3=O ZINC000587444912 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OC)c4ccc(OC)cc14)[C@@H](C2)C3=O ZINC000587444913 GI Annotated Anodyne COc1ccc([C@]2(c3ccccc3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(O)c1 ZINC000587444943 GI Annotated Anodyne COc1ccc([C@@]2(c3ccccc3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)c(O)c1 ZINC000587444944 GI Annotated Anodyne CCOc1cc(N2CCCC2)ccc1[C@@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587444960 GI Annotated Anodyne CCOc1cc(N2CCCC2)ccc1[C@H]1Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587444973 GI Annotated Anodyne CCOc1cc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)ccc1N1CCCC1 ZINC000587444981 GI Annotated Anodyne CCOc1cc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)ccc1N1CCCC1 ZINC000587444983 GI Annotated Anodyne COC(=O)C[C@@]1(c2cccc3ccccc23)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587445213 GI Annotated Anodyne COC(=O)C[C@]1(c2cccc3ccccc23)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587445215 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C[C@@H]4CCC[C@H](C1)N4Cc1ccccc1)[C@@H](C2)C3=O ZINC000587445624 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@@H]4CCC[C@H](C1)N4Cc1ccccc1)[C@@H](C2)C3=O ZINC000587445625 GI Annotated Anodyne COc1cc2c3c(c1)OC1(C[C@@H]4CCC[C@@H](C1)N4Cc1ccccc1)[C@@H](C2)C3=O ZINC000587445626 GI Annotated Anodyne COc1cc2c3c(c1)OC1(C[C@@H]4CC[C@@H](C1)N4Cc1ccccc1)[C@@H](C2)C3=O ZINC000587445627 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C[C@@H]4CC[C@H](C1)N4Cc1ccccc1)[C@@H](C2)C3=O ZINC000587445628 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C[C@@H]4CC[C@H](C1)N4Cc1ccccc1)[C@@H](C2)C3=O ZINC000587445629 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C#CC(=O)c1ccccc1)(c1ccccc1)[C@@H](C2)C3=O ZINC000587445682 GI Annotated Mild COc1cc2c3c(c1)O[C@@](C#CC(=O)c1ccccc1)(c1ccccc1)[C@@H](C2)C3=O ZINC000587445683 GI Annotated Mild COc1cc2c3c(c1)O[C@@]1(CCCN(Cc4ccccc4)C1(C)C)[C@@H](C2)C3=O ZINC000587445765 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCN(Cc4ccccc4)C1(C)C)[C@@H](C2)C3=O ZINC000587445770 GI Annotated Anodyne CC[C@@]1(CC(=O)O)Cc2ccccc2[C@]2(C1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587446163 GI Annotated Anodyne CC[C@]1(CC(=O)O)Cc2ccccc2[C@@]2(C1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587446165 GI Annotated Anodyne CC[C@@]1(CC(=O)O)Cc2ccccc2[C@@]2(C1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587446168 GI Annotated Anodyne CC[C@]1(CC(=O)O)Cc2ccccc2[C@]2(C1)Oc1cc(OC)cc3c1C(=O)[C@H]2C3 ZINC000587446172 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4ccccc4C(=O)c4cc(C)ccc41)[C@@H](C2)C3=O ZINC000587446271 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccccc4C(=O)c4cc(C)ccc41)[C@@H](C2)C3=O ZINC000587446275 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCC(=O)O)(c1cccc4ccccc14)[C@@H](C2)C3=O ZINC000587446314 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCC(=O)O)(c1cccc4ccccc14)[C@@H](C2)C3=O ZINC000587446316 GI Annotated Anodyne CCc1ccc2c(c1)C(=O)c1ccccc1[C@@]21Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587446676 GI Annotated Anodyne CCc1ccc2c(c1)C(=O)c1ccccc1[C@]21Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587446678 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCC(=O)O)(c1ccc4c(c1)CCCC4)[C@@H](C2)C3=O ZINC000587446700 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCC(=O)O)(c1ccc4c(c1)CCCC4)[C@@H](C2)C3=O ZINC000587446701 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCC(=O)O)(c1ccc4ccccc4c1)[C@@H](C2)C3=O ZINC000587446865 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCC(=O)O)(c1ccc4ccccc4c1)[C@@H](C2)C3=O ZINC000587446866 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CC(C)(C)CC(=O)O)(c1ccccc1)[C@@H](C2)C3=O ZINC000587446953 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CC(C)(C)CC(=O)O)(c1ccccc1)[C@@H](C2)C3=O ZINC000587446954 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc([C@H](C)C(=O)O)cc1)(C(C)C)[C@@H](C2)C3=O ZINC000587447000 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc([C@H](C)C(=O)O)cc1)(C(C)C)[C@@H](C2)C3=O ZINC000587447001 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc([C@@H](C)C(=O)O)cc1)(C(C)C)[C@@H](C2)C3=O ZINC000587447002 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc([C@@H](C)C(=O)O)cc1)(C(C)C)[C@@H](C2)C3=O ZINC000587447003 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C(=O)O)(c1ccc(-c4ccccc4)cc1)[C@@H](C2)C3=O ZINC000587447020 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C(=O)O)(c1ccc(-c4ccccc4)cc1)[C@@H](C2)C3=O ZINC000587447021 GI Annotated Anodyne CCCc1ccc([C@]2(CCC(=O)O)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587447123 GI Annotated Anodyne CCCc1ccc([C@@]2(CCC(=O)O)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587447124 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4ccccc4C(=O)c4ccc(C)cc41)[C@@H](C2)C3=O ZINC000587447187 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccccc4C(=O)c4ccc(C)cc41)[C@@H](C2)C3=O ZINC000587447188 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCCCC(=O)O)(c1ccc(C)cc1)[C@@H](C2)C3=O ZINC000587447299 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCCCC(=O)O)(c1ccc(C)cc1)[C@@H](C2)C3=O ZINC000587447300 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCC(=O)O)(c1ccc(CC(C)C)cc1)[C@@H](C2)C3=O ZINC000587447430 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCC(=O)O)(c1ccc(CC(C)C)cc1)[C@@H](C2)C3=O ZINC000587447431 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCCC(=O)O)(c1cc(C)cc(C)c1)[C@@H](C2)C3=O ZINC000587447604 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCCC(=O)O)(c1cc(C)cc(C)c1)[C@@H](C2)C3=O ZINC000587447605 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@H]1O[C@@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587447714 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccccc1)([C@H]1O[C@@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587447715 GI Annotated Anodyne CCc1ccc([C@]2(CCCC(=O)O)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587447788 GI Annotated Anodyne CCc1ccc([C@@]2(CCCC(=O)O)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587447789 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(-c4ccc5c(c4)C(=O)OC5)o1)[C@@H](C2)C3=O ZINC000587448043 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(-c4ccc5c(c4)C(=O)OC5)o1)[C@@H](C2)C3=O ZINC000587448047 GI Annotated Anodyne CCc1ccc2c(c1)[C@]1(Oc3cc(OC)cc4c3C(=O)[C@H]1C4)c1ccccc1C2=O ZINC000587448156 GI Annotated Anodyne CCc1ccc2c(c1)[C@@]1(Oc3cc(OC)cc4c3C(=O)[C@H]1C4)c1ccccc1C2=O ZINC000587448157 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(-c4ccc(C=O)cc4)cc1O)[C@@H](C2)C3=O ZINC000587448255 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(-c4ccc(C=O)cc4)cc1O)[C@@H](C2)C3=O ZINC000587448256 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@@H]1CC=CC[C@H]1C(=O)O)[C@@H](C2)C3=O ZINC000587448257 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@H]1CC=CC[C@@H]1C(=O)O)[C@@H](C2)C3=O ZINC000587448258 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@@H]1CC=CC[C@@H]1C(=O)O)[C@@H](C2)C3=O ZINC000587448259 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@H]1CC=CC[C@H]1C(=O)O)[C@@H](C2)C3=O ZINC000587448260 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1([C@@H](CC(=O)O)CCC[C@@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587448263 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1([C@H](CC(=O)O)CCC[C@@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587448264 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1([C@H](c4ccccc4)CCC[C@@H]1CC(=O)O)[C@@H](C2)C3=O ZINC000587448265 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1([C@H](CC(=O)O)CCC[C@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587448266 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4ccccc4-c4cccc(C(=O)O)c41)[C@@H](C2)C3=O ZINC000587448277 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccccc4-c4cccc(C(=O)O)c41)[C@@H](C2)C3=O ZINC000587448278 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1nc(-c4ccc5c(c4)OCO5)cs1)[C@@H](C2)C3=O ZINC000587448670 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1nc(-c4ccc5c(c4)OCO5)cs1)[C@@H](C2)C3=O ZINC000587448673 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccs1)([C@H](O)c1cccs1)[C@@H](C2)C3=O ZINC000587448704 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccs1)([C@@H](O)c1cccs1)[C@@H](C2)C3=O ZINC000587448714 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccs1)([C@@H](O)c1cccs1)[C@@H](C2)C3=O ZINC000587448716 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccs1)([C@H](O)c1cccs1)[C@@H](C2)C3=O ZINC000587448718 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccc(OC(=O)c4cccs4)c1)[C@@H](C2)C3=O ZINC000587448730 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccc(OC(=O)c4cccs4)c1)[C@@H](C2)C3=O ZINC000587448733 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1csc(-c4cccc([N+](=O)[O-])c4)n1)[C@@H](C2)C3=O ZINC000587449082 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1csc(-c4cccc([N+](=O)[O-])c4)n1)[C@@H](C2)C3=O ZINC000587449084 GI Annotated Bother COc1cc2c3c(c1)O[C@@](CC#N)(c1ccc(Br)s1)[C@@H](C2)C3=O ZINC000587449128 GI Annotated Mild COc1cc2c3c(c1)O[C@](CC#N)(c1ccc(Br)s1)[C@@H](C2)C3=O ZINC000587449129 GI Annotated Mild COc1cc2c3c(c1)O[C@@](c1ccccc1)(c1ccccc1C(=O)O)[C@@H](C2)C3=O ZINC000587449182 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)(c1ccccc1C(=O)O)[C@@H](C2)C3=O ZINC000587449183 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccccc1)([C@H]1CCC[C@@H](C(=O)O)C1)[C@@H](C2)C3=O ZINC000587449188 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@H]1CCC[C@@H](C(=O)O)C1)[C@@H](C2)C3=O ZINC000587449189 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccccc1)(c1ccc(C(=O)O)cc1)[C@@H](C2)C3=O ZINC000587449387 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)(c1ccc(C(=O)O)cc1)[C@@H](C2)C3=O ZINC000587449389 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1sc4nc(C)c(C)c(C)c4c1N)[C@@H](C2)C3=O ZINC000587449465 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1sc4nc(C)c(C)c(C)c4c1N)[C@@H](C2)C3=O ZINC000587449470 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1sc(-c4ccc(C)n4C)nc1C)[C@@H](C2)C3=O ZINC000587449609 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1sc(-c4ccc(C)n4C)nc1C)[C@@H](C2)C3=O ZINC000587449612 GI Annotated Anodyne CC[C@]1(CSc2ccccc2[N+](=O)[O-])Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587449671 GI Annotated Bother CC[C@@]1(CSc2ccccc2[N+](=O)[O-])Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587449673 GI Annotated Bother COc1cc2c3c(c1)O[C@H](c1sc(=Nc4ccccc4)[nH]c1Cl)[C@@H](C2)C3=O ZINC000587449835 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1sc(=Nc4ccccc4)[nH]c1Cl)[C@@H](C2)C3=O ZINC000587449840 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CSc1nc4ccccc4[nH]1)(C1CC1)[C@@H](C2)C3=O ZINC000587449848 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CSc1nc4ccccc4[nH]1)(C1CC1)[C@@H](C2)C3=O ZINC000587449849 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCC(C)=O)(c1ccc(SC)cc1)[C@@H](C2)C3=O ZINC000587449876 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCC(C)=O)(c1ccc(SC)cc1)[C@@H](C2)C3=O ZINC000587449877 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccccc1)(c1cccc(C(=O)O)c1)[C@@H](C2)C3=O ZINC000587449898 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)(c1cccc(C(=O)O)c1)[C@@H](C2)C3=O ZINC000587449899 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4ccccc4CCc4cc(O)ccc41)[C@@H](C2)C3=O ZINC000587449937 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccccc4CCc4cc(O)ccc41)[C@@H](C2)C3=O ZINC000587449938 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1sc4nc(C)nc(C)c4c1C)[C@@H](C2)C3=O ZINC000587450094 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1sc4nc(C)nc(C)c4c1C)[C@@H](C2)C3=O ZINC000587450097 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCCC(=O)O)(c1ccc(Cl)s1)[C@@H](C2)C3=O ZINC000587450179 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCCC(=O)O)(c1ccc(Cl)s1)[C@@H](C2)C3=O ZINC000587450185 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1sc(-c4ccncc4)nc1C)[C@@H](C2)C3=O ZINC000587450200 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1sc(-c4ccncc4)nc1C)[C@@H](C2)C3=O ZINC000587450201 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1csc(COc4ccccc4)n1)[C@@H](C2)C3=O ZINC000587450387 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1csc(COc4ccccc4)n1)[C@@H](C2)C3=O ZINC000587450389 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C=C(SC)SC)(c1ccccn1)[C@@H](C2)C3=O ZINC000587450517 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C=C(SC)SC)(c1ccccn1)[C@@H](C2)C3=O ZINC000587450528 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnc(-c4ccccc4OC)s1)[C@@H](C2)C3=O ZINC000587450767 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnc(-c4ccccc4OC)s1)[C@@H](C2)C3=O ZINC000587450768 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1sc(N(C)C)nc1-c1ccccc1)[C@@H](C2)C3=O ZINC000587450781 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1sc(N(C)C)nc1-c1ccccc1)[C@@H](C2)C3=O ZINC000587450797 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1cccs1)(c1ccccc1C(=O)O)[C@@H](C2)C3=O ZINC000587450848 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccs1)(c1ccccc1C(=O)O)[C@@H](C2)C3=O ZINC000587450850 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cccn1Cc1cnc(Cl)s1)[C@@H](C2)C3=O ZINC000587450929 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cccn1Cc1cnc(Cl)s1)[C@@H](C2)C3=O ZINC000587450940 GI Annotated Anodyne COc1ccc(-c2nc([C@@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)cs2)cc1 ZINC000587450954 GI Annotated Anodyne COc1ccc(-c2nc([C@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)cs2)cc1 ZINC000587450956 GI Annotated Anodyne CCCCC[C@@]1(CP(=O)(OC)OC)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587450958 GI Annotated Anodyne CCCCC[C@]1(CP(=O)(OC)OC)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587450959 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cc4ccc(SC)cc4nc1O)[C@@H](C2)C3=O ZINC000587451022 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc4ccc(SC)cc4nc1O)[C@@H](C2)C3=O ZINC000587451023 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(SC)sc(SC)c1CO)[C@@H](C2)C3=O ZINC000587451045 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(SC)sc(SC)c1CO)[C@@H](C2)C3=O ZINC000587451047 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C=C(SC)SC)(c1cccnc1)[C@@H](C2)C3=O ZINC000587451049 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C=C(SC)SC)(c1cccnc1)[C@@H](C2)C3=O ZINC000587451050 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccsc1)([C@H](O)c1ccsc1)[C@@H](C2)C3=O ZINC000587451071 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccsc1)([C@H](O)c1ccsc1)[C@@H](C2)C3=O ZINC000587451074 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccsc1)([C@@H](O)c1ccsc1)[C@@H](C2)C3=O ZINC000587451075 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccsc1)([C@@H](O)c1ccsc1)[C@@H](C2)C3=O ZINC000587451077 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(Cl)nc(SC)nc1Cl)[C@@H](C2)C3=O ZINC000587451131 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(Cl)nc(SC)nc1Cl)[C@@H](C2)C3=O ZINC000587451136 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1sc4nc(C)cc(C)c4c1N)[C@@H](C2)C3=O ZINC000587451203 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1sc4nc(C)cc(C)c4c1N)[C@@H](C2)C3=O ZINC000587451207 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4ccccc4-c4ccc(C(=O)O)cc41)[C@@H](C2)C3=O ZINC000587451221 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccccc4-c4ccc(C(=O)O)cc41)[C@@H](C2)C3=O ZINC000587451222 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccccc4-c4c(C(=O)O)cccc41)[C@@H](C2)C3=O ZINC000587451235 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4ccccc4-c4c(C(=O)O)cccc41)[C@@H](C2)C3=O ZINC000587451237 GI Annotated Anodyne COc1ccc(Oc2ncc([C@@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)s2)cc1 ZINC000587451264 GI Annotated Anodyne COc1ccc(Oc2ncc([C@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)s2)cc1 ZINC000587451272 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cn(CCC#N)nc1-c1cccs1)[C@@H](C2)C3=O ZINC000587451319 GI Annotated Mild COc1cc2c3c(c1)O[C@H](c1cn(CCC#N)nc1-c1cccs1)[C@@H](C2)C3=O ZINC000587451323 GI Annotated Mild COc1ccc(-c2csc([C@@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)n2)cc1 ZINC000587451351 GI Annotated Anodyne COc1ccc(-c2csc([C@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)n2)cc1 ZINC000587451353 GI Annotated Anodyne COc1cccc(-c2nc([C@@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)cs2)c1 ZINC000587451466 GI Annotated Anodyne COc1cccc(-c2nc([C@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)cs2)c1 ZINC000587451468 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](/C=C/N(C)C)(c1ccc(Cl)s1)[C@@H](C2)C3=O ZINC000587451514 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](/C=C/N(C)C)(c1ccc(Cl)s1)[C@@H](C2)C3=O ZINC000587451525 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](/C=C\N(C)C)(c1ccc(Cl)s1)[C@@H](C2)C3=O ZINC000587451526 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](/C=C\N(C)C)(c1ccc(Cl)s1)[C@@H](C2)C3=O ZINC000587451527 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cnc(SCc4ccccc4)nc1)[C@@H](C2)C3=O ZINC000587451561 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1cnc(SCc4ccccc4)nc1)[C@@H](C2)C3=O ZINC000587451562 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1c(C)[nH]c(-c4ccco4)nc1=S)[C@@H](C2)C3=O ZINC000587451592 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1c(C)[nH]c(-c4ccco4)nc1=S)[C@@H](C2)C3=O ZINC000587451593 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)c4ccccc4O[C@@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587451848 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)c4ccccc4O[C@@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587451850 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)c4ccccc4O[C@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587451853 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)c4ccccc4O[C@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587451857 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@@H]1CCCC[C@H]1C(=O)O)[C@@H](C2)C3=O ZINC000587451858 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccccc1)([C@@H]1CCCC[C@H]1C(=O)O)[C@@H](C2)C3=O ZINC000587451860 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@H]1CCCC[C@@H]1C(=O)O)[C@@H](C2)C3=O ZINC000587451862 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@@H]1CCCC[C@@H]1C(=O)O)[C@@H](C2)C3=O ZINC000587451865 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@H]1CCCC[C@H]1C(=O)O)[C@@H](C2)C3=O ZINC000587451867 GI Annotated Anodyne COc1cc2c3c(c1)OC1(C[C@@H]4CCC[C@H](C1)N4Cc1cccs1)[C@@H](C2)C3=O ZINC000587451940 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1cccs1)([C@@H](C)Br)[C@@H](C2)C3=O ZINC000587451949 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](c1cccs1)([C@H](C)Br)[C@@H](C2)C3=O ZINC000587451956 GI Annotated Reactive COc1cc2c3c(c1)O[C@](c1cccs1)([C@H](C)Br)[C@@H](C2)C3=O ZINC000587451958 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](c1cccs1)([C@@H](C)Br)[C@@H](C2)C3=O ZINC000587451960 GI Annotated Reactive COc1cc2c3c(c1)O[C@](C)(c1sc(-c4ccc(O)cc4)nc1C)[C@@H](C2)C3=O ZINC000587451966 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1sc(-c4ccc(O)cc4)nc1C)[C@@H](C2)C3=O ZINC000587451968 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1nc(-c4ccccc4OC)cs1)[C@@H](C2)C3=O ZINC000587451995 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1nc(-c4ccccc4OC)cs1)[C@@H](C2)C3=O ZINC000587451996 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)[C@@H](c4ccccc4)Oc4ccccc41)[C@@H](C2)C3=O ZINC000587452074 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)[C@H](c4ccccc4)Oc4ccccc41)[C@@H](C2)C3=O ZINC000587452079 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(=O)[C@H](c4ccccc4)Oc4ccccc41)[C@@H](C2)C3=O ZINC000587452081 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(=O)[C@@H](c4ccccc4)Oc4ccccc41)[C@@H](C2)C3=O ZINC000587452084 GI Annotated Anodyne COc1cc2c3c(c1)OC1(CCC(C4CCC5(CC4)OCCO5)CC1)[C@@H](C2)C3=O ZINC000587452114 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@@H]1O[C@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587452127 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@H]1O[C@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587452132 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)([C@@H]1O[C@@H]1c1ccccc1)[C@@H](C2)C3=O ZINC000587452134 GI Annotated Anodyne CCOC(=O)C[C@]1(c2ccc(Cl)s2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587452197 GI Annotated Anodyne CCOC(=O)C[C@@]1(c2ccc(Cl)s2)Oc2cc(OC)cc3c2C(=O)[C@H]1C3 ZINC000587452200 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CC#N)(c1sccc1-n1cccc1)[C@@H](C2)C3=O ZINC000587452221 GI Annotated Mild COc1cc2c3c(c1)O[C@@](CC#N)(c1sccc1-n1cccc1)[C@@H](C2)C3=O ZINC000587452223 GI Annotated Mild COc1cc2c3c(c1)O[C@]1(C=C(c4ccccc4)Oc4ccc(O)cc41)[C@@H](C2)C3=O ZINC000587452285 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C=C(c4ccccc4)Oc4ccc(O)cc41)[C@@H](C2)C3=O ZINC000587452288 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](CCC(=O)O)(c1csc4ccccc14)[C@@H](C2)C3=O ZINC000587452452 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CCC(=O)O)(c1csc4ccccc14)[C@@H](C2)C3=O ZINC000587452474 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C(=O)c1cccs1)(c1cccs1)[C@@H](C2)C3=O ZINC000587452689 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C(=O)c1cccs1)(c1cccs1)[C@@H](C2)C3=O ZINC000587452690 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(-c4ccc(OC)nc4)s1)[C@@H](C2)C3=O ZINC000587452695 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(-c4ccc(OC)nc4)s1)[C@@H](C2)C3=O ZINC000587452696 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CBr)(c1ccc(Cl)s1)[C@@H](C2)C3=O ZINC000587452730 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CBr)(c1ccc(Cl)s1)[C@@H](C2)C3=O ZINC000587452734 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](CCl)(c1sccc1Br)[C@@H](C2)C3=O ZINC000587452755 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CCl)(c1sccc1Br)[C@@H](C2)C3=O ZINC000587452759 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](c1ccccc1)(c1ccsc1C(=O)O)[C@@H](C2)C3=O ZINC000587452791 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccccc1)(c1ccsc1C(=O)O)[C@@H](C2)C3=O ZINC000587452792 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1coc4ccc(C(C)C)cc4c1=O)[C@@H](C2)C3=O ZINC000587452849 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1coc4ccc(C(C)C)cc4c1=O)[C@@H](C2)C3=O ZINC000587452850 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(Br)sc1C)[C@@H](C2)C3=O ZINC000587452902 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(Br)sc1C)[C@@H](C2)C3=O ZINC000587452907 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCOc4cc5c(cc41)CCCC5)[C@@H](C2)C3=O ZINC000587453010 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4sc(Br)cc41)[C@@H](C2)C3=O ZINC000587453025 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4sc(Br)cc41)[C@@H](C2)C3=O ZINC000587453029 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCOc4cc5c(cc41)CCCC5)[C@@H](C2)C3=O ZINC000587453030 GI Annotated Anodyne COc1ccc(-c2ncc([C@@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)s2)cc1 ZINC000587453111 GI Annotated Anodyne COc1ccc(-c2ncc([C@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)s2)cc1 ZINC000587453112 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1sc(N4CCCCC4)nc1Cl)[C@@H](C2)C3=O ZINC000587453181 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1sc(N4CCCCC4)nc1Cl)[C@@H](C2)C3=O ZINC000587453182 GI Annotated Anodyne COc1cccc(-c2ncc([C@@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)s2)c1 ZINC000587453197 GI Annotated Anodyne COc1cccc(-c2ncc([C@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)s2)c1 ZINC000587453198 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C[C@H]1CC[C@@H](C(=O)O)C1)(c1ccccc1)[C@@H](C2)C3=O ZINC000587453297 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C[C@H]1CC[C@@H](C(=O)O)C1)(c1ccccc1)[C@@H](C2)C3=O ZINC000587453298 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C(=O)c1ccsc1)(c1ccsc1)[C@@H](C2)C3=O ZINC000587453426 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C(=O)c1ccsc1)(c1ccsc1)[C@@H](C2)C3=O ZINC000587453429 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(-c4ccc(C=O)c(O)c4)cc1)[C@@H](C2)C3=O ZINC000587453511 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(-c4ccc(C=O)c(O)c4)cc1)[C@@H](C2)C3=O ZINC000587453514 GI Annotated Anodyne COC(=O)c1sccc1-c1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)o1 ZINC000587453532 GI Annotated Anodyne COC(=O)c1sccc1-c1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)o1 ZINC000587453538 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccccc1OCc1cscn1)[C@@H](C2)C3=O ZINC000587453579 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccccc1OCc1cscn1)[C@@H](C2)C3=O ZINC000587453581 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccsc4CC[C@H]1Br)[C@@H](C2)C3=O ZINC000587453629 GI Annotated Reactive COc1cc2c3c(c1)O[C@@]1(c4ccsc4CC[C@@H]1Br)[C@@H](C2)C3=O ZINC000587453632 GI Annotated Reactive COc1cc2c3c(c1)O[C@]1(c4ccsc4CC[C@H]1Br)[C@@H](C2)C3=O ZINC000587453634 GI Annotated Reactive COc1cc2c3c(c1)O[C@]1(c4ccsc4CC[C@@H]1Br)[C@@H](C2)C3=O ZINC000587453638 GI Annotated Reactive COc1cc2c3c(c1)O[C@@](C)(c1sc(-c4ccccn4)nc1C)[C@@H](C2)C3=O ZINC000587453679 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1sc(-c4ccccn4)nc1C)[C@@H](C2)C3=O ZINC000587453682 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1csc(-c4ccc5c(c4)OCO5)n1)[C@@H](C2)C3=O ZINC000587453723 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1csc(-c4ccc5c(c4)OCO5)n1)[C@@H](C2)C3=O ZINC000587453725 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1csc(-c4ccccc4OC)n1)[C@@H](C2)C3=O ZINC000587453785 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1csc(-c4ccccc4OC)n1)[C@@H](C2)C3=O ZINC000587453786 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccc(C)cc1)(c1ccsc1N)[C@@H](C2)C3=O ZINC000587453815 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccc(C)cc1)(c1ccsc1N)[C@@H](C2)C3=O ZINC000587453817 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1sc(Nc4cccnc4)nc1C)[C@@H](C2)C3=O ZINC000587453821 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1sc(Nc4cccnc4)nc1C)[C@@H](C2)C3=O ZINC000587453822 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C=C(c4ccccc4)Oc4cc(O)ccc41)[C@@H](C2)C3=O ZINC000587453981 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C=C(c4ccccc4)Oc4cc(O)ccc41)[C@@H](C2)C3=O ZINC000587453983 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(OCc4cscn4)cc1)[C@@H](C2)C3=O ZINC000587454057 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(OCc4cscn4)cc1)[C@@H](C2)C3=O ZINC000587454059 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(CCCc4nc(-c5cccnc5)sc41)[C@@H](C2)C3=O ZINC000587454089 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(CCCc4nc(-c5cccnc5)sc41)[C@@H](C2)C3=O ZINC000587454091 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1c(SC(C)C)nc4sccn14)[C@@H](C2)C3=O ZINC000587454093 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(SC(C)C)nc4sccn14)[C@@H](C2)C3=O ZINC000587454097 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(NC4=NCCCS4)cc1)[C@@H](C2)C3=O ZINC000587454134 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1ccc(NC4=NCCCS4)cc1)[C@@H](C2)C3=O ZINC000587454135 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CBr)(c1sccc1Cl)[C@@H](C2)C3=O ZINC000587454194 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CBr)(c1sccc1Cl)[C@@H](C2)C3=O ZINC000587454195 GI Annotated Reactive COc1cc2c3c(c1)O[C@H](c1c(C)nc4sc5ccccc5n14)[C@@H](C2)C3=O ZINC000587454283 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1c(C)nc4sc5ccccc5n14)[C@@H](C2)C3=O ZINC000587454286 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](C)(c1cc(C)c(Br)s1)[C@@H](C2)C3=O ZINC000587454443 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1cc(C)c(Br)s1)[C@@H](C2)C3=O ZINC000587454444 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](CSC#N)(c1sccc1Cl)[C@@H](C2)C3=O ZINC000587454449 GI Annotated Reactive COc1cc2c3c(c1)O[C@](CSC#N)(c1sccc1Cl)[C@@H](C2)C3=O ZINC000587454450 GI Annotated Reactive COc1cc2c3c(c1)O[C@@H](c1cc(Br)c(OC)s1)[C@@H](C2)C3=O ZINC000587454471 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1cc(Br)c(OC)s1)[C@@H](C2)C3=O ZINC000587454472 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(c4ccsc4C(=O)c4ccsc41)[C@@H](C2)C3=O ZINC000587454501 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(c4ccsc4C(=O)c4ccsc41)[C@@H](C2)C3=O ZINC000587454502 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(C(c4ccccc4)=COc4cc(O)ccc41)[C@@H](C2)C3=O ZINC000587454734 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(C(c4ccccc4)=COc4cc(O)ccc41)[C@@H](C2)C3=O ZINC000587454735 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(/C(=C/c4ccccc4)Oc4cc(O)ccc41)[C@@H](C2)C3=O ZINC000587454749 GI Annotated Anodyne COc1cc2c3c(c1)O[C@]1(/C(=C\c4ccccc4)Oc4cc(O)ccc41)[C@@H](C2)C3=O ZINC000587454750 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(/C(=C\c4ccccc4)Oc4cc(O)ccc41)[C@@H](C2)C3=O ZINC000587454751 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@]1(/C(=C/c4ccccc4)Oc4cc(O)ccc41)[C@@H](C2)C3=O ZINC000587454752 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](c1ccco1)(c1coc4ccc(O)cc14)[C@@H](C2)C3=O ZINC000587455015 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@](c1ccco1)(c1coc4ccc(O)cc14)[C@@H](C2)C3=O ZINC000587455018 GI Annotated Anodyne CCCOc1cc2c(cc1[C@@H]1Oc3cc(OC)cc4c3C(=O)[C@H]1C4)O[C@H](C)C2 ZINC000587455105 GI Annotated Anodyne CCCOc1cc2c(cc1[C@@H]1Oc3cc(OC)cc4c3C(=O)[C@H]1C4)O[C@@H](C)C2 ZINC000587455106 GI Annotated Anodyne CCCOc1cc2c(cc1[C@H]1Oc3cc(OC)cc4c3C(=O)[C@H]1C4)O[C@@H](C)C2 ZINC000587455107 GI Annotated Anodyne CCCOc1cc2c(cc1[C@H]1Oc3cc(OC)cc4c3C(=O)[C@H]1C4)O[C@H](C)C2 ZINC000587455108 GI Annotated Anodyne C=C1CC([C@]2(CCCCC3OCCO3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)C1 ZINC000587455141 GI Annotated Mild C=C1CC([C@@]2(CCCCC3OCCO3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)C1 ZINC000587455142 GI Annotated Mild COc1cc2c3c(c1)O[C@@](C)(c1ccc(-c4ccc(C(=O)O)o4)cc1)[C@@H](C2)C3=O ZINC000587455163 GI Annotated Anodyne COc1cc2c3c(c1)O[C@](C)(c1ccc(-c4ccc(C(=O)O)o4)cc1)[C@@H](C2)C3=O ZINC000587455164 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(-c4ccc(C(=O)O)cc4)o1)[C@@H](C2)C3=O ZINC000587455241 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(-c4ccc(C(=O)O)cc4)o1)[C@@H](C2)C3=O ZINC000587455242 GI Annotated Anodyne CCOc1ccc([C@]2(c3ccco3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587455245 GI Annotated Anodyne CCOc1ccc([C@@]2(c3ccco3)Oc3cc(OC)cc4c3C(=O)[C@H]2C4)cc1 ZINC000587455246 GI Annotated Anodyne COc1ccc(OCc2ccc([C@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)o2)cc1 ZINC000587455259 GI Annotated Anodyne COc1ccc(OCc2ccc([C@@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)o2)cc1 ZINC000587455260 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(O)cc(Br)c1O)CC2=O ZINC000587455355 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(O)cc(Br)c1O)CC2=O ZINC000587455356 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(Br)c(O)cc1O)CC2=O ZINC000587455559 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(Br)c(O)cc1O)CC2=O ZINC000587455560 GI Annotated Anodyne COC(=O)c1ccccc1-c1ccc([C@@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)o1 ZINC000587455632 GI Annotated Anodyne COC(=O)c1ccccc1-c1ccc([C@H]2Oc3cc(OC)cc4c3C(=O)[C@H]2C4)o1 ZINC000587455633 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccccc1CO[C@H]1CCCCO1)[C@@H](C2)C3=O ZINC000587455636 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccccc1CO[C@@H]1CCCCO1)[C@@H](C2)C3=O ZINC000587455637 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccccc1CO[C@H]1CCCCO1)[C@@H](C2)C3=O ZINC000587455638 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccccc1CO[C@@H]1CCCCO1)[C@@H](C2)C3=O ZINC000587455639 GI Annotated Anodyne COc1cc2c3c(c1)O[C@H](c1ccc(COc4ccccc4OC)o1)[C@@H](C2)C3=O ZINC000587455660 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(COc4ccccc4OC)o1)[C@@H](C2)C3=O ZINC000587455661 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CBr)(c1cccc(O)c1)CC2=O ZINC000587455669 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CBr)(c1cccc(O)c1)CC2=O ZINC000587455670 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CBr)(c1ccc(O)cc1)CC2=O ZINC000587455993 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CBr)(c1ccc(O)cc1)CC2=O ZINC000587455994 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@H](c1c(N)cccc1Br)CC2=O ZINC000587456011 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(N)cccc1Br)CC2=O ZINC000587456027 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccc(Br)c1N)CC2=O ZINC000587456070 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccc(Br)c1N)CC2=O ZINC000587456071 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CBr)(c1ccc(N)cc1)CC2=O ZINC000587456084 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CBr)(c1ccc(N)cc1)CC2=O ZINC000587456085 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@H](c1c(O)ccc(O)c1Br)CC2=O ZINC000587456256 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(O)ccc(O)c1Br)CC2=O ZINC000587456257 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C=O)(c1ccccc1Br)CC2=O ZINC000587456306 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](C=O)(c1ccccc1Br)CC2=O ZINC000587456307 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](CBr)(c1oc(C)nc1C)CC2=O ZINC000587456395 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CBr)(c1oc(C)nc1C)CC2=O ZINC000587456398 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C)(c1cc(Br)ccn1)CC2=O ZINC000587456656 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cc(Br)ccn1)CC2=O ZINC000587456659 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C=O)(c1cccc(Br)c1)CC2=O ZINC000587456660 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](C=O)(c1cccc(Br)c1)CC2=O ZINC000587456662 GI Annotated Mild COc1cc2c3c(c1)O[C@H](c1ccc(-c4ccccc4C(=O)O)o1)[C@@H](C2)C3=O ZINC000587456965 GI Annotated Anodyne COc1cc2c3c(c1)O[C@@H](c1ccc(-c4ccccc4C(=O)O)o1)[C@@H](C2)C3=O ZINC000587456969 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(O)c(Br)cc1O)CC2=O ZINC000587457029 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(O)c(Br)cc1O)CC2=O ZINC000587457030 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(Br)ccc1N)CC2=O ZINC000587457091 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(Br)ccc1N)CC2=O ZINC000587457093 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ncccc1Br)CC2=O ZINC000587457135 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ncccc1Br)CC2=O ZINC000587457137 GI Annotated Anodyne COC(=O)c1ccc(-c2ccc([C@@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)o2)cc1 ZINC000587457146 GI Annotated Anodyne COC(=O)c1ccc(-c2ccc([C@H]3Oc4cc(OC)cc5c4C(=O)[C@H]3C5)o2)cc1 ZINC000587457147 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](C(=O)c1cccc(Br)c1)CC2=O ZINC000587457304 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](C(=O)c1cccc(Br)c1)CC2=O ZINC000587457307 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](C(=O)c1ccccc1Br)CC2=O ZINC000587457336 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](C(=O)c1ccccc1Br)CC2=O ZINC000587457338 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C=O)(c1ccc(Br)cc1)CC2=O ZINC000587457635 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](C=O)(c1ccc(Br)cc1)CC2=O ZINC000587457636 GI Annotated Mild CCCc1c(O)ccc2c1O[C@@](C)(c1cccnc1Br)CC2=O ZINC000587457689 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cccnc1Br)CC2=O ZINC000587457690 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccncc1Br)CC2=O ZINC000587457697 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccncc1Br)CC2=O ZINC000587457698 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ncc(Br)cc1OC)CC2=O ZINC000587457701 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ncc(Br)cc1OC)CC2=O ZINC000587457702 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccnc(Br)c1OC)CC2=O ZINC000587457856 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccnc(Br)c1OC)CC2=O ZINC000587457857 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1nn(CC)cc1Br)CC2=O ZINC000587457897 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1nn(CC)cc1Br)CC2=O ZINC000587457898 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1c(Br)cnn1CC)CC2=O ZINC000587457989 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1c(Br)cnn1CC)CC2=O ZINC000587457990 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)Cl)(c1c[nH]c3ccccc13)CC2=O ZINC000587458025 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C(=O)Cl)(c1c[nH]c3ccccc13)CC2=O ZINC000587458028 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](C)([C@H](Cl)C(=O)Nc1ccccc1)CC2=O ZINC000587458067 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](C)([C@@H](Cl)C(=O)Nc1ccccc1)CC2=O ZINC000587458069 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C)([C@@H](Cl)C(=O)Nc1ccccc1)CC2=O ZINC000587458070 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C)([C@H](Cl)C(=O)Nc1ccccc1)CC2=O ZINC000587458071 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@H](c1nn(CC)cc1Br)CC2=O ZINC000587458126 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1nn(CC)cc1Br)CC2=O ZINC000587458128 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC#N)(c1ccc(Br)o1)CC2=O ZINC000587458227 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](CC#N)(c1ccc(Br)o1)CC2=O ZINC000587458228 GI Annotated Mild CCCc1c(O)ccc2c1O[C@H](c1c(Br)cnn1CC)CC2=O ZINC000587458279 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(Br)cnn1CC)CC2=O ZINC000587458280 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCl)(c1nnc(-c3ccccc3)o1)CC2=O ZINC000587458406 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CCl)(c1nnc(-c3ccccc3)o1)CC2=O ZINC000587458407 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](C)(c1cccc(NC(=O)CCl)c1)CC2=O ZINC000587458418 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C)(c1cccc(NC(=O)CCl)c1)CC2=O ZINC000587458419 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@H](c1cc(OC)ncc1Br)CC2=O ZINC000587458467 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(OC)ncc1Br)CC2=O ZINC000587458469 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCl)(c1cccc(C(=O)OC)c1)CC2=O ZINC000587458475 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C)(c1cccc(Br)n1)CC2=O ZINC000587458509 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cccc(Br)n1)CC2=O ZINC000587458510 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cncc(Br)c1)CC2=O ZINC000587458517 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cncc(Br)c1)CC2=O ZINC000587458518 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCl)(c1cccc(C(=O)OC)c1)CC2=O ZINC000587458590 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@H](c1cn(Cc3ccc(Cl)cc3)nn1)CC2=O ZINC000587458602 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cn(Cc3ccc(Cl)cc3)nn1)CC2=O ZINC000587458605 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCl)([C@H](C)NC(=O)OC(C)(C)C)CC2=O ZINC000587458610 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CCl)([C@H](C)NC(=O)OC(C)(C)C)CC2=O ZINC000587458613 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](C)(c1ccc(OC)c(Cl)c1N)CC2=O ZINC000587458685 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(OC)c(Cl)c1N)CC2=O ZINC000587458688 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc3nc(O)oc3c1)CC2=O ZINC000587458878 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc3nc(O)oc3c1)CC2=O ZINC000587458882 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@H](C(=O)c1ccc(Br)cc1)CC2=O ZINC000587458912 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](C(=O)c1ccc(Br)cc1)CC2=O ZINC000587458913 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1nc(OC)ccc1Br)CC2=O ZINC000587458929 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1nc(OC)ccc1Br)CC2=O ZINC000587458932 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OC)(c1ccccc1Cl)CC2=O ZINC000587458987 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OC)(c1ccccc1Cl)CC2=O ZINC000587459012 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(Br)cn1)CC2=O ZINC000587459067 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(Br)cn1)CC2=O ZINC000587459069 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc3nc(O)[nH]c3c1)CC2=O ZINC000587459241 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc3nc(O)[nH]c3c1)CC2=O ZINC000587459243 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CCl)(c1cc(C(=O)O)oc1C)CC2=O ZINC000587459281 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CCl)(c1cc(C(=O)O)oc1C)CC2=O ZINC000587459289 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@H](c1cn(-c3ccc(Cl)cc3)nn1)CC2=O ZINC000587459405 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cn(-c3ccc(Cl)cc3)nn1)CC2=O ZINC000587459406 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2cc(Cl)ccc2OC(=O)[C@H]1C ZINC000587459469 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2cc(Cl)ccc2OC(=O)[C@@H]1C ZINC000587459475 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2cc(Cl)ccc2OC(=O)[C@@H]1C ZINC000587459478 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2cc(Cl)ccc2OC(=O)[C@H]1C ZINC000587459481 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(Br)cc1N)CC2=O ZINC000587459628 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(Cl)[nH]c(=N)n1-c1ccccc1)CC2=O ZINC000587459639 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(Cl)[nH]c(=N)n1-c1ccccc1)CC2=O ZINC000587459642 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(C)C)([C@@H](Cl)C(=O)OCC)CC2=O ZINC000587459728 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CC(C)C)([C@@H](Cl)C(=O)OCC)CC2=O ZINC000587459734 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CC(C)C)([C@H](Cl)C(=O)OCC)CC2=O ZINC000587459735 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CC(C)C)([C@H](Cl)C(=O)OCC)CC2=O ZINC000587459737 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@H](CCc1cncc(Br)c1)CC2=O ZINC000587459805 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](CCc1cncc(Br)c1)CC2=O ZINC000587459807 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(Br)cc1N)CC2=O ZINC000587459823 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(Br)cnc1OC)CC2=O ZINC000587459933 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(Br)cnc1OC)CC2=O ZINC000587459934 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc(N(C)C=O)cc1)CC2=O ZINC000587459957 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc(N(C)C=O)cc1)CC2=O ZINC000587459960 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@H](c1cc([N+](=O)[O-])cc(CCl)c1O)CC2=O ZINC000587459980 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@H](c1cc([N+](=O)[O-])cc(CCl)c1O)CC2=O ZINC000587459981 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](C(=O)OC)([C@H](Cl)c1ccccc1)CC2=O ZINC000587460044 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](C(=O)OC)([C@@H](Cl)c1ccccc1)CC2=O ZINC000587460046 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C(=O)OC)([C@@H](Cl)c1ccccc1)CC2=O ZINC000587460048 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C(=O)OC)([C@H](Cl)c1ccccc1)CC2=O ZINC000587460049 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@H](c1ccc(OC)c(Br)n1)CC2=O ZINC000587460120 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(OC)c(Br)n1)CC2=O ZINC000587460122 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CC(=O)Nc1ccc(Cl)cn1)CC2=O ZINC000587460317 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)Nc1ccc(Cl)cn1)CC2=O ZINC000587460320 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(-n3cncn3)cc1Cl)CC2=O ZINC000587460516 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(-n3cncn3)cc1Cl)CC2=O ZINC000587460518 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCl)(c1cc(OC)ccc1OC)CC2=O ZINC000587460553 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CCl)(c1cc(OC)ccc1OC)CC2=O ZINC000587460554 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CCCCCCl)(C(=O)OCC)CC2=O ZINC000587460676 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CCCCCCl)(C(=O)OCC)CC2=O ZINC000587460684 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@]1(CCC[C@H](C(F)(F)C(=O)OCC)C1)CC2=O ZINC000587460694 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc(NC(C)=O)cc1)CC2=O ZINC000587460699 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc(NC(C)=O)cc1)CC2=O ZINC000587460700 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc3c(c1)OCCO3)CC2=O ZINC000587460701 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc3c(c1)OCCO3)CC2=O ZINC000587460702 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@]1(CCC[C@H](C(F)(F)C(=O)OCC)C1)CC2=O ZINC000587460707 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCC[C@@H](C(F)(F)C(=O)OCC)C1)CC2=O ZINC000587460710 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCC[C@@H](C(F)(F)C(=O)OCC)C1)CC2=O ZINC000587460712 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc3c(C)nn(C)c3nc1Cl)CC2=O ZINC000587460835 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cnn(-c3ccc(Cl)cc3)n1)CC2=O ZINC000587460836 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cnn(-c3ccc(Cl)cc3)n1)CC2=O ZINC000587460837 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc3c(C)nn(C)c3nc1Cl)CC2=O ZINC000587460840 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc(OC)cc1OC)CC2=O ZINC000587461013 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc(OC)cc1OC)CC2=O ZINC000587461014 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@H](c1ccc(Cl)cc1-n1cncn1)CC2=O ZINC000587461449 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(Cl)cc1-n1cncn1)CC2=O ZINC000587461452 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1nc(Br)ccc1OC)CC2=O ZINC000587461791 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1nc(Br)ccc1OC)CC2=O ZINC000587461792 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(Br)nc1)CC2=O ZINC000587461850 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(Br)nc1)CC2=O ZINC000587461851 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccccc1NC(=O)CCl)CC2=O ZINC000587461917 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](C)(c1ccccc1NC(=O)CCl)CC2=O ZINC000587461918 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc3c(c1)CCC(=O)N3)CC2=O ZINC000587461946 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc3c(c1)CCC(=O)N3)CC2=O ZINC000587461947 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CC(=O)OC)(c1ccc(Cl)cc1)CC2=O ZINC000587462007 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OC)(c1ccc(Cl)cc1)CC2=O ZINC000587462009 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(Cl)cc([N+](=O)[O-])c1O)CC2=O ZINC000587462235 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@H](c1cc(Cl)cc([N+](=O)[O-])c1O)CC2=O ZINC000587462236 GI Annotated Bother CCCc1c(O)ccc2c1O[C@H](c1ccnc(Cl)c1C(OC)OC)CC2=O ZINC000587462408 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccnc(Cl)c1C(OC)OC)CC2=O ZINC000587462411 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(Cl)cnc(OC)c1OC)CC2=O ZINC000587462530 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(Cl)cnc(OC)c1OC)CC2=O ZINC000587462542 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCC(N(C)CC(F)(F)F)CC1)CC2=O ZINC000587462546 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCC(=O)O)(c1ccc(Cl)cn1)CC2=O ZINC000587462695 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCC(=O)O)(c1ccc(Cl)cn1)CC2=O ZINC000587462696 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](Cc1c(Cl)nc(C)nc1Cl)CC2=O ZINC000587462764 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](Cc1c(Cl)nc(C)nc1Cl)CC2=O ZINC000587462765 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OCC)(c1ccc(Cl)cc1)CC2=O ZINC000587462942 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OCC)(c1ccc(Cl)cc1)CC2=O ZINC000587462943 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2cc(Cl)c(Cl)cc21 ZINC000587462994 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2cc(Cl)c(Cl)cc21 ZINC000587462995 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(O)ccc([N+](=O)[O-])c1Cl)CC2=O ZINC000587463127 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@H](c1c(O)ccc([N+](=O)[O-])c1Cl)CC2=O ZINC000587463128 GI Annotated Bother CCCc1c(O)ccc2c1O[C@](C(=O)OCC)(c1cccc(Cl)c1)CC2=O ZINC000587463200 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OCC)(c1cccc(Cl)c1)CC2=O ZINC000587463201 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2c(Cl)cc(Cl)cc21 ZINC000587463244 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2c(Cl)cc(Cl)cc21 ZINC000587463245 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2c(Cl)ccc(Cl)c21 ZINC000587463274 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2c(Cl)ccc(Cl)c21 ZINC000587463275 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](COC(C)=O)(c1ccc(Cl)cc1)CC2=O ZINC000587463278 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](COC(C)=O)(c1ccc(Cl)cc1)CC2=O ZINC000587463279 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC[C@@H](C(F)(F)C(=O)OCC)C1)CC2=O ZINC000587463342 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC[C@H](C(F)(F)C(=O)OCC)C1)CC2=O ZINC000587463343 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC[C@@H](C(F)(F)C(=O)OCC)C1)CC2=O ZINC000587463344 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC[C@H](C(F)(F)C(=O)OCC)C1)CC2=O ZINC000587463345 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CC2=O)CC(c2ncc3c(Cl)nccn23)C1 ZINC000587463364 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(C)nn(C)c1OCC(F)(F)F)CC2=O ZINC000587463384 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(C)nn(C)c1OCC(F)(F)F)CC2=O ZINC000587463385 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1cccnc1Cl)CC2=O ZINC000587463656 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C\N(C)C)(c1cccnc1Cl)CC2=O ZINC000587463661 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C\N(C)C)(c1cccnc1Cl)CC2=O ZINC000587463663 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1cccnc1Cl)CC2=O ZINC000587463666 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cnn(-c3cccc(Cl)c3)n1)CC2=O ZINC000587463680 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cnn(-c3cccc(Cl)c3)n1)CC2=O ZINC000587463682 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2cc(Cl)cc(Cl)c21 ZINC000587463687 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2cc(Cl)cc(Cl)c21 ZINC000587463688 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2c1ccc(Cl)c2Cl ZINC000587463717 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2c1ccc(Cl)c2Cl ZINC000587463718 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2cccc(C(F)(F)F)c21 ZINC000587464288 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2cccc(C(F)(F)F)c21 ZINC000587464289 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2c(C(F)(F)F)cccc21 ZINC000587464469 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2c(C(F)(F)F)cccc21 ZINC000587464470 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CO)(c1ccc(C(F)(F)F)cc1)CC2=O ZINC000587464507 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CO)(c1ccc(C(F)(F)F)cc1)CC2=O ZINC000587464508 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2ccc(C(F)(F)F)cc21 ZINC000587464525 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2ccc(C(F)(F)F)cc21 ZINC000587464526 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1sc(=N)[nH]c1C(F)(F)F)CC2=O ZINC000587464533 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1sc(=N)[nH]c1C(F)(F)F)CC2=O ZINC000587464534 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(OC(F)(F)C(=O)O)cc1)CC2=O ZINC000587464584 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(OC(F)(F)C(=O)O)cc1)CC2=O ZINC000587464585 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(C(F)(F)F)nn(C)c1Cl)CC2=O ZINC000587464752 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(C(F)(F)F)nn(C)c1Cl)CC2=O ZINC000587464753 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1c(F)cccc1OCCOC)CC2=O ZINC000587464830 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1c(F)cccc1OCCOC)CC2=O ZINC000587464831 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCC[C@H]([C@H](F)C(=O)OCC)C1)CC2=O ZINC000587464903 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCC[C@@H]([C@@H](F)C(=O)OCC)C1)CC2=O ZINC000587464904 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCC[C@@H]([C@H](F)C(=O)OCC)C1)CC2=O ZINC000587464905 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCC[C@H]([C@@H](F)C(=O)OCC)C1)CC2=O ZINC000587464906 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2cc(C(F)(F)F)ccc21 ZINC000587464921 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2cc(C(F)(F)F)ccc21 ZINC000587464922 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C(C#N)=C\N(C)C)(c1ccc(F)cc1)CC2=O ZINC000587465086 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](/C(C#N)=C/N(C)C)(c1ccc(F)cc1)CC2=O ZINC000587465088 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](/C(C#N)=C/N(C)C)(c1ccc(F)cc1)CC2=O ZINC000587465091 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](/C(C#N)=C\N(C)C)(c1ccc(F)cc1)CC2=O ZINC000587465092 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](C)(c1cc(F)cc([N+](=O)[O-])c1OC)CC2=O ZINC000587465117 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](C)(c1cc(F)cc([N+](=O)[O-])c1OC)CC2=O ZINC000587465124 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(N3CCOCC3)c(F)c1)CC2=O ZINC000587465210 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(N3CCOCC3)c(F)c1)CC2=O ZINC000587465212 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(F)c(F)c(C=O)c(F)c1F)CC2=O ZINC000587465280 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(F)c(F)c(C=O)c(F)c1F)CC2=O ZINC000587465281 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OCC)(c1ccc(C)c(F)c1)CC2=O ZINC000587465376 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OCC)(c1ccc(C)c(F)c1)CC2=O ZINC000587465377 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1c(F)ccc(F)c1C(=O)O)CC2=O ZINC000587465389 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1c(F)ccc(F)c1C(=O)O)CC2=O ZINC000587465392 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccc(F)cc1)(c1ccn(C)n1)CC2=O ZINC000587465494 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccc(F)cc1)(c1ccn(C)n1)CC2=O ZINC000587465495 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cn(Cc3ccc(F)cc3)nn1)CC2=O ZINC000587465544 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cn(Cc3ccc(F)cc3)nn1)CC2=O ZINC000587465545 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccc(F)c1N1CCOCC1)CC2=O ZINC000587465584 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccc(F)c1N1CCOCC1)CC2=O ZINC000587465585 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](COC(C)=O)(c1ccc(F)cc1F)CC2=O ZINC000587465686 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](COC(C)=O)(c1ccc(F)cc1F)CC2=O ZINC000587465688 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C[C@@H](C)C(=O)O)(c1cccc(F)c1)CC2=O ZINC000587465723 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C[C@@H](C)C(=O)O)(c1cccc(F)c1)CC2=O ZINC000587465729 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C[C@H](C)C(=O)O)(c1cccc(F)c1)CC2=O ZINC000587465732 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C[C@H](C)C(=O)O)(c1cccc(F)c1)CC2=O ZINC000587465735 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccc(F)cc1)(C1CCNCC1)CC2=O ZINC000587465761 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccc(F)cc1)(C1CCNCC1)CC2=O ZINC000587465763 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(Cc1c([N+](=O)[O-])ccc(F)c1F)CC2=O ZINC000587465766 GI Annotated Bother CCCc1c(O)ccc2c1O[C@](C)(Cc1c([N+](=O)[O-])ccc(F)c1F)CC2=O ZINC000587465768 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](C)(Cc1c([N+](=O)[O-])ccc(O)c1F)CC2=O ZINC000587465775 GI Annotated Bother CCCc1c(O)ccc2c1O[C@](C)(Cc1c([N+](=O)[O-])ccc(O)c1F)CC2=O ZINC000587465779 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](c1cccc(F)c1)(C1CCNCC1)CC2=O ZINC000587465790 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccc(F)c1)(C1CCNCC1)CC2=O ZINC000587465792 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(N3CCOCC3)c(F)c1)CC2=O ZINC000587465824 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccc(F)cc1)(c1ncccn1)CC2=O ZINC000587465825 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(N3CCOCC3)c(F)c1)CC2=O ZINC000587465826 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccc(F)cc1)(c1ncccn1)CC2=O ZINC000587465828 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)(c1ccc(F)cc1)CC2=O ZINC000587465898 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)(c1ccc(F)cc1)CC2=O ZINC000587465899 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccc(F)cc1)(c1cnccn1)CC2=O ZINC000587466124 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccc(F)cc1)(c1cnccn1)CC2=O ZINC000587466126 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc3c(cc1OC(F)F)OCO3)CC2=O ZINC000587466152 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc3c(cc1OC(F)F)OCO3)CC2=O ZINC000587466154 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OCC)(c1ccc(F)c(F)c1)CC2=O ZINC000587466168 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OCC)(c1ccc(F)c(F)c1)CC2=O ZINC000587466170 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccccc1F)(c1nccn1C)CC2=O ZINC000587466180 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccccc1F)(c1nccn1C)CC2=O ZINC000587466182 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cnn(Cc3ccc(F)cc3)c1)CC2=O ZINC000587466282 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cnn(Cc3ccc(F)cc3)c1)CC2=O ZINC000587466284 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CC(=O)Nc1ccc(F)cc1F)CC2=O ZINC000587466325 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)Nc1ccc(F)cc1F)CC2=O ZINC000587466329 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCC(=O)O)(c1cc(F)ccc1F)CC2=O ZINC000587466481 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCC(=O)O)(c1cc(F)ccc1F)CC2=O ZINC000587466484 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1c(F)cccc1N1CCOCC1)CC2=O ZINC000587466531 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1c(F)cccc1N1CCOCC1)CC2=O ZINC000587466534 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC#N)(c1cc(OC)cc(OC)c1)CC2=O ZINC000587466664 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](CC#N)(c1cc(OC)cc(OC)c1)CC2=O ZINC000587466665 GI Annotated Mild CCCc1c(O)ccc2c1O[C@@](Cc1ccncn1)(c1ccc(F)cc1)CC2=O ZINC000587466684 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](Cc1ccncn1)(c1ccc(F)cc1)CC2=O ZINC000587466688 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]([C@@H](CCC#N)C(=O)OC)(C(C)(C)C)CC2=O ZINC000587466698 GI Annotated Mild CCCc1c(O)ccc2c1O[C@]([C@@H](CCC#N)C(=O)OC)(C(C)(C)C)CC2=O ZINC000587466703 GI Annotated Mild CCCc1c(O)ccc2c1O[C@]([C@H](CCC#N)C(=O)OC)(C(C)(C)C)CC2=O ZINC000587466705 GI Annotated Mild CCCc1c(O)ccc2c1O[C@@]([C@H](CCC#N)C(=O)OC)(C(C)(C)C)CC2=O ZINC000587466707 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](C)(CC(=O)Nc1ccc(F)c(F)c1)CC2=O ZINC000587466741 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)Nc1ccc(F)c(F)c1)CC2=O ZINC000587466743 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccc(F)c1)([C@H](C)CC(=O)O)CC2=O ZINC000587466771 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cccc(F)c1)([C@H](C)CC(=O)O)CC2=O ZINC000587466772 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cccc(F)c1)([C@@H](C)CC(=O)O)CC2=O ZINC000587466774 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccc(F)c1)([C@@H](C)CC(=O)O)CC2=O ZINC000587466776 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC#N)(c1ccc(OC)c(OC)c1)CC2=O ZINC000587466804 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](CC#N)(c1ccc(OC)c(OC)c1)CC2=O ZINC000587466807 GI Annotated Mild CCCc1c(O)ccc2c1O[C@H](c1nc(Br)ccc1F)CC2=O ZINC000587466851 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1nc(Br)ccc1F)CC2=O ZINC000587466852 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](Cn1ccnc1)(c1ccc(F)cc1)CC2=O ZINC000587466854 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](Cn1ccnc1)(c1ccc(F)cc1)CC2=O ZINC000587466856 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccc(OC)c1)([C@@H](C)CN(C)C)CC2=O ZINC000587467062 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccc(OC)c1)([C@H](C)CN(C)C)CC2=O ZINC000587467064 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cccc(OC)c1)([C@@H](C)CN(C)C)CC2=O ZINC000587467065 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cccc(OC)c1)([C@H](C)CN(C)C)CC2=O ZINC000587467066 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(N3CCOCC3)cc1F)CC2=O ZINC000587467071 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(N3CCOCC3)cc1F)CC2=O ZINC000587467072 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ncc(Br)cc1F)CC2=O ZINC000587467146 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ncc(Br)cc1F)CC2=O ZINC000587467147 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)(c1ccc(C#N)cc1)CC2=O ZINC000587467153 GI Annotated Mild CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)(c1ccc(C#N)cc1)CC2=O ZINC000587467154 GI Annotated Mild CCCc1c(O)ccc2c1O[C@@](c1cnn(CC(C)C)c1)(C(F)F)CC2=O ZINC000587467225 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cnn(CC(C)C)c1)(C(F)F)CC2=O ZINC000587467229 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccc(F)c1)(c1nccn1C)CC2=O ZINC000587467258 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cccc(F)c1)(c1nccn1C)CC2=O ZINC000587467259 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OCC)(c1cc(F)cc(F)c1)CC2=O ZINC000587467262 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OCC)(c1cc(F)cc(F)c1)CC2=O ZINC000587467263 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)(c1ccccc1F)CC2=O ZINC000587467368 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)(c1ccccc1F)CC2=O ZINC000587467369 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](CC(C)(C)NC(=O)OC(C)(C)C)CC2=O ZINC000587467508 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](CC(C)(C)NC(=O)OC(C)(C)C)CC2=O ZINC000587467511 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CC(=O)NCCCc1ccccc1)CC2=O ZINC000587467543 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)NCCCc1ccccc1)CC2=O ZINC000587467545 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCC)(CNC(=O)OC(C)(C)C)CC2=O ZINC000587467587 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCC)(CNC(=O)OC(C)(C)C)CC2=O ZINC000587467592 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1cccc3ncoc13)CC2=O ZINC000587467641 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1cccc3ncoc13)CC2=O ZINC000587467657 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(N(C)C)nc3ccccc3c1O)CC2=O ZINC000587467701 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(N(C)C)nc3ccccc3c1O)CC2=O ZINC000587467705 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCN(Cc3cccc(F)c3)CC1)CC2=O ZINC000587467737 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccnc(Br)c1F)CC2=O ZINC000587467752 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccnc(Br)c1F)CC2=O ZINC000587467753 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](Cn1ccnc1)(c1cccc(F)c1)CC2=O ZINC000587467758 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](Cn1ccnc1)(c1cccc(F)c1)CC2=O ZINC000587467759 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(F)cccc1N1CCOCC1)CC2=O ZINC000587467836 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(F)cccc1N1CCOCC1)CC2=O ZINC000587467838 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(F)c(N3CCOCC3)c1)CC2=O ZINC000587467861 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(F)c(N3CCOCC3)c1)CC2=O ZINC000587467863 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C[C@@H](C)C(=O)O)(c1ccccc1F)CC2=O ZINC000587467945 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C[C@@H](C)C(=O)O)(c1ccccc1F)CC2=O ZINC000587467946 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C[C@H](C)C(=O)O)(c1ccccc1F)CC2=O ZINC000587467947 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C[C@H](C)C(=O)O)(c1ccccc1F)CC2=O ZINC000587467948 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2ccccc2C(=O)c2c(N)cccc21 ZINC000587468047 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2ccccc2C(=O)c2c(N)cccc21 ZINC000587468049 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cccc(NC(=O)CN=[N+]=[N-])c1)CC2=O ZINC000587468062 GI Annotated Clean CCCc1c(O)ccc2c1O[C@@](C)(c1cccc(NC(=O)CN=[N+]=[N-])c1)CC2=O ZINC000587468063 GI Annotated Clean CCCc1c(O)ccc2c1O[C@](/C=C\N(C)C)(c1cccc([N+](=O)[O-])c1)CC2=O ZINC000587468093 GI Annotated Bother CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1cccc([N+](=O)[O-])c1)CC2=O ZINC000587468095 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](/C=C\N(C)C)(c1cccc([N+](=O)[O-])c1)CC2=O ZINC000587468097 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1cccc([N+](=O)[O-])c1)CC2=O ZINC000587468098 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1cccc(OC)c1)CC2=O ZINC000587468150 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1cccc(OC)c1)CC2=O ZINC000587468152 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)(c1cccc(F)c1)CC2=O ZINC000587468488 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)(c1cccc(F)c1)CC2=O ZINC000587468491 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCC(=O)O)(c1ccc(F)cc1F)CC2=O ZINC000587468504 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCC(=O)O)(c1ccc(F)cc1F)CC2=O ZINC000587468506 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC1OCCO1)(c1cccc(F)c1)CC2=O ZINC000587468658 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC1OCCO1)(c1cccc(F)c1)CC2=O ZINC000587468665 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)CC2=O ZINC000587468819 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](C)(CCN(C)C(=O)OC(C)(C)C)CC2=O ZINC000587468823 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CCN(C)C(=O)OC(C)(C)C)CC2=O ZINC000587468826 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](C(C)(C)N(C)C(=O)OC(C)(C)C)CC2=O ZINC000587468828 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)CC2=O ZINC000587468829 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@H](C(C)(C)N(C)C(=O)OC(C)(C)C)CC2=O ZINC000587468833 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C\N(C)C)(c1ccc(OC)cc1)CC2=O ZINC000587468840 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C\N(C)C)(c1ccc(OC)cc1)CC2=O ZINC000587468841 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1ccc(OC)cc1)CC2=O ZINC000587468842 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1ccc(OC)cc1)CC2=O ZINC000587468844 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1ccc([N+](=O)[O-])cc1)CC2=O ZINC000587468984 GI Annotated Bother CCCc1c(O)ccc2c1OC1(CC2=O)CC(C)(NC(=O)OC(C)(C)C)C1 ZINC000587469051 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccc(F)cc1)(c1cccnc1N)CC2=O ZINC000587469148 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccc(F)cc1)(c1cccnc1N)CC2=O ZINC000587469149 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccc(F)c1)(c1cnn(C)c1)CC2=O ZINC000587469167 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cccc(F)c1)(c1cnn(C)c1)CC2=O ZINC000587469168 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C(C#N)=C/N(C)C)(c1ccc(C)cc1)CC2=O ZINC000587469180 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](/C(C#N)=C/N(C)C)(c1ccc(C)cc1)CC2=O ZINC000587469181 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CCC(=O)OC)(c1ccc(F)cc1)CC2=O ZINC000587469438 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCC(=O)OC)(c1ccc(F)cc1)CC2=O ZINC000587469439 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccccc1)(c1cc(C=O)n(C)c1)CC2=O ZINC000587469473 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccccc1)(c1cc(C=O)n(C)c1)CC2=O ZINC000587469474 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)Nc1ccccc1OC)CC2=O ZINC000587469496 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CC(=O)Nc1ccccc1OC)CC2=O ZINC000587469497 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cccc(OCCN(C)C)c1)CC2=O ZINC000587469569 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cccc(OCCN(C)C)c1)CC2=O ZINC000587469571 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccc(OCCCN(C)C)c1)CC2=O ZINC000587469572 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccc(OCCCN(C)C)c1)CC2=O ZINC000587469579 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(Br)c(F)n1)CC2=O ZINC000587469588 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(Br)c(F)n1)CC2=O ZINC000587469589 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](CCOc1ccc(C#N)cc1OC)CC2=O ZINC000587469605 GI Annotated Mild CCCc1c(O)ccc2c1O[C@H](CCOc1ccc(C#N)cc1OC)CC2=O ZINC000587469607 GI Annotated Mild CCCc1c(O)ccc2c1O[C@H](c1c(F)cncc1Br)CC2=O ZINC000587469635 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(F)cncc1Br)CC2=O ZINC000587469638 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccccc1OCCCN(C)C)CC2=O ZINC000587469700 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccccc1OCCCN(C)C)CC2=O ZINC000587469701 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(OCCN(C)C)cc1)CC2=O ZINC000587469774 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(OCCN(C)C)cc1)CC2=O ZINC000587469775 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccn1CCc1ccccn1)CC2=O ZINC000587469831 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccn1CCc1ccccn1)CC2=O ZINC000587469832 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)(c1cccc(C#N)c1)CC2=O ZINC000587469972 GI Annotated Mild CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)(c1cccc(C#N)c1)CC2=O ZINC000587469974 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](C)(CCCOc1ccccc1C(N)=O)CC2=O ZINC000587470076 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CCCOc1ccccc1C(N)=O)CC2=O ZINC000587470077 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CC(=O)Nc1ccc([N+](=O)[O-])cc1)CC2=O ZINC000587470117 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)Nc1ccc([N+](=O)[O-])cc1)CC2=O ZINC000587470119 GI Annotated Bother CCCc1c(O)ccc2c1O[C@H](c1nccn1-c1ccc(OC)cc1)CC2=O ZINC000587470215 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1nccn1-c1ccc(OC)cc1)CC2=O ZINC000587470218 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cc(F)nc(N3CCCC3)c1)CC2=O ZINC000587470244 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cc(F)nc(N3CCCC3)c1)CC2=O ZINC000587470245 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](/C(=C/N(C)C)c1ccc(OC)cc1)CC2=O ZINC000587470381 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](/C(=C/N(C)C)c1ccc(OC)cc1)CC2=O ZINC000587470384 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(-c3ccc(C(N)=O)cc3)o1)CC2=O ZINC000587470392 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(-c3ccc(C(N)=O)cc3)o1)CC2=O ZINC000587470394 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CC(=O)N[C@H](C)c1ccccc1)CC2=O ZINC000587470400 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)N[C@H](C)c1ccccc1)CC2=O ZINC000587470401 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)N[C@@H](C)c1ccccc1)CC2=O ZINC000587470402 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CC(=O)N[C@@H](C)c1ccccc1)CC2=O ZINC000587470403 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCC[C@H]1NC(=O)OC(C)(C)C)CC2=O ZINC000587470424 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCC[C@@H]1NC(=O)OC(C)(C)C)CC2=O ZINC000587470425 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCC[C@H]1NC(=O)OC(C)(C)C)CC2=O ZINC000587470426 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCC[C@@H]1NC(=O)OC(C)(C)C)CC2=O ZINC000587470427 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC[C@@H](NC(=O)OC(C)(C)C)C1)CC2=O ZINC000587470444 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC[C@@H](NC(=O)OC(C)(C)C)C1)CC2=O ZINC000587470445 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC[C@H](NC(=O)OC(C)(C)C)C1)CC2=O ZINC000587470446 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC[C@H](NC(=O)OC(C)(C)C)C1)CC2=O ZINC000587470447 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(-n3c(C)cnc3O)cc1)CC2=O ZINC000587470480 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(-n3c(C)cnc3O)cc1)CC2=O ZINC000587470485 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCc3cc(OC)c([N+](=O)[O-])cc31)CC2=O ZINC000587470496 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@]1(CCCc3cc(OC)c([N+](=O)[O-])cc31)CC2=O ZINC000587470499 GI Annotated Bother CCCc1c(O)ccc2c1O[C@]1(CC2=O)CN(C(=O)OC(C)(C)C)CC[C@H]1F ZINC000587470685 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)CN(C(=O)OC(C)(C)C)CC[C@@H]1F ZINC000587470691 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)CN(C(=O)OC(C)(C)C)CC[C@H]1F ZINC000587470692 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)CN(C(=O)OC(C)(C)C)CC[C@@H]1F ZINC000587470693 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCN(C(=O)OC(C)(C)C)C[C@H]1F)CC2=O ZINC000587470728 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCN(C(=O)OC(C)(C)C)C[C@@H]1F)CC2=O ZINC000587470729 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCN(C(=O)OC(C)(C)C)C[C@H]1F)CC2=O ZINC000587470730 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCN(C(=O)OC(C)(C)C)C[C@@H]1F)CC2=O ZINC000587470731 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cn(CC(=O)O)c3ccccc13)CC2=O ZINC000587470834 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cn(CC(=O)O)c3ccccc13)CC2=O ZINC000587470838 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccc(OCCn3ccnc3)c1)CC2=O ZINC000587470845 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccc(OCCn3ccnc3)c1)CC2=O ZINC000587470846 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1nc(-c3ccc([N+](=O)[O-])cc3)no1)CC2=O ZINC000587470878 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@H](c1nc(-c3ccc([N+](=O)[O-])cc3)no1)CC2=O ZINC000587470884 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)Nc1ccc(N(C)C)cc1)CC2=O ZINC000587471028 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CC(=O)Nc1ccc(N(C)C)cc1)CC2=O ZINC000587471030 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)NCc1ccc(C)cc1)CC2=O ZINC000587471073 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CC(=O)NCc1ccc(C)cc1)CC2=O ZINC000587471074 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C=C/N(C)C)(c1ccc3c(c1)OCO3)CC2=O ZINC000587471106 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1ccc3c(c1)OCO3)CC2=O ZINC000587471107 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCN(Cc3ccccc3)C[C@H]1F)CC2=O ZINC000587471138 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCN(Cc3ccccc3)C[C@H]1F)CC2=O ZINC000587471139 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCN(Cc3ccccc3)C[C@@H]1F)CC2=O ZINC000587471140 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCN(Cc3ccccc3)C[C@@H]1F)CC2=O ZINC000587471141 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(Br)ccnc1F)CC2=O ZINC000587471150 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(Br)ccnc1F)CC2=O ZINC000587471151 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c[nH]c3ccc(OC)c([N+](=O)[O-])c13)CC2=O ZINC000587471346 GI Annotated Bother CCCc1c(O)ccc2c1O[C@H](c1c[nH]c3ccc(OC)c([N+](=O)[O-])c13)CC2=O ZINC000587471350 GI Annotated Bother CCCc1c(O)ccc2c1O[C@](CNC(=O)OC(C)(C)C)(C1CCC1)CC2=O ZINC000587471358 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CNC(=O)OC(C)(C)C)(C1CCC1)CC2=O ZINC000587471359 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)Nc1ccc(OC)cc1)CC2=O ZINC000587471372 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CC(=O)Nc1ccc(OC)cc1)CC2=O ZINC000587471373 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(C[C@@H](C)NC(=O)OC(C)(C)C)CC2=O ZINC000587471386 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(C[C@@H](C)NC(=O)OC(C)(C)C)CC2=O ZINC000587471387 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(C[C@H](C)NC(=O)OC(C)(C)C)CC2=O ZINC000587471388 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(C[C@H](C)NC(=O)OC(C)(C)C)CC2=O ZINC000587471389 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccn1-c1ccc(OC)nc1)CC2=O ZINC000587471458 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccn1-c1ccc(OC)nc1)CC2=O ZINC000587471459 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccccc1)(c1nccn1CC)CC2=O ZINC000587471488 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccccc1)(c1nccn1CC)CC2=O ZINC000587471489 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccn1CCc1ccncc1)CC2=O ZINC000587471513 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccn1CCc1ccncc1)CC2=O ZINC000587471514 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(C(=O)O)n(C)c3ccccc13)CC2=O ZINC000587471529 GI Annotated Clean CCCc1c(O)ccc2c1O[C@H](c1c(C(=O)O)n(C)c3ccccc13)CC2=O ZINC000587471530 GI Annotated Clean CCCc1c(O)ccc2c1O[C@](Cc1nccn1C)(c1ccccc1)CC2=O ZINC000587471533 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](Cc1nccn1C)(c1ccccc1)CC2=O ZINC000587471534 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H]([C@H](CNC(=O)OC(C)(C)C)C(C)C)CC2=O ZINC000587471602 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H]([C@@H](CNC(=O)OC(C)(C)C)C(C)C)CC2=O ZINC000587471603 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H]([C@@H](CNC(=O)OC(C)(C)C)C(C)C)CC2=O ZINC000587471605 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H]([C@H](CNC(=O)OC(C)(C)C)C(C)C)CC2=O ZINC000587471607 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(Br)cnc1F)CC2=O ZINC000587471624 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(Br)cnc1F)CC2=O ZINC000587471626 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(Br)ncc1F)CC2=O ZINC000587471646 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(Br)ncc1F)CC2=O ZINC000587471647 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(C(=O)OC)n(C)c3ccccc13)CC2=O ZINC000587471795 GI Annotated Clean CCCc1c(O)ccc2c1O[C@@H](c1c(C(=O)OC)n(C)c3ccccc13)CC2=O ZINC000587471796 GI Annotated Clean CCCc1c(O)ccc2c1O[C@H](c1ccc3c([N+](=O)[O-])ccc(O)c3n1)CC2=O ZINC000587471803 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@H](c1ccc3c([N+](=O)[O-])ccc(O)c3n1)CC2=O ZINC000587471804 GI Annotated Bother CCCc1c(O)ccc2c1O[C@H](c1ccc(OCc3nccn3C)cc1)CC2=O ZINC000587471807 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(OCc3nccn3C)cc1)CC2=O ZINC000587471808 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccc(C)cc1)(c1nccn1C)CC2=O ZINC000587471827 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccc(C)cc1)(c1nccn1C)CC2=O ZINC000587471828 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(OC)c(NC(C)=O)c1)CC2=O ZINC000587471857 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(OC)c(NC(C)=O)c1)CC2=O ZINC000587471858 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c[nH]ccc1=NC(=O)OC(C)(C)C)CC2=O ZINC000587471869 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c[nH]ccc1=NC(=O)OC(C)(C)C)CC2=O ZINC000587471870 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCC[C@H]1CNC(=O)OC(C)(C)C)CC2=O ZINC000587471873 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCC[C@@H]1CNC(=O)OC(C)(C)C)CC2=O ZINC000587471874 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCC[C@@H]1CNC(=O)OC(C)(C)C)CC2=O ZINC000587471875 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCC[C@H]1CNC(=O)OC(C)(C)C)CC2=O ZINC000587471876 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCN(c3ccc([N+](=O)[O-])cc3)CC1)CC2=O ZINC000587472044 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@]1(CCc3ccc(OC)c([N+](=O)[O-])c31)CC2=O ZINC000587472060 GI Annotated Bother CCCc1c(O)ccc2c1O[C@]1(CCc3ccc(OC)c([N+](=O)[O-])c31)CC2=O ZINC000587472061 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(N3CCCC3)nc1F)CC2=O ZINC000587472066 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(N3CCCC3)nc1F)CC2=O ZINC000587472067 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccn1-c1nc(C)cc(C)n1)CC2=O ZINC000587472092 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccn1-c1nc(C)cc(C)n1)CC2=O ZINC000587472093 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cccnc1NC(=O)C(C)(C)C)CC2=O ZINC000587472194 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cccnc1NC(=O)C(C)(C)C)CC2=O ZINC000587472195 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(NC(C)=O)cc1OC)CC2=O ZINC000587472215 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(NC(C)=O)cc1OC)CC2=O ZINC000587472216 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1coc3ccc([N+](=O)[O-])cc3c1=O)CC2=O ZINC000587472239 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@H](c1coc3ccc([N+](=O)[O-])cc3c1=O)CC2=O ZINC000587472240 GI Annotated Bother CCCc1c(O)ccc2c1O[C@](CNC(C)C)(c1ccccc1OC)CC2=O ZINC000587472289 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CNC(C)C)(c1ccccc1OC)CC2=O ZINC000587472290 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C/N(C)C)(c1ccc([N+](=O)[O-])cc1)CC2=O ZINC000587472295 GI Annotated Bother CCCc1c(O)ccc2c1O[C@](/C=C\N(C)C)(c1ccc([N+](=O)[O-])cc1)CC2=O ZINC000587472296 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](/C=C\N(C)C)(c1ccc([N+](=O)[O-])cc1)CC2=O ZINC000587472297 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](C)(c1nnn(-c3ccc(F)cc3)c1C)CC2=O ZINC000587472396 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1nnn(-c3ccc(F)cc3)c1C)CC2=O ZINC000587472397 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2ccccc2C(=O)c2ccc(N)cc21 ZINC000587472541 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2ccccc2C(=O)c2ccc(N)cc21 ZINC000587472542 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CC(=O)Nc1cccc([N+](=O)[O-])c1)CC2=O ZINC000587472543 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](C)(CC(=O)Nc1cccc([N+](=O)[O-])c1)CC2=O ZINC000587472544 GI Annotated Bother CCCc1c(O)ccc2c1OC(c1ccc(N)cc1)(c1ccc(N)cc1)CC2=O ZINC000587472571 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCN(C(C)=O)Cc3cc(F)ccc31)CC2=O ZINC000587472593 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCN(C(C)=O)Cc3cc(F)ccc31)CC2=O ZINC000587472594 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(C(=O)O)[nH]c3ccc(F)cc13)CC2=O ZINC000587472642 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(C(=O)O)[nH]c3ccc(F)cc13)CC2=O ZINC000587472643 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2ccccc2C(=O)c2cccc(N)c21 ZINC000587472778 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2ccccc2C(=O)c2cccc(N)c21 ZINC000587472779 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cc(C)cc([N+](=O)[O-])c1OC)CC2=O ZINC000587472925 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](C)(c1cc(C)cc([N+](=O)[O-])c1OC)CC2=O ZINC000587472926 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](c1ccccc1)(c1ccc(N)c(N)c1)CC2=O ZINC000587472963 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccccc1)(c1ccc(N)c(N)c1)CC2=O ZINC000587472964 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1c(C)[nH]c3ccccc3c1=N)CC2=O ZINC000587472965 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1c(C)[nH]c3ccccc3c1=N)CC2=O ZINC000587472966 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(OCC)c(O)c([N+](=O)[O-])c1)CC2=O ZINC000587473094 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@H](c1cc(OCC)c(O)c([N+](=O)[O-])c1)CC2=O ZINC000587473095 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](CN)(c1ccc([C@@H](C)OCC)cc1)CC2=O ZINC000587473212 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CN)(c1ccc([C@@H](C)OCC)cc1)CC2=O ZINC000587473213 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CN)(c1ccc([C@H](C)OCC)cc1)CC2=O ZINC000587473215 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CN)(c1ccc([C@H](C)OCC)cc1)CC2=O ZINC000587473217 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCOc3c([N+](=O)[O-])cc(F)cc31)CC2=O ZINC000587473277 GI Annotated Bother CCCc1c(O)ccc2c1O[C@]1(CCOc3c([N+](=O)[O-])cc(F)cc31)CC2=O ZINC000587473278 GI Annotated Bother CCCc1c(O)ccc2c1O[C@@](C)(Cc1ccc(OC)cc1[N+](=O)[O-])CC2=O ZINC000587473399 GI Annotated Bother CCCc1c(O)ccc2c1O[C@](C)(Cc1ccc(OC)cc1[N+](=O)[O-])CC2=O ZINC000587473400 GI Annotated Bother CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2ccccc2C(=O)c2cc(N)ccc21 ZINC000587473448 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2ccccc2C(=O)c2cc(N)ccc21 ZINC000587473449 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCC)(c1cc3c(cc1N)OCCO3)CC2=O ZINC000587473568 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCC)(c1cc3c(cc1N)OCCO3)CC2=O ZINC000587473569 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cccc(N3CCCC3=O)c1)CC2=O ZINC000587473619 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cccc(N3CCCC3=O)c1)CC2=O ZINC000587473620 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587473674 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587473676 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(N3CCOCC3)cc1)CC2=O ZINC000587473773 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(N3CCOCC3)cc1)CC2=O ZINC000587473774 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](C1CCN(c3cccc(C)n3)CC1)CC2=O ZINC000587473878 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](C1CCN(c3cccc(C)n3)CC1)CC2=O ZINC000587473879 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(Cn3cncn3)c(C)cc1C)CC2=O ZINC000587473926 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(Cn3cncn3)c(C)cc1C)CC2=O ZINC000587473928 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cnc(N3CCCCC3)nc1C)CC2=O ZINC000587473950 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cnc(N3CCCCC3)nc1C)CC2=O ZINC000587473952 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCN(c3ccc(C#N)cc3)CC1)CC2=O ZINC000587473967 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](C)([C@H]1CCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587474018 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@@H]1CCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587474020 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)([C@@H]1CCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587474022 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@H]1CCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587474023 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(N3CCC(O)CC3)cc1)CC2=O ZINC000587474144 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(N3CCC(O)CC3)cc1)CC2=O ZINC000587474146 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cn(CCC(=O)O)c3ccccc13)CC2=O ZINC000587474153 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cn(CCC(=O)O)c3ccccc13)CC2=O ZINC000587474154 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(N3CCOCC3)cc1C)CC2=O ZINC000587474193 GI Annotated Clean CCCc1c(O)ccc2c1O[C@H](c1ccc(N3CCOCC3)cc1C)CC2=O ZINC000587474200 GI Annotated Clean CCCc1c(O)ccc2c1O[C@]1(CCCc3nn(-c4ccccc4)nc31)CC2=O ZINC000587474319 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCc3nn(-c4ccccc4)nc31)CC2=O ZINC000587474321 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCN(c3ccc(OC)cc3)CC1)CC2=O ZINC000587474333 GI Annotated Clean CCCc1c(O)ccc2c1O[C@@](C)(c1cnn(Cc3ccccc3)c1)CC2=O ZINC000587474366 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cnn(Cc3ccccc3)c1)CC2=O ZINC000587474367 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCN(C(=O)OC(C)(C)C)[C@@H](C)C1)CC2=O ZINC000587474510 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCN(C(=O)OC(C)(C)C)[C@H](C)C1)CC2=O ZINC000587474513 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCN(C(=O)OC(C)(C)C)[C@H](C)C1)CC2=O ZINC000587474516 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCN(C(=O)OC(C)(C)C)[C@@H](C)C1)CC2=O ZINC000587474518 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCN(Cc3cccc(OC)c3)CC1)CC2=O ZINC000587474519 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCN(Cc3ccc(C#N)cc3)CC1)CC2=O ZINC000587474530 GI Annotated Mild CCCc1c(O)ccc2c1O[C@@](C)(c1nnn(-c3ccc(C)cc3)c1C)CC2=O ZINC000587474538 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1nnn(-c3ccc(C)cc3)c1C)CC2=O ZINC000587474540 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccccc1N1CCN(CC)CC1)CC2=O ZINC000587474612 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccccc1N1CCN(CC)CC1)CC2=O ZINC000587474613 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587474638 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587474639 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cnn(-c3cccc(OC)c3)c1)CC2=O ZINC000587474670 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cnn(-c3cccc(OC)c3)c1)CC2=O ZINC000587474671 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(C)nn(-c3ccccc3)c1N)CC2=O ZINC000587474712 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(C)nn(-c3ccccc3)c1N)CC2=O ZINC000587474713 GI Annotated Anodyne C=CN1CC[C@H]([C@@]2(c3ccccc3)CC(=O)c3ccc(O)c(CCC)c3O2)C1=O ZINC000587474740 GI Annotated Anodyne C=CN1CC[C@@H]([C@@]2(c3ccccc3)CC(=O)c3ccc(O)c(CCC)c3O2)C1=O ZINC000587474742 GI Annotated Anodyne C=CN1CC[C@@H]([C@]2(c3ccccc3)CC(=O)c3ccc(O)c(CCC)c3O2)C1=O ZINC000587474743 GI Annotated Anodyne C=CN1CC[C@H]([C@]2(c3ccccc3)CC(=O)c3ccc(O)c(CCC)c3O2)C1=O ZINC000587474745 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C[C@@H](C)N(C(=O)OC(C)(C)C)C1 ZINC000587474804 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C[C@@H](C)N(C(=O)OC(C)(C)C)C1 ZINC000587474806 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C[C@H](C)N(C(=O)OC(C)(C)C)C1 ZINC000587474809 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C[C@H](C)N(C(=O)OC(C)(C)C)C1 ZINC000587474810 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(N3CCOC3=O)cc1)CC2=O ZINC000587474914 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(N3CCOC3=O)cc1)CC2=O ZINC000587474915 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(C)nn(-c3ccccn3)c1C)CC2=O ZINC000587475010 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(C)nn(-c3ccccn3)c1C)CC2=O ZINC000587475011 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cnn(-c3ccc(OC)cc3)c1)CC2=O ZINC000587475050 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cnn(-c3ccc(OC)cc3)c1)CC2=O ZINC000587475051 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc3c(c1)CCN3C(C)=O)CC2=O ZINC000587475088 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc3c(c1)CCN3C(C)=O)CC2=O ZINC000587475090 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(OC)ccc1-n1cccn1)CC2=O ZINC000587475110 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(OC)ccc1-n1cccn1)CC2=O ZINC000587475112 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccccc1N1CCOC1=O)CC2=O ZINC000587475119 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccccc1N1CCOC1=O)CC2=O ZINC000587475120 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1nnn(-c3ccccc3)c1C)CC2=O ZINC000587475201 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1nnn(-c3ccccc3)c1C)CC2=O ZINC000587475202 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cn(CC(=O)O)c3ccccc13)CC2=O ZINC000587475286 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cn(CC(=O)O)c3ccccc13)CC2=O ZINC000587475287 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)CN(C(=O)OC(C)(C)C)CC[C@@H]1C ZINC000587475394 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)CN(C(=O)OC(C)(C)C)CC[C@H]1C ZINC000587475396 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)CN(C(=O)OC(C)(C)C)CC[C@H]1C ZINC000587475399 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)CN(C(=O)OC(C)(C)C)CC[C@@H]1C ZINC000587475401 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1nnn(Cc3ccccc3)c1C)CC2=O ZINC000587475426 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1nnn(Cc3ccccc3)c1C)CC2=O ZINC000587475427 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cccc(N3CCOC3=O)c1)CC2=O ZINC000587475478 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cccc(N3CCOC3=O)c1)CC2=O ZINC000587475479 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCN(c3nc4ccccc4o3)CC1)CC2=O ZINC000587475496 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCC(=O)N(Cc3ccccc3)CC1)CC2=O ZINC000587475565 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCC(=O)N(Cc3ccccc3)CC1)CC2=O ZINC000587475566 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccc(OC)c1)([C@H](C)C(=O)OC)CC2=O ZINC000587475611 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cccc(OC)c1)([C@@H](C)C(=O)OC)CC2=O ZINC000587475612 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccc(OC)c1)([C@@H](C)C(=O)OC)CC2=O ZINC000587475613 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cccc(OC)c1)([C@H](C)C(=O)OC)CC2=O ZINC000587475614 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cnn(-c3cc(C)cc(C)c3)n1)CC2=O ZINC000587475642 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cnn(-c3cc(C)cc(C)c3)n1)CC2=O ZINC000587475643 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)(c1ccccc1OC)CC2=O ZINC000587475693 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)(c1ccccc1OC)CC2=O ZINC000587475695 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC)(CC(=O)Oc1cccc(OC)c1)CC2=O ZINC000587475702 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC)(CC(=O)Oc1cccc(OC)c1)CC2=O ZINC000587475704 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cnn(-c3ccccc3OC)c1)CC2=O ZINC000587475724 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cnn(-c3ccccc3OC)c1)CC2=O ZINC000587475725 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(N3CCCC3)nc1OC)CC2=O ZINC000587475882 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(N3CCCC3)nc1OC)CC2=O ZINC000587475885 GI Annotated Anodyne C=CN1CCCC[C@H]([C@]2(C3CC3)CC(=O)c3ccc(O)c(CCC)c3O2)C1=O ZINC000587475887 GI Annotated Anodyne C=CN1CCCC[C@@H]([C@@]2(C3CC3)CC(=O)c3ccc(O)c(CCC)c3O2)C1=O ZINC000587475889 GI Annotated Anodyne C=CN1CCCC[C@H]([C@@]2(C3CC3)CC(=O)c3ccc(O)c(CCC)c3O2)C1=O ZINC000587475891 GI Annotated Anodyne C=CN1CCCC[C@@H]([C@]2(C3CC3)CC(=O)c3ccc(O)c(CCC)c3O2)C1=O ZINC000587475893 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cccc(N3CCOCC3)c1)CC2=O ZINC000587475903 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cccc(N3CCOCC3)c1)CC2=O ZINC000587475906 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCC13CN(C(=O)OC(C)(C)C)C3)CC2=O ZINC000587475932 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCC13CN(C(=O)OC(C)(C)C)C3)CC2=O ZINC000587475934 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cc(N3CCCC3)ccc1N)CC2=O ZINC000587475938 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cc(N3CCCC3)ccc1N)CC2=O ZINC000587475941 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(C)nn(C)c1Oc1cccnc1)CC2=O ZINC000587476123 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(C)nn(C)c1Oc1cccnc1)CC2=O ZINC000587476124 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(OC)c(OC(C)=O)c1)CC2=O ZINC000587476157 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(OC)c(OC(C)=O)c1)CC2=O ZINC000587476159 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cn(CC(=O)OC)c3ccccc13)CC2=O ZINC000587476220 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cn(CC(=O)OC)c3ccccc13)CC2=O ZINC000587476221 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(OCC)c(C(=O)OC)c1)CC2=O ZINC000587476280 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(OCC)c(C(=O)OC)c1)CC2=O ZINC000587476281 GI Annotated Anodyne C#CCOc1ccc([C@@H]2CC(=O)c3ccc(O)c(CCC)c3O2)cc1OCC ZINC000587476284 GI Annotated Mild C#CCOc1ccc([C@H]2CC(=O)c3ccc(O)c(CCC)c3O2)cc1OCC ZINC000587476285 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](C)([C@@H]1CCCN1C(=O)OC(C)(C)C)CC2=O ZINC000587476356 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)([C@H]1CCCN1C(=O)OC(C)(C)C)CC2=O ZINC000587476358 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@@H]1CCCN1C(=O)OC(C)(C)C)CC2=O ZINC000587476360 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@H]1CCCN1C(=O)OC(C)(C)C)CC2=O ZINC000587476361 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC[C@@H](C(=O)OC)c3ccccc31)CC2=O ZINC000587476389 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC[C@@H](C(=O)OC)c3ccccc31)CC2=O ZINC000587476395 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC[C@H](C(=O)OC)c3ccccc31)CC2=O ZINC000587476398 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC[C@H](C(=O)OC)c3ccccc31)CC2=O ZINC000587476401 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(N3CCC(CO)CC3)cc1)CC2=O ZINC000587476494 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(N3CCC(CO)CC3)cc1)CC2=O ZINC000587476498 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCN(c3ccc(N(C)C)cc3)CC1)CC2=O ZINC000587476517 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCN(c3ccc(C(=O)O)cc3)CC1)CC2=O ZINC000587476546 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](Cc1cc3ccccc3o1)(C(=O)O)CC2=O ZINC000587476615 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](Cc1cc3ccccc3o1)(C(=O)O)CC2=O ZINC000587476617 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(N3CCCC3)nc1OC)CC2=O ZINC000587476622 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(N3CCCC3)nc1OC)CC2=O ZINC000587476624 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(OC)c(OC)c1OC)CC2=O ZINC000587476866 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(OC)c(OC)c1OC)CC2=O ZINC000587476867 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CC2=O)[C@H]2CC3C[C@H]1CC(OC(C)=O)(C3)C2 ZINC000587476986 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(OC(C)=O)c(OC)c1)CC2=O ZINC000587477011 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(OC(C)=O)c(OC)c1)CC2=O ZINC000587477013 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cn(C)c3cccc(C(=O)OC)c13)CC2=O ZINC000587477101 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cn(C)c3cccc(C(=O)OC)c13)CC2=O ZINC000587477103 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cn(C)nc1-c1ccccc1OC)CC2=O ZINC000587477108 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cn(C)nc1-c1ccccc1OC)CC2=O ZINC000587477109 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2ccccc2CC[C@@]1(C)C(=O)OC ZINC000587477118 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2ccccc2CC[C@]1(C)C(=O)OC ZINC000587477119 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2ccccc2CC[C@]1(C)C(=O)OC ZINC000587477120 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2ccccc2CC[C@@]1(C)C(=O)OC ZINC000587477121 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)[C@H]2C[C@H]3C[C@@H]1C[C@@](C(=O)OC)(C3)C2 ZINC000587477144 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)[C@H]2C[C@H]3C[C@@H]1C[C@@](C(=O)OC)(C3)C2 ZINC000587477145 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CC2=O)CC2(CN(C(=O)OC(C)(C)C)C2)C1 ZINC000587477235 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(C=O)cc3c1N(C)CCC3)CC2=O ZINC000587477288 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(C=O)cc3c1N(C)CCC3)CC2=O ZINC000587477290 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(N3CCCC3=O)cc1)CC2=O ZINC000587477363 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(N3CCCC3=O)cc1)CC2=O ZINC000587477367 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCN(C(=O)OC(C)(C)C)[C@H]1C)CC2=O ZINC000587477389 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCN(C(=O)OC(C)(C)C)[C@@H]1C)CC2=O ZINC000587477393 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCN(C(=O)OC(C)(C)C)[C@@H]1C)CC2=O ZINC000587477396 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCN(C(=O)OC(C)(C)C)[C@H]1C)CC2=O ZINC000587477401 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCN(C(=O)OC(C)(C)C)C1(C)C)CC2=O ZINC000587477449 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCN(C(=O)OC(C)(C)C)C1(C)C)CC2=O ZINC000587477451 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccccc1)([C@H](C)C(=O)OCC)CC2=O ZINC000587477483 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccccc1)([C@H](C)C(=O)OCC)CC2=O ZINC000587477493 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccccc1)([C@@H](C)C(=O)OCC)CC2=O ZINC000587477496 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccccc1)([C@@H](C)C(=O)OCC)CC2=O ZINC000587477501 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](CCc1cccc(CC(=O)OCC)c1)CC2=O ZINC000587477638 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](CCc1cccc(CC(=O)OCC)c1)CC2=O ZINC000587477639 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cc(OC)c(OC)c(OC)c1)CC2=O ZINC000587477708 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cc(OC)c(OC)c(OC)c1)CC2=O ZINC000587477709 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cn(C)nc1-c1ccc(C#N)cc1)CC2=O ZINC000587477832 GI Annotated Mild CCCc1c(O)ccc2c1O[C@@H](c1cn(C)nc1-c1ccc(C#N)cc1)CC2=O ZINC000587477839 GI Annotated Mild CCCc1c(O)ccc2c1O[C@H](c1c(C)nn(-c3ccccc3)c1O)CC2=O ZINC000587477912 GI Annotated Clean CCCc1c(O)ccc2c1O[C@@H](c1c(C)nn(-c3ccccc3)c1O)CC2=O ZINC000587477913 GI Annotated Clean CCCc1c(O)ccc2c1O[C@@](C)(c1cnn(-c3ccc(OC)cc3)c1)CC2=O ZINC000587477914 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cnn(-c3ccc(OC)cc3)c1)CC2=O ZINC000587477915 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cnn(-c3ccccn3)c1C)CC2=O ZINC000587477930 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cnn(-c3ccccn3)c1C)CC2=O ZINC000587477931 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCN(c3ccc4c(c3)OCO4)CC1)CC2=O ZINC000587478003 GI Annotated Clean CCCc1c(O)ccc2c1O[C@@]1(CCCN(C(=O)OC(C)(C)C)CC1)CC2=O ZINC000587478023 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCN(C(=O)OC(C)(C)C)CC1)CC2=O ZINC000587478025 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc(C)nc(N3CCCCC3)n1)CC2=O ZINC000587478093 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc(C)nc(N3CCCCC3)n1)CC2=O ZINC000587478094 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](C(=O)c1ccc(OCC)c(OCC)c1)CC2=O ZINC000587478322 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](C(=O)c1ccc(OCC)c(OCC)c1)CC2=O ZINC000587478327 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H]([C@H]1CCCCN1C(=O)OC(C)(C)C)CC2=O ZINC000587478472 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H]([C@@H]1CCCCN1C(=O)OC(C)(C)C)CC2=O ZINC000587478475 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H]([C@@H]1CCCCN1C(=O)OC(C)(C)C)CC2=O ZINC000587478479 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H]([C@H]1CCCCN1C(=O)OC(C)(C)C)CC2=O ZINC000587478483 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(OCC(=O)OCC)cc1)CC2=O ZINC000587478605 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(OCC(=O)OCC)cc1)CC2=O ZINC000587478610 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2cc(C(=O)O)ccc2OC1(C)C ZINC000587478672 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2cc(C(=O)O)ccc2OC1(C)C ZINC000587478674 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCN(C(=O)OC(C)(C)C)C[C@@H]1C)CC2=O ZINC000587478823 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCN(C(=O)OC(C)(C)C)C[C@H]1C)CC2=O ZINC000587478825 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCN(C(=O)OC(C)(C)C)C[C@H]1C)CC2=O ZINC000587478829 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCN(C(=O)OC(C)(C)C)C[C@@H]1C)CC2=O ZINC000587478831 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)(c1ccc(C)cc1)CC2=O ZINC000587478852 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)(c1ccc(C)cc1)CC2=O ZINC000587478854 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(OC(=O)CC)c(OC)c1)CC2=O ZINC000587478918 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(OC(=O)CC)c(OC)c1)CC2=O ZINC000587478920 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cc(C(C)=O)c(OC)cc1OC)CC2=O ZINC000587479028 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cc(C(C)=O)c(OC)cc1OC)CC2=O ZINC000587479030 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1c(OC)cc(OC)cc1OC)CC2=O ZINC000587479045 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1c(OC)cc(OC)cc1OC)CC2=O ZINC000587479047 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCC(=O)O)(c1ccc(OC)cc1C)CC2=O ZINC000587479057 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCC(=O)O)(c1ccc(OC)cc1C)CC2=O ZINC000587479064 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC[C@H]3CN(C(C)=O)c4cccc1c43)CC2=O ZINC000587479111 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC[C@@H]3CN(C(C)=O)c4cccc1c43)CC2=O ZINC000587479115 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC[C@H]3CN(C(C)=O)c4cccc1c43)CC2=O ZINC000587479118 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC[C@@H]3CN(C(C)=O)c4cccc1c43)CC2=O ZINC000587479122 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](Cc1ccccc1)([C@H](C)C(=O)OC)CC2=O ZINC000587479158 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](Cc1ccccc1)([C@H](C)C(=O)OC)CC2=O ZINC000587479159 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](Cc1ccccc1)([C@@H](C)C(=O)OC)CC2=O ZINC000587479160 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](Cc1ccccc1)([C@@H](C)C(=O)OC)CC2=O ZINC000587479161 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OCC)(c1ccc(OCC)cc1)CC2=O ZINC000587479202 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OCC)(c1ccc(OCC)cc1)CC2=O ZINC000587479203 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c[nH]nc1-c1ccc(OC)cc1)CC2=O ZINC000587479372 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c[nH]nc1-c1ccc(OC)cc1)CC2=O ZINC000587479374 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cn(CCN)c3ccccc13)CC2=O ZINC000587479446 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cn(CCN)c3ccccc13)CC2=O ZINC000587479450 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cnn(-c3ccccc3OC)c1)CC2=O ZINC000587479555 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cnn(-c3ccccc3OC)c1)CC2=O ZINC000587479558 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](COc1ccc(C(=O)O)cc1)(C1CC1)CC2=O ZINC000587479583 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](COc1ccc(C(=O)O)cc1)(C1CC1)CC2=O ZINC000587479587 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(OCCC(=O)O)cc1)CC2=O ZINC000587479667 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(OCCC(=O)O)cc1)CC2=O ZINC000587479670 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CCN(C(=O)OC(C)(C)C)CC1)CC2=O ZINC000587479719 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCN(c3ccc(OCC)cc3)C1)CC2=O ZINC000587479743 GI Annotated Clean CCCc1c(O)ccc2c1O[C@@]1(CCN(c3ccc(OCC)cc3)C1)CC2=O ZINC000587479748 GI Annotated Clean CCCc1c(O)ccc2c1O[C@@](C)(c1c[nH]c3ccc(C(=O)OC)cc13)CC2=O ZINC000587479895 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1c[nH]c3ccc(C(=O)OC)cc13)CC2=O ZINC000587479898 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C=O)(c1ccc(OCC)c(OCC)c1)CC2=O ZINC000587479976 GI Annotated Mild CCCc1c(O)ccc2c1O[C@@](C=O)(c1ccc(OCC)c(OCC)c1)CC2=O ZINC000587479980 GI Annotated Mild CCCc1c(O)ccc2c1O[C@H]([C@@]1(C)CCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587479981 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H]([C@@]1(C)CCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587479988 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H]([C@]1(C)CCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587479992 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H]([C@]1(C)CCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587479997 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H]([C@H]1CCCN1C(=O)OC(C)(C)C)CC2=O ZINC000587480001 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H]([C@@H]1CCCN1C(=O)OC(C)(C)C)CC2=O ZINC000587480006 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H]([C@H]1CCCN1C(=O)OC(C)(C)C)CC2=O ZINC000587480010 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H]([C@@H]1CCCN1C(=O)OC(C)(C)C)CC2=O ZINC000587480013 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C[C@H](OCC)[C@@H]1Oc1ccccc1 ZINC000587480022 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OCC)(c1c[nH]c3ccccc13)CC2=O ZINC000587480029 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C[C@@H](OCC)[C@@H]1Oc1ccccc1 ZINC000587480031 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OCC)(c1c[nH]c3ccccc13)CC2=O ZINC000587480033 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C[C@H](OCC)[C@H]1Oc1ccccc1 ZINC000587480038 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C[C@@H](OCC)[C@H]1Oc1ccccc1 ZINC000587480044 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(C(=O)OC)[nH]c3ccccc13)CC2=O ZINC000587480144 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(C(=O)OC)[nH]c3ccccc13)CC2=O ZINC000587480146 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cccc(OCC(=O)OCC)c1)CC2=O ZINC000587480447 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cccc(OCC(=O)OCC)c1)CC2=O ZINC000587480449 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OCC)(c1cc(C)cc(C)c1)CC2=O ZINC000587480517 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OCC)(c1cc(C)cc(C)c1)CC2=O ZINC000587480519 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)([C@@H](Cc1ccccc1)C(=O)OCC)CC2=O ZINC000587480524 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)([C@H](Cc1ccccc1)C(=O)OCC)CC2=O ZINC000587480527 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@H](Cc1ccccc1)C(=O)OCC)CC2=O ZINC000587480528 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@@H](Cc1ccccc1)C(=O)OCC)CC2=O ZINC000587480534 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H]([C@H](Cc1ccccc1)C(=O)OCC)CC2=O ZINC000587480563 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H]([C@@H](Cc1ccccc1)C(=O)OCC)CC2=O ZINC000587480564 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H]([C@H](Cc1ccccc1)C(=O)OCC)CC2=O ZINC000587480565 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2ccc(C(C)(C)C)cc21 ZINC000587480569 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2ccc(C(C)(C)C)cc21 ZINC000587480571 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2c(C(C)(C)C)cccc21 ZINC000587480670 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2c(C(C)(C)C)cccc21 ZINC000587480673 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(OC)c(Cn3cccn3)c1)CC2=O ZINC000587480960 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(OC)c(Cn3cccn3)c1)CC2=O ZINC000587480964 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(N3C[C@H](C)O[C@@H](C)C3)nc1)CC2=O ZINC000587480987 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(N3C[C@H](C)O[C@H](C)C3)nc1)CC2=O ZINC000587480989 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(N3C[C@@H](C)O[C@H](C)C3)nc1)CC2=O ZINC000587480991 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(N3C[C@H](C)O[C@H](C)C3)nc1)CC2=O ZINC000587480993 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCOc3cc(OC)cc(OC)c31)CC2=O ZINC000587481098 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCOc3cc(OC)cc(OC)c31)CC2=O ZINC000587481102 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)(c1cccc(OC)c1)CC2=O ZINC000587481133 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)(c1cccc(OC)c1)CC2=O ZINC000587481136 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(C=C(C(=O)OCC)Oc3ccccc31)CC2=O ZINC000587481263 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(C=C(C(=O)OCC)Oc3ccccc31)CC2=O ZINC000587481264 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(Cl)cccc1S(C)(=O)=O)CC2=O ZINC000587481320 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(Cl)cccc1S(C)(=O)=O)CC2=O ZINC000587481322 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H]([C@@H](Cc1ccccc1)C(=O)OCC)CC2=O ZINC000587481337 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCc1ccccc1)(C(=O)OCC)CC2=O ZINC000587481342 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCc1ccccc1)(C(=O)OCC)CC2=O ZINC000587481343 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CCc1ccc(OCC(=O)O)cc1)CC2=O ZINC000587481418 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CCc1ccc(OCC(=O)O)cc1)CC2=O ZINC000587481420 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)(Cc1ccccc1)CC2=O ZINC000587481477 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)(Cc1ccccc1)CC2=O ZINC000587481478 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)(c1cccc(C)c1)CC2=O ZINC000587481537 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)(c1cccc(C)c1)CC2=O ZINC000587481538 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)O)(c1c(C)[nH]c3ccccc13)CC2=O ZINC000587481751 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)O)(c1c(C)[nH]c3ccccc13)CC2=O ZINC000587481753 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c[nH]nc1-c1cccc(OC)c1)CC2=O ZINC000587481902 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c[nH]nc1-c1cccc(OC)c1)CC2=O ZINC000587481905 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCn1cncn1)(c1ccc(C)cc1)CC2=O ZINC000587481935 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCn1cncn1)(c1ccc(C)cc1)CC2=O ZINC000587481942 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)(c1ccc(OC)cc1)CC2=O ZINC000587481976 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)(c1ccc(OC)cc1)CC2=O ZINC000587481979 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC#N)(c1ccc(-n3cccn3)cc1)CC2=O ZINC000587481980 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](CC#N)(c1ccc(-n3cccn3)cc1)CC2=O ZINC000587481984 GI Annotated Mild CCCc1c(O)ccc2c1O[C@]1(CCCc3c1cnn3-c1ccccn1)CC2=O ZINC000587481998 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCc3c1cnn3-c1ccccn1)CC2=O ZINC000587482000 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccnn1-c1ccccc1OC)CC2=O ZINC000587482004 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccnn1-c1ccccc1OC)CC2=O ZINC000587482005 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(C=C(C)N(Cc3ccccc3)C(=O)C1)CC2=O ZINC000587482054 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(C=C(C)N(Cc3ccccc3)C(=O)C1)CC2=O ZINC000587482056 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H]([C@@H]1CCCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587482129 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H]([C@H]1CCCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587482131 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H]([C@@H]1CCCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587482132 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H]([C@H]1CCCN(C(=O)OC(C)(C)C)C1)CC2=O ZINC000587482133 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCC(=O)O)(c1cc(C)ccc1OC)CC2=O ZINC000587482182 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCC(=O)O)(c1cc(C)ccc1OC)CC2=O ZINC000587482184 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(O)ccc3c(C)cc(=O)oc13)CC2=O ZINC000587482209 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(O)ccc3c(C)cc(=O)oc13)CC2=O ZINC000587482210 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC)(c1ccc(OC[C@H]3CO3)cc1)CC2=O ZINC000587482221 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC)(c1ccc(OC[C@@H]3CO3)cc1)CC2=O ZINC000587482222 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC)(c1ccc(OC[C@H]3CO3)cc1)CC2=O ZINC000587482223 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC)(c1ccc(OC[C@@H]3CO3)cc1)CC2=O ZINC000587482224 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](CCc1ccc(C(=O)OCC)cc1)CC2=O ZINC000587482286 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](CCc1ccc(C(=O)OCC)cc1)CC2=O ZINC000587482288 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OCC)(c1cc(C)ccc1C)CC2=O ZINC000587482294 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OCC)(c1cc(C)ccc1C)CC2=O ZINC000587482297 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1c[nH]c3cc(C(=O)O)ccc13)CC2=O ZINC000587482575 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1c[nH]c3cc(C(=O)O)ccc13)CC2=O ZINC000587482582 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(CC(=O)OCC)cc1)CC2=O ZINC000587482617 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(CC(=O)OCC)cc1)CC2=O ZINC000587482620 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(OCC(=O)OC(C)C)cc1)CC2=O ZINC000587482656 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(OCC(=O)OC(C)C)cc1)CC2=O ZINC000587482659 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCC(=O)OC)(c1ccc(C)cc1)CC2=O ZINC000587482689 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCC(=O)OC)(c1ccc(C)cc1)CC2=O ZINC000587482691 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)CC2(CCNCC2)Oc2ccccc21 ZINC000587482754 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)CC2(CCNCC2)Oc2ccccc21 ZINC000587482756 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c[nH]c3cccc(C(=O)OC)c13)CC2=O ZINC000587482814 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c[nH]c3cccc(C(=O)OC)c13)CC2=O ZINC000587482817 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c[nH]c3ccc(C(=O)OC)cc13)CC2=O ZINC000587482846 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c[nH]c3ccc(C(=O)OC)cc13)CC2=O ZINC000587482847 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(OCc3noc(C)n3)cc1)CC2=O ZINC000587482864 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(OCc3noc(C)n3)cc1)CC2=O ZINC000587482869 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C[C@@H](C)C(=O)O)(c1ccc(OC)cc1)CC2=O ZINC000587482998 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C[C@H](C)C(=O)O)(c1ccc(OC)cc1)CC2=O ZINC000587483002 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C[C@H](C)C(=O)O)(c1ccc(OC)cc1)CC2=O ZINC000587483003 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C[C@@H](C)C(=O)O)(c1ccc(OC)cc1)CC2=O ZINC000587483004 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C[C@@H](CC(=O)O)c2cc(OC)ccc21 ZINC000587483024 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C[C@H](CC(=O)O)c2cc(OC)ccc21 ZINC000587483028 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C[C@H](CC(=O)O)c2cc(OC)ccc21 ZINC000587483031 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C[C@@H](CC(=O)O)c2cc(OC)ccc21 ZINC000587483032 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccc(OC)cc1)([C@H](C)C(=O)OC)CC2=O ZINC000587483037 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccc(OC)cc1)([C@@H](C)C(=O)OC)CC2=O ZINC000587483038 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccc(OC)cc1)([C@@H](C)C(=O)OC)CC2=O ZINC000587483039 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccc(OC)cc1)([C@H](C)C(=O)OC)CC2=O ZINC000587483040 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OC)([C@H](C)c1ccccc1)CC2=O ZINC000587483149 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OC)([C@H](C)c1ccccc1)CC2=O ZINC000587483151 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OC)([C@@H](C)c1ccccc1)CC2=O ZINC000587483152 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OC)([C@@H](C)c1ccccc1)CC2=O ZINC000587483153 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2ccccc2CC[C@H]1C(=O)OCC ZINC000587483166 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2ccccc2CC[C@@H]1C(=O)OCC ZINC000587483168 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2ccccc2CC[C@@H]1C(=O)OCC ZINC000587483170 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2ccccc2CC[C@H]1C(=O)OCC ZINC000587483172 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CCc1ccc3c(c1)OCCO3)CC2=O ZINC000587483173 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CCc1ccc3c(c1)OCCO3)CC2=O ZINC000587483176 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1c(C)[nH]c(C(=O)OCC)c1C)CC2=O ZINC000587483184 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1c(C)[nH]c(C(=O)OCC)c1C)CC2=O ZINC000587483187 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c(C)cc(OC)c(OC)c1OC)CC2=O ZINC000587483248 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c(C)cc(OC)c(OC)c1OC)CC2=O ZINC000587483257 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc3c4c(c1O)CCCN4CCC3)CC2=O ZINC000587483263 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc3c4c(c1O)CCCN4CCC3)CC2=O ZINC000587483277 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1[nH]c(C)c(C(=O)OCC)c1C)CC2=O ZINC000587483336 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1[nH]c(C)c(C(=O)OCC)c1C)CC2=O ZINC000587483340 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@@H](C(=O)OCC)c1ccccc1)CC2=O ZINC000587483558 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@H](C(=O)OCC)c1ccccc1)CC2=O ZINC000587483563 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)([C@@H](C(=O)OCC)c1ccccc1)CC2=O ZINC000587483566 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)([C@H](C(=O)OCC)c1ccccc1)CC2=O ZINC000587483570 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OCC)(c1ccc(C)c(C)c1)CC2=O ZINC000587483592 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OCC)(c1ccc(C)c(C)c1)CC2=O ZINC000587483593 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccc(C(=O)O)cc1)(c1cc[nH]c1)CC2=O ZINC000587483699 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccc(C(=O)O)cc1)(c1cc[nH]c1)CC2=O ZINC000587483701 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(OC[C@H]3CO3)c(OC)c1)CC2=O ZINC000587483715 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(OC[C@H]3CO3)c(OC)c1)CC2=O ZINC000587483716 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(OC[C@@H]3CO3)c(OC)c1)CC2=O ZINC000587483718 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(OC[C@@H]3CO3)c(OC)c1)CC2=O ZINC000587483720 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(C=C(C(=O)O)Oc3ccc(CC)cc31)CC2=O ZINC000587483769 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(C=C(C(=O)O)Oc3ccc(CC)cc31)CC2=O ZINC000587483772 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C[C@H]2C[C@H]1N(C(=O)OC(C)(C)C)C2 ZINC000587483814 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C[C@H]2C[C@H]1N(C(=O)OC(C)(C)C)C2 ZINC000587483823 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(OC(=O)C3CC3)c(OC)c1)CC2=O ZINC000587484035 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(OC(=O)C3CC3)c(OC)c1)CC2=O ZINC000587484037 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CC2=O)CC(C(=O)OCc2ccccc2)C1 ZINC000587484167 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2ccccc2CCC[C@H]1C(=O)OC ZINC000587484182 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2ccccc2CCC[C@@H]1C(=O)OC ZINC000587484183 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2ccccc2CCC[C@@H]1C(=O)OC ZINC000587484185 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2ccccc2CCC[C@H]1C(=O)OC ZINC000587484188 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(Cc1ccc(C(=O)OCC)cc1)CC2=O ZINC000587484568 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(Cc1ccc(C(=O)OCC)cc1)CC2=O ZINC000587484570 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC(=O)OCC)(c1ccccc1C)CC2=O ZINC000587484596 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC(=O)OCC)(c1ccccc1C)CC2=O ZINC000587484598 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC)(c1ccc(OCC(=O)O)cc1)CC2=O ZINC000587484689 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CC)(c1ccc(OCC(=O)O)cc1)CC2=O ZINC000587484691 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccccc1CC(=O)OCC)CC2=O ZINC000587484713 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccccc1CC(=O)OCC)CC2=O ZINC000587484715 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(OCCOC)c(OC)c1)CC2=O ZINC000587484730 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(OCCOC)c(OC)c1)CC2=O ZINC000587484732 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CC2=O)[C@H]2C[C@H]1CN(Cc1ccccc1)C2 ZINC000587484744 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc3c(c1)CCC(=O)N3C)CC2=O ZINC000587484928 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc3c(c1)CCC(=O)N3C)CC2=O ZINC000587484931 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c[nH]nc1-c1ccc3c(c1)OCO3)CC2=O ZINC000587484974 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c[nH]nc1-c1ccc3c(c1)OCO3)CC2=O ZINC000587484981 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCc3oc(C(=O)OC)c(C)c31)CC2=O ZINC000587485223 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCc3oc(C(=O)OC)c(C)c31)CC2=O ZINC000587485225 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C[C@@H]2CC[C@H]1N2C(=O)OC(C)(C)C ZINC000587485543 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C ZINC000587485545 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C[C@@H]2CC[C@H]1N2C(=O)OC(C)(C)C ZINC000587485547 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C[C@H]2CC[C@H]1N2C(=O)OC(C)(C)C ZINC000587485548 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CC2=O)CC2(CCN2C(=O)OC(C)(C)C)C1 ZINC000587485601 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](Cc1ccccc1)([C@@H]1CCCNC1)CC2=O ZINC000587485638 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](Cc1ccccc1)([C@@H]1CCCNC1)CC2=O ZINC000587485640 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](Cc1ccccc1)([C@H]1CCCNC1)CC2=O ZINC000587485642 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](Cc1ccccc1)([C@H]1CCCNC1)CC2=O ZINC000587485643 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cc(C(=O)OCC)c(C)nc1C)CC2=O ZINC000587485664 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(C=C(C(=O)O)Oc3c(C)cc(C)cc31)CC2=O ZINC000587485667 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(C=C(C(=O)O)Oc3c(C)cc(C)cc31)CC2=O ZINC000587485668 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cc(C(=O)OCC)c(C)nc1C)CC2=O ZINC000587485670 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c[nH]c3cc(C(=O)OC)ccc13)CC2=O ZINC000587485936 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c[nH]c3cc(C(=O)OC)ccc13)CC2=O ZINC000587485937 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OC)(c1c(C)[nH]c3ccccc13)CC2=O ZINC000587485961 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OC)(c1c(C)[nH]c3ccccc13)CC2=O ZINC000587485966 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(S(=O)(=O)CC)cc1)CC2=O ZINC000587486158 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(S(=O)(=O)CC)cc1)CC2=O ZINC000587486162 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccccc1OCC(=O)OCC)CC2=O ZINC000587486257 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccccc1OCC(=O)OCC)CC2=O ZINC000587486261 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccc(C=O)c1)(C1CCOCC1)CC2=O ZINC000587486437 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cccc(C=O)c1)(C1CCOCC1)CC2=O ZINC000587486441 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cccc(O[C@H](C)C(=O)O)c1)CC2=O ZINC000587486602 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cccc(O[C@H](C)C(=O)O)c1)CC2=O ZINC000587486612 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cccc(O[C@@H](C)C(=O)O)c1)CC2=O ZINC000587486614 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cccc(O[C@@H](C)C(=O)O)c1)CC2=O ZINC000587486617 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(O[C@H](C)C(=O)O)cc1)CC2=O ZINC000587486654 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(O[C@H](C)C(=O)O)cc1)CC2=O ZINC000587486656 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(O[C@@H](C)C(=O)O)cc1)CC2=O ZINC000587486659 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(O[C@@H](C)C(=O)O)cc1)CC2=O ZINC000587486660 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc3c(c1)C(C)(C)C(=O)N3)CC2=O ZINC000587486742 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc3c(c1)C(C)(C)C(=O)N3)CC2=O ZINC000587486745 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(OC3CCOCC3)nc1)CC2=O ZINC000587486786 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(OC3CCOCC3)nc1)CC2=O ZINC000587486787 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)N(CC(C)C)c2ccccc21 ZINC000587486828 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)N(CC(C)C)c2ccccc21 ZINC000587486829 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1c(C)[nH]c(C(=O)CC#N)c1C)CC2=O ZINC000587486885 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](C)(c1c(C)[nH]c(C(=O)CC#N)c1C)CC2=O ZINC000587486888 GI Annotated Mild CCCc1c(O)ccc2c1O[C@@](C)(Cc1nc(-c3ccccc3)no1)CC2=O ZINC000587486948 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(Cc1nc(-c3ccccc3)no1)CC2=O ZINC000587486950 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CC#N)(c1[nH]c(C)c(C(C)=O)c1C)CC2=O ZINC000587487122 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](CC#N)(c1[nH]c(C)c(C(C)=O)c1C)CC2=O ZINC000587487127 GI Annotated Mild CCCc1c(O)ccc2c1O[C@]1(CC2=O)CC(C)(C)Cc2occ(C(=O)O)c21 ZINC000587487354 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)CC(C)(C)Cc2occ(C(=O)O)c21 ZINC000587487359 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C[C@H]2C[C@H]1CN2C(=O)OC(C)(C)C ZINC000587487754 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C[C@H]2C[C@H]1CN2C(=O)OC(C)(C)C ZINC000587487756 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCc3[nH]c(C(=O)OCC)c(C)c31)CC2=O ZINC000587487840 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCc3[nH]c(C(=O)OCC)c(C)c31)CC2=O ZINC000587487841 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(OCc3ncon3)cc1)CC2=O ZINC000587487884 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(OCc3ncon3)cc1)CC2=O ZINC000587487886 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1c[nH]c3cc(C(=O)OC)ccc13)CC2=O ZINC000587487895 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1c[nH]c3cc(C(=O)OC)ccc13)CC2=O ZINC000587487896 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1ccccc1)(c1c[nH]c(C(=O)O)c1)CC2=O ZINC000587487955 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccccc1)(c1c[nH]c(C(=O)O)c1)CC2=O ZINC000587487957 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1c[nH]c3c(C(=O)OC)cccc13)CC2=O ZINC000587487960 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1c[nH]c3c(C(=O)OC)cccc13)CC2=O ZINC000587487962 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@H](C#N)c1nc3ccccc3[nH]1)CC2=O ZINC000587487999 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](C)([C@@H](C#N)c1nc3ccccc3[nH]1)CC2=O ZINC000587488007 GI Annotated Mild CCCc1c(O)ccc2c1O[C@@](C)([C@@H](C#N)c1nc3ccccc3[nH]1)CC2=O ZINC000587488010 GI Annotated Mild CCCc1c(O)ccc2c1O[C@](C)([C@H](C#N)c1nc3ccccc3[nH]1)CC2=O ZINC000587488012 GI Annotated Mild CCCc1c(O)ccc2c1O[C@@H](c1cc3cc4c(cc3nc1O)OCO4)CC2=O ZINC000587488178 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc3cc4c(cc3nc1O)OCO4)CC2=O ZINC000587488183 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(S(=O)(=O)Cl)cc1)CC2=O ZINC000587488224 GI Annotated Unstable CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(S(=O)(=O)Cl)cc1)CC2=O ZINC000587488229 GI Annotated Unstable CCCc1c(O)ccc2c1OC1(CCC(C#N)(c3ccncc3)CC1)CC2=O ZINC000587488340 GI Annotated Mild CCCc1c(O)ccc2c1O[C@@](CCCC(=O)OCC)(c1ccccn1)CC2=O ZINC000587488523 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCCC(=O)OCC)(c1ccccn1)CC2=O ZINC000587488525 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)[C@H]2CC[C@H]1N(Cc1ccccc1)C2 ZINC000587488664 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)[C@H]2CC[C@H]1N(Cc1ccccc1)C2 ZINC000587488668 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cccc(S(=O)(=O)Cl)c1)CC2=O ZINC000587488815 GI Annotated Unstable CCCc1c(O)ccc2c1O[C@@](C)(c1cccc(S(=O)(=O)Cl)c1)CC2=O ZINC000587488817 GI Annotated Unstable CCCc1c(O)ccc2c1O[C@H](c1cc3ccc(OC)cc3nc1O)CC2=O ZINC000587488821 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc3ccc(OC)cc3nc1O)CC2=O ZINC000587488822 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(S(C)(=O)=O)cc1Cl)CC2=O ZINC000587488906 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(S(C)(=O)=O)cc1Cl)CC2=O ZINC000587488907 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CSC#N)(c1cccc([N+](=O)[O-])c1)CC2=O ZINC000587489158 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CSC#N)(c1cccc([N+](=O)[O-])c1)CC2=O ZINC000587489165 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@]1(CC2=O)[C@H]2CC[C@H]1N(C(=O)OC(C)(C)C)C2 ZINC000587489321 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)[C@H]2CC[C@H]1N(C(=O)OC(C)(C)C)C2 ZINC000587489322 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cnc3ccccc3c1C(=O)O)CC2=O ZINC000587489682 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cnc3ccccc3c1C(=O)O)CC2=O ZINC000587489693 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCn3c(O)nc4cccc1c43)CC2=O ZINC000587490130 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCn3c(O)nc4cccc1c43)CC2=O ZINC000587490138 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CC2=O)C[C@@H]2C[C@H](C1)N2C(=O)OC(C)(C)C ZINC000587490550 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(/C=C/C(=O)O)=COc2ccccc21 ZINC000587490693 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(/C=C\C(=O)O)=COc2ccccc21 ZINC000587490704 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(/C=C\C(=O)O)=COc2ccccc21 ZINC000587490706 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(/C=C/C(=O)O)=COc2ccccc21 ZINC000587490708 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(C#Cc3cncnc3)cc1)CC2=O ZINC000587490914 GI Annotated Mild CCCc1c(O)ccc2c1O[C@H](c1ccc(C#Cc3cncnc3)cc1)CC2=O ZINC000587490916 GI Annotated Mild CCCc1c(O)ccc2c1O[C@@](C(=O)O)(c1ccc3c(c1)CCCC3)CC2=O ZINC000587490973 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)O)(c1ccc3c(c1)CCCC3)CC2=O ZINC000587490975 GI Annotated Anodyne CCCc1c(O)ccc2c1OC1(CC2=O)CC(Cc2ccc3c(c2)OCO3)C1 ZINC000587491182 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cc3cc(OCC)ccc3[nH]c1=O)CC2=O ZINC000587491444 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cc3cc(OCC)ccc3[nH]c1=O)CC2=O ZINC000587491447 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1cnc(SC)nc1SC)CC2=O ZINC000587491674 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1cnc(SC)nc1SC)CC2=O ZINC000587491678 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)([C@@H](C)Oc1ccc3c(c1)OCO3)CC2=O ZINC000587491712 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@@H](C)Oc1ccc3c(c1)OCO3)CC2=O ZINC000587491716 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)([C@H](C)Oc1ccc3c(c1)OCO3)CC2=O ZINC000587491718 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)([C@H](C)Oc1ccc3c(c1)OCO3)CC2=O ZINC000587491720 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C(=O)OC(C)(C)C)(C1=COCCC1)CC2=O ZINC000587491736 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C(=O)OC(C)(C)C)(C1=COCCC1)CC2=O ZINC000587491740 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1sc(CCOC)nc1C)CC2=O ZINC000587492039 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1sc(CCOC)nc1C)CC2=O ZINC000587492043 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(O)c3nc(O)ccc13)CC2=O ZINC000587492097 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(O)c3nc(O)ccc13)CC2=O ZINC000587492098 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1coc3ccc(OC)cc3c1=O)CC2=O ZINC000587492474 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1coc3ccc(OC)cc3c1=O)CC2=O ZINC000587492475 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CCc1ccc(OC[C@@H]3CO3)cc1)CC2=O ZINC000587492698 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CCc1ccc(OC[C@@H]3CO3)cc1)CC2=O ZINC000587492700 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(CCc1ccc(OC[C@H]3CO3)cc1)CC2=O ZINC000587492704 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(CCc1ccc(OC[C@H]3CO3)cc1)CC2=O ZINC000587492707 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2ccccc2C(=O)c2cnccc21 ZINC000587492870 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2ccccc2C(=O)c2cnccc21 ZINC000587492873 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](Cc1csc(=N)[nH]1)(c1ccccc1)CC2=O ZINC000587492921 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](Cc1csc(=N)[nH]1)(c1ccccc1)CC2=O ZINC000587492925 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)c2ccccc2C(=O)c2ccncc21 ZINC000587492967 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)c2ccccc2C(=O)c2ccncc21 ZINC000587492970 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CSC#N)(c1ccc(OC)cc1)CC2=O ZINC000587493074 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CSC#N)(c1ccc(OC)cc1)CC2=O ZINC000587493076 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](c1ccccc1)(c1sc(=N)[nH]c1C)CC2=O ZINC000587493410 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1ccccc1)(c1sc(=N)[nH]c1C)CC2=O ZINC000587493411 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(N3CCC(O)CC3)s1)CC2=O ZINC000587493412 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(N3CCC(O)CC3)s1)CC2=O ZINC000587493413 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCl)([C@H](C#N)c1nc(C)cs1)CC2=O ZINC000587493447 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CCl)([C@@H](C#N)c1nc(C)cs1)CC2=O ZINC000587493448 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CCl)([C@H](C#N)c1nc(C)cs1)CC2=O ZINC000587493449 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CCl)([C@@H](C#N)c1nc(C)cs1)CC2=O ZINC000587493450 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@]1(CCCc3nc(S)c(C#N)cc31)CC2=O ZINC000587493585 GI Annotated Mild CCCc1c(O)ccc2c1O[C@]1(CCCc3nc(S)c(C#N)cc31)CC2=O ZINC000587493587 GI Annotated Mild CCCc1c(O)ccc2c1O[C@]1(CCOC[C@H]1OCc1ccccc1)CC2=O ZINC000587493600 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCOC[C@H]1OCc1ccccc1)CC2=O ZINC000587493603 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCOC[C@@H]1OCc1ccccc1)CC2=O ZINC000587493604 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCOC[C@@H]1OCc1ccccc1)CC2=O ZINC000587493605 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](CCc1cccc(C3OCCO3)c1)CC2=O ZINC000587493761 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](CCc1cccc(C3OCCO3)c1)CC2=O ZINC000587493763 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccs1)([C@H](C)C(=O)OCC)CC2=O ZINC000587493798 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cccs1)([C@H](C)C(=O)OCC)CC2=O ZINC000587493801 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](c1cccs1)([C@@H](C)C(=O)OCC)CC2=O ZINC000587493802 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](c1cccs1)([C@@H](C)C(=O)OCC)CC2=O ZINC000587493803 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1sc(-c3cnccn3)nc1C)CC2=O ZINC000587493916 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1sc(-c3cnccn3)nc1C)CC2=O ZINC000587493917 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CC2=O)C(=O)Nc2cc(SCC)ccc21 ZINC000587493976 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CC2=O)C(=O)Nc2cc(SCC)ccc21 ZINC000587493977 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1ccc(N3CCOCC3)s1)CC2=O ZINC000587494492 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ccc(N3CCOCC3)s1)CC2=O ZINC000587494496 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](CCl)(c1cc(C(=O)O)cs1)CC2=O ZINC000587494717 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](CCl)(c1cc(C(=O)O)cs1)CC2=O ZINC000587494718 GI Annotated Reactive CCOC(=O)[C@@H](Cl)[C@]1(CC(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587494764 GI Annotated Reactive CCOC(=O)[C@H](Cl)[C@]1(CC(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587494771 GI Annotated Reactive CCOC(=O)[C@H](Cl)[C@@]1(CC(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587494775 GI Annotated Reactive COc1ccc(Br)c([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)n1 ZINC000587494776 GI Annotated Anodyne CCOC(=O)[C@@H](Cl)[C@@]1(CC(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587494778 GI Annotated Reactive COc1ccc(Br)c([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)n1 ZINC000587494781 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1nc3c(s1)CN(C(C)C)CC3)CC2=O ZINC000587494840 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1nc3c(s1)CN(C(C)C)CC3)CC2=O ZINC000587494847 GI Annotated Anodyne N#CC[C@@]1(c2cncc(Br)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587494857 GI Annotated Mild N#CC[C@]1(c2cncc(Br)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587494863 GI Annotated Mild COc1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)nc1Br ZINC000587494949 GI Annotated Anodyne COc1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)nc1Br ZINC000587494952 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CBr)(c1nccs1)CC2=O ZINC000587495094 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CBr)(c1nccs1)CC2=O ZINC000587495095 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](C)(c1ncc(Br)s1)CC2=O ZINC000587495097 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1ncc(Br)s1)CC2=O ZINC000587495100 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](C)(c1cc3c(s1)SCC(=O)N3)CC2=O ZINC000587495134 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](C)(c1cc3c(s1)SCC(=O)N3)CC2=O ZINC000587495141 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](CCl)(c1ccc(CC(=O)O)s1)CC2=O ZINC000587495199 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](CCl)(c1ccc(CC(=O)O)s1)CC2=O ZINC000587495201 GI Annotated Reactive CCn1ncc(Br)c1[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587495278 GI Annotated Anodyne CCn1ncc(Br)c1[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587495279 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@](/C(C#N)=C/N(C)C)(c1cccs1)CC2=O ZINC000587495734 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](/C(C#N)=C\N(C)C)(c1cccs1)CC2=O ZINC000587495735 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@@](/C(C#N)=C\N(C)C)(c1cccs1)CC2=O ZINC000587495736 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@](/C(C#N)=C/N(C)C)(c1cccs1)CC2=O ZINC000587495737 GI Annotated Reactive C[C@@H](Cl)C(=O)NC[C@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587495838 GI Annotated Reactive C[C@@H](Cl)C(=O)NC[C@@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587495854 GI Annotated Reactive C[C@H](Cl)C(=O)NC[C@@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587495857 GI Annotated Reactive C[C@H](Cl)C(=O)NC[C@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587495860 GI Annotated Reactive O=C1C[C@]2(CCNc3nc(Br)ccc32)Oc2c1ccc1c2CCCC1 ZINC000587495903 GI Annotated Anodyne O=C1C[C@@]2(CCNc3nc(Br)ccc32)Oc2c1ccc1c2CCCC1 ZINC000587495908 GI Annotated Anodyne O=C[C@]1(c2ccc(Br)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496064 GI Annotated Mild O=C[C@@]1(c2ccc(Br)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496066 GI Annotated Mild COC(=O)[C@]1([C@H](Cl)c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496164 GI Annotated Reactive COC(=O)[C@@]1([C@H](Cl)c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496166 GI Annotated Reactive COC(=O)[C@]1([C@@H](Cl)c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496169 GI Annotated Reactive COC(=O)[C@@]1([C@@H](Cl)c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496171 GI Annotated Reactive O=C1C[C@@H](c2ccc(Cl)nc2N2CCOCC2)Oc2c1ccc1c2CCCC1 ZINC000587496298 GI Annotated Anodyne O=C1C[C@H](c2ccc(Cl)nc2N2CCOCC2)Oc2c1ccc1c2CCCC1 ZINC000587496302 GI Annotated Anodyne CC(=O)NCc1ccc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587496345 GI Annotated Reactive CC(=O)NCc1ccc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587496347 GI Annotated Reactive Cc1nn(-c2ccnc(Cl)n2)cc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496449 GI Annotated Anodyne Cc1nn(-c2ccnc(Cl)n2)cc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496455 GI Annotated Anodyne COc1ccc(Br)nc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496514 GI Annotated Anodyne COc1ccc(Br)nc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496515 GI Annotated Anodyne NC(=O)CCc1ccc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587496543 GI Annotated Reactive NC(=O)CCc1ccc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587496544 GI Annotated Reactive Cn1c(=O)oc2cc([C@]3(CCl)CC(=O)c4ccc5c(c4O3)CCCC5)ccc21 ZINC000587496545 GI Annotated Reactive Cn1c(=O)oc2cc([C@@]3(CCl)CC(=O)c4ccc5c(c4O3)CCCC5)ccc21 ZINC000587496547 GI Annotated Reactive O=C1C[C@@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1cc(Br)ccc12 ZINC000587496557 GI Annotated Anodyne O=C1C[C@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1cc(Br)ccc12 ZINC000587496560 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1ccc(N(C)C)c3nsnc13)CC2=O ZINC000587496694 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(N(C)C)c3nsnc13)CC2=O ZINC000587496695 GI Annotated Anodyne O=C(CCCl)NC[C@@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496755 GI Annotated Reactive O=C(CCCl)NC[C@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496757 GI Annotated Reactive CCCc1c(O)ccc2c1O[C@H](c1ccc(CN3CCSCC3)o1)CC2=O ZINC000587496796 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1ccc(CN3CCSCC3)o1)CC2=O ZINC000587496798 GI Annotated Anodyne C[C@H](NC(=O)OC(C)(C)C)[C@]1(CCl)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496899 GI Annotated Reactive C[C@H](NC(=O)OC(C)(C)C)[C@@]1(CCl)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496903 GI Annotated Reactive O=C1C[C@H](c2cc(O)c(Br)cc2O)Oc2c1ccc1c2CCCC1 ZINC000587496950 GI Annotated Anodyne O=C1C[C@@H](c2cc(O)c(Br)cc2O)Oc2c1ccc1c2CCCC1 ZINC000587496952 GI Annotated Anodyne O=C(O)CC[C@@]1(c2ccc(Cl)cn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496974 GI Annotated Anodyne O=C(O)CC[C@]1(c2ccc(Cl)cn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587496975 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCC[C@H]1N1CCSCC1)CC2=O ZINC000587497008 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@]1(CCCC[C@@H]1N1CCSCC1)CC2=O ZINC000587497011 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCC[C@@H]1N1CCSCC1)CC2=O ZINC000587497013 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@]1(CCCC[C@H]1N1CCSCC1)CC2=O ZINC000587497015 GI Annotated Anodyne CCOC(=O)C[C@@]1(c2ccc(Cl)cn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587497117 GI Annotated Anodyne CCOC(=O)C[C@]1(c2ccc(Cl)cn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587497119 GI Annotated Anodyne O=C1C[C@@H](c2c[nH]c3ncc(Br)nc23)Oc2c1ccc1c2CCCC1 ZINC000587497129 GI Annotated Anodyne O=C1C[C@H](c2c[nH]c3ncc(Br)nc23)Oc2c1ccc1c2CCCC1 ZINC000587497130 GI Annotated Anodyne O=C1C[C@@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1cccc(Br)c12 ZINC000587497208 GI Annotated Anodyne O=C1C[C@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1cccc(Br)c12 ZINC000587497209 GI Annotated Anodyne O=C(O)C1=C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2cc(Cl)ccc2O1 ZINC000587497288 GI Annotated Anodyne O=C(O)C1=C[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2cc(Cl)ccc2O1 ZINC000587497290 GI Annotated Anodyne O=C1C[C@](CBr)(C2CCOCC2)Oc2c1ccc1c2CCCC1 ZINC000587497402 GI Annotated Reactive O=C1C[C@@](CBr)(C2CCOCC2)Oc2c1ccc1c2CCCC1 ZINC000587497405 GI Annotated Reactive O=C1C[C@]2(C[C@H](C(=O)O)Oc3ccc(Cl)cc32)Oc2c1ccc1c2CCCC1 ZINC000587497496 GI Annotated Anodyne O=C1C[C@@]2(C[C@H](C(=O)O)Oc3ccc(Cl)cc32)Oc2c1ccc1c2CCCC1 ZINC000587497498 GI Annotated Anodyne O=C1C[C@]2(C[C@@H](C(=O)O)Oc3ccc(Cl)cc32)Oc2c1ccc1c2CCCC1 ZINC000587497503 GI Annotated Anodyne O=C1C[C@@]2(C[C@@H](C(=O)O)Oc3ccc(Cl)cc32)Oc2c1ccc1c2CCCC1 ZINC000587497506 GI Annotated Anodyne CN(C=O)c1ccc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587497511 GI Annotated Reactive CN(C=O)c1ccc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587497513 GI Annotated Reactive O=C1C[C@@H](c2cc(O)c(O)c(Br)c2)Oc2c1ccc1c2CCCC1 ZINC000587497525 GI Annotated Clean O=C1C[C@H](c2cc(O)c(O)c(Br)c2)Oc2c1ccc1c2CCCC1 ZINC000587497527 GI Annotated Clean CCCc1c(O)ccc2c1O[C@@](/C=C1/SCC(=O)N1C)(C(C)(C)C)CC2=O ZINC000587497587 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@](/C=C1/SCC(=O)N1C)(C(C)(C)C)CC2=O ZINC000587497593 GI Annotated Anodyne Nc1ccc([C@@]2(CBr)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587497603 GI Annotated Reactive Nc1ccc([C@]2(CBr)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587497604 GI Annotated Reactive O=C1C[C@@H](c2cc(O)cc(Br)c2O)Oc2c1ccc1c2CCCC1 ZINC000587497626 GI Annotated Anodyne O=C1C[C@H](c2cc(O)cc(Br)c2O)Oc2c1ccc1c2CCCC1 ZINC000587497629 GI Annotated Anodyne COC(=O)C[C@]1(C(F)(F)C(F)(F)F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587497742 GI Annotated Anodyne COC(=O)C[C@@]1(C(F)(F)C(F)(F)F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587497744 GI Annotated Anodyne C=C1Nn2c(nc(C(C)C)c2[C@@H]2CC(=O)c3ccc(O)c(CCC)c3O2)S1 ZINC000587497941 GI Annotated Anodyne C=C1Nn2c(nc(C(C)C)c2[C@H]2CC(=O)c3ccc(O)c(CCC)c3O2)S1 ZINC000587497948 GI Annotated Anodyne CC(=O)OC[C@]1(c2ccc(Cl)cn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587497958 GI Annotated Anodyne CC(=O)OC[C@@]1(c2ccc(Cl)cn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587497961 GI Annotated Anodyne O=C1C[C@@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1c(Br)cccc12 ZINC000587498014 GI Annotated Anodyne O=C1C[C@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1c(Br)cccc12 ZINC000587498018 GI Annotated Anodyne COc1cc(Br)cnc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587498040 GI Annotated Anodyne COc1cc(Br)cnc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587498043 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@@H](c1csc(N(C(C)=O)C3CC3)n1)CC2=O ZINC000587498250 GI Annotated Anodyne CCCc1c(O)ccc2c1O[C@H](c1csc(N(C(C)=O)C3CC3)n1)CC2=O ZINC000587498251 GI Annotated Anodyne O=C1C[C@@](CCl)(c2ccc3c(c2)OCCO3)Oc2c1ccc1c2CCCC1 ZINC000587498343 GI Annotated Reactive O=C1C[C@](CCl)(c2ccc3c(c2)OCCO3)Oc2c1ccc1c2CCCC1 ZINC000587498344 GI Annotated Reactive CCOC(=O)C[C@]1([C@@H](C)Br)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587498399 GI Annotated Reactive CCOC(=O)C[C@]1([C@H](C)Br)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587498402 GI Annotated Reactive CCOC(=O)C[C@@]1([C@@H](C)Br)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587498403 GI Annotated Reactive CCOC(=O)C[C@@]1([C@H](C)Br)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587498404 GI Annotated Reactive COc1ncc(Br)cc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587498519 GI Annotated Anodyne COc1ncc(Br)cc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587498522 GI Annotated Anodyne CC(=O)Nc1cc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)ccc1O ZINC000587498790 GI Annotated Reactive CC(=O)Nc1cc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)ccc1O ZINC000587498791 GI Annotated Reactive O=C1C[C@](CCl)(c2ccc3nc(O)[nH]c3c2)Oc2c1ccc1c2CCCC1 ZINC000587498841 GI Annotated Reactive O=C1C[C@@](CCl)(c2ccc3nc(O)[nH]c3c2)Oc2c1ccc1c2CCCC1 ZINC000587498842 GI Annotated Reactive NC(=O)Nc1ccc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587498948 GI Annotated Reactive NC(=O)Nc1ccc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587498949 GI Annotated Reactive Cc1nc(C)c([C@@]2(CBr)CC(=O)c3ccc4c(c3O2)CCCC4)o1 ZINC000587498956 GI Annotated Reactive Cc1nc(C)c([C@]2(CBr)CC(=O)c3ccc4c(c3O2)CCCC4)o1 ZINC000587498957 GI Annotated Reactive CCn1cc(Br)c([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)n1 ZINC000587499009 GI Annotated Anodyne O=C1CC2(CCN(c3ccc(Cl)nn3)CC2)Oc2c1ccc1c2CCCC1 ZINC000587499010 GI Annotated Anodyne CCn1cc(Br)c([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)n1 ZINC000587499011 GI Annotated Anodyne COc1c([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)ccnc1Br ZINC000587499033 GI Annotated Anodyne COc1c([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)ccnc1Br ZINC000587499034 GI Annotated Anodyne COC(=O)c1cccc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587499443 GI Annotated Reactive COC(=O)c1cccc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587499445 GI Annotated Reactive O=CN1CCc2cc([C@]3(CCl)CC(=O)c4ccc5c(c4O3)CCCC5)ccc21 ZINC000587499562 GI Annotated Reactive O=CN1CCc2cc([C@@]3(CCl)CC(=O)c4ccc5c(c4O3)CCCC5)ccc21 ZINC000587499563 GI Annotated Reactive CCOC(=O)[C@@]1(c2ccc(Cl)nc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587499903 GI Annotated Anodyne CCOC(=O)[C@]1(c2ccc(Cl)nc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587499904 GI Annotated Anodyne O=C1CC(CBr)(CBr)Oc2c1ccc1c2CCCC1 ZINC000587500154 GI Annotated Reactive O=C1C[C@@H](c2cnc3cnc(Br)cn23)Oc2c1ccc1c2CCCC1 ZINC000587500275 GI Annotated Anodyne O=C1C[C@H](c2cnc3cnc(Br)cn23)Oc2c1ccc1c2CCCC1 ZINC000587500287 GI Annotated Anodyne Cn1cc([C@]2(c3cccc(F)c3)CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587500337 GI Annotated Anodyne Cn1cc([C@@]2(c3cccc(F)c3)CC(=O)c3ccc4c(c3O2)CCCC4)cn1 ZINC000587500339 GI Annotated Anodyne CCn1cc(Br)c([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)n1 ZINC000587500363 GI Annotated Anodyne CCn1cc(Br)c([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)n1 ZINC000587500366 GI Annotated Anodyne O=C1C[C@@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1ccc(Br)cc12 ZINC000587500459 GI Annotated Anodyne O=C1C[C@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1ccc(Br)cc12 ZINC000587500463 GI Annotated Anodyne CCOC(=O)C(F)(F)[C@@H]1CC[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)C1 ZINC000587500512 GI Annotated Anodyne CCOC(=O)C(F)(F)[C@H]1CC[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)C1 ZINC000587500517 GI Annotated Anodyne CCOC(=O)C(F)(F)[C@@H]1CC[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)C1 ZINC000587500519 GI Annotated Anodyne CCOC(=O)C(F)(F)[C@H]1CC[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)C1 ZINC000587500521 GI Annotated Anodyne O=C1C[C@H](c2cc(Br)c(O)cc2O)Oc2c1ccc1c2CCCC1 ZINC000587500670 GI Annotated Anodyne O=C1C[C@@H](c2cc(Br)c(O)cc2O)Oc2c1ccc1c2CCCC1 ZINC000587500671 GI Annotated Anodyne Cn1ccnc1[C@]1(c2cccc(F)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587500815 GI Annotated Anodyne Cn1ccnc1[C@@]1(c2cccc(F)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587500816 GI Annotated Anodyne COc1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c(Br)cn1 ZINC000587501017 GI Annotated Anodyne COc1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c(Br)cn1 ZINC000587501020 GI Annotated Anodyne CN(C)CCOc1ccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587501219 GI Annotated Anodyne CN(C)CCOc1ccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587501222 GI Annotated Anodyne O=C[C@]1(c2cccc(Br)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587501694 GI Annotated Mild O=C[C@@]1(c2cccc(Br)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587501696 GI Annotated Mild CCOC(=O)[C@]1(c2cc(F)cc(F)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587501856 GI Annotated Anodyne CCOC(=O)[C@@]1(c2cc(F)cc(F)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587501876 GI Annotated Anodyne COc1cc(OC)cc([C@@]2(CC#N)CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587501904 GI Annotated Mild COc1cc(OC)cc([C@]2(CC#N)CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587501908 GI Annotated Mild COC(=O)C1=C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2cc(F)ccc2O1 ZINC000587502257 GI Annotated Anodyne COC(=O)C1=C[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2cc(F)ccc2O1 ZINC000587502262 GI Annotated Anodyne O=C1C[C@@H](c2c(F)cccc2N2CCOCC2)Oc2c1ccc1c2CCCC1 ZINC000587502403 GI Annotated Anodyne O=C1C[C@H](c2c(F)cccc2N2CCOCC2)Oc2c1ccc1c2CCCC1 ZINC000587502408 GI Annotated Anodyne CN1CCN(c2cc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)ccc2F)CC1 ZINC000587502428 GI Annotated Anodyne CN1CCN(c2cc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)ccc2F)CC1 ZINC000587502440 GI Annotated Anodyne Cc1nn(C)c(OCC(F)(F)F)c1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587502651 GI Annotated Anodyne Cc1nn(C)c(OCC(F)(F)F)c1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587502664 GI Annotated Anodyne Cc1nn(C)c([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1Br ZINC000587502673 GI Annotated Anodyne Cc1nn(C)c([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1Br ZINC000587502680 GI Annotated Anodyne CN1CCN(c2ccc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)c(F)c2)CC1 ZINC000587502946 GI Annotated Anodyne CN1CCN(c2ccc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)c(F)c2)CC1 ZINC000587502947 GI Annotated Anodyne CCOC(=O)C[C@]1(c2cccc(C#N)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587502955 GI Annotated Mild CCOC(=O)C[C@@]1(c2cccc(C#N)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587502966 GI Annotated Mild O=C1C[C@@](Cn2ccnc2)(c2cccc(F)c2)Oc2c1ccc1c2CCCC1 ZINC000587502982 GI Annotated Anodyne O=C1C[C@](Cn2ccnc2)(c2cccc(F)c2)Oc2c1ccc1c2CCCC1 ZINC000587502983 GI Annotated Anodyne Cn1ccc([C@]2(c3ccc(F)cc3)CC(=O)c3ccc4c(c3O2)CCCC4)n1 ZINC000587503281 GI Annotated Anodyne Cn1ccc([C@@]2(c3ccc(F)cc3)CC(=O)c3ccc4c(c3O2)CCCC4)n1 ZINC000587503286 GI Annotated Anodyne CCOC(=O)[C@]1(c2ccc(F)c(F)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587503303 GI Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(F)c(F)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587503306 GI Annotated Anodyne CCOC(=O)[C@]1(c2ccc(OC)c(F)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587503374 GI Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(OC)c(F)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587503384 GI Annotated Anodyne Cc1c([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)nnn1-c1ccc(F)cc1 ZINC000587503401 GI Annotated Anodyne Cc1c([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)nnn1-c1ccc(F)cc1 ZINC000587503409 GI Annotated Anodyne O=C1C[C@](CO)(c2ccc(C(F)(F)F)cc2)Oc2c1ccc1c2CCCC1 ZINC000587503705 GI Annotated Anodyne O=C1C[C@@](CO)(c2ccc(C(F)(F)F)cc2)Oc2c1ccc1c2CCCC1 ZINC000587503708 GI Annotated Anodyne CN(C)CCOc1cccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587503819 GI Annotated Anodyne CN(C)CCOc1cccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587503821 GI Annotated Anodyne C[C@@]1(CC(=O)Nc2ccc(Cl)cn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587503828 GI Annotated Anodyne C[C@]1(CC(=O)Nc2ccc(Cl)cn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587503830 GI Annotated Anodyne O=C1C[C@H](c2ccc(N3CCOCC3)cc2F)Oc2c1ccc1c2CCCC1 ZINC000587503972 GI Annotated Anodyne O=C1C[C@@H](c2ccc(N3CCOCC3)cc2F)Oc2c1ccc1c2CCCC1 ZINC000587503976 GI Annotated Anodyne O=C(O)C1=COc2ccc(Cl)cc2[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587504293 GI Annotated Anodyne O=C(O)C1=COc2ccc(Cl)cc2[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587504299 GI Annotated Anodyne O=C1C[C@@H](c2cccc(F)c2N2CCOCC2)Oc2c1ccc1c2CCCC1 ZINC000587504538 GI Annotated Anodyne O=C1C[C@H](c2cccc(F)c2N2CCOCC2)Oc2c1ccc1c2CCCC1 ZINC000587504543 GI Annotated Anodyne C[C@]1(c2cn(Cc3ccc(F)cc3)nn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587504553 GI Annotated Anodyne C[C@@]1(c2cn(Cc3ccc(F)cc3)nn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587504557 GI Annotated Anodyne O=C1C[C@@](Cn2ccnc2)(c2ccc(F)cc2)Oc2c1ccc1c2CCCC1 ZINC000587504854 GI Annotated Anodyne O=C1C[C@](Cn2ccnc2)(c2ccc(F)cc2)Oc2c1ccc1c2CCCC1 ZINC000587504856 GI Annotated Anodyne O=C1C[C@@H](C(=O)Cc2cccc(Br)c2)Oc2c1ccc1c2CCCC1 ZINC000587505092 GI Annotated Anodyne O=C1C[C@H](C(=O)Cc2cccc(Br)c2)Oc2c1ccc1c2CCCC1 ZINC000587505093 GI Annotated Anodyne CCOC(=O)[C@H](C#N)[C@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587505300 GI Annotated Mild CCOC(=O)[C@@H](C#N)[C@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587505303 GI Annotated Mild CCOC(=O)[C@H](C#N)[C@@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587505307 GI Annotated Mild CCOC(=O)[C@@H](C#N)[C@@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587505310 GI Annotated Mild CCO/C=C(\C(=O)OCC)[C@]1(C(F)F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587505324 GI Annotated Anodyne CCO/C=C(\C(=O)OCC)[C@@]1(C(F)F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587505327 GI Annotated Anodyne CCO/C=C(/C(=O)OCC)[C@]1(C(F)F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587505328 GI Annotated Anodyne CCO/C=C(/C(=O)OCC)[C@@]1(C(F)F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587505331 GI Annotated Anodyne O=C1C[C@@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1cc(C(F)(F)F)ccc12 ZINC000587505478 GI Annotated Anodyne O=C1C[C@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1cc(C(F)(F)F)ccc12 ZINC000587505480 GI Annotated Anodyne O=C1C[C@]2(CCOc3c([N+](=O)[O-])cc(F)cc32)Oc2c1ccc1c2CCCC1 ZINC000587505540 GI Annotated Bother O=C1C[C@@]2(CCOc3c([N+](=O)[O-])cc(F)cc32)Oc2c1ccc1c2CCCC1 ZINC000587505547 GI Annotated Bother O=C[C@]1(Cc2cccc(Br)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587505550 GI Annotated Mild O=C[C@@]1(Cc2cccc(Br)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587505551 GI Annotated Mild C[C@]1(CC(=O)NCc2ccc(F)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587505629 GI Annotated Anodyne C[C@@]1(CC(=O)NCc2ccc(F)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587505634 GI Annotated Anodyne O=C1C[C@@H](c2c(O)ccc(O)c2Br)Oc2c1ccc1c2CCCC1 ZINC000587505760 GI Annotated Anodyne O=C1C[C@H](c2c(O)ccc(O)c2Br)Oc2c1ccc1c2CCCC1 ZINC000587505764 GI Annotated Anodyne O=C1C[C@@](CC2OCCO2)(c2cccc(F)c2)Oc2c1ccc1c2CCCC1 ZINC000587505907 GI Annotated Anodyne O=C1C[C@](CC2OCCO2)(c2cccc(F)c2)Oc2c1ccc1c2CCCC1 ZINC000587505909 GI Annotated Anodyne O=C1C[C@H](c2ccc(N3CCOCC3)c(F)c2)Oc2c1ccc1c2CCCC1 ZINC000587506069 GI Annotated Anodyne O=C1C[C@@H](c2ccc(N3CCOCC3)c(F)c2)Oc2c1ccc1c2CCCC1 ZINC000587506070 GI Annotated Anodyne CCOC(=O)C[C@]1(c2ccc(C#N)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587506097 GI Annotated Mild CCOC(=O)C[C@@]1(c2ccc(C#N)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587506099 GI Annotated Mild COc1ccc([C@@]2(CC#N)CC(=O)c3ccc4c(c3O2)CCCC4)cc1OC ZINC000587506213 GI Annotated Mild COc1ccc([C@]2(CC#N)CC(=O)c3ccc4c(c3O2)CCCC4)cc1OC ZINC000587506217 GI Annotated Mild O=C1C[C@](CO)(c2ccc(Br)cc2)Oc2c1ccc1c2CCCC1 ZINC000587506458 GI Annotated Anodyne O=C1C[C@@](CO)(c2ccc(Br)cc2)Oc2c1ccc1c2CCCC1 ZINC000587506461 GI Annotated Anodyne Cn1ccnc1[C@]1(c2ccccc2F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587506473 GI Annotated Anodyne Cn1ccnc1[C@@]1(c2ccccc2F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587506478 GI Annotated Anodyne C[C@@]1(c2sc(=N)[nH]c2C(F)(F)F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587506688 GI Annotated Anodyne C[C@]1(c2sc(=N)[nH]c2C(F)(F)F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587506721 GI Annotated Anodyne CCOC(=O)[C@]1(c2ccc(C)c(F)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587506789 GI Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(C)c(F)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587506790 GI Annotated Anodyne C[C@@]1(c2c(F)cccc2N2CCOCC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587506834 GI Annotated Anodyne C[C@]1(c2c(F)cccc2N2CCOCC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587506836 GI Annotated Anodyne O=C1C[C@H](c2ccc(F)c(N3CCOCC3)c2)Oc2c1ccc1c2CCCC1 ZINC000587506861 GI Annotated Anodyne O=C1C[C@@H](c2ccc(F)c(N3CCOCC3)c2)Oc2c1ccc1c2CCCC1 ZINC000587506862 GI Annotated Anodyne CCn1ncc(Br)c1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587506977 GI Annotated Anodyne CCn1ncc(Br)c1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587506980 GI Annotated Anodyne O=C[C@]1(c2ccccc2Br)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587506983 GI Annotated Mild O=C[C@@]1(c2ccccc2Br)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587506985 GI Annotated Mild O=C1C[C@@H](c2cc(I)c[nH]2)Oc2c1ccc1c2CCCC1 ZINC000587507013 GI Annotated Anodyne O=C1C[C@H](c2cc(I)c[nH]2)Oc2c1ccc1c2CCCC1 ZINC000587507015 GI Annotated Anodyne COC(=O)c1ccc([C@@]2(CC#N)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587507086 GI Annotated Mild COC(=O)c1ccc([C@]2(CC#N)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587507087 GI Annotated Mild CC(C)(C)OC(=O)N1CC(F)(F)[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)C1 ZINC000587507565 GI Annotated Anodyne CC(C)(C)OC(=O)N1CC(F)(F)[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)C1 ZINC000587507575 GI Annotated Anodyne COc1ccc([C@@]2(CCC(=O)O)CC(=O)c3ccc4c(c3O2)CCCC4)cc1F ZINC000587507786 GI Annotated Anodyne COc1ccc([C@]2(CCC(=O)O)CC(=O)c3ccc4c(c3O2)CCCC4)cc1F ZINC000587507787 GI Annotated Anodyne C[C@]1(Cc2c([N+](=O)[O-])ccc(O)c2F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587507805 GI Annotated Bother C[C@@]1(Cc2c([N+](=O)[O-])ccc(O)c2F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587507806 GI Annotated Bother CCOC(=O)[C@]1([C@@H](C#N)c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587507846 GI Annotated Mild CCOC(=O)[C@]1([C@H](C#N)c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587507848 GI Annotated Mild CCOC(=O)[C@@]1([C@@H](C#N)c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587507849 GI Annotated Mild CCOC(=O)[C@@]1([C@H](C#N)c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587507850 GI Annotated Mild CCOC(=O)[C@]1(c2cc(F)ccc2OC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508029 GI Annotated Anodyne CCOC(=O)[C@@]1(c2cc(F)ccc2OC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508032 GI Annotated Anodyne COC(=O)C[C@@]1(Cc2ccccc2F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508105 GI Annotated Anodyne COC(=O)C[C@]1(Cc2ccccc2F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508106 GI Annotated Anodyne O=C1C[C@H](c2ccc(OC(F)(F)C(=O)O)cc2)Oc2c1ccc1c2CCCC1 ZINC000587508211 GI Annotated Anodyne O=C1C[C@@H](c2ccc(OC(F)(F)C(=O)O)cc2)Oc2c1ccc1c2CCCC1 ZINC000587508222 GI Annotated Anodyne CN(C)c1ccc(NC(=O)C[C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587508231 GI Annotated Anodyne CN(C)c1ccc(NC(=O)C[C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587508234 GI Annotated Anodyne O=C1C[C@@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1ccc(C(F)(F)F)cc12 ZINC000587508277 GI Annotated Anodyne O=C1C[C@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1ccc(C(F)(F)F)cc12 ZINC000587508280 GI Annotated Anodyne O=C1C[C@@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1c(C(F)(F)F)cccc12 ZINC000587508359 GI Annotated Anodyne O=C1C[C@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1c(C(F)(F)F)cccc12 ZINC000587508362 GI Annotated Anodyne O=C1C[C@@H](c2ccc(I)o2)Oc2c1ccc1c2CCCC1 ZINC000587508399 GI Annotated Anodyne O=C1C[C@H](c2ccc(I)o2)Oc2c1ccc1c2CCCC1 ZINC000587508404 GI Annotated Anodyne C[C@@]1(c2ccc(N3CCOCC3)c(F)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508565 GI Annotated Anodyne C[C@]1(c2ccc(N3CCOCC3)c(F)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508570 GI Annotated Anodyne CC(=O)Nc1ccc2c(c1)[C@@]1(CCO2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508787 GI Annotated Anodyne CC(=O)Nc1ccc2c(c1)[C@]1(CCO2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587508789 GI Annotated Anodyne O=C1C[C@](c2ccc(Cl)c(Cl)c2)(C(O)O)Oc2c1ccc1c2CCCC1 ZINC000587508828 GI Annotated Anodyne O=C1C[C@@](c2ccc(Cl)c(Cl)c2)(C(O)O)Oc2c1ccc1c2CCCC1 ZINC000587508835 GI Annotated Anodyne COc1ccc([C@]2(C(=O)O)CC(=O)c3ccc4c(c3O2)CCCC4)cc1Cl ZINC000587508838 GI Annotated Anodyne COc1ccc([C@@]2(C(=O)O)CC(=O)c3ccc4c(c3O2)CCCC4)cc1Cl ZINC000587508841 GI Annotated Anodyne N#CC[C@]1(c2cccc3c2OCCO3)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509161 GI Annotated Mild N#CC[C@@]1(c2cccc3c2OCCO3)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509162 GI Annotated Mild CC(=O)OC[C@@]1(c2ccc(F)cc2F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509178 GI Annotated Anodyne CC(=O)OC[C@]1(c2ccc(F)cc2F)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509181 GI Annotated Anodyne CN1CCN(c2ccc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cc2F)CC1 ZINC000587509211 GI Annotated Anodyne CN1CCN(c2ccc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cc2F)CC1 ZINC000587509215 GI Annotated Anodyne COc1cc(C#N)ccc1OCC[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509269 GI Annotated Mild COc1cc(C#N)ccc1OCC[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509274 GI Annotated Mild COC(=O)[C@H](CCC#N)[C@@]1(C(C)(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509470 GI Annotated Mild COC(=O)[C@@H](CCC#N)[C@]1(C(C)(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509477 GI Annotated Mild COC(=O)[C@H](CCC#N)[C@]1(C(C)(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509480 GI Annotated Mild COC(=O)[C@@H](CCC#N)[C@@]1(C(C)(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509483 GI Annotated Mild C[C@@]1(CC(=O)NCCc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509496 GI Annotated Anodyne C[C@]1(CC(=O)NCCc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509500 GI Annotated Anodyne COc1ccc(OC)c([N+](=O)[O-])c1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509650 GI Annotated Bother COc1ccc(OC)c([N+](=O)[O-])c1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587509651 GI Annotated Bother Cc1ccc(CNC(=O)C[C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587509657 GI Annotated Anodyne Cc1ccc(CNC(=O)C[C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587509661 GI Annotated Anodyne O=C1C[C@H](c2cccc(OC(F)(F)C(=O)O)c2)Oc2c1ccc1c2CCCC1 ZINC000587509826 GI Annotated Anodyne O=C1C[C@@H](c2cccc(OC(F)(F)C(=O)O)c2)Oc2c1ccc1c2CCCC1 ZINC000587509827 GI Annotated Anodyne [N-]=[N+]=NCCN1C(=O)[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587509856 GI Annotated Clean [N-]=[N+]=NCCN1C(=O)[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587509860 GI Annotated Clean C[C@@]1(Cn2cc(C(F)(F)F)ccc2=O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587510042 GI Annotated Anodyne C[C@]1(Cn2cc(C(F)(F)F)ccc2=O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587510043 GI Annotated Anodyne C[C@@]1(c2cc3c(cc2[N+](=O)[O-])OCO3)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587510271 GI Annotated Bother C[C@]1(c2cc3c(cc2[N+](=O)[O-])OCO3)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587510274 GI Annotated Bother COC(=O)c1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)ccc1N(C)C ZINC000587510328 GI Annotated Anodyne COC(=O)c1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)ccc1N(C)C ZINC000587510330 GI Annotated Anodyne O=C(NC1CC2(CC(=O)c3ccc4c(c3O2)CCCC4)C1)OCc1ccccc1 ZINC000587510464 GI Annotated Anodyne COc1cc([N+](=O)[O-])c(OC)cc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587510480 GI Annotated Bother COc1cc([N+](=O)[O-])c(OC)cc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587510485 GI Annotated Bother CCO[C@@H](C)c1ccc([C@@]2(CN)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587510488 GI Annotated Anodyne CCO[C@H](C)c1ccc([C@@]2(CN)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587510493 GI Annotated Anodyne CCO[C@@H](C)c1ccc([C@]2(CN)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587510496 GI Annotated Anodyne CCO[C@H](C)c1ccc([C@]2(CN)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587510501 GI Annotated Anodyne O=C1CC2(CCN(c3ccc([N+](=O)[O-])cc3)CC2)Oc2c1ccc1c2CCCC1 ZINC000587510613 GI Annotated Bother COc1ccc2c(c1[N+](=O)[O-])[C@@]1(CC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587510658 GI Annotated Bother COc1ccc2c(c1[N+](=O)[O-])[C@]1(CC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587510662 GI Annotated Bother O=C1C[C@@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1cccc(C(F)(F)F)c12 ZINC000587510737 GI Annotated Anodyne O=C1C[C@]2(Oc3c1ccc1c3CCCC1)C(=O)Nc1cccc(C(F)(F)F)c12 ZINC000587510738 GI Annotated Anodyne CC(=O)N1CC[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccc(F)cc2C1 ZINC000587510807 GI Annotated Anodyne CC(=O)N1CC[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccc(F)cc2C1 ZINC000587510809 GI Annotated Anodyne COc1ccnc(-n2cccc2[C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1C#N ZINC000587510962 GI Annotated Mild COc1ccnc(-n2cccc2[C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1C#N ZINC000587510964 GI Annotated Mild O=C1C[C@H](c2cnc(=NCc3ccccc3)[nH]c2)Oc2c1ccc1c2CCCC1 ZINC000587511051 GI Annotated Anodyne O=C1C[C@@H](c2cnc(=NCc3ccccc3)[nH]c2)Oc2c1ccc1c2CCCC1 ZINC000587511057 GI Annotated Anodyne C[C@@]1(c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511097 GI Annotated Bother COc1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc([N+](=O)[O-])c1OC ZINC000587511098 GI Annotated Bother C[C@]1(c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511099 GI Annotated Bother COc1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc([N+](=O)[O-])c1OC ZINC000587511100 GI Annotated Bother C#CCNC(=O)Nc1ccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587511185 GI Annotated Mild C#CCNC(=O)Nc1ccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587511188 GI Annotated Mild CN(C)/C=C/c1nc(O)ccc1[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511248 GI Annotated Anodyne COc1cc([N+](=O)[O-])c([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1OC ZINC000587511254 GI Annotated Bother COc1cc([N+](=O)[O-])c([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1OC ZINC000587511255 GI Annotated Bother CN(C)/C=C/c1nc(O)ccc1[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511261 GI Annotated Anodyne C[C@]1([C@H](N=O)C(=O)Nc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511264 GI Annotated Anodyne C[C@@]1([C@H](N=O)C(=O)Nc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511270 GI Annotated Anodyne C[C@]1([C@@H](N=O)C(=O)Nc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511271 GI Annotated Anodyne COc1cc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc([N+](=O)[O-])c1O ZINC000587511272 GI Annotated Bother C[C@@]1([C@@H](N=O)C(=O)Nc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511273 GI Annotated Anodyne COc1cc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc([N+](=O)[O-])c1O ZINC000587511274 GI Annotated Bother COc1ccc(C[C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c([N+](=O)[O-])c1 ZINC000587511276 GI Annotated Bother COc1ccc(C[C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c([N+](=O)[O-])c1 ZINC000587511280 GI Annotated Bother CN(C)/C=C\[C@@]1(c2cccc([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511324 GI Annotated Bother CN(C)/C=C/[C@]1(c2cccc([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511327 GI Annotated Bother CN(C)/C=C/[C@@]1(c2cccc([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511329 GI Annotated Bother CN(C)/C=C\[C@]1(c2cccc([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511333 GI Annotated Bother COc1ccc(CNC(=O)C[C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587511421 GI Annotated Anodyne COc1ccc(CNC(=O)C[C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587511428 GI Annotated Anodyne C[C@]1(CC(=O)Nc2ccc3c(c2)OCO3)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511431 GI Annotated Anodyne C[C@@]1(CC(=O)Nc2ccc3c(c2)OCO3)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511433 GI Annotated Anodyne COc1ccccc1CNC(=O)C[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511446 GI Annotated Anodyne COc1ccccc1CNC(=O)C[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511448 GI Annotated Anodyne CCOc1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc([N+](=O)[O-])c1O ZINC000587511475 GI Annotated Bother CCOc1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc([N+](=O)[O-])c1O ZINC000587511477 GI Annotated Bother C[C@]1(c2ccc(N(CC(=O)O)N=O)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511566 GI Annotated Anodyne C[C@@]1(c2ccc(N(CC(=O)O)N=O)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511569 GI Annotated Anodyne C[C@H](CC(=O)O)[C@]1(c2ccc(N)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511610 GI Annotated Anodyne C[C@@H](CC(=O)O)[C@@]1(c2ccc(N)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511611 GI Annotated Anodyne C[C@@H](CC(=O)O)[C@]1(c2ccc(N)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511613 GI Annotated Anodyne CC(=O)NCCc1ccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587511614 GI Annotated Anodyne C[C@H](CC(=O)O)[C@@]1(c2ccc(N)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511615 GI Annotated Anodyne CC(=O)NCCc1ccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587511619 GI Annotated Anodyne COc1ccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1NC(C)=O ZINC000587511624 GI Annotated Anodyne COc1ccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1NC(C)=O ZINC000587511625 GI Annotated Anodyne O=C1C[C@H](c2nc(-c3ccc([N+](=O)[O-])cc3)no2)Oc2c1ccc1c2CCCC1 ZINC000587511724 GI Annotated Bother O=C1C[C@@H](c2nc(-c3ccc([N+](=O)[O-])cc3)no2)Oc2c1ccc1c2CCCC1 ZINC000587511725 GI Annotated Bother CCOC(=O)c1c(N)oc(C)c1[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511814 GI Annotated Anodyne CN(C)/C=C\[C@@]1(c2ccc([N+](=O)[O-])cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511818 GI Annotated Bother CN(C)/C=C\[C@]1(c2ccc([N+](=O)[O-])cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511819 GI Annotated Bother CN(C)/C=C/[C@]1(c2ccc([N+](=O)[O-])cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511820 GI Annotated Bother CN(C)/C=C/[C@@]1(c2ccc([N+](=O)[O-])cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511821 GI Annotated Bother CCOC(=O)c1c(N)oc(C)c1[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511826 GI Annotated Anodyne C[C@]1(CC(=O)Nc2cccc([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511834 GI Annotated Bother C[C@@]1(CC(=O)Nc2cccc([N+](=O)[O-])c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587511839 GI Annotated Bother CC(=O)N1CC[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc2C1 ZINC000587511922 GI Annotated Anodyne CC(=O)N1CC[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc2C1 ZINC000587511923 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1[N+](=O)[O-] ZINC000587512185 GI Annotated Bother CC(=O)Nc1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1[N+](=O)[O-] ZINC000587512187 GI Annotated Bother O=C1C[C@]2(CCN(Cc3ccccc3)C(=O)C2)Oc2c1ccc1c2CCCC1 ZINC000587512260 GI Annotated Anodyne O=C1C[C@@]2(CCN(Cc3ccccc3)C(=O)C2)Oc2c1ccc1c2CCCC1 ZINC000587512261 GI Annotated Anodyne C[C@]1(CC(=O)Nc2ccc([N+](=O)[O-])cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587512306 GI Annotated Bother C[C@@]1(CC(=O)Nc2ccc([N+](=O)[O-])cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587512309 GI Annotated Bother O=C1C[C@@H](c2coc3ccc([N+](=O)[O-])cc3c2=O)Oc2c1ccc1c2CCCC1 ZINC000587512321 GI Annotated Bother O=C1C[C@H](c2coc3ccc([N+](=O)[O-])cc3c2=O)Oc2c1ccc1c2CCCC1 ZINC000587512324 GI Annotated Bother C[C@]1(CCCOc2ccccc2C(N)=O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587512614 GI Annotated Anodyne C[C@@]1(CCCOc2ccccc2C(N)=O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587512616 GI Annotated Anodyne C[C@]1(CC(=O)NCCCc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587512631 GI Annotated Anodyne C[C@@]1(CC(=O)NCCCc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587512632 GI Annotated Anodyne COc1ccccc1[C@@]1(CNC(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587512684 GI Annotated Anodyne COc1ccccc1[C@]1(CNC(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587512686 GI Annotated Anodyne COc1ccc(NC(=O)C[C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587512753 GI Annotated Anodyne COc1ccc(NC(=O)C[C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587512756 GI Annotated Anodyne COc1cccc(NC(=O)C[C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587512762 GI Annotated Anodyne COc1cccc(NC(=O)C[C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587512765 GI Annotated Anodyne COc1ccccc1NC(=O)C[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587512777 GI Annotated Anodyne COc1ccccc1NC(=O)C[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587512779 GI Annotated Anodyne CCN1CCN(c2ccccc2[C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)CC1 ZINC000587512796 GI Annotated Anodyne CCN1CCN(c2ccccc2[C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)CC1 ZINC000587512797 GI Annotated Anodyne C[C@]1(c2ccccc2N2CCOC2=O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587512844 GI Annotated Anodyne C[C@@]1(c2ccccc2N2CCOC2=O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587512847 GI Annotated Anodyne O=C1C[C@@H](c2ccc(Cn3ccc([N+](=O)[O-])n3)o2)Oc2c1ccc1c2CCCC1 ZINC000587512858 GI Annotated Bother O=C1C[C@H](c2ccc(Cn3ccc([N+](=O)[O-])n3)o2)Oc2c1ccc1c2CCCC1 ZINC000587512859 GI Annotated Bother CN1CCCc2cc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cc(C=O)c21 ZINC000587512865 GI Annotated Anodyne CN1CCCc2cc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cc(C=O)c21 ZINC000587512869 GI Annotated Anodyne C=CN1CC[C@@H]([C@@]2(c3ccccc3)CC(=O)c3ccc4c(c3O2)CCCC4)C1=O ZINC000587512945 GI Annotated Anodyne C=CN1CC[C@H]([C@@]2(c3ccccc3)CC(=O)c3ccc4c(c3O2)CCCC4)C1=O ZINC000587512947 GI Annotated Anodyne C=CN1CC[C@@H]([C@]2(c3ccccc3)CC(=O)c3ccc4c(c3O2)CCCC4)C1=O ZINC000587512949 GI Annotated Anodyne C=CN1CC[C@H]([C@]2(c3ccccc3)CC(=O)c3ccc4c(c3O2)CCCC4)C1=O ZINC000587512950 GI Annotated Anodyne O=C1C[C@@H](c2ccc(C#Cc3cncnc3)cc2)Oc2c1ccc1c2CCCC1 ZINC000587513138 GI Annotated Mild CC(=O)N1CCc2cc([C@]3(C)CC(=O)c4ccc5c(c4O3)CCCC5)ccc21 ZINC000587513145 GI Annotated Anodyne CC(=O)N1CCc2cc([C@@]3(C)CC(=O)c4ccc5c(c4O3)CCCC5)ccc21 ZINC000587513147 GI Annotated Anodyne O=C1C[C@H](c2ccc(C#Cc3cncnc3)cc2)Oc2c1ccc1c2CCCC1 ZINC000587513150 GI Annotated Mild C[C@]1(c2cccc(N3CCOC3=O)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513156 GI Annotated Anodyne C[C@@]1(c2cccc(N3CCOC3=O)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513158 GI Annotated Anodyne N#Cc1ccc(CN2CCC3(CC2)CC(=O)c2ccc4c(c2O3)CCCC4)cc1 ZINC000587513215 GI Annotated Mild Cc1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)nc(N2CCCCC2)n1 ZINC000587513234 GI Annotated Anodyne O=C1C[C@@H](c2cc([N+](=O)[O-])cc3c2OCOC3)Oc2c1ccc1c2CCCC1 ZINC000587513236 GI Annotated Bother Cc1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)nc(N2CCCCC2)n1 ZINC000587513237 GI Annotated Anodyne O=C1C[C@H](c2cc([N+](=O)[O-])cc3c2OCOC3)Oc2c1ccc1c2CCCC1 ZINC000587513238 GI Annotated Bother O=C(N[C@@H]1CC[C@]12CC(=O)c1ccc3c(c1O2)CCCC3)OCc1ccccc1 ZINC000587513272 GI Annotated Anodyne O=C(N[C@H]1CC[C@]12CC(=O)c1ccc3c(c1O2)CCCC3)OCc1ccccc1 ZINC000587513275 GI Annotated Anodyne O=C(N[C@H]1CC[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3)OCc1ccccc1 ZINC000587513281 GI Annotated Anodyne O=C(N[C@@H]1CC[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3)OCc1ccccc1 ZINC000587513288 GI Annotated Anodyne Cn1nc(C(C)(C)C)c([N+](=O)[O-])c1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513468 GI Annotated Bother Cn1nc(C(C)(C)C)c([N+](=O)[O-])c1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513469 GI Annotated Bother N#CCCn1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c(-c2ccncc2)n1 ZINC000587513481 GI Annotated Mild N#CCCn1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c(-c2ccncc2)n1 ZINC000587513482 GI Annotated Mild Cc1c([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc2n1CC(N)=O ZINC000587513521 GI Annotated Clean Cc1c([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc2n1CC(N)=O ZINC000587513522 GI Annotated Clean CN(CCC[C@]1(c2cccnc2)CC(=O)c2ccc3c(c2O1)CCCC3)N=O ZINC000587513604 GI Annotated Anodyne CN(CCC[C@@]1(c2cccnc2)CC(=O)c2ccc3c(c2O1)CCCC3)N=O ZINC000587513608 GI Annotated Anodyne COc1cc(NC(C)=O)ccc1[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513655 GI Annotated Anodyne COc1cc(NC(C)=O)ccc1[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513657 GI Annotated Anodyne CCC[C@@]1(/C(=C\N(C)C)C(=O)OCC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513731 GI Annotated Anodyne CCC[C@]1(/C(=C/N(C)C)C(=O)OCC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513737 GI Annotated Anodyne CCC[C@@]1(/C(=C/N(C)C)C(=O)OCC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513740 GI Annotated Anodyne CCC[C@]1(/C(=C\N(C)C)C(=O)OCC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587513743 GI Annotated Anodyne O=C1C[C@H](c2ccc(N3CCC(O)CC3)cc2)Oc2c1ccc1c2CCCC1 ZINC000587513774 GI Annotated Anodyne O=C1C[C@@H](c2ccc(N3CCC(O)CC3)cc2)Oc2c1ccc1c2CCCC1 ZINC000587513778 GI Annotated Anodyne O=C1C[C@@H](c2ccc3c([N+](=O)[O-])ccc(O)c3n2)Oc2c1ccc1c2CCCC1 ZINC000587513927 GI Annotated Bother O=C1C[C@H](c2ccc3c([N+](=O)[O-])ccc(O)c3n2)Oc2c1ccc1c2CCCC1 ZINC000587513929 GI Annotated Bother O=C1C[C@@]2(CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)Oc2c1ccc1c2CCCC1 ZINC000587513972 GI Annotated Bother O=C1C[C@]2(CCCN(C(=O)c3ccccc3)C2)Oc2c1ccc1c2CCCC1 ZINC000587514193 GI Annotated Anodyne O=C1C[C@@]2(CCCN(C(=O)c3ccccc3)C2)Oc2c1ccc1c2CCCC1 ZINC000587514195 GI Annotated Anodyne C[C@@H](Oc1cccnc1)[C@]1(/C=C/N(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514243 GI Annotated Anodyne C[C@H](Oc1cccnc1)[C@@]1(/C=C/N(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514246 GI Annotated Anodyne C[C@H](Oc1cccnc1)[C@]1(/C=C/N(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514249 GI Annotated Anodyne C[C@@H](Oc1cccnc1)[C@@]1(/C=C/N(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514251 GI Annotated Anodyne O=C1C[C@]2(CCCC[C@H]2n2ccc([N+](=O)[O-])n2)Oc2c1ccc1c2CCCC1 ZINC000587514292 GI Annotated Bother O=C1C[C@]2(CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)Oc2c1ccc1c2CCCC1 ZINC000587514294 GI Annotated Bother O=C1C[C@@]2(CCCC[C@H]2n2ccc([N+](=O)[O-])n2)Oc2c1ccc1c2CCCC1 ZINC000587514296 GI Annotated Bother O=C1CC2(CCN(c3ccc4c(c3)OCO4)CC2)Oc2c1ccc1c2CCCC1 ZINC000587514331 GI Annotated Clean CCOC(=O)[C@@]1(c2ccc(N(C)C)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514373 GI Annotated Anodyne CCOC(=O)[C@]1(c2ccc(N(C)C)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514375 GI Annotated Anodyne O=C1C[C@@H](c2ccc(Cn3cc([N+](=O)[O-])cn3)o2)Oc2c1ccc1c2CCCC1 ZINC000587514460 GI Annotated Bother O=C1C[C@H](c2ccc(Cn3cc([N+](=O)[O-])cn3)o2)Oc2c1ccc1c2CCCC1 ZINC000587514461 GI Annotated Bother C[C@]1(c2ccc(N3CCOC3=O)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514684 GI Annotated Anodyne C[C@@]1(c2ccc(N3CCOC3=O)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514687 GI Annotated Anodyne CN1CCN(c2ccccc2[C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)CC1 ZINC000587514723 GI Annotated Anodyne CN1CCN(c2ccccc2[C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)CC1 ZINC000587514726 GI Annotated Anodyne O=C1C[C@]2(CCC(=O)N(Cc3ccccc3)CC2)Oc2c1ccc1c2CCCC1 ZINC000587514799 GI Annotated Anodyne CCOC(=O)CC[C@]1(c2ccccn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514802 GI Annotated Anodyne CCOC(=O)CC[C@@]1(c2ccccn2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514804 GI Annotated Anodyne O=C1C[C@@H](c2ccc(OC3CCOCC3)nc2)Oc2c1ccc1c2CCCC1 ZINC000587514806 GI Annotated Anodyne O=C1C[C@H](c2ccc(OC3CCOCC3)nc2)Oc2c1ccc1c2CCCC1 ZINC000587514808 GI Annotated Anodyne O=C1C[C@@]2(CCC(=O)N(Cc3ccccc3)CC2)Oc2c1ccc1c2CCCC1 ZINC000587514811 GI Annotated Anodyne CN1CCN(c2cccc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)c2)CC1 ZINC000587514848 GI Annotated Anodyne CN1CCN(c2cccc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)c2)CC1 ZINC000587514850 GI Annotated Anodyne O=C(O)c1ccc(N2CCC3(CC2)CC(=O)c2ccc4c(c2O3)CCCC4)cc1 ZINC000587514866 GI Annotated Anodyne CN(C)/C=C/[C@@]1(c2ccc3c(c2)OCO3)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514925 GI Annotated Anodyne CN(C)/C=C/[C@]1(c2ccc3c(c2)OCO3)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514926 GI Annotated Anodyne CC(C)(C)OC(=O)N=c1cc[nH]cc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514945 GI Annotated Anodyne CC(C)(C)OC(=O)N=c1cc[nH]cc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514946 GI Annotated Anodyne CNC(=O)COc1c(C)cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1C ZINC000587514965 GI Annotated Anodyne CNC(=O)COc1c(C)cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1C ZINC000587514966 GI Annotated Anodyne CC(C)(C)C(=O)N=c1cc[nH]cc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514989 GI Annotated Anodyne CC(C)(C)C(=O)N=c1cc[nH]cc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587514990 GI Annotated Anodyne NC(=O)CCn1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587515037 GI Annotated Anodyne NC(=O)CCn1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587515038 GI Annotated Anodyne Cn1c(C(=O)O)c([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587515087 GI Annotated Clean Cn1c(C(=O)O)c([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587515091 GI Annotated Clean CN1CCCc2cc(C=O)cc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)c21 ZINC000587515118 GI Annotated Anodyne CN1CCCc2cc(C=O)cc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)c21 ZINC000587515121 GI Annotated Anodyne C[C@H]1CN(c2ccc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cn2)C[C@@H](C)O1 ZINC000587515124 GI Annotated Anodyne C[C@@H]1CN(c2ccc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cn2)C[C@@H](C)O1 ZINC000587515127 GI Annotated Anodyne C[C@@H]1CN(c2ccc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cn2)C[C@@H](C)O1 ZINC000587515130 GI Annotated Anodyne C[C@H]1CN(c2ccc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cn2)C[C@@H](C)O1 ZINC000587515132 GI Annotated Anodyne C=CN1CCCC[C@H]([C@]2(C3CC3)CC(=O)c3ccc4c(c3O2)CCCC4)C1=O ZINC000587515147 GI Annotated Anodyne C=CN1CCCC[C@@H]([C@]2(C3CC3)CC(=O)c3ccc4c(c3O2)CCCC4)C1=O ZINC000587515148 GI Annotated Anodyne C=CN1CCCC[C@H]([C@@]2(C3CC3)CC(=O)c3ccc4c(c3O2)CCCC4)C1=O ZINC000587515150 GI Annotated Anodyne C=CN1CCCC[C@@H]([C@@]2(C3CC3)CC(=O)c3ccc4c(c3O2)CCCC4)C1=O ZINC000587515152 GI Annotated Anodyne O=C1C[C@@H](c2ccc(N3CCC(CO)CC3)cc2)Oc2c1ccc1c2CCCC1 ZINC000587515165 GI Annotated Anodyne O=C1C[C@H](c2ccc(N3CCC(CO)CC3)cc2)Oc2c1ccc1c2CCCC1 ZINC000587515168 GI Annotated Anodyne COc1nc(N2CCCC2)ccc1[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515173 GI Annotated Anodyne COc1nc(N2CCCC2)ccc1[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515175 GI Annotated Anodyne C[C@]1(c2ccc(N3CCC(O)CC3)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515299 GI Annotated Anodyne CCOC(=O)CC[C@]1(c2cccnc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515300 GI Annotated Anodyne CCOC(=O)CC[C@@]1(c2cccnc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515301 GI Annotated Anodyne C[C@@]1(c2ccc(N3CCC(O)CC3)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515302 GI Annotated Anodyne C[C@]1([C@H]2CN(Cc3ccccc3)CCO2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515590 GI Annotated Anodyne C[C@@]1([C@H]2CN(Cc3ccccc3)CCO2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515591 GI Annotated Anodyne C[C@]1([C@@H]2CN(Cc3ccccc3)CCO2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515592 GI Annotated Anodyne C[C@@]1([C@@H]2CN(Cc3ccccc3)CCO2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515593 GI Annotated Anodyne CN1CCN(c2ccc([C@@]3(C)CC(=O)c4ccc5c(c4O3)CCCC5)cc2)CC1 ZINC000587515616 GI Annotated Anodyne CN1CCN(c2ccc([C@]3(C)CC(=O)c4ccc5c(c4O3)CCCC5)cc2)CC1 ZINC000587515617 GI Annotated Anodyne CCn1cc([C@]2(/C=C\N(C)C)CC(=O)c3ccc4c(c3O2)CCCC4)c(C)n1 ZINC000587515687 GI Annotated Anodyne CCn1cc([C@@]2(/C=C/N(C)C)CC(=O)c3ccc4c(c3O2)CCCC4)c(C)n1 ZINC000587515688 GI Annotated Anodyne CCn1cc([C@]2(/C=C/N(C)C)CC(=O)c3ccc4c(c3O2)CCCC4)c(C)n1 ZINC000587515689 GI Annotated Anodyne CCn1cc([C@@]2(/C=C\N(C)C)CC(=O)c3ccc4c(c3O2)CCCC4)c(C)n1 ZINC000587515690 GI Annotated Anodyne O=C1c2ccccc2[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccncc21 ZINC000587515748 GI Annotated Anodyne O=C1c2ccccc2[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccncc21 ZINC000587515749 GI Annotated Anodyne O=C1C[C@@](C(=O)c2ccccn2)(c2ccccn2)Oc2c1ccc1c2CCCC1 ZINC000587515758 GI Annotated Anodyne O=C1C[C@](C(=O)c2ccccn2)(c2ccccn2)Oc2c1ccc1c2CCCC1 ZINC000587515759 GI Annotated Anodyne CCN1CCN(c2ccc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cc2)CC1 ZINC000587515828 GI Annotated Anodyne CCN1CCN(c2ccc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cc2)CC1 ZINC000587515829 GI Annotated Anodyne COC(=O)[C@@]1(c2cn(C)c3ccccc23)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515989 GI Annotated Anodyne COC(=O)[C@]1(c2cn(C)c3ccccc23)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587515990 GI Annotated Anodyne COc1nc(N2CCCC2)ccc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516154 GI Annotated Anodyne COc1nc(N2CCCC2)ccc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516155 GI Annotated Anodyne CN1CCN(c2ccc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cc2)CC1 ZINC000587516200 GI Annotated Anodyne CN1CCN(c2ccc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cc2)CC1 ZINC000587516201 GI Annotated Anodyne CCOC(=O)[C@@H](c1cccnc1)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516321 GI Annotated Anodyne CCOC(=O)[C@H](c1cccnc1)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516323 GI Annotated Anodyne CCOC(=O)[C@@H](c1cccnc1)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516325 GI Annotated Anodyne CCOC(=O)[C@H](c1cccnc1)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516327 GI Annotated Anodyne CCn1ncc([C@]2(/C=C\N(C)C)CC(=O)c3ccc4c(c3O2)CCCC4)c1C ZINC000587516352 GI Annotated Anodyne CCn1ncc([C@@]2(/C=C/N(C)C)CC(=O)c3ccc4c(c3O2)CCCC4)c1C ZINC000587516356 GI Annotated Anodyne CCn1ncc([C@]2(/C=C/N(C)C)CC(=O)c3ccc4c(c3O2)CCCC4)c1C ZINC000587516358 GI Annotated Anodyne CCn1ncc([C@@]2(/C=C\N(C)C)CC(=O)c3ccc4c(c3O2)CCCC4)c1C ZINC000587516360 GI Annotated Anodyne Cc1c([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)nnn1Cc1ccccc1 ZINC000587516393 GI Annotated Anodyne Cc1c([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)nnn1Cc1ccccc1 ZINC000587516406 GI Annotated Anodyne Cc1nn(CC(=O)OC(C)C)c(C)c1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516488 GI Annotated Anodyne Cc1nn(CC(=O)OC(C)C)c(C)c1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516489 GI Annotated Anodyne O=C1c2ccccc2[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2cnccc21 ZINC000587516802 GI Annotated Anodyne O=C1c2ccccc2[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2cnccc21 ZINC000587516805 GI Annotated Anodyne CCOC(=O)c1nn(C(C)(C)C)cc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516806 GI Annotated Anodyne CCOC(=O)c1nn(C(C)(C)C)cc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587516809 GI Annotated Anodyne O=C1C[C@]2(CCCc3nn(-c4ccccc4)nc32)Oc2c1ccc1c2CCCC1 ZINC000587516913 GI Annotated Anodyne O=C1C[C@@]2(CCCc3nn(-c4ccccc4)nc32)Oc2c1ccc1c2CCCC1 ZINC000587516915 GI Annotated Anodyne O=C(O)Cn1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587516968 GI Annotated Anodyne O=C(O)Cn1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587516969 GI Annotated Anodyne COC(=O)Cn1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587516986 GI Annotated Anodyne COC(=O)Cn1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587516987 GI Annotated Anodyne C[C@@]1(c2cn(CC(=O)O)c3ccccc23)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517022 GI Annotated Anodyne C[C@]1(c2cn(CC(=O)O)c3ccccc23)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517023 GI Annotated Anodyne Cc1ccc([C@]2(CCn3cncn3)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587517110 GI Annotated Anodyne Cc1ccc([C@@]2(CCn3cncn3)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587517111 GI Annotated Anodyne O=C1C[C@]2(CN(Cc3ccccc3)C(=O)C23CC3)Oc2c1ccc1c2CCCC1 ZINC000587517192 GI Annotated Anodyne O=C1C[C@@]2(CN(Cc3ccccc3)C(=O)C23CC3)Oc2c1ccc1c2CCCC1 ZINC000587517193 GI Annotated Anodyne CC(C)(C)OC(=O)N1CC[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@@H](C#N)C1 ZINC000587517350 GI Annotated Mild CC(C)(C)OC(=O)N1CC[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@H](C#N)C1 ZINC000587517351 GI Annotated Mild CC(C)(C)OC(=O)N1CC[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@@H](C#N)C1 ZINC000587517352 GI Annotated Mild CC(C)(C)OC(=O)N1CC[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)[C@H](C#N)C1 ZINC000587517353 GI Annotated Mild CC(C)(C)OC(=O)N1C(=O)C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)C1(C)C ZINC000587517362 GI Annotated Anodyne CC(C)(C)OC(=O)N1C(=O)C[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)C1(C)C ZINC000587517363 GI Annotated Anodyne CC1=C[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)CC(=O)N1Cc1ccco1 ZINC000587517368 GI Annotated Anodyne CC1=C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)CC(=O)N1Cc1ccco1 ZINC000587517369 GI Annotated Anodyne C[C@@H]1CN(C(=O)OC(C)(C)C)C(=O)C[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587517408 GI Annotated Anodyne C[C@H]1CN(C(=O)OC(C)(C)C)C(=O)C[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587517409 GI Annotated Anodyne C[C@H]1CN(C(=O)OC(C)(C)C)C(=O)C[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587517410 GI Annotated Anodyne C[C@@H]1CN(C(=O)OC(C)(C)C)C(=O)C[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587517411 GI Annotated Anodyne C[C@H]1CN(Cc2ccccn2)CC[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587517558 GI Annotated Anodyne C[C@@H]1CN(Cc2ccccn2)CC[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587517559 GI Annotated Anodyne C[C@@H]1CN(Cc2ccccn2)CC[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587517560 GI Annotated Anodyne C[C@H]1CN(Cc2ccccn2)CC[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587517561 GI Annotated Anodyne O=C1C[C@]2(CCCc3c2cnn3-c2ccccn2)Oc2c1ccc1c2CCCC1 ZINC000587517762 GI Annotated Anodyne O=C1C[C@@]2(CCCc3c2cnn3-c2ccccn2)Oc2c1ccc1c2CCCC1 ZINC000587517763 GI Annotated Anodyne CC(C)(C)OC(=O)N1CC([C@@]2(CC#N)CC(=O)c3ccc4c(c3O2)CCCC4)C1 ZINC000587517812 GI Annotated Mild CC(C)(C)OC(=O)N1CC([C@]2(CC#N)CC(=O)c3ccc4c(c3O2)CCCC4)C1 ZINC000587517813 GI Annotated Mild CC(C)(C)OC(=O)N1CC[C@@H]1[C@@]1(CC#N)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517815 GI Annotated Mild CC(C)(C)OC(=O)N1CC[C@H]1[C@]1(CC#N)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517816 GI Annotated Mild CC(C)(C)OC(=O)N1CC[C@H]1[C@@]1(CC#N)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517817 GI Annotated Mild CC(C)(C)OC(=O)N1CC[C@@H]1[C@]1(CC#N)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587517818 GI Annotated Mild CC1=C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)CC(=O)N1Cc1cccnc1 ZINC000587517891 GI Annotated Anodyne CC1=C[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)CC(=O)N1Cc1cccnc1 ZINC000587517892 GI Annotated Anodyne CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@]1(CC(=O)c3ccc4c(c3O1)CCCC4)C2 ZINC000587518158 GI Annotated Anodyne CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@@]1(CC(=O)c3ccc4c(c3O1)CCCC4)C2 ZINC000587518159 GI Annotated Anodyne CC(C)(C)OC(=O)N1[C@H]2CC[C@H]1[C@]1(CC(=O)c3ccc4c(c3O1)CCCC4)C2 ZINC000587518160 GI Annotated Anodyne CC(C)(C)OC(=O)N1[C@H]2CC[C@@H]1[C@@]1(CC(=O)c3ccc4c(c3O1)CCCC4)C2 ZINC000587518161 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H]2C[C@H](C1)C21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518162 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H]2[C@H]([C@@]3(C)CC(=O)c4ccc5c(c4O3)CCCC5)[C@@H]2C1 ZINC000587518227 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518228 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H]2[C@H]([C@]3(C)CC(=O)c4ccc5c(c4O3)CCCC5)[C@@H]2C1 ZINC000587518229 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518230 GI Annotated Anodyne COc1cc(N2CCOCC2)ccc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518251 GI Annotated Anodyne COc1cc(N2CCOCC2)ccc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518252 GI Annotated Anodyne C[C@@]1(c2ccc(N3CCOCC3)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518284 GI Annotated Anodyne C[C@]1(c2ccc(N3CCOCC3)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518285 GI Annotated Anodyne CN1C(=O)CCc2cc([C@]3(C)CC(=O)c4ccc5c(c4O3)CCCC5)ccc21 ZINC000587518290 GI Annotated Anodyne CN1C(=O)CCc2cc([C@@]3(C)CC(=O)c4ccc5c(c4O3)CCCC5)ccc21 ZINC000587518291 GI Annotated Anodyne O=C1C[C@H](C2(CN3CCOCC3)CCCCC2)Oc2c1ccc1c2CCCC1 ZINC000587518324 GI Annotated Anodyne O=C1C[C@@H](C2(CN3CCOCC3)CCCCC2)Oc2c1ccc1c2CCCC1 ZINC000587518325 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518332 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H]2[C@H]([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)[C@@H]2C1 ZINC000587518333 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H]2[C@@H](C1)[C@@H]2[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518334 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H]2C([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)[C@@H]2C1 ZINC000587518335 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H]2[C@H]([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)[C@@H]2C1 ZINC000587518336 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H]2C([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)[C@@H]2C1 ZINC000587518337 GI Annotated Anodyne CC(C)(C)OC(=O)N1[C@H]2C[C@H]1CC1(CC(=O)c3ccc4c(c3O1)CCCC4)C2 ZINC000587518532 GI Annotated Anodyne CC(C)(C)OC(=O)N1CCC12CC1(CC(=O)c3ccc4c(c3O1)CCCC4)C2 ZINC000587518533 GI Annotated Anodyne Cc1ccccc1[C@]1(CN2CCOCC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518593 GI Annotated Anodyne Cc1ccccc1[C@@]1(CN2CCOCC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518594 GI Annotated Anodyne O=C1C[C@H](c2cccc(CN3CCOCC3)c2)Oc2c1ccc1c2CCCC1 ZINC000587518690 GI Annotated Anodyne O=C1C[C@@H](c2cccc(CN3CCOCC3)c2)Oc2c1ccc1c2CCCC1 ZINC000587518691 GI Annotated Anodyne CC(C)(C)OC(=O)N1CC2(CC[C@@]23CC(=O)c2ccc4c(c2O3)CCCC4)C1 ZINC000587518746 GI Annotated Anodyne CC(C)(C)OC(=O)N1CC2(CC[C@]23CC(=O)c2ccc4c(c2O3)CCCC4)C1 ZINC000587518747 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1C[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518752 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1C[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518753 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H]2C[C@@]3(CC(=O)c4ccc5c(c4O3)CCCC5)[C@H]2C1 ZINC000587518785 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C1)C[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518786 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H]2C[C@@]3(CC(=O)c4ccc5c(c4O3)CCCC5)[C@H]2C1 ZINC000587518787 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H]2[C@H](C1)C[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518788 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H]2C[C@]3(CC(=O)c4ccc5c(c4O3)CCCC5)[C@H]2C1 ZINC000587518789 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@@H]2C[C@]3(CC(=O)c4ccc5c(c4O3)CCCC5)[C@H]2C1 ZINC000587518790 GI Annotated Anodyne C[C@@]1(c2cccc(N3CCOCC3)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518795 GI Annotated Anodyne C[C@]1(c2cccc(N3CCOCC3)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518796 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518838 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H]2CC[C@H]1[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518839 GI Annotated Anodyne Cc1cc(N2CCOCC2)ccc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518956 GI Annotated Clean Cc1cc(N2CCOCC2)ccc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587518957 GI Annotated Clean CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@@]1(CC(=O)c3ccc4c(c3O1)CCCC4)C2 ZINC000587518984 GI Annotated Anodyne CC(C)(C)OC(=O)N1C[C@H]2C[C@H]1[C@]1(CC(=O)c3ccc4c(c3O1)CCCC4)C2 ZINC000587518985 GI Annotated Anodyne CC(C)CN1C(=O)[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587518994 GI Annotated Anodyne CC(C)CN1C(=O)[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587518995 GI Annotated Anodyne CC(C)(C)OC(=O)N1CC2(C1)CC1(CC(=O)c3ccc4c(c3O1)CCCC4)C2 ZINC000587518998 GI Annotated Anodyne O=C1C[C@](CCN2CCOCC2)(c2ccccc2)Oc2c1ccc1c2CCCC1 ZINC000587519322 GI Annotated Anodyne O=C1C[C@@](CCN2CCOCC2)(c2ccccc2)Oc2c1ccc1c2CCCC1 ZINC000587519323 GI Annotated Anodyne COCCOCCOc1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587520439 GI Annotated Anodyne COCCOCCOc1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587520440 GI Annotated Anodyne CCOC(=O)COc1cccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587520467 GI Annotated Anodyne CCOC(=O)COc1cccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587520468 GI Annotated Anodyne CCOC(=O)COc1ccccc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587520493 GI Annotated Anodyne CCOC(=O)COc1ccccc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587520494 GI Annotated Anodyne O=C(O)c1ccc(OC[C@]2(C3CC3)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587520534 GI Annotated Anodyne O=C(O)c1ccc(OC[C@@]2(C3CC3)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587520535 GI Annotated Anodyne COC(=O)[C@H](C)Oc1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587520873 GI Annotated Anodyne COC(=O)[C@H](C)Oc1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587520875 GI Annotated Anodyne COC(=O)[C@@H](C)Oc1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587520877 GI Annotated Anodyne COC(=O)[C@@H](C)Oc1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587520878 GI Annotated Anodyne C[C@]1(CCc2ccc(OCC(=O)O)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587520929 GI Annotated Anodyne C[C@@]1(CCc2ccc(OCC(=O)O)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587520930 GI Annotated Anodyne CCOC(=O)COc1ccccc1[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587521020 GI Annotated Anodyne CCOC(=O)COc1ccccc1[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587521021 GI Annotated Anodyne CCOC(=O)[C@]1(CCc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587521042 GI Annotated Anodyne CCOC(=O)[C@@]1(CCc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587521043 GI Annotated Anodyne C[C@]1(c2ccc(O)c3nc(O)ccc23)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587521346 GI Annotated Anodyne C[C@@]1(c2ccc(O)c3nc(O)ccc23)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587521386 GI Annotated Anodyne COCCOc1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1OC ZINC000587521597 GI Annotated Anodyne COCCOc1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1OC ZINC000587521603 GI Annotated Anodyne CCOC(=O)[C@H](Cc1ccccc1)[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587521701 GI Annotated Anodyne CCOC(=O)[C@H](Cc1ccccc1)[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587521703 GI Annotated Anodyne CCOC(=O)[C@@H](Cc1ccccc1)[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587521705 GI Annotated Anodyne CCOC(=O)[C@@H](Cc1ccccc1)[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587521706 GI Annotated Anodyne COC1=C(OC)[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc2C1=O ZINC000587521767 GI Annotated Mild COC1=C(OC)[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc2C1=O ZINC000587521772 GI Annotated Mild COc1cc(OC)c([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c(OC)c1 ZINC000587521951 GI Annotated Anodyne COc1cc(OC)c([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c(OC)c1 ZINC000587521954 GI Annotated Anodyne O=C1C[C@](Cc2c[nH]c3ccccc23)(C(=O)O)Oc2c1ccc1c2CCCC1 ZINC000587522176 GI Annotated Anodyne O=C1C[C@@](Cc2c[nH]c3ccccc23)(C(=O)O)Oc2c1ccc1c2CCCC1 ZINC000587522196 GI Annotated Anodyne CCOc1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1C(=O)OC ZINC000587522251 GI Annotated Anodyne CCOc1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1C(=O)OC ZINC000587522253 GI Annotated Anodyne CCOC(=O)c1nocc1[C@]1(C2CC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522270 GI Annotated Anodyne CCOC(=O)c1nocc1[C@@]1(C2CC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522273 GI Annotated Anodyne COC(=O)[C@]1(c2c[nH]c3ccccc23)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522362 GI Annotated Anodyne COC(=O)[C@@]1(c2c[nH]c3ccccc23)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522364 GI Annotated Anodyne C[C@]1(c2ccc(OCCC(=O)O)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522418 GI Annotated Anodyne C[C@@]1(c2ccc(OCCC(=O)O)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522423 GI Annotated Anodyne CCOC(=O)C[C@]1(c2ccccc2OC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522647 GI Annotated Anodyne CCOC(=O)C[C@@]1(c2ccccc2OC)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522650 GI Annotated Anodyne COC(=O)[C@H](C)[C@]1(Cc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522800 GI Annotated Anodyne COC(=O)[C@@H](C)[C@]1(Cc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522802 GI Annotated Anodyne COC(=O)[C@H](C)[C@@]1(Cc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522806 GI Annotated Anodyne COC(=O)[C@@H](C)[C@@]1(Cc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587522809 GI Annotated Anodyne O=C1CC2(CC(C(=O)OCc3ccccc3)C2)Oc2c1ccc1c2CCCC1 ZINC000587522907 GI Annotated Anodyne O=C1C[C@]2(CC3(CCNCC3)Oc3ccccc32)Oc2c1ccc1c2CCCC1 ZINC000587523001 GI Annotated Anodyne O=C1C[C@@]2(CC3(CCNCC3)Oc3ccccc32)Oc2c1ccc1c2CCCC1 ZINC000587523010 GI Annotated Anodyne COc1cccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1O[C@@H](C)C(=O)O ZINC000587523087 GI Annotated Anodyne COc1cccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1O[C@@H](C)C(=O)O ZINC000587523088 GI Annotated Anodyne COc1cccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1O[C@H](C)C(=O)O ZINC000587523089 GI Annotated Anodyne COc1cccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1O[C@H](C)C(=O)O ZINC000587523090 GI Annotated Anodyne Cc1[nH]c2ccccc2c1[C@@]1(C(=O)O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587523156 GI Annotated Anodyne Cc1[nH]c2ccccc2c1[C@]1(C(=O)O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587523160 GI Annotated Anodyne Cc1nn2c(=O)c3ccccc3[nH]c2c1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587523240 GI Annotated Anodyne Cc1nn2c(=O)c3ccccc3[nH]c2c1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587523244 GI Annotated Anodyne CCOC(=O)C[C@]1(c2ccc(OC)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587523387 GI Annotated Anodyne CCOC(=O)C[C@@]1(c2ccc(OC)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587523388 GI Annotated Anodyne CCOC(=O)[C@@]1(c2ccc(OCC)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587523557 GI Annotated Anodyne CCOC(=O)[C@]1(c2ccc(OCC)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587523559 GI Annotated Anodyne Cc1cc2cc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)c3nnnn3c2cc1C ZINC000587523848 GI Annotated Anodyne Cc1cc2cc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)c3nnnn3c2cc1C ZINC000587523851 GI Annotated Anodyne O=C1C[C@@H](c2c[nH]nc2-c2ccc3c(c2)OCO3)Oc2c1ccc1c2CCCC1 ZINC000587524032 GI Annotated Anodyne O=C1C[C@H](c2c[nH]nc2-c2ccc3c(c2)OCO3)Oc2c1ccc1c2CCCC1 ZINC000587524040 GI Annotated Anodyne COC(=O)[C@H](C)[C@@]1(c2cccc(OC)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587524288 GI Annotated Anodyne COC(=O)[C@@H](C)[C@]1(c2cccc(OC)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587524291 GI Annotated Anodyne COC(=O)[C@H](C)[C@]1(c2cccc(OC)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587524292 GI Annotated Anodyne COC(=O)[C@@H](C)[C@@]1(c2cccc(OC)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587524293 GI Annotated Anodyne COc1cc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc(OC)c1OC ZINC000587524323 GI Annotated Anodyne COc1cc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc(OC)c1OC ZINC000587524324 GI Annotated Anodyne COc1ccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1CC(=O)O ZINC000587524767 GI Annotated Anodyne COc1ccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1CC(=O)O ZINC000587524773 GI Annotated Anodyne COC(=O)[C@@H]1CC[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587524912 GI Annotated Anodyne COC(=O)[C@@H]1CC[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587524917 GI Annotated Anodyne COC(=O)[C@H]1CC[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587524919 GI Annotated Anodyne COC(=O)[C@H]1CC[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc21 ZINC000587524921 GI Annotated Anodyne Cc1c([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)[nH]c2cc(O)nc(O)c12 ZINC000587524965 GI Annotated Clean Cc1c([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)[nH]c2cc(O)nc(O)c12 ZINC000587524989 GI Annotated Clean CCOC(=O)C(=O)C[C@]1(C2CCCCC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525207 GI Annotated Anodyne CCOC(=O)C(=O)C[C@@]1(C2CCCCC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525218 GI Annotated Anodyne C[C@@H](Oc1ccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1)C(=O)O ZINC000587525229 GI Annotated Anodyne C[C@H](Oc1ccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1)C(=O)O ZINC000587525230 GI Annotated Anodyne C[C@H](Oc1ccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1)C(=O)O ZINC000587525232 GI Annotated Anodyne CC(=O)Oc1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1OC(C)=O ZINC000587525233 GI Annotated Anodyne C[C@@H](Oc1ccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1)C(=O)O ZINC000587525234 GI Annotated Anodyne CC(=O)Oc1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1OC(C)=O ZINC000587525238 GI Annotated Anodyne Cc1[nH]c(C(=O)CC#N)c(C)c1[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525578 GI Annotated Mild Cc1[nH]c(C(=O)CC#N)c(C)c1[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525595 GI Annotated Mild CCOC(=O)C[C@]1(Cc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525717 GI Annotated Anodyne CCOC(=O)C[C@@]1(Cc2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525718 GI Annotated Anodyne CCOC(=O)C[C@@]1(c2cccc(O)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525792 GI Annotated Anodyne CC(=O)c1c(C)[nH]c([C@@]2(CC#N)CC(=O)c3ccc4c(c3O2)CCCC4)c1C ZINC000587525799 GI Annotated Mild CC(=O)c1c(C)[nH]c([C@]2(CC#N)CC(=O)c3ccc4c(c3O2)CCCC4)c1C ZINC000587525800 GI Annotated Mild CCOC(=O)C[C@]1(c2cccc(O)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587525804 GI Annotated Anodyne O=C1C[C@@H](c2ccc(OCc3ncon3)cc2)Oc2c1ccc1c2CCCC1 ZINC000587525829 GI Annotated Anodyne O=C1C[C@H](c2ccc(OCc3ncon3)cc2)Oc2c1ccc1c2CCCC1 ZINC000587525830 GI Annotated Anodyne COCCOc1ccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1OC ZINC000587525842 GI Annotated Anodyne COCCOc1ccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1OC ZINC000587525843 GI Annotated Anodyne COc1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)ccc1OCCC(=O)O ZINC000587525986 GI Annotated Anodyne COc1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)ccc1OCCC(=O)O ZINC000587525987 GI Annotated Anodyne COC(=O)[C@@]12C[C@H]3C[C@@H](C1)[C@@]1(CC(=O)c4ccc5c(c4O1)CCCC5)[C@H](C3)C2 ZINC000587526182 GI Annotated Anodyne COC(=O)[C@@]12C[C@H]3C[C@@H](C1)[C@]1(CC(=O)c4ccc5c(c4O1)CCCC5)[C@H](C3)C2 ZINC000587526186 GI Annotated Anodyne CCOC(=O)[C@@H]1Cc2ccccc2[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587526286 GI Annotated Anodyne CCOC(=O)[C@H]1Cc2ccccc2[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587526303 GI Annotated Anodyne CCOC(=O)[C@@H]1Cc2ccccc2[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587526306 GI Annotated Anodyne CCOC(=O)[C@H]1Cc2ccccc2[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587526310 GI Annotated Anodyne CC[C@]1(c2ccc(OCC(=O)O)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587526493 GI Annotated Anodyne CC[C@@]1(c2ccc(OCC(=O)O)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587526497 GI Annotated Anodyne COc1ccc([C@@]2(CCC(=O)O)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587526500 GI Annotated Anodyne COc1ccc([C@]2(CCC(=O)O)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587526502 GI Annotated Anodyne CCOC(=O)COc1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587526530 GI Annotated Anodyne CCOC(=O)COc1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587526533 GI Annotated Anodyne C[C@@H](Oc1cccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c1)C(=O)O ZINC000587526582 GI Annotated Anodyne C[C@H](Oc1cccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c1)C(=O)O ZINC000587526588 GI Annotated Anodyne C[C@H](Oc1cccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c1)C(=O)O ZINC000587526590 GI Annotated Anodyne C[C@@H](Oc1cccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)c1)C(=O)O ZINC000587526591 GI Annotated Anodyne COC(=O)COc1c(C)cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1C ZINC000587526612 GI Annotated Anodyne COC(=O)COc1c(C)cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1C ZINC000587526616 GI Annotated Anodyne CCOC(=O)COc1ccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587526735 GI Annotated Anodyne CCOC(=O)COc1ccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587526736 GI Annotated Anodyne CC(=O)OC12CC3C[C@@H](C1)C1(CC(=O)c4ccc5c(c4O1)CCCC5)[C@@H](C3)C2 ZINC000587526901 GI Annotated Anodyne CCOC(=O)[C@@]1(c2c[nH]c3ccccc23)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587526975 GI Annotated Anodyne CCOC(=O)[C@]1(c2c[nH]c3ccccc23)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587526976 GI Annotated Anodyne COC(=O)[C@H](C)[C@@]1(c2ccc(OC)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587527122 GI Annotated Anodyne COC(=O)[C@@H](C)[C@]1(c2ccc(OC)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587527125 GI Annotated Anodyne COC(=O)[C@H](C)[C@]1(c2ccc(OC)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587527129 GI Annotated Anodyne COC(=O)[C@@H](C)[C@@]1(c2ccc(OC)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587527132 GI Annotated Anodyne COC(=O)[C@@]1(c2c(C)[nH]c3ccccc23)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587527223 GI Annotated Anodyne COC(=O)[C@]1(c2c(C)[nH]c3ccccc23)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587527228 GI Annotated Anodyne O=C1C[C@@H](c2cc3cc4c(cc3nc2O)OCO4)Oc2c1ccc1c2CCCC1 ZINC000587527282 GI Annotated Anodyne O=C1C[C@H](c2cc3cc4c(cc3nc2O)OCO4)Oc2c1ccc1c2CCCC1 ZINC000587527284 GI Annotated Anodyne COC(=O)/C=C/c1ccc(O)c([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587527497 GI Annotated Anodyne COC(=O)/C=C/c1ccc(O)c([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587527501 GI Annotated Anodyne COC(=O)[C@@H]1CCc2ccccc2[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587527513 GI Annotated Anodyne COC(=O)[C@H]1CCc2ccccc2[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587527515 GI Annotated Anodyne COC(=O)[C@@H]1CCc2ccccc2[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587527517 GI Annotated Anodyne COC(=O)[C@H]1CCc2ccccc2[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587527518 GI Annotated Anodyne CCOc1ccc([C@@]2(C=O)CC(=O)c3ccc4c(c3O2)CCCC4)cc1OCC ZINC000587527613 GI Annotated Mild CCOc1ccc([C@]2(C=O)CC(=O)c3ccc4c(c3O2)CCCC4)cc1OCC ZINC000587527615 GI Annotated Mild O=C1C[C@@]2(Oc3c1ccc1c3CCCC1)C(=O)c1cccnc1-c1ncccc12 ZINC000587527949 GI Annotated Anodyne O=C1C[C@]2(Oc3c1ccc1c3CCCC1)C(=O)c1cccnc1-c1ncccc12 ZINC000587527975 GI Annotated Anodyne COc1ccc2[nH]c(=O)c([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cc2c1 ZINC000587528006 GI Annotated Anodyne COc1ccc2[nH]c(=O)c([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)cc2c1 ZINC000587528007 GI Annotated Anodyne COc1ccc2c(c1)[C@@H](CC(=O)O)C[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587528045 GI Annotated Anodyne COc1ccc2c(c1)[C@H](CC(=O)O)C[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587528054 GI Annotated Anodyne COc1ccc2c(c1)[C@@H](CC(=O)O)C[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587528055 GI Annotated Anodyne COc1ccc2c(c1)[C@H](CC(=O)O)C[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587528056 GI Annotated Anodyne CCOC(=O)C[C@]1(c2cccc(OC)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587528072 GI Annotated Anodyne CCOC(=O)C[C@@]1(c2cccc(OC)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587528073 GI Annotated Anodyne CC(C)(O)c1nn2ccccc2c1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587528333 GI Annotated Anodyne CC(C)(O)c1nn2ccccc2c1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587528334 GI Annotated Anodyne O=C1C[C@@](C(=O)O)(c2ccc3c(c2)CCCC3)Oc2c1ccc1c2CCCC1 ZINC000587529282 GI Annotated Anodyne O=C1C[C@](C(=O)O)(c2ccc3c(c2)CCCC3)Oc2c1ccc1c2CCCC1 ZINC000587529283 GI Annotated Anodyne CN(C)/C=C(\C#N)[C@]1(c2cccs2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587529603 GI Annotated Reactive CN(C)/C=C(\C#N)[C@@]1(c2cccs2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587529616 GI Annotated Reactive CN(C)/C=C(/C#N)[C@@]1(c2cccs2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587529618 GI Annotated Reactive CN(C)/C=C(/C#N)[C@]1(c2cccs2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587529619 GI Annotated Reactive Cc1cccc2c1OC(C(=O)O)=C[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587529965 GI Annotated Anodyne Cc1cccc2c1OC(C(=O)O)=C[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587529979 GI Annotated Anodyne O=C1C[C@@]2(CCOC[C@H]2OCc2ccccc2)Oc2c1ccc1c2CCCC1 ZINC000587530175 GI Annotated Anodyne O=C1C[C@@]2(CCOC[C@@H]2OCc2ccccc2)Oc2c1ccc1c2CCCC1 ZINC000587530177 GI Annotated Anodyne O=C1C[C@]2(CCOC[C@@H]2OCc2ccccc2)Oc2c1ccc1c2CCCC1 ZINC000587530178 GI Annotated Anodyne O=C1C[C@]2(CCOC[C@H]2OCc2ccccc2)Oc2c1ccc1c2CCCC1 ZINC000587530180 GI Annotated Anodyne CS(=O)(=O)c1cccc(Cl)c1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530203 GI Annotated Anodyne CC1(C)Oc2ccc(C(=O)O)cc2[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587530204 GI Annotated Anodyne CC1(C)Oc2ccc(C(=O)O)cc2[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587530209 GI Annotated Anodyne CS(=O)(=O)c1cccc(Cl)c1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530212 GI Annotated Anodyne CCc1ccc2c(c1)[C@@]1(C=C(C(=O)O)O2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530214 GI Annotated Anodyne CCc1ccc2c(c1)[C@]1(C=C(C(=O)O)O2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530217 GI Annotated Anodyne N#Cc1cc2c(nc1S)CCC[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530293 GI Annotated Mild N#Cc1cc2c(nc1S)CCC[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530297 GI Annotated Mild O=C1C[C@H](c2ccc(S(=O)(=O)Cl)cc2)Oc2c1ccc1c2CCCC1 ZINC000587530613 GI Annotated Unstable O=C1C[C@@H](c2ccc(S(=O)(=O)Cl)cc2)Oc2c1ccc1c2CCCC1 ZINC000587530618 GI Annotated Unstable CCOC(=O)C[C@@]1(c2sc(C)nc2C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530635 GI Annotated Anodyne CCOC(=O)C[C@]1(c2sc(C)nc2C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530637 GI Annotated Anodyne C[C@]1(c2cc(CN3CCOCC3)cs2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530678 GI Annotated Anodyne C[C@@]1(c2cc(CN3CCOCC3)cs2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530687 GI Annotated Anodyne Cc1cc(=O)oc2c([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)c(O)ccc12 ZINC000587530704 GI Annotated Anodyne Cc1cc(=O)oc2c([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)c(O)ccc12 ZINC000587530706 GI Annotated Anodyne CCSc1ccc2c(c1)NC(=O)[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530807 GI Annotated Anodyne CCSc1ccc2c(c1)NC(=O)[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587530813 GI Annotated Anodyne Cc1ccc2c(c1)[C@]1(CC(=O)c3ccc4c(c3O1)CCCC4)C(C(=O)O)=CO2 ZINC000587531070 GI Annotated Anodyne Cc1ccc2c(c1)[C@@]1(CC(=O)c3ccc4c(c3O1)CCCC4)C(C(=O)O)=CO2 ZINC000587531072 GI Annotated Anodyne C[C@@]1(c2cccc(S(=O)(=O)Cl)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587531193 GI Annotated Unstable C[C@]1(c2cccc(S(=O)(=O)Cl)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587531195 GI Annotated Unstable Cc1ccc2c(c1)OC(C(=O)O)=C[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587531266 GI Annotated Anodyne Cc1ccc2c(c1)OC(C(=O)O)=C[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587531267 GI Annotated Anodyne Cc1cc(C)c2c(c1)[C@@]1(C=C(C(=O)O)O2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587531650 GI Annotated Anodyne Cc1cc(C)c2c(c1)[C@]1(C=C(C(=O)O)O2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587531653 GI Annotated Anodyne O=C(O)/C=C/C1=COc2ccccc2[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587531667 GI Annotated Anodyne O=C(O)/C=C\C1=COc2ccccc2[C@@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587531668 GI Annotated Anodyne O=C(O)/C=C\C1=COc2ccccc2[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587531669 GI Annotated Anodyne O=C(O)/C=C/C1=COc2ccccc2[C@]12CC(=O)c1ccc3c(c1O2)CCCC3 ZINC000587531670 GI Annotated Anodyne CS(=O)(=O)c1cc(Cl)ccc1[C@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587531701 GI Annotated Anodyne CS(=O)(=O)c1cc(Cl)ccc1[C@@H]1CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587531703 GI Annotated Anodyne CCS(=O)(=O)Nc1ccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587531715 GI Annotated Anodyne CCS(=O)(=O)Nc1ccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587531720 GI Annotated Anodyne O=C(O)Cc1ccc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)s1 ZINC000587531819 GI Annotated Reactive O=C(O)Cc1ccc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)s1 ZINC000587531821 GI Annotated Reactive O=C(O)CSC[C@@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587531922 GI Annotated Anodyne O=C(O)CSC[C@]1(c2ccccc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587531928 GI Annotated Anodyne O=C1C[C@](Cc2cc3ccccc3o2)(C(=O)O)Oc2c1ccc1c2CCCC1 ZINC000587531931 GI Annotated Anodyne O=C1C[C@@](Cc2cc3ccccc3o2)(C(=O)O)Oc2c1ccc1c2CCCC1 ZINC000587531932 GI Annotated Anodyne CCOC(=O)C1=C[C@@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc2O1 ZINC000587532028 GI Annotated Anodyne CCOC(=O)C1=C[C@]2(CC(=O)c3ccc4c(c3O2)CCCC4)c2ccccc2O1 ZINC000587532040 GI Annotated Anodyne O=C1C[C@@H](c2ccc(N3CCC(O)CC3)s2)Oc2c1ccc1c2CCCC1 ZINC000587532262 GI Annotated Anodyne O=C1C[C@H](c2ccc(N3CCC(O)CC3)s2)Oc2c1ccc1c2CCCC1 ZINC000587532267 GI Annotated Anodyne Cc1ccc2c(c1)[C@@]1(CCCS2(=O)=O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587532320 GI Annotated Anodyne Cc1ccc2c(c1)[C@]1(CCCS2(=O)=O)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587532325 GI Annotated Anodyne O=C1C[C@@H](c2ccc(CN3CCOCC3)s2)Oc2c1ccc1c2CCCC1 ZINC000587532327 GI Annotated Anodyne O=C1C[C@H](c2ccc(CN3CCOCC3)s2)Oc2c1ccc1c2CCCC1 ZINC000587532328 GI Annotated Anodyne N#CSC[C@]1(c2ccc(O)c(O)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587532553 GI Annotated Reactive CCCS(=O)(=O)c1cccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587532562 GI Annotated Anodyne CCCS(=O)(=O)c1cccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587532563 GI Annotated Anodyne N#CSC[C@@]1(c2ccc(O)c(O)c2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587532733 GI Annotated Reactive CCS(=O)(=O)c1ccc([C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587532815 GI Annotated Anodyne CCS(=O)(=O)c1ccc([C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587532818 GI Annotated Anodyne C[C@@]1(c2ccc(S(=O)(=O)Cl)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587532832 GI Annotated Unstable C[C@]1(c2ccc(S(=O)(=O)Cl)cc2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587532833 GI Annotated Unstable CN(C)C(=S)Oc1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587532944 GI Annotated Anodyne CN(C)C(=S)Oc1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587532945 GI Annotated Anodyne Cc1ccc(S(=O)(=O)C[C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587532955 GI Annotated Anodyne Cc1ccc(S(=O)(=O)C[C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)cc1 ZINC000587532959 GI Annotated Anodyne O=C(O)c1csc([C@@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587533125 GI Annotated Reactive O=C(O)c1csc([C@]2(CCl)CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587533133 GI Annotated Reactive CC(C)S(=O)(=O)c1cccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587533400 GI Annotated Anodyne CC(C)S(=O)(=O)c1cccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587533403 GI Annotated Anodyne CS(=O)(=O)c1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c(Cl)c1 ZINC000587533442 GI Annotated Anodyne CS(=O)(=O)c1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c(Cl)c1 ZINC000587533444 GI Annotated Anodyne C[C@]1(c2ccc(N3CCOCC3)s2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587533535 GI Annotated Anodyne C[C@@]1(c2ccc(N3CCOCC3)s2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587533537 GI Annotated Anodyne Cn1cnnc1Sc1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)o1 ZINC000587533776 GI Annotated Anodyne Cn1cnnc1Sc1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)o1 ZINC000587533783 GI Annotated Anodyne COC(=O)c1oc2c(c1C)[C@@]1(CCC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587533983 GI Annotated Anodyne COC(=O)c1oc2c(c1C)[C@]1(CCC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587533984 GI Annotated Anodyne CN(C)C(=S)Oc1cccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587534238 GI Annotated Anodyne CN(C)C(=S)Oc1cccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c1 ZINC000587534240 GI Annotated Anodyne COc1ccc2occ([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)c(=O)c2c1 ZINC000587534368 GI Annotated Anodyne COc1ccc2occ([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)c(=O)c2c1 ZINC000587534369 GI Annotated Anodyne Cc1ccc2c(c1)[C@]1(C=C(C(=O)O)O2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587534387 GI Annotated Anodyne Cc1ccc2c(c1)[C@@]1(C=C(C(=O)O)O2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587534389 GI Annotated Anodyne C[C@@H](Oc1ccc2c(c1)OCO2)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587534726 GI Annotated Anodyne C[C@H](Oc1ccc2c(c1)OCO2)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587534729 GI Annotated Anodyne C[C@H](Oc1ccc2c(c1)OCO2)[C@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587534731 GI Annotated Anodyne C[C@@H](Oc1ccc2c(c1)OCO2)[C@@]1(C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587534735 GI Annotated Anodyne COCCOc1cc2c(cc1[C@@H]1CC(=O)c3ccc4c(c3O1)CCCC4)OCO2 ZINC000587534747 GI Annotated Anodyne COCCOc1cc2c(cc1[C@H]1CC(=O)c3ccc4c(c3O1)CCCC4)OCO2 ZINC000587534752 GI Annotated Anodyne CC(C)(C)OC(=O)[C@]1(C2=COCCC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587534933 GI Annotated Anodyne CC(C)(C)OC(=O)[C@@]1(C2=COCCC2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587534936 GI Annotated Anodyne CC(C)N1CCc2nc([C@@H]3CC(=O)c4ccc5c(c4O3)CCCC5)sc2C1 ZINC000587534940 GI Annotated Anodyne CC(C)N1CCc2nc([C@H]3CC(=O)c4ccc5c(c4O3)CCCC5)sc2C1 ZINC000587534942 GI Annotated Anodyne CN1CCc2c(sc(N)c2[C@@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)C1 ZINC000587535039 GI Annotated Anodyne CN1CCc2c(sc(N)c2[C@]2(C)CC(=O)c3ccc4c(c3O2)CCCC4)C1 ZINC000587535042 GI Annotated Anodyne CC(=O)N(c1nc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cs1)C1CC1 ZINC000587535445 GI Annotated Anodyne CC(=O)N(c1nc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cs1)C1CC1 ZINC000587535446 GI Annotated Anodyne O=C1C[C@](CBr)(c2nccs2)Oc2c1ccc1c2CCCC1 ZINC000587536063 GI Annotated Reactive O=C1C[C@@](CBr)(c2nccs2)Oc2c1ccc1c2CCCC1 ZINC000587536064 GI Annotated Reactive COc1cc(OC)c2c(c1)OCC[C@@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587536241 GI Annotated Anodyne COc1cc(OC)c2c(c1)OCC[C@]21CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587536242 GI Annotated Anodyne O=C1C[C@@H](c2ccccc2OCC2OCCO2)Oc2c1ccc1c2CCCC1 ZINC000587536500 GI Annotated Anodyne O=C1C[C@H](c2ccccc2OCC2OCCO2)Oc2c1ccc1c2CCCC1 ZINC000587536501 GI Annotated Anodyne CN(C)c1ccc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c2nsnc12 ZINC000587537180 GI Annotated Anodyne CN(C)c1ccc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)c2nsnc12 ZINC000587537181 GI Annotated Anodyne CN1C(=O)CS/C1=C/[C@@]1(c2ccco2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587537212 GI Annotated Anodyne CN1C(=O)CS/C1=C/[C@]1(c2ccco2)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587537214 GI Annotated Anodyne COc1cc([C@@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc2sc(=O)oc12 ZINC000587537257 GI Annotated Anodyne COc1cc([C@H]2CC(=O)c3ccc4c(c3O2)CCCC4)cc2sc(=O)oc12 ZINC000587537260 GI Annotated Anodyne CC(C)[C@H](Br)[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587537261 GI Annotated Reactive CC(C)[C@H](Br)[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587537262 GI Annotated Reactive CC(C)[C@H](Br)[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587537263 GI Annotated Reactive CC(C)[C@H](Br)[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587537264 GI Annotated Reactive O=C1C[C@@H](c2ccc(N3CCSCC3)nc2)Oc2c1ccc1c2CCCC1 ZINC000587537549 GI Annotated Anodyne O=C1C[C@H](c2ccc(N3CCSCC3)nc2)Oc2c1ccc1c2CCCC1 ZINC000587537550 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(CBr)C1CCC1 ZINC000587537567 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(CBr)C1CCC1 ZINC000587537568 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(CBr)C1CCC1 ZINC000587537569 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(CBr)C1CCC1 ZINC000587537570 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ncccc1Br ZINC000587537715 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ncccc1Br ZINC000587537717 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ncccc1Br ZINC000587537719 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ncccc1Br ZINC000587537721 GI Annotated Anodyne CC[C@]1([C@H](C)Br)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587537801 GI Annotated Reactive CC[C@]1([C@@H](C)Br)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587537802 GI Annotated Reactive CC[C@]1([C@H](C)Br)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587537803 GI Annotated Reactive CC[C@]1([C@@H](C)Br)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587537804 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(Br)ccn1 ZINC000587538412 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(Br)ccn1 ZINC000587538413 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(Br)ccn1 ZINC000587538414 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(Br)ccn1 ZINC000587538415 GI Annotated Anodyne CN1C(=O)CS/C1=C/[C@@]1(C(C)(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587538522 GI Annotated Anodyne CN1C(=O)CS/C1=C/[C@]1(C(C)(C)C)CC(=O)c2ccc3c(c2O1)CCCC3 ZINC000587538524 GI Annotated Anodyne O=C1C[C@@H](c2ccc(CN3CCSCC3)o2)Oc2c1ccc1c2CCCC1 ZINC000587538659 GI Annotated Anodyne O=C1C[C@H](c2ccc(CN3CCSCC3)o2)Oc2c1ccc1c2CCCC1 ZINC000587538660 GI Annotated Anodyne C=CCC[C@@]1(CBr)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587539296 GI Annotated Reactive C=CCC[C@@]1(CBr)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587539302 GI Annotated Reactive C=CCC[C@]1(CBr)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587539303 GI Annotated Reactive C=CCC[C@]1(CBr)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587539304 GI Annotated Reactive CC(C)(Br)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587539397 GI Annotated Anodyne CC(C)(Br)[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587539399 GI Annotated Anodyne CC(C)(Br)[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587539401 GI Annotated Anodyne CC(C)(Br)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587539403 GI Annotated Anodyne CC(C)[C@@]1(CBr)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587539437 GI Annotated Reactive CC(C)[C@@]1(CBr)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587539438 GI Annotated Reactive CC(C)[C@]1(CBr)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587539439 GI Annotated Reactive CC(C)[C@]1(CBr)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587539440 GI Annotated Reactive C[C@]1(CCCBr)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587539723 GI Annotated Reactive C[C@]1(CCCBr)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587539724 GI Annotated Reactive C[C@@]1(CCCBr)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587539725 GI Annotated Reactive C[C@@]1(CCCBr)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587539726 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(CBr)CC1CC1 ZINC000587539766 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(CBr)CC1CC1 ZINC000587539767 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(CBr)CC1CC1 ZINC000587539771 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(CBr)CC1CC1 ZINC000587539773 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccncc1Br ZINC000587540032 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccncc1Br ZINC000587540034 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccncc1Br ZINC000587540036 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccncc1Br ZINC000587540037 GI Annotated Anodyne C[C@H](Br)[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587540063 GI Annotated Reactive C[C@H](Br)[C@@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587540064 GI Annotated Reactive C[C@H](Br)[C@]1(C2CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587540065 GI Annotated Reactive C[C@H](Br)[C@]1(C2CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587540066 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1[nH]ccc1Br ZINC000587540427 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1[nH]ccc1Br ZINC000587540428 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1[nH]ccc1Br ZINC000587540429 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1[nH]ccc1Br ZINC000587540430 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(Cl)c(O)cc1O ZINC000587540483 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(Cl)c(O)cc1O ZINC000587540484 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(Cl)c(O)cc1O ZINC000587540485 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(Cl)c(O)cc1O ZINC000587540486 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1occc1Br ZINC000587540585 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1occc1Br ZINC000587540587 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1occc1Br ZINC000587540589 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1occc1Br ZINC000587540591 GI Annotated Anodyne COc1cc(O)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(Cl)c1 ZINC000587540983 GI Annotated Anodyne COc1cc(O)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(Cl)c1 ZINC000587540984 GI Annotated Anodyne COc1cc(O)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(Cl)c1 ZINC000587540985 GI Annotated Anodyne COc1cc(O)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(Cl)c1 ZINC000587540986 GI Annotated Anodyne CN(C)c1nccc(Cl)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587541019 GI Annotated Anodyne CN(C)c1nccc(Cl)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587541020 GI Annotated Anodyne CN(C)c1nccc(Cl)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587541021 GI Annotated Anodyne CN(C)c1nccc(Cl)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587541022 GI Annotated Anodyne N#Cc1ccc([C@@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587541263 GI Annotated Reactive N#Cc1ccc([C@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587541264 GI Annotated Reactive N#Cc1ccc([C@@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587541265 GI Annotated Reactive N#Cc1ccc([C@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587541266 GI Annotated Reactive Cc1cc([C@@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)[nH]1 ZINC000587541567 GI Annotated Reactive Cc1cc([C@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)[nH]1 ZINC000587541578 GI Annotated Reactive Cc1cc([C@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)[nH]1 ZINC000587541580 GI Annotated Reactive Cc1cc([C@@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)[nH]1 ZINC000587541582 GI Annotated Reactive Cc1nc(C)c([C@@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)o1 ZINC000587541596 GI Annotated Reactive Cc1nc(C)c([C@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)o1 ZINC000587541598 GI Annotated Reactive Cc1nc(C)c([C@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)o1 ZINC000587541599 GI Annotated Reactive Cc1nc(C)c([C@@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)o1 ZINC000587541600 GI Annotated Reactive Cc1nn(CCCl)c(C)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587541900 GI Annotated Reactive Cc1nn(CCCl)c(C)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587541906 GI Annotated Reactive Cc1nn(CCCl)c(C)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587541908 GI Annotated Reactive Cc1nn(CCCl)c(C)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587541911 GI Annotated Reactive O=C(O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(Cl)c1 ZINC000587542018 GI Annotated Anodyne O=C(O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(Cl)c1 ZINC000587542019 GI Annotated Anodyne O=C(O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(Cl)c1 ZINC000587542021 GI Annotated Anodyne O=C(O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(Cl)c1 ZINC000587542022 GI Annotated Anodyne O=C(Cl)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587542217 GI Annotated Reactive O=C(Cl)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587542218 GI Annotated Reactive O=C(Cl)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587542219 GI Annotated Reactive O=C(Cl)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587542220 GI Annotated Reactive CC(C)(C)O[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[C@H]1Cl ZINC000587542654 GI Annotated Reactive CC(C)(C)O[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[C@H]1Cl ZINC000587542659 GI Annotated Reactive CC(C)(C)O[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[C@@H]1Cl ZINC000587542660 GI Annotated Reactive CC(C)(C)O[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[C@@H]1Cl ZINC000587542662 GI Annotated Reactive Cc1nn(C[C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)c1Cl ZINC000587542898 GI Annotated Anodyne Cc1nn(C[C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)c1Cl ZINC000587542910 GI Annotated Anodyne Cc1nn(C[C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)c1Cl ZINC000587542911 GI Annotated Anodyne Cc1nn(C[C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)c1Cl ZINC000587542913 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(CCl)COc1ccccc1 ZINC000587543155 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccnc1Br ZINC000587543158 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(CCl)COc1ccccc1 ZINC000587543159 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(CCl)COc1ccccc1 ZINC000587543160 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccnc1Br ZINC000587543161 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(CCl)COc1ccccc1 ZINC000587543162 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccnc1Br ZINC000587543164 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccnc1Br ZINC000587543165 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccoc1Br ZINC000587543206 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccoc1Br ZINC000587543207 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccoc1Br ZINC000587543209 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccoc1Br ZINC000587543210 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(CCl)c1ccc(O)cc1 ZINC000587543448 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(CCl)c1ccc(O)cc1 ZINC000587543456 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(CCl)c1ccc(O)cc1 ZINC000587543458 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(CCl)c1ccc(O)cc1 ZINC000587543459 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCC[C@@H]2Br ZINC000587543530 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCC[C@H]2Br ZINC000587543537 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCCC[C@H]2Br ZINC000587543540 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCCC[C@@H]2Br ZINC000587543546 GI Annotated Reactive COc1cc(O)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1Cl ZINC000587543689 GI Annotated Anodyne COc1cc(O)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1Cl ZINC000587543698 GI Annotated Anodyne COc1cc(O)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1Cl ZINC000587543700 GI Annotated Anodyne COc1cc(O)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1Cl ZINC000587543701 GI Annotated Anodyne C[C@H](O)[C@]1(c2cccc(Cl)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587543961 GI Annotated Anodyne C[C@H](O)[C@]1(c2cccc(Cl)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587543966 GI Annotated Anodyne C[C@H](O)[C@@]1(c2cccc(Cl)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587543967 GI Annotated Anodyne C[C@H](O)[C@@]1(c2cccc(Cl)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587543968 GI Annotated Anodyne O=C(O)c1cc(Cl)ccc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587543974 GI Annotated Anodyne O=C(O)c1cc(Cl)ccc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587543976 GI Annotated Anodyne O=C(O)c1cc(Cl)ccc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587543977 GI Annotated Anodyne O=C(O)c1cc(Cl)ccc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587543979 GI Annotated Anodyne Cc1nc(O)c(Cl)cc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587544474 GI Annotated Anodyne Cc1nc(O)c(Cl)cc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587544481 GI Annotated Anodyne Cc1nc(O)c(Cl)cc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587544483 GI Annotated Anodyne Cc1nc(O)c(Cl)cc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587544485 GI Annotated Anodyne COc1ncc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1Cl ZINC000587544494 GI Annotated Anodyne COc1ncc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1Cl ZINC000587544495 GI Annotated Anodyne COc1ncc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1Cl ZINC000587544497 GI Annotated Anodyne COc1ncc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1Cl ZINC000587544499 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(O)c(O)c(Cl)c1 ZINC000587544680 GI Annotated Clean O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(O)c(O)c(Cl)c1 ZINC000587544682 GI Annotated Clean O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(O)c(O)c(Cl)c1 ZINC000587544684 GI Annotated Clean O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(O)c(O)c(Cl)c1 ZINC000587544686 GI Annotated Clean CCn1ncc(Cl)c1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587545007 GI Annotated Anodyne CCn1ncc(Cl)c1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587545009 GI Annotated Anodyne CCn1ncc(Cl)c1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587545010 GI Annotated Anodyne CCn1ncc(Cl)c1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587545011 GI Annotated Anodyne COc1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc(Cl)c1O ZINC000587545168 GI Annotated Anodyne COc1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc(Cl)c1O ZINC000587545169 GI Annotated Anodyne COc1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc(Cl)c1O ZINC000587545171 GI Annotated Anodyne COc1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc(Cl)c1O ZINC000587545173 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC12CCC(Br)CC2 ZINC000587545363 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC12CCC(Br)CC2 ZINC000587545365 GI Annotated Reactive CC(=O)[C@]1(c2cccc(Cl)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587545571 GI Annotated Anodyne CC(=O)[C@@]1(c2cccc(Cl)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587545576 GI Annotated Anodyne CC(=O)[C@]1(c2cccc(Cl)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587545577 GI Annotated Anodyne CC(=O)[C@@]1(c2cccc(Cl)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587545578 GI Annotated Anodyne COc1ccc([C@@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587545605 GI Annotated Reactive COc1ccc([C@]2(CCl)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587545608 GI Annotated Reactive COc1ccc([C@@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587545609 GI Annotated Reactive COc1ccc([C@]2(CCl)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587545610 GI Annotated Reactive COc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(Cl)c1O ZINC000587545771 GI Annotated Anodyne COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(Cl)c1O ZINC000587545772 GI Annotated Anodyne COc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(Cl)c1O ZINC000587545773 GI Annotated Anodyne COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(Cl)c1O ZINC000587545774 GI Annotated Anodyne CC(=O)[C@]1(c2ccc(Cl)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587546054 GI Annotated Anodyne CC(=O)[C@@]1(c2ccc(Cl)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587546055 GI Annotated Anodyne CC(=O)[C@]1(c2ccc(Cl)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587546057 GI Annotated Anodyne CC(=O)[C@@]1(c2ccc(Cl)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587546059 GI Annotated Anodyne N#CC[C@]1(c2cc(Cl)ccn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587546190 GI Annotated Mild N#CC[C@@]1(c2cc(Cl)ccn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587546191 GI Annotated Mild N#CC[C@@]1(c2cc(Cl)ccn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587546192 GI Annotated Mild N#CC[C@]1(c2cc(Cl)ccn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587546193 GI Annotated Mild Cc1noc(C)c1[C@@]1(CCl)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587546239 GI Annotated Reactive Cc1noc(C)c1[C@]1(CCl)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587546241 GI Annotated Reactive Cc1noc(C)c1[C@]1(CCl)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587546243 GI Annotated Reactive Cc1noc(C)c1[C@@]1(CCl)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587546245 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(Br)o1 ZINC000587546554 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(Br)o1 ZINC000587546556 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(Br)o1 ZINC000587546558 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(Br)o1 ZINC000587546559 GI Annotated Anodyne COc1cc(Cl)cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1O ZINC000587546642 GI Annotated Anodyne COc1cc(Cl)cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1O ZINC000587546645 GI Annotated Anodyne COc1cc(Cl)cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1O ZINC000587546648 GI Annotated Anodyne COc1cc(Cl)cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1O ZINC000587546651 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCC[C@@H]2Br ZINC000587547118 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCC[C@@H]2Br ZINC000587547120 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCC[C@H]2Br ZINC000587547122 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCC[C@H]2Br ZINC000587547124 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(Br)cn1 ZINC000587547158 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(Br)cn1 ZINC000587547159 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(Br)cn1 ZINC000587547161 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(Br)cn1 ZINC000587547163 GI Annotated Anodyne COc1ccc(Cl)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587547166 GI Annotated Anodyne COc1ccc(Cl)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587547167 GI Annotated Anodyne COc1ccc(Cl)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587547169 GI Annotated Anodyne COc1ccc(Cl)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587547170 GI Annotated Anodyne O=C(O)c1cccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1Cl ZINC000587547531 GI Annotated Anodyne O=C(O)c1cccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1Cl ZINC000587547532 GI Annotated Anodyne O=C(O)c1cccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1Cl ZINC000587547535 GI Annotated Anodyne O=C(O)c1cccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1Cl ZINC000587547538 GI Annotated Anodyne CCn1nc(C)c(Cl)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587547568 GI Annotated Anodyne CCn1nc(C)c(Cl)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587547570 GI Annotated Anodyne CCn1nc(C)c(Cl)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587547572 GI Annotated Anodyne CCn1nc(C)c(Cl)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587547574 GI Annotated Anodyne COc1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(Cl)cc1O ZINC000587547965 GI Annotated Anodyne COc1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(Cl)cc1O ZINC000587547968 GI Annotated Anodyne COc1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(Cl)cc1O ZINC000587547971 GI Annotated Anodyne COc1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(Cl)cc1O ZINC000587547974 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(Br)nc1 ZINC000587548114 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(Br)nc1 ZINC000587548116 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(Br)nc1 ZINC000587548117 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(Br)nc1 ZINC000587548119 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(Br)[nH]1 ZINC000587548138 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(Br)[nH]1 ZINC000587548139 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(Br)[nH]1 ZINC000587548140 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(Br)[nH]1 ZINC000587548142 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(Br)co1 ZINC000587548217 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(Br)co1 ZINC000587548218 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(Br)co1 ZINC000587548219 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(Br)co1 ZINC000587548220 GI Annotated Anodyne COc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(O)c1Cl ZINC000587548515 GI Annotated Anodyne COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(O)c1Cl ZINC000587548516 GI Annotated Anodyne COc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(O)c1Cl ZINC000587548517 GI Annotated Anodyne COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(O)c1Cl ZINC000587548518 GI Annotated Anodyne COc1nccc(Cl)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587548846 GI Annotated Anodyne COc1nccc(Cl)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587548847 GI Annotated Anodyne COc1nccc(Cl)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587548849 GI Annotated Anodyne COc1nccc(Cl)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587548851 GI Annotated Anodyne O=C(O)c1cc(Cl)cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587549610 GI Annotated Anodyne O=C(O)c1cc(Cl)cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587549611 GI Annotated Anodyne O=C(O)c1cc(Cl)cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587549612 GI Annotated Anodyne O=C(O)c1cc(Cl)cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587549613 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccc(Br)n1 ZINC000587549826 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccc(Br)n1 ZINC000587549828 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccc(Br)n1 ZINC000587549830 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccc(Br)n1 ZINC000587549831 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(Br)c[nH]1 ZINC000587549858 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(Br)c[nH]1 ZINC000587549860 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(Br)c[nH]1 ZINC000587549862 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(Br)c[nH]1 ZINC000587549864 GI Annotated Anodyne COc1ncc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1Cl ZINC000587549912 GI Annotated Anodyne COc1ncc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1Cl ZINC000587549913 GI Annotated Anodyne COc1ncc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1Cl ZINC000587549914 GI Annotated Anodyne COc1ncc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1Cl ZINC000587549915 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccnc(Br)c1 ZINC000587550012 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccnc(Br)c1 ZINC000587550013 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccnc(Br)c1 ZINC000587550014 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccnc(Br)c1 ZINC000587550015 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(Cl)c2c(c1)OCO2 ZINC000587550426 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(Cl)c2c(c1)OCO2 ZINC000587550427 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(Cl)c2c(c1)OCO2 ZINC000587550428 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(Cl)c2c(c1)OCO2 ZINC000587550429 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cncc2c(Cl)n[nH]c12 ZINC000587550720 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cncc2c(Cl)n[nH]c12 ZINC000587550728 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cncc2c(Cl)n[nH]c12 ZINC000587550730 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cncc2c(Cl)n[nH]c12 ZINC000587550732 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1c(Cl)ncnc1Cl ZINC000587550770 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1c(Cl)ncnc1Cl ZINC000587550774 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1c(Cl)ncnc1Cl ZINC000587550776 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1c(Cl)ncnc1Cl ZINC000587550777 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12c1ccccc1C[C@@H]2Cl ZINC000587550968 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12c1ccccc1C[C@H]2Cl ZINC000587550972 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12c1ccccc1C[C@@H]2Cl ZINC000587550974 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12c1ccccc1C[C@H]2Cl ZINC000587550976 GI Annotated Reactive COc1ncc(Cl)cc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587551092 GI Annotated Anodyne COc1ncc(Cl)cc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587551093 GI Annotated Anodyne COc1ncc(Cl)cc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587551094 GI Annotated Anodyne COc1ncc(Cl)cc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587551095 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc2c(cc1Cl)OCO2 ZINC000587551441 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc2c(cc1Cl)OCO2 ZINC000587551442 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc2c(cc1Cl)OCO2 ZINC000587551443 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc2c(cc1Cl)OCO2 ZINC000587551444 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12COc1ccc(Cl)cc1C2 ZINC000587551573 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12COc1ccc(Cl)cc1C2 ZINC000587551574 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12COc1ccc(Cl)cc1C2 ZINC000587551575 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12COc1ccc(Cl)cc1C2 ZINC000587551576 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnc(Cl)nc1Cl ZINC000587551593 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnc(Cl)nc1Cl ZINC000587551594 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnc(Cl)nc1Cl ZINC000587551595 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnc(Cl)nc1Cl ZINC000587551596 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12COCc1cccc(Cl)c12 ZINC000587551625 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12COCc1cccc(Cl)c12 ZINC000587551626 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12COCc1cccc(Cl)c12 ZINC000587551627 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12COCc1cccc(Cl)c12 ZINC000587551628 GI Annotated Anodyne Nc1cc2c(cc1Cl)CC[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587551677 GI Annotated Anodyne Nc1cc2c(cc1Cl)CC[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587551678 GI Annotated Anodyne Nc1cc2c(cc1Cl)CC[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587551679 GI Annotated Anodyne Nc1cc2c(cc1Cl)CC[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587551680 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCNc1nc(Cl)ccc12 ZINC000587551725 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCNc1nc(Cl)ccc12 ZINC000587551726 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCNc1nc(Cl)ccc12 ZINC000587551727 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCNc1nc(Cl)ccc12 ZINC000587551728 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCc1nc(Cl)ccc12 ZINC000587551767 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCc1nc(Cl)ccc12 ZINC000587551768 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCc1nc(Cl)ccc12 ZINC000587551769 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCc1nc(Cl)ccc12 ZINC000587551770 GI Annotated Anodyne CNc1cc(Cl)ncc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587551771 GI Annotated Anodyne CNc1cc(Cl)ncc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587551772 GI Annotated Anodyne CNc1cc(Cl)ncc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587551773 GI Annotated Anodyne CNc1cc(Cl)ncc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587551774 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(Cl)nnc1Cl ZINC000587551873 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(Cl)nnc1Cl ZINC000587551874 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(Cl)nnc1Cl ZINC000587551875 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(Cl)nnc1Cl ZINC000587551876 GI Annotated Anodyne CN(C)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(Cl)n1 ZINC000587551891 GI Annotated Anodyne CN(C)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(Cl)n1 ZINC000587551892 GI Annotated Anodyne CN(C)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(Cl)n1 ZINC000587551893 GI Annotated Anodyne CN(C)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(Cl)n1 ZINC000587551894 GI Annotated Anodyne Cc1cnc(Cl)nc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587551895 GI Annotated Anodyne Cc1cnc(Cl)nc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587551896 GI Annotated Anodyne Cc1cnc(Cl)nc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587551897 GI Annotated Anodyne Cc1cnc(Cl)nc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587551898 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1c(Cl)ccc2nccn12 ZINC000587551963 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1c(Cl)ccc2nccn12 ZINC000587551964 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1c(Cl)ccc2nccn12 ZINC000587551965 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1c(Cl)ccc2nccn12 ZINC000587551966 GI Annotated Anodyne CCc1nn(C)c(Cl)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587552033 GI Annotated Anodyne CCc1nn(C)c(Cl)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587552034 GI Annotated Anodyne CCc1nn(C)c(Cl)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587552035 GI Annotated Anodyne CCc1nn(C)c(Cl)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587552036 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCc1ccc(Cl)nc12 ZINC000587552127 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCc1ccc(Cl)nc12 ZINC000587552128 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCc1ccc(Cl)nc12 ZINC000587552129 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCc1ccc(Cl)nc12 ZINC000587552130 GI Annotated Anodyne COc1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc(Cl)n1 ZINC000587552237 GI Annotated Anodyne COc1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc(Cl)n1 ZINC000587552238 GI Annotated Anodyne COc1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc(Cl)n1 ZINC000587552239 GI Annotated Anodyne COc1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc(Cl)n1 ZINC000587552240 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnc2n[nH]c(Cl)c2c1 ZINC000587552265 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnc2n[nH]c(Cl)c2c1 ZINC000587552266 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnc2n[nH]c(Cl)c2c1 ZINC000587552267 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnc2n[nH]c(Cl)c2c1 ZINC000587552268 GI Annotated Anodyne COc1ccnc(Cl)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587552333 GI Annotated Anodyne COc1ccnc(Cl)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587552334 GI Annotated Anodyne COc1ccnc(Cl)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587552335 GI Annotated Anodyne COc1ccnc(Cl)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587552336 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1c(Cl)nc2ccccn12 ZINC000587552337 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1c(Cl)nc2ccccn12 ZINC000587552338 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1c(Cl)nc2ccccn12 ZINC000587552339 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1c(Cl)nc2ccccn12 ZINC000587552340 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cn2cc(Cl)ccc2n1 ZINC000587552516 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cn2cc(Cl)ccc2n1 ZINC000587552519 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cn2cc(Cl)ccc2n1 ZINC000587552520 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cn2cc(Cl)ccc2n1 ZINC000587552522 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(OCCF)cc1 ZINC000587552587 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(OCCF)cc1 ZINC000587552588 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(OCCF)cc1 ZINC000587552589 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(OCCF)cc1 ZINC000587552590 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnc2ccc(Cl)cn12 ZINC000587552917 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnc2ccc(Cl)cn12 ZINC000587552918 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnc2ccc(Cl)cn12 ZINC000587552919 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnc2ccc(Cl)cn12 ZINC000587552921 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc([N+](=O)[O-])c(F)c1 ZINC000587552975 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc([N+](=O)[O-])c(F)c1 ZINC000587552977 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc([N+](=O)[O-])c(F)c1 ZINC000587552978 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc([N+](=O)[O-])c(F)c1 ZINC000587552979 GI Annotated Bother Cc1c(C(F)(F)F)n[nH]c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587552986 GI Annotated Anodyne Cc1c(C(F)(F)F)n[nH]c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587552988 GI Annotated Anodyne Cc1c(C(F)(F)F)n[nH]c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587552989 GI Annotated Anodyne Cc1c(C(F)(F)F)n[nH]c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587552990 GI Annotated Anodyne CN(C)c1nc(Cl)ccc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587553245 GI Annotated Anodyne CN(C)c1nc(Cl)ccc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587553246 GI Annotated Anodyne CN(C)c1nc(Cl)ccc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587553247 GI Annotated Anodyne CN(C)c1nc(Cl)ccc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587553248 GI Annotated Anodyne COc1cc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(F)cc1O ZINC000587553410 GI Annotated Anodyne COc1cc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(F)cc1O ZINC000587553412 GI Annotated Anodyne COc1cc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(F)cc1O ZINC000587553413 GI Annotated Anodyne COc1cc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(F)cc1O ZINC000587553414 GI Annotated Anodyne Cc1ccc(OC(F)F)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587553561 GI Annotated Anodyne Cc1ccc(OC(F)F)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587553567 GI Annotated Anodyne Cc1ccc(OC(F)F)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587553568 GI Annotated Anodyne Cc1ccc(OC(F)F)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587553569 GI Annotated Anodyne COc1c(F)cccc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587554016 GI Annotated Anodyne COc1c(F)cccc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587554017 GI Annotated Anodyne COc1c(F)cccc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587554018 GI Annotated Anodyne COc1c(F)cccc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587554019 GI Annotated Anodyne Cc1ccc2nc(O)c(-c3ccc4c(O)nc(O)nc4n3)c(-c3ccccc3)c2c1 ZINC000587554209 GI Annotated Anodyne COc1c(F)cc(F)cc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587554283 GI Annotated Anodyne COc1c(F)cc(F)cc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587554291 GI Annotated Anodyne COc1c(F)cc(F)cc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587554293 GI Annotated Anodyne COc1c(F)cc(F)cc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587554294 GI Annotated Anodyne Cn1c(Cl)nc(Cl)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587554310 GI Annotated Anodyne Cn1c(Cl)nc(Cl)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587554333 GI Annotated Anodyne Cn1c(Cl)nc(Cl)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587554337 GI Annotated Anodyne N#C[C@H](F)[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587554338 GI Annotated Mild Cn1c(Cl)nc(Cl)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587554340 GI Annotated Anodyne N#C[C@H](F)[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587554346 GI Annotated Mild N#C[C@H](F)[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587554350 GI Annotated Mild N#C[C@H](F)[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587554354 GI Annotated Mild COc1nc(Cl)ccc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587554390 GI Annotated Anodyne COc1nc(Cl)ccc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587554391 GI Annotated Anodyne COc1nc(Cl)ccc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587554392 GI Annotated Anodyne COc1nc(Cl)ccc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587554394 GI Annotated Anodyne COC(=O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1F ZINC000587554593 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1F ZINC000587554600 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1F ZINC000587554602 GI Annotated Anodyne COC(=O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1F ZINC000587554603 GI Annotated Anodyne COc1cc(F)cc(F)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587554694 GI Annotated Anodyne COc1cc(F)cc(F)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587554695 GI Annotated Anodyne COc1cc(F)cc(F)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587554696 GI Annotated Anodyne COc1cc(F)cc(F)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587554697 GI Annotated Anodyne N#Cc1ccc(F)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1F ZINC000587554789 GI Annotated Mild N#Cc1ccc(F)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1F ZINC000587554797 GI Annotated Mild N#Cc1ccc(F)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1F ZINC000587554800 GI Annotated Mild N#Cc1ccc(F)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1F ZINC000587554803 GI Annotated Mild CCn1cc(Cl)c([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587555019 GI Annotated Anodyne CCn1cc(Cl)c([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587555020 GI Annotated Anodyne CCn1cc(Cl)c([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587555022 GI Annotated Anodyne CCn1cc(Cl)c([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587555024 GI Annotated Anodyne O=CC1=C(Cl)[C@H]([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CCC1 ZINC000587555232 GI Annotated Reactive O=CC1=C(Cl)[C@H]([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CCC1 ZINC000587555234 GI Annotated Reactive O=CC1=C(Cl)[C@H]([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CCC1 ZINC000587555236 GI Annotated Reactive O=CC1=C(Cl)[C@H]([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CCC1 ZINC000587555238 GI Annotated Reactive COc1cc(F)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1OC ZINC000587555307 GI Annotated Anodyne COc1cc(F)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1OC ZINC000587555309 GI Annotated Anodyne COc1cc(F)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1OC ZINC000587555310 GI Annotated Anodyne COc1cc(F)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1OC ZINC000587555312 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1nc(Cl)cnc1Cl ZINC000587555333 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1nc(Cl)cnc1Cl ZINC000587555336 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1nc(Cl)cnc1Cl ZINC000587555339 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1nc(Cl)cnc1Cl ZINC000587555340 GI Annotated Anodyne C[C@]1(c2ccc(C#N)c(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587555344 GI Annotated Mild C[C@@]1(c2ccc(C#N)c(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587555347 GI Annotated Mild C[C@]1(c2ccc(C#N)c(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587555348 GI Annotated Mild C[C@@]1(c2ccc(C#N)c(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587555350 GI Annotated Mild O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(F)c([N+](=O)[O-])cc1F ZINC000587555352 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(F)c([N+](=O)[O-])cc1F ZINC000587555367 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(F)c([N+](=O)[O-])cc1F ZINC000587555369 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(F)c([N+](=O)[O-])cc1F ZINC000587555371 GI Annotated Bother Oc1nc(O)c2ccc(-c3c(O)nc4ccccc4c3-c3ccccc3)nc2n1 ZINC000587555487 GI Annotated Anodyne COc1ccc(F)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1F ZINC000587555595 GI Annotated Anodyne COc1ccc(F)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1F ZINC000587555597 GI Annotated Anodyne COc1ccc(F)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1F ZINC000587555599 GI Annotated Anodyne COc1ccc(F)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1F ZINC000587555600 GI Annotated Anodyne N#CC[C@]1(c2ccc(F)c(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587555613 GI Annotated Mild N#CC[C@@]1(c2ccc(F)c(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587555617 GI Annotated Mild N#CC[C@]1(c2ccc(F)c(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587555620 GI Annotated Mild N#CC[C@@]1(c2ccc(F)c(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587555621 GI Annotated Mild CN(C)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1F ZINC000587555641 GI Annotated Anodyne CN(C)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1F ZINC000587555646 GI Annotated Anodyne CN(C)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1F ZINC000587555649 GI Annotated Anodyne CN(C)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1F ZINC000587555652 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1c(F)cc([N+](=O)[O-])cc1F ZINC000587555955 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1c(F)cc([N+](=O)[O-])cc1F ZINC000587555957 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1c(F)cc([N+](=O)[O-])cc1F ZINC000587555959 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1c(F)cc([N+](=O)[O-])cc1F ZINC000587555961 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc([N+](=O)[O-])ccc1F ZINC000587556117 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc([N+](=O)[O-])ccc1F ZINC000587556118 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc([N+](=O)[O-])ccc1F ZINC000587556119 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc([N+](=O)[O-])ccc1F ZINC000587556120 GI Annotated Bother N#CC[C@]1(c2cc(F)ccc2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587556121 GI Annotated Mild N#CC[C@@]1(c2cc(F)ccc2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587556123 GI Annotated Mild N#CC[C@]1(c2cc(F)ccc2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587556125 GI Annotated Mild N#CC[C@@]1(c2cc(F)ccc2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587556127 GI Annotated Mild Cc1c(-c2ccc3c(O)nc(O)nc3n2)c2cc(O)ccc2n1-c1ccccc1 ZINC000587556315 GI Annotated Anodyne Cc1cc(F)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587556337 GI Annotated Bother Cc1cc(F)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587556346 GI Annotated Bother Cc1cc(F)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587556348 GI Annotated Bother Cc1cc(F)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587556350 GI Annotated Bother COC[C@]1(c2ccc(F)c(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587556435 GI Annotated Anodyne COC[C@@]1(c2ccc(F)c(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587556439 GI Annotated Anodyne COC[C@]1(c2ccc(F)c(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587556442 GI Annotated Anodyne COC[C@@]1(c2ccc(F)c(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587556444 GI Annotated Anodyne CCn1c2ccc(C(C)=O)cc2c2cc(-c3ccc4c(O)nc(O)nc4n3)ccc21 ZINC000587556748 GI Annotated Anodyne COc1ccc(F)c([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587556798 GI Annotated Anodyne COc1ccc(F)c([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587556799 GI Annotated Anodyne COc1ccc(F)c([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587556801 GI Annotated Anodyne COc1ccc(F)c([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587556802 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccc(OCCF)c1 ZINC000587556903 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccc(OCCF)c1 ZINC000587556905 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccc(OCCF)c1 ZINC000587556907 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccc(OCCF)c1 ZINC000587556909 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1c(F)ccc([N+](=O)[O-])c1F ZINC000587557087 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1c(F)ccc([N+](=O)[O-])c1F ZINC000587557090 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1c(F)ccc([N+](=O)[O-])c1F ZINC000587557094 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1c(F)ccc([N+](=O)[O-])c1F ZINC000587557095 GI Annotated Bother C[C@]1(c2c(N)cc(F)cc2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587557191 GI Annotated Anodyne C[C@@]1(c2c(N)cc(F)cc2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587557192 GI Annotated Anodyne C[C@@]1(c2c(N)cc(F)cc2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587557193 GI Annotated Anodyne C[C@]1(c2c(N)cc(F)cc2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587557194 GI Annotated Anodyne COc1cc(F)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(F)c1 ZINC000587557199 GI Annotated Anodyne COc1cc(F)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(F)c1 ZINC000587557200 GI Annotated Anodyne COc1cc(F)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(F)c1 ZINC000587557201 GI Annotated Anodyne COc1cc(F)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(F)c1 ZINC000587557202 GI Annotated Anodyne Cn1cc([C@H](c2ccccc2)c2cnc3nc(O)nc(O)c3c2)c2ccccc21 ZINC000587557260 GI Annotated Anodyne COc1c(F)ccc(F)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587557319 GI Annotated Anodyne COc1c(F)ccc(F)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587557320 GI Annotated Anodyne COc1c(F)ccc(F)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587557321 GI Annotated Anodyne COc1c(F)ccc(F)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587557322 GI Annotated Anodyne C[C@]1(c2ccc(F)c([N+](=O)[O-])c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587557351 GI Annotated Bother C[C@@]1(c2ccc(F)c([N+](=O)[O-])c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587557352 GI Annotated Bother C[C@@]1(c2ccc(F)c([N+](=O)[O-])c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587557353 GI Annotated Bother C[C@]1(c2ccc(F)c([N+](=O)[O-])c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587557354 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(OC(F)F)nc1 ZINC000587557412 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(OC(F)F)nc1 ZINC000587557418 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(OC(F)F)nc1 ZINC000587557419 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(OC(F)F)nc1 ZINC000587557420 GI Annotated Anodyne COC(=O)c1ccc(F)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587557585 GI Annotated Anodyne COC(=O)c1ccc(F)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587557586 GI Annotated Anodyne COC(=O)c1ccc(F)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587557587 GI Annotated Anodyne COC(=O)c1ccc(F)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587557588 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1c(F)cccc1[N+](=O)[O-] ZINC000587557601 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1c(F)cccc1[N+](=O)[O-] ZINC000587557602 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1c(F)cccc1[N+](=O)[O-] ZINC000587557603 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1c(F)cccc1[N+](=O)[O-] ZINC000587557604 GI Annotated Bother N#Cc1c(F)cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1F ZINC000587557847 GI Annotated Mild N#Cc1c(F)cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1F ZINC000587557848 GI Annotated Mild N#Cc1c(F)cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1F ZINC000587557849 GI Annotated Mild N#Cc1c(F)cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1F ZINC000587557850 GI Annotated Mild C[C@@]1(c2ccc(C(=O)O)c(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587557875 GI Annotated Anodyne C[C@@]1(c2ccc(C(=O)O)c(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587557877 GI Annotated Anodyne C[C@]1(c2ccc(C(=O)O)c(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587557878 GI Annotated Anodyne C[C@]1(c2ccc(C(=O)O)c(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587557880 GI Annotated Anodyne C[C@]1(c2cc([N+](=O)[O-])ccc2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587557891 GI Annotated Bother C[C@@]1(c2cc([N+](=O)[O-])ccc2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587557893 GI Annotated Bother C[C@@]1(c2cc([N+](=O)[O-])ccc2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587557894 GI Annotated Bother C[C@]1(c2cc([N+](=O)[O-])ccc2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587557896 GI Annotated Bother Cc1ccc(-n2c(C)c(-c3ccc4c(O)nc(O)nc4n3)c3cc(O)ccc32)cc1 ZINC000587557930 GI Annotated Anodyne COc1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(F)cc1F ZINC000587558109 GI Annotated Anodyne COc1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(F)cc1F ZINC000587558110 GI Annotated Anodyne COc1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(F)cc1F ZINC000587558111 GI Annotated Anodyne COc1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(F)cc1F ZINC000587558112 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1F ZINC000587558121 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1F ZINC000587558122 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1F ZINC000587558123 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1F ZINC000587558124 GI Annotated Anodyne C[C@]1(c2ccc(C#N)cc2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587558185 GI Annotated Mild C[C@@]1(c2ccc(C#N)cc2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587558186 GI Annotated Mild C[C@]1(c2ccc(C#N)cc2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587558187 GI Annotated Mild C[C@@]1(c2ccc(C#N)cc2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587558188 GI Annotated Mild N#Cc1cc(F)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(F)c1 ZINC000587558427 GI Annotated Mild N#Cc1cc(F)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(F)c1 ZINC000587558428 GI Annotated Mild N#Cc1cc(F)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(F)c1 ZINC000587558429 GI Annotated Mild N#Cc1cc(F)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(F)c1 ZINC000587558430 GI Annotated Mild COc1cc(F)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1F ZINC000587558431 GI Annotated Anodyne COc1cc(F)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1F ZINC000587558432 GI Annotated Anodyne COc1cc(F)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1F ZINC000587558433 GI Annotated Anodyne COc1cc(F)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1F ZINC000587558434 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(F)c([N+](=O)[O-])c1 ZINC000587558445 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(F)c([N+](=O)[O-])c1 ZINC000587558446 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(F)c([N+](=O)[O-])c1 ZINC000587558447 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(F)c([N+](=O)[O-])c1 ZINC000587558448 GI Annotated Bother COc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(F)c1F ZINC000587558486 GI Annotated Anodyne COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(F)c1F ZINC000587558488 GI Annotated Anodyne COc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(F)c1F ZINC000587558490 GI Annotated Anodyne COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(F)c1F ZINC000587558492 GI Annotated Anodyne C[C@]1(c2cc(F)c(N)c(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587558730 GI Annotated Anodyne C[C@]1(c2cc(F)c(N)c(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587558732 GI Annotated Anodyne C[C@@]1(c2cc(F)c(N)c(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587558733 GI Annotated Anodyne C[C@@]1(c2cc(F)c(N)c(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587558734 GI Annotated Anodyne COc1c(F)cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1F ZINC000587558752 GI Annotated Anodyne COc1c(F)cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1F ZINC000587558754 GI Annotated Anodyne COc1c(F)cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1F ZINC000587558756 GI Annotated Anodyne COc1c(F)cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1F ZINC000587558757 GI Annotated Anodyne Cc1ccc([C@]2([C@@H](F)C#N)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587558881 GI Annotated Mild Cc1ccc([C@]2([C@@H](F)C#N)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587558882 GI Annotated Mild Cc1ccc([C@]2([C@H](F)C#N)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587558883 GI Annotated Mild Cc1ccc([C@]2([C@H](F)C#N)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587558884 GI Annotated Mild O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccc2c1OC(F)(F)O2 ZINC000587558932 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccc2c1OC(F)(F)O2 ZINC000587558934 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccc2c1OC(F)(F)O2 ZINC000587558936 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccc2c1OC(F)(F)O2 ZINC000587558937 GI Annotated Anodyne COC(=O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(F)c1 ZINC000587559030 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(F)c1 ZINC000587559031 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(F)c1 ZINC000587559032 GI Annotated Anodyne COC(=O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(F)c1 ZINC000587559033 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2c(c1)OC(F)(F)O2 ZINC000587559195 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc2c(c1)OC(F)(F)O2 ZINC000587559196 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc2c(c1)OC(F)(F)O2 ZINC000587559197 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2c(c1)OC(F)(F)O2 ZINC000587559199 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc([N+](=O)[O-])c(F)cc1F ZINC000587559334 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc([N+](=O)[O-])c(F)cc1F ZINC000587559335 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc([N+](=O)[O-])c(F)cc1F ZINC000587559336 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc([N+](=O)[O-])c(F)cc1F ZINC000587559337 GI Annotated Bother COc1cc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1F ZINC000587559588 GI Annotated Anodyne COc1cc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1F ZINC000587559589 GI Annotated Anodyne COc1cc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1F ZINC000587559590 GI Annotated Anodyne COc1cc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1F ZINC000587559591 GI Annotated Anodyne Cc1cc(C(=O)[C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1F ZINC000587559636 GI Annotated Anodyne Cc1cc(C(=O)[C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1F ZINC000587559637 GI Annotated Anodyne Cc1cc(C(=O)[C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1F ZINC000587559638 GI Annotated Anodyne Cc1cc(C(=O)[C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1F ZINC000587559639 GI Annotated Anodyne C[C@]1(c2cc(F)c(O)c(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587559644 GI Annotated Anodyne C[C@]1(c2cc(F)c(O)c(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587559645 GI Annotated Anodyne C[C@@]1(c2cc(F)c(O)c(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587559646 GI Annotated Anodyne C[C@@]1(c2cc(F)c(O)c(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587559647 GI Annotated Anodyne COc1cccc(F)c1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587559668 GI Annotated Anodyne COc1cccc(F)c1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587559669 GI Annotated Anodyne COc1cccc(F)c1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587559670 GI Annotated Anodyne COc1cccc(F)c1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587559671 GI Annotated Anodyne COC(=O)c1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1F ZINC000587559672 GI Annotated Anodyne COC(=O)c1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1F ZINC000587559673 GI Annotated Anodyne COC(=O)c1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1F ZINC000587559674 GI Annotated Anodyne COC(=O)c1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1F ZINC000587559675 GI Annotated Anodyne C[C@]1(c2ccc(F)c(C#N)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587559684 GI Annotated Mild C[C@@]1(c2ccc(F)c(C#N)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587559685 GI Annotated Mild C[C@]1(c2ccc(F)c(C#N)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587559774 GI Annotated Mild C[C@@]1(c2ccc(F)c(C#N)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587559775 GI Annotated Mild COc1ccc(F)c(F)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587559844 GI Annotated Anodyne COc1ccc(F)c(F)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587559845 GI Annotated Anodyne COc1ccc(F)c(F)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587559846 GI Annotated Anodyne COc1ccc(F)c(F)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587559847 GI Annotated Anodyne COc1cc(F)c(F)cc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587559848 GI Annotated Anodyne COc1cc(F)c(F)cc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587559849 GI Annotated Anodyne COc1cc(F)c(F)cc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587559850 GI Annotated Anodyne COc1cc(F)c(F)cc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587559851 GI Annotated Anodyne COc1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc(F)c1F ZINC000587559852 GI Annotated Anodyne COc1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc(F)c1F ZINC000587559853 GI Annotated Anodyne COc1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc(F)c1F ZINC000587559854 GI Annotated Anodyne COc1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc(F)c1F ZINC000587559855 GI Annotated Anodyne CCCCC/C=C/c1nc2nc(O)nc(O)c2cc1Cc1ccc(O)c(OC)c1 ZINC000587560003 GI Annotated Anodyne CCCCC/C=C\c1nc2nc(O)nc(O)c2cc1Cc1ccc(O)c(OC)c1 ZINC000587560004 GI Annotated Anodyne CC1(C)CCC[C@]2(C)c3cc(O)c(O)cc3-c3nc4nc(O)nc(O)c4cc3[C@@H]12 ZINC000587560844 GI Annotated Clean CC(=O)c1ccc(CCc2ccc(-c3ccc4c(O)nc(O)nc4n3)cc2)cc1 ZINC000587560892 GI Annotated Anodyne CC1(C)CCC[C@]2(C)c3cc(O)c(O)cc3-c3nc4nc(O)nc(O)c4cc3[C@H]12 ZINC000587560963 GI Annotated Clean COc1cc(C)ccc1OCc1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587563301 GI Annotated Anodyne Cc1cccc(OCc2nc3cccc(I)c3[nH]2)c1C ZINC000587563337 GI Annotated Anodyne COc1cc(C)ccc1OCc1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587563379 GI Annotated Clean Cc1cc(C)cc(OCc2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)c1 ZINC000587563771 GI Annotated Bother Cc1nc(Cc2ccc(Cl)cc2)sc1-c1ccc2c(O)nc(O)nc2n1 ZINC000587563839 GI Annotated Anodyne COc1cc(C)ccc1OCc1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587563859 GI Annotated Anodyne Cc1cc(C)cc(OCc2nc3cccc(I)c3[nH]2)c1 ZINC000587563882 GI Annotated Anodyne Oc1nc(O)c2ccc(-c3ccc(Nc4nc5ccccc5s4)cc3)nc2n1 ZINC000587563906 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(COc3cccc(C)c3C)nc2c1 ZINC000587563962 GI Annotated Anodyne Cc1cc(C)cc(OCc2nc3ccc(I)cc3[nH]2)c1 ZINC000587564001 GI Annotated Anodyne O=C(Nc1ccc(-c2ccc3c(O)nc(O)nc3n2)cc1)c1ccc(Cl)s1 ZINC000587564052 GI Annotated Anodyne COc1cc(C)ccc1OCc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587564154 GI Annotated Bother COc1cc(C)ccc1OCc1nc2cc(Br)c(F)c(F)c2[nH]1 ZINC000587564174 GI Annotated Anodyne Cc1cccc(OCc2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)c1C ZINC000587564201 GI Annotated Anodyne Cc1cc(C)cc(OCc2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)c1 ZINC000587564251 GI Annotated Bother Cc1cccc(OCc2nc3cc(Br)cc(C(=O)O)c3[nH]2)c1C ZINC000587564258 GI Annotated Anodyne C#CCOc1ccc(-c2nc3c4c(ccc3[nH]2)C(=O)c2ccccc2C4=O)cc1 ZINC000587564322 GI Annotated Mild Cc1ccc(C)c(Nc2nc(C)c(-c3ccc4c(O)nc(O)nc4n3)s2)c1 ZINC000587564367 GI Annotated Anodyne COc1cc(C)ccc1OCc1nc2ccc(I)cc2[nH]1 ZINC000587564465 GI Annotated Anodyne COc1cc(C)ccc1OCc1nc2cccc(I)c2[nH]1 ZINC000587564508 GI Annotated Anodyne Cc1cccc(OCc2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)c1C ZINC000587564523 GI Annotated Bother Cc1cccc(OCc2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)c1C ZINC000587564530 GI Annotated Bother Cc1cc(C)cc(OCc2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)c1 ZINC000587564647 GI Annotated Anodyne Cc1cccc(OCc2nc3ccc(I)cc3[nH]2)c1C ZINC000587564754 GI Annotated Anodyne COc1cc(C)ccc1OCc1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587564851 GI Annotated Bother CCC(C)(C)c1ccc(OCc2nc3nc(Br)c[nH]c-3n2)cc1 ZINC000587565033 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(COc3cc(C)cc(C)c3)nc2c1 ZINC000587565107 GI Annotated Anodyne Cc1ccc(OCc2nc3c(I)cnc(Cl)c3[nH]2)cc1 ZINC000587565404 GI Annotated Anodyne Cc1ccc(OCc2nc3c(Br)cnc(Br)c3[nH]2)cc1 ZINC000587565416 GI Annotated Anodyne CC(C)COc1cccc(OCc2nc3ccc(Br)nc3[nH]2)c1 ZINC000587565539 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(COc3cccc(OCC(C)C)c3)[nH]c2c1 ZINC000587565599 GI Annotated Anodyne CC(C)COc1cccc(OCc2nc3ccc(CN4CCOCC4)cc3[nH]2)c1 ZINC000587565700 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(COc3ccc(C)cc3)nc2c1 ZINC000587565912 GI Annotated Anodyne CC(C)COc1cccc(OCc2nc3cc(Br)ncc3[nH]2)c1 ZINC000587566068 GI Annotated Anodyne CC(C)COc1cccc(OCc2nc3cc(Br)cnc3[nH]2)c1 ZINC000587566109 GI Annotated Anodyne CC(C)COc1cccc(OCc2nc3ccnc(Br)c3[nH]2)c1 ZINC000587566117 GI Annotated Anodyne CC(C)COc1cccc(OCc2nc3c(Br)ccnc3[nH]2)c1 ZINC000587566183 GI Annotated Anodyne CC(C)COc1cccc(OCc2nc3c(F)cnc(Br)c3[nH]2)c1 ZINC000587566187 GI Annotated Anodyne CC(C)COc1cccc(OCc2nc3cncc(Br)c3[nH]2)c1 ZINC000587566189 GI Annotated Anodyne O=Cc1ccc(OCCc2nc3cc(Br)c(F)c(F)c3[nH]2)cc1 ZINC000587566216 GI Annotated Anodyne O=Cc1ccc(OCCc2nc3cc(Cl)cc(Br)c3[nH]2)cc1 ZINC000587566288 GI Annotated Anodyne O=Cc1ccc(OCCc2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)cc1 ZINC000587566534 GI Annotated Anodyne COc1ccccc1[C@@]1(CC#N)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587566658 GI Annotated Mild COc1ccccc1[C@@]1(CC#N)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587566671 GI Annotated Mild COc1ccccc1[C@]1(CC#N)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587566672 GI Annotated Mild COc1ccccc1[C@]1(CC#N)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587566673 GI Annotated Mild O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCNc1c(F)cccc12 ZINC000587566675 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCNc1c(F)cccc12 ZINC000587566682 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCNc1c(F)cccc12 ZINC000587566683 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCNc1c(F)cccc12 ZINC000587566684 GI Annotated Anodyne COc1cc(F)cc(OC)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587566685 GI Annotated Anodyne COc1cc(F)cc(OC)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587566687 GI Annotated Anodyne COc1cc(F)cc(OC)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587566688 GI Annotated Anodyne COc1cc(F)cc(OC)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587566690 GI Annotated Anodyne C[C@]1(c2ncc(F)cc2Cl)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587566802 GI Annotated Anodyne C[C@@]1(c2ncc(F)cc2Cl)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587566806 GI Annotated Anodyne C[C@@]1(c2ncc(F)cc2Cl)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587566808 GI Annotated Anodyne C[C@]1(c2ncc(F)cc2Cl)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587566811 GI Annotated Anodyne O=C1c2ccccc2C(=O)c2c1ccc1nc(CCOCc3ccccc3)[nH]c21 ZINC000587566877 GI Annotated Clean O=Cc1ccc(OCCc2nc3cc(Br)cc(Cl)c3[nH]2)cc1 ZINC000587566881 GI Annotated Anodyne C[C@]1(COc2ccc(F)c(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587566950 GI Annotated Anodyne C[C@@]1(COc2ccc(F)c(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587566951 GI Annotated Anodyne C[C@]1(COc2ccc(F)c(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587566952 GI Annotated Anodyne C[C@@]1(COc2ccc(F)c(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587566953 GI Annotated Anodyne C[C@]1(c2cccc([N+](=O)[O-])c2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587566976 GI Annotated Bother C[C@]1(c2cccc([N+](=O)[O-])c2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587566977 GI Annotated Bother C[C@@]1(c2cccc([N+](=O)[O-])c2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587566978 GI Annotated Bother C[C@@]1(c2cccc([N+](=O)[O-])c2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587566979 GI Annotated Bother COc1cc(F)c2c(c1)CC[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567053 GI Annotated Anodyne COc1cc(F)c2c(c1)CC[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567054 GI Annotated Anodyne COc1cc(F)c2c(c1)CC[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567055 GI Annotated Anodyne COc1cc(F)c2c(c1)CC[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567056 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCOc1c(F)ccc(F)c12 ZINC000587567077 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCOc1c(F)ccc(F)c12 ZINC000587567078 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCOc1c(F)ccc(F)c12 ZINC000587567079 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCOc1c(F)ccc(F)c12 ZINC000587567080 GI Annotated Anodyne COc1cccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1F ZINC000587567120 GI Annotated Anodyne COc1cccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1F ZINC000587567121 GI Annotated Anodyne COc1cccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1F ZINC000587567122 GI Annotated Anodyne COc1cccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1F ZINC000587567123 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1[nH]c2nccc-2cc1F ZINC000587567186 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1[nH]c2nccc-2cc1F ZINC000587567187 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1[nH]c2nccc-2cc1F ZINC000587567188 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1[nH]c2nccc-2cc1F ZINC000587567189 GI Annotated Anodyne Cn1ncc2cc(F)c([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cc21 ZINC000587567257 GI Annotated Anodyne Cn1ncc2cc(F)c([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cc21 ZINC000587567258 GI Annotated Anodyne Cn1ncc2cc(F)c([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cc21 ZINC000587567259 GI Annotated Anodyne Cn1ncc2cc(F)c([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cc21 ZINC000587567260 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1c(F)c[nH]c2nccc1-2 ZINC000587567285 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1c(F)c[nH]c2nccc1-2 ZINC000587567286 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1c(F)c[nH]c2nccc1-2 ZINC000587567287 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1c(F)c[nH]c2nccc1-2 ZINC000587567288 GI Annotated Anodyne C[C@]1(c2ncc(Cl)cc2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567379 GI Annotated Anodyne C[C@@]1(c2ncc(Cl)cc2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567380 GI Annotated Anodyne C[C@@]1(c2ncc(Cl)cc2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567381 GI Annotated Anodyne C[C@]1(c2ncc(Cl)cc2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567382 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCN(c1ccc(F)cc1)C2 ZINC000587567415 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCN(c1ccc(F)cc1)C2 ZINC000587567416 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCN(c1ccc(F)cc1)C2 ZINC000587567417 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCN(c1ccc(F)cc1)C2 ZINC000587567418 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(F)cc2c1OCOC2 ZINC000587567437 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(F)cc2c1OCOC2 ZINC000587567438 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(F)cc2c1OCOC2 ZINC000587567439 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(F)cc2c1OCOC2 ZINC000587567440 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCOc1cc(F)cc(F)c12 ZINC000587567452 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCOc1cc(F)cc(F)c12 ZINC000587567454 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCOc1cc(F)cc(F)c12 ZINC000587567456 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCOc1cc(F)cc(F)c12 ZINC000587567458 GI Annotated Anodyne COc1cccc([C@@]2(CC#N)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587567480 GI Annotated Mild COc1cccc([C@@]2(CC#N)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587567481 GI Annotated Mild COc1cccc([C@]2(CC#N)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587567483 GI Annotated Mild COc1cccc([C@]2(CC#N)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587567486 GI Annotated Mild C[C@]1(c2nc3ccc(F)cc3[nH]2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567577 GI Annotated Anodyne C[C@]1(c2nc3ccc(F)cc3[nH]2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567578 GI Annotated Anodyne C[C@@]1(c2nc3ccc(F)cc3[nH]2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567579 GI Annotated Anodyne C[C@@]1(c2nc3ccc(F)cc3[nH]2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567580 GI Annotated Anodyne COc1ccc(F)cc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567719 GI Annotated Anodyne COc1ccc(F)cc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567720 GI Annotated Anodyne COc1ccc(F)cc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567721 GI Annotated Anodyne COc1ccc(F)cc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567722 GI Annotated Anodyne N#CC[C@]1(c2cccc(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567739 GI Annotated Mild N#CC[C@@]1(c2cccc(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567740 GI Annotated Mild N#CC[C@]1(c2cccc(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567741 GI Annotated Mild N#CC[C@@]1(c2cccc(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567742 GI Annotated Mild C[C@@]1(c2c(F)c[nH]c3nccc2-3)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567765 GI Annotated Anodyne C[C@@]1(c2c(F)c[nH]c3nccc2-3)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567786 GI Annotated Anodyne C[C@]1(c2c(F)c[nH]c3nccc2-3)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567787 GI Annotated Anodyne C[C@]1(c2c(F)c[nH]c3nccc2-3)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567788 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12C=COc1cc(F)ccc12 ZINC000587567825 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12C=COc1cc(F)ccc12 ZINC000587567826 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12C=COc1cc(F)ccc12 ZINC000587567827 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12C=COc1cc(F)ccc12 ZINC000587567829 GI Annotated Anodyne N#CC[C@]1(c2cccc(C#N)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567841 GI Annotated Mild N#CC[C@]1(c2cccc(C#N)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567842 GI Annotated Mild N#CC[C@@]1(c2cccc(C#N)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587567843 GI Annotated Mild N#CC[C@@]1(c2cccc(C#N)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587567844 GI Annotated Mild N#CC[C@@H]1CC2=C(CCC[C@@]23Oc2ccccc2C(=O)[C@@H]3C(=O)c2ccco2)O1 ZINC000587567870 GI Annotated Mild N#CC[C@@H]1CC2=C(CCC[C@]23Oc2ccccc2C(=O)[C@H]3C(=O)c2ccco2)O1 ZINC000587567871 GI Annotated Mild N#CC[C@@H]1CC2=C(CCC[C@@]23Oc2ccccc2C(=O)[C@H]3C(=O)c2ccco2)O1 ZINC000587567872 GI Annotated Mild N#CC[C@@H]1CC2=C(CCC[C@]23Oc2ccccc2C(=O)[C@@H]3C(=O)c2ccco2)O1 ZINC000587567873 GI Annotated Mild O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCc1ccc(F)cc1C2 ZINC000587567889 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCc1ccc(F)cc1C2 ZINC000587567892 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCc1ccc(F)cc1C2 ZINC000587567895 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCc1ccc(F)cc1C2 ZINC000587567897 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(F)cc1[N+](=O)[O-] ZINC000587568092 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(F)cc1[N+](=O)[O-] ZINC000587568094 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(F)cc1[N+](=O)[O-] ZINC000587568096 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(F)cc1[N+](=O)[O-] ZINC000587568098 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCc1c(F)ccc(F)c12 ZINC000587568310 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCc1c(F)ccc(F)c12 ZINC000587568311 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCc1c(F)ccc(F)c12 ZINC000587568313 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCc1c(F)ccc(F)c12 ZINC000587568316 GI Annotated Anodyne N#CC1(c2ccccc2)CC2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587568375 GI Annotated Mild N#CC1(c2ccccc2)CC2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587568376 GI Annotated Mild CC(C)NC[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587568399 GI Annotated Anodyne CC(C)NC[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587568401 GI Annotated Anodyne CC(C)NC[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587568402 GI Annotated Anodyne CC(C)NC[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587568404 GI Annotated Anodyne C[C@]1(c2ccc(OCC#N)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587568646 GI Annotated Mild C[C@]1(c2ccc(OCC#N)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587568647 GI Annotated Mild C[C@@]1(c2ccc(OCC#N)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587568648 GI Annotated Mild C[C@@]1(c2ccc(OCC#N)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587568650 GI Annotated Mild N#Cc1ccc2c(c1)OC=C[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587568726 GI Annotated Mild N#Cc1ccc2c(c1)OC=C[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587568734 GI Annotated Mild N#Cc1ccc2c(c1)OC=C[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587568736 GI Annotated Mild N#Cc1ccc2c(c1)OC=C[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587568737 GI Annotated Mild COc1cc(C#N)ccc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587568763 GI Annotated Mild COc1cc(C#N)ccc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587568764 GI Annotated Mild COc1cc(C#N)ccc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587568765 GI Annotated Mild COc1cc(C#N)ccc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587568766 GI Annotated Mild CC[C@]1(CNC(=O)OC(C)(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587568777 GI Annotated Anodyne CC[C@@]1(CNC(=O)OC(C)(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587568779 GI Annotated Anodyne CC[C@]1(CNC(=O)OC(C)(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587568781 GI Annotated Anodyne CC[C@@]1(CNC(=O)OC(C)(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587568784 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(F)cc([N+](=O)[O-])c1 ZINC000587568961 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(F)cc([N+](=O)[O-])c1 ZINC000587568962 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(F)cc([N+](=O)[O-])c1 ZINC000587568963 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(F)cc([N+](=O)[O-])c1 ZINC000587568964 GI Annotated Bother C[C@@]1(c2cc(F)cnc2Cl)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587569003 GI Annotated Anodyne C[C@]1(c2cc(F)cnc2Cl)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587569004 GI Annotated Anodyne C[C@]1(c2cc(F)cnc2Cl)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587569005 GI Annotated Anodyne C[C@@]1(c2cc(F)cnc2Cl)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587569006 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCOc1c(F)cccc12 ZINC000587569039 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCOc1c(F)cccc12 ZINC000587569040 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCOc1c(F)cccc12 ZINC000587569041 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCOc1c(F)cccc12 ZINC000587569042 GI Annotated Anodyne CN(C)c1ccccc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587569214 GI Annotated Anodyne CN(C)c1ccccc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587569216 GI Annotated Anodyne CN(C)c1ccccc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587569218 GI Annotated Anodyne CN(C)c1ccccc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587569219 GI Annotated Anodyne C[C@]1(c2ccc(F)cc2[N+](=O)[O-])Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587569239 GI Annotated Bother C[C@@]1(c2ccc(F)cc2[N+](=O)[O-])Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587569241 GI Annotated Bother C[C@@]1(c2ccc(F)cc2[N+](=O)[O-])Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587569244 GI Annotated Bother C[C@]1(c2ccc(F)cc2[N+](=O)[O-])Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587569247 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(F)ccc1[N+](=O)[O-] ZINC000587569318 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(F)ccc1[N+](=O)[O-] ZINC000587569319 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(F)ccc1[N+](=O)[O-] ZINC000587569322 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(F)ccc1[N+](=O)[O-] ZINC000587569323 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCc1c(F)cc(F)cc12 ZINC000587569419 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCc1c(F)cc(F)cc12 ZINC000587569420 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCc1c(F)cc(F)cc12 ZINC000587569421 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCc1c(F)cc(F)cc12 ZINC000587569422 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12C=COc1ccc(F)cc12 ZINC000587569477 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12C=COc1ccc(F)cc12 ZINC000587569478 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12C=COc1ccc(F)cc12 ZINC000587569479 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12C=COc1ccc(F)cc12 ZINC000587569480 GI Annotated Anodyne CN(C)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1C#N ZINC000587569504 GI Annotated Mild CN(C)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1C#N ZINC000587569505 GI Annotated Mild CN(C)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1C#N ZINC000587569507 GI Annotated Mild CN(C)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1C#N ZINC000587569509 GI Annotated Mild COc1cc(F)ccc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587569525 GI Annotated Anodyne COc1cc(F)ccc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587569527 GI Annotated Anodyne COc1cc(F)ccc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587569530 GI Annotated Anodyne COc1cc(F)ccc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587569531 GI Annotated Anodyne Cc1cc(F)cc2c([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)n[nH]c12 ZINC000587569813 GI Annotated Anodyne Cc1cc(F)cc2c([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)n[nH]c12 ZINC000587569814 GI Annotated Anodyne Cc1cc(F)cc2c([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)n[nH]c12 ZINC000587569815 GI Annotated Anodyne Cc1cc(F)cc2c([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)n[nH]c12 ZINC000587569816 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCOc1cc(F)ccc12 ZINC000587569829 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCOc1cc(F)ccc12 ZINC000587569830 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCOc1cc(F)ccc12 ZINC000587569831 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCOc1cc(F)ccc12 ZINC000587569832 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1nc2ccc(F)cc2[nH]1 ZINC000587569881 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1nc2ccc(F)cc2[nH]1 ZINC000587569882 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1nc2ccc(F)cc2[nH]1 ZINC000587569883 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1nc2ccc(F)cc2[nH]1 ZINC000587569884 GI Annotated Anodyne COc1ccc([C@@]2(CC#N)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587569889 GI Annotated Mild COc1ccc([C@@]2(CC#N)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587569890 GI Annotated Mild COc1ccc([C@]2(CC#N)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587569891 GI Annotated Mild COc1ccc([C@]2(CC#N)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587569892 GI Annotated Mild CC(C)N(C)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587570006 GI Annotated Anodyne CC(C)N(C)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587570008 GI Annotated Anodyne CC(C)N(C)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587570011 GI Annotated Anodyne CC(C)N(C)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587570014 GI Annotated Anodyne CN(C)c1cc(F)ccc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587570023 GI Annotated Anodyne CN(C)c1cc(F)ccc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587570033 GI Annotated Anodyne CN(C)c1cc(F)ccc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587570034 GI Annotated Anodyne CN(C)c1cc(F)ccc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587570035 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(F)c1 ZINC000587570039 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(F)c1 ZINC000587570041 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(F)c1 ZINC000587570043 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(F)c1 ZINC000587570045 GI Annotated Anodyne CN(C)/C=C/[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587570109 GI Annotated Anodyne CN(C)/C=C/[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587570110 GI Annotated Anodyne CN(C)/C=C/[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587570112 GI Annotated Anodyne CN(C)/C=C/[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587570114 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCOc1ccc(F)cc12 ZINC000587570201 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCOc1ccc(F)cc12 ZINC000587570202 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCOc1ccc(F)cc12 ZINC000587570203 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCOc1ccc(F)cc12 ZINC000587570204 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc([N+](=O)[O-])cc1F ZINC000587570326 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc([N+](=O)[O-])cc1F ZINC000587570327 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc([N+](=O)[O-])cc1F ZINC000587570328 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc([N+](=O)[O-])cc1F ZINC000587570329 GI Annotated Bother N#CC[C@]1(c2ccccc2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587570346 GI Annotated Mild N#CC[C@@]1(c2ccccc2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587570347 GI Annotated Mild N#CC[C@]1(c2ccccc2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587570348 GI Annotated Mild N#CC[C@@]1(c2ccccc2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587570349 GI Annotated Mild O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccc([N+](=O)[O-])c1F ZINC000587570351 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccc([N+](=O)[O-])c1F ZINC000587570352 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccc([N+](=O)[O-])c1F ZINC000587570353 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccc([N+](=O)[O-])c1F ZINC000587570354 GI Annotated Bother N#CC1=COc2ccccc2[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587570512 GI Annotated Reactive N#CC1=COc2ccccc2[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587570514 GI Annotated Reactive N#CC1=COc2ccccc2[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587570516 GI Annotated Reactive N#CC1=COc2ccccc2[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587570519 GI Annotated Reactive N#CC[C@]1(c2ccc(F)cc2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587570767 GI Annotated Mild N#CC[C@@]1(c2ccc(F)cc2F)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587570768 GI Annotated Mild N#CC[C@]1(c2ccc(F)cc2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587570769 GI Annotated Mild N#CC[C@@]1(c2ccc(F)cc2F)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587570770 GI Annotated Mild O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1n[nH]c2ccc(F)cc12 ZINC000587571134 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1n[nH]c2ccc(F)cc12 ZINC000587571135 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1n[nH]c2ccc(F)cc12 ZINC000587571136 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1n[nH]c2ccc(F)cc12 ZINC000587571137 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1c[nH]c2ncc(F)cc12 ZINC000587571264 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1c[nH]c2ncc(F)cc12 ZINC000587571266 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1c[nH]c2ncc(F)cc12 ZINC000587571269 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1c[nH]c2ncc(F)cc12 ZINC000587571270 GI Annotated Anodyne N#CC[C@]1(c2cc(F)cc(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587571407 GI Annotated Mild N#CC[C@@]1(c2cc(F)cc(F)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587571408 GI Annotated Mild N#CC[C@]1(c2cc(F)cc(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587571409 GI Annotated Mild N#CC[C@@]1(c2cc(F)cc(F)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587571410 GI Annotated Mild C[C@]1(c2cc(F)ccc2[N+](=O)[O-])Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587571427 GI Annotated Bother C[C@@]1(c2cc(F)ccc2[N+](=O)[O-])Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587571428 GI Annotated Bother C[C@@]1(c2cc(F)ccc2[N+](=O)[O-])Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587571429 GI Annotated Bother C[C@]1(c2cc(F)ccc2[N+](=O)[O-])Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587571430 GI Annotated Bother COC(=O)c1cc(F)cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587571431 GI Annotated Anodyne COC(=O)c1cc(F)cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587571432 GI Annotated Anodyne CN(C)Cc1cccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587571459 GI Annotated Anodyne CN(C)Cc1cccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587571460 GI Annotated Anodyne CN(C)Cc1cccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587571461 GI Annotated Anodyne CN(C)Cc1cccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587571462 GI Annotated Anodyne CC(C)(C)OC(=O)NC(C)(C)[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587571536 GI Annotated Anodyne CC(C)(C)OC(=O)NC(C)(C)[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587571537 GI Annotated Anodyne CC(C)(C)OC(=O)NC(C)(C)[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587571538 GI Annotated Anodyne CC(C)(C)OC(=O)NC(C)(C)[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587571539 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCc1c2ccc(F)c1F ZINC000587571582 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCc1c2ccc(F)c1F ZINC000587571583 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCc1c2ccc(F)c1F ZINC000587571584 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCc1c2ccc(F)c1F ZINC000587571585 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCOc1c(F)cc(F)cc12 ZINC000587571595 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCOc1c(F)cc(F)cc12 ZINC000587571597 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCOc1c(F)cc(F)cc12 ZINC000587571599 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCOc1c(F)cc(F)cc12 ZINC000587571600 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(c1cncc(F)c1)C1CC1 ZINC000587571610 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(c1cncc(F)c1)C1CC1 ZINC000587571611 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(c1cncc(F)c1)C1CC1 ZINC000587571612 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(c1cncc(F)c1)C1CC1 ZINC000587571613 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCc1cc(F)cc(F)c12 ZINC000587571654 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCc1cc(F)cc(F)c12 ZINC000587571655 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCc1cc(F)cc(F)c12 ZINC000587571656 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCc1cc(F)cc(F)c12 ZINC000587571657 GI Annotated Anodyne Cc1cc([C@@]2(CC#N)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)o1 ZINC000587571674 GI Annotated Mild Cc1cc([C@]2(CC#N)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)o1 ZINC000587571675 GI Annotated Mild COC(=O)c1cc(F)cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587571676 GI Annotated Anodyne COC(=O)c1cc(F)cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587571677 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(CCCO)c1ccc(F)cc1 ZINC000587571758 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(CCCO)c1ccc(F)cc1 ZINC000587571759 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(CCCO)c1ccc(F)cc1 ZINC000587571760 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(CCCO)c1ccc(F)cc1 ZINC000587571761 GI Annotated Anodyne Cc1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1N(C)C ZINC000587571797 GI Annotated Anodyne Cc1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1N(C)C ZINC000587571798 GI Annotated Anodyne Cc1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1N(C)C ZINC000587571799 GI Annotated Anodyne Cc1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1N(C)C ZINC000587571800 GI Annotated Anodyne N#Cc1ccc2c(c1)CCC[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587571805 GI Annotated Mild N#Cc1ccc2c(c1)CCC[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587571806 GI Annotated Mild N#Cc1ccc2c(c1)CCC[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587571807 GI Annotated Mild N#Cc1ccc2c(c1)CCC[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587571808 GI Annotated Mild Cc1cc([C@@]2(CC#N)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)o1 ZINC000587571858 GI Annotated Mild Cc1cc([C@]2(CC#N)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)o1 ZINC000587571859 GI Annotated Mild O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCc1cc(F)ccc1C2 ZINC000587571965 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCc1cc(F)ccc1C2 ZINC000587571966 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCc1cc(F)ccc1C2 ZINC000587571967 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCc1cc(F)ccc1C2 ZINC000587571968 GI Annotated Anodyne COCC[C@]1(c2ccc(F)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572017 GI Annotated Anodyne COCC[C@]1(c2ccc(F)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572018 GI Annotated Anodyne COCC[C@@]1(c2ccc(F)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572019 GI Annotated Anodyne COCC[C@@]1(c2ccc(F)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572020 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCc1cc(F)c(F)cc12 ZINC000587572087 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCc1cc(F)c(F)cc12 ZINC000587572088 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCc1cc(F)c(F)cc12 ZINC000587572089 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCc1cc(F)c(F)cc12 ZINC000587572090 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1c[nH]c2nc(F)ccc12 ZINC000587572151 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1c[nH]c2nc(F)ccc12 ZINC000587572153 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1c[nH]c2nc(F)ccc12 ZINC000587572154 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1c[nH]c2nc(F)ccc12 ZINC000587572155 GI Annotated Anodyne CN(C)C1=C[C@]2(CC(C)(C)C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587572168 GI Annotated Anodyne CN(C)C1=C[C@@]2(CC(C)(C)C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587572170 GI Annotated Anodyne CN(C)C1=C[C@]2(CC(C)(C)C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587572172 GI Annotated Anodyne CN(C)C1=C[C@@]2(CC(C)(C)C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587572175 GI Annotated Anodyne CC(C)[C@]1(c2ccc(F)cn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572232 GI Annotated Anodyne CC(C)[C@@]1(c2ccc(F)cn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572237 GI Annotated Anodyne CC(C)[C@]1(c2ccc(F)cn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572238 GI Annotated Anodyne CC(C)[C@@]1(c2ccc(F)cn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572240 GI Annotated Anodyne COc1cc2c(cc1F)CC[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572303 GI Annotated Anodyne COc1cc2c(cc1F)CC[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572304 GI Annotated Anodyne COc1cc2c(cc1F)CC[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572305 GI Annotated Anodyne COc1cc2c(cc1F)CC[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572306 GI Annotated Anodyne CC(C)C[C@H](CN(C)C)[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572518 GI Annotated Anodyne CC(C)C[C@H](CN(C)C)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572523 GI Annotated Anodyne CC(C)C[C@H](CN(C)C)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572524 GI Annotated Anodyne CC(C)C[C@H](CN(C)C)[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572525 GI Annotated Anodyne Cc1ccc2c(c1)[C@@]1(Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)C(C#N)=CO2 ZINC000587572534 GI Annotated Reactive Cc1ccc2c(c1)[C@@]1(Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)C(C#N)=CO2 ZINC000587572538 GI Annotated Reactive Cc1ccc2c(c1)[C@]1(Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)C(C#N)=CO2 ZINC000587572540 GI Annotated Reactive Cc1ccc2c(c1)[C@]1(Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)C(C#N)=CO2 ZINC000587572542 GI Annotated Reactive CN(C)c1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587572693 GI Annotated Anodyne CN(C)c1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587572694 GI Annotated Anodyne CN(C)c1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587572695 GI Annotated Anodyne CN(C)c1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587572696 GI Annotated Anodyne C[C@]1(c2ccccc2OCC#N)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572780 GI Annotated Mild C[C@]1(c2ccccc2OCC#N)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572781 GI Annotated Mild C[C@@]1(c2ccccc2OCC#N)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572782 GI Annotated Mild C[C@@]1(c2ccccc2OCC#N)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572787 GI Annotated Mild O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCNc1ccc(F)cc12 ZINC000587572828 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCNc1ccc(F)cc12 ZINC000587572830 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCNc1ccc(F)cc12 ZINC000587572832 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCNc1ccc(F)cc12 ZINC000587572835 GI Annotated Anodyne CC(C)(C)OC(=O)NCC[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572837 GI Annotated Anodyne CC(C)(C)OC(=O)NCC[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572840 GI Annotated Anodyne CC(C)(C)OC(=O)NCC[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572842 GI Annotated Anodyne CC(C)(C)OC(=O)NCC[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572843 GI Annotated Anodyne COc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587572887 GI Annotated Bother COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587572889 GI Annotated Bother COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587572890 GI Annotated Bother COc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587572892 GI Annotated Bother C[C@]1(c2ccc([N+](=O)[O-])cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572937 GI Annotated Bother C[C@@]1(c2ccc([N+](=O)[O-])cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572938 GI Annotated Bother C[C@@]1(c2ccc([N+](=O)[O-])cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572940 GI Annotated Bother C[C@]1(c2ccc([N+](=O)[O-])cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572941 GI Annotated Bother C[C@]1(C(=O)c2ccc(F)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572978 GI Annotated Anodyne C[C@]1(C(=O)c2ccc(F)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572983 GI Annotated Anodyne C[C@@]1(C(=O)c2ccc(F)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587572984 GI Annotated Anodyne C[C@@]1(C(=O)c2ccc(F)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587572985 GI Annotated Anodyne C[C@H](C#N)Oc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587573173 GI Annotated Mild C[C@H](C#N)Oc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587573177 GI Annotated Mild C[C@H](C#N)Oc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587573178 GI Annotated Mild C[C@H](C#N)Oc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587573180 GI Annotated Mild CN(C)c1cccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587573220 GI Annotated Anodyne CN(C)c1cccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587573221 GI Annotated Anodyne CN(C)c1cccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587573222 GI Annotated Anodyne CN(C)c1cccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587573223 GI Annotated Anodyne CN(C)Cc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587573224 GI Annotated Anodyne CN(C)Cc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587573225 GI Annotated Anodyne CN(C)Cc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587573226 GI Annotated Anodyne CN(C)Cc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587573227 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCOc1cccc(F)c12 ZINC000587573244 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCOc1cccc(F)c12 ZINC000587573245 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCOc1cccc(F)c12 ZINC000587573246 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCOc1cccc(F)c12 ZINC000587573247 GI Annotated Anodyne Cc1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1[N+](=O)[O-] ZINC000587573473 GI Annotated Bother Cc1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1[N+](=O)[O-] ZINC000587573474 GI Annotated Bother Cc1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1[N+](=O)[O-] ZINC000587573475 GI Annotated Bother Cc1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1[N+](=O)[O-] ZINC000587573476 GI Annotated Bother COc1ccc2c(c1F)CC[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587573564 GI Annotated Anodyne COc1ccc2c(c1F)CC[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587573565 GI Annotated Anodyne COc1ccc2c(c1F)CC[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587573566 GI Annotated Anodyne COc1ccc2c(c1F)CC[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587573567 GI Annotated Anodyne CCN(CC)[C@@H]1CCCC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587573651 GI Annotated Anodyne CCN(CC)[C@@H]1CCCC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587573652 GI Annotated Anodyne CCN(CC)[C@@H]1CCCC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587573653 GI Annotated Anodyne CCN(CC)[C@@H]1CCCC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587573654 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(C(=O)Cl)c1ccc(F)cc1 ZINC000587573730 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(C(=O)Cl)c1ccc(F)cc1 ZINC000587573732 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(C(=O)Cl)c1ccc(F)cc1 ZINC000587573734 GI Annotated Reactive O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(C(=O)Cl)c1ccc(F)cc1 ZINC000587573736 GI Annotated Reactive N#CC[C@]1(c2ccc(F)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587573766 GI Annotated Mild N#CC[C@@]1(c2ccc(F)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587573768 GI Annotated Mild N#CC[C@]1(c2ccc(F)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587573770 GI Annotated Mild N#CC[C@@]1(c2ccc(F)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587573771 GI Annotated Mild C[C@]1(c2cccc([N+](=O)[O-])c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587573855 GI Annotated Bother C[C@@]1(c2cccc([N+](=O)[O-])c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587573857 GI Annotated Bother C[C@@]1(c2cccc([N+](=O)[O-])c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587573859 GI Annotated Bother C[C@]1(c2cccc([N+](=O)[O-])c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587573861 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1nccn1-c1ccccc1 ZINC000587573999 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1nccn1-c1ccccc1 ZINC000587574000 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1nccn1-c1ccccc1 ZINC000587574001 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1nccn1-c1ccccc1 ZINC000587574002 GI Annotated Anodyne Cn1c([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)nc2ccccc21 ZINC000587574056 GI Annotated Anodyne Cn1c([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)nc2ccccc21 ZINC000587574066 GI Annotated Anodyne Cn1c([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)nc2ccccc21 ZINC000587574068 GI Annotated Anodyne Cn1c([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)nc2ccccc21 ZINC000587574069 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(-n2ccnc2)cc1 ZINC000587574092 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(-n2ccnc2)cc1 ZINC000587574094 GI Annotated Anodyne COc1cc2c(cc1F)[C@@]1(CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587574095 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(-n2ccnc2)cc1 ZINC000587574096 GI Annotated Anodyne COc1cc2c(cc1F)[C@@]1(CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587574097 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(-n2ccnc2)cc1 ZINC000587574098 GI Annotated Anodyne COc1cc2c(cc1F)[C@]1(CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587574100 GI Annotated Anodyne COc1cc2c(cc1F)[C@]1(CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587574101 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCc1cc(F)c(O)cc12 ZINC000587574126 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCc1cc(F)c(O)cc12 ZINC000587574134 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCc1cc(F)c(O)cc12 ZINC000587574136 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCc1cc(F)c(O)cc12 ZINC000587574138 GI Annotated Anodyne C[C@H](N(C)C)[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587574193 GI Annotated Anodyne C[C@H](N(C)C)[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587574194 GI Annotated Anodyne C[C@H](N(C)C)[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587574195 GI Annotated Anodyne C[C@H](N(C)C)[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587574196 GI Annotated Anodyne CCN[C@H](C)[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587574234 GI Annotated Anodyne CCN[C@H](C)[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587574235 GI Annotated Anodyne CCN[C@H](C)[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587574237 GI Annotated Anodyne CCN[C@H](C)[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587574239 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccc(-n2ccnc2)c1 ZINC000587574781 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccc(-n2ccnc2)c1 ZINC000587574783 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccc(-n2ccnc2)c1 ZINC000587574785 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccc(-n2ccnc2)c1 ZINC000587574787 GI Annotated Anodyne Cc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c([N+](=O)[O-])c1 ZINC000587574953 GI Annotated Bother Cc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c([N+](=O)[O-])c1 ZINC000587574954 GI Annotated Bother Cc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c([N+](=O)[O-])c1 ZINC000587574955 GI Annotated Bother Cc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c([N+](=O)[O-])c1 ZINC000587574956 GI Annotated Bother COc1cccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1[N+](=O)[O-] ZINC000587574957 GI Annotated Bother COc1cccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1[N+](=O)[O-] ZINC000587574958 GI Annotated Bother COc1cccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1[N+](=O)[O-] ZINC000587574959 GI Annotated Bother COc1cccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1[N+](=O)[O-] ZINC000587574960 GI Annotated Bother C[C@H](N=O)[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587574978 GI Annotated Anodyne C[C@H](N=O)[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587574983 GI Annotated Anodyne C[C@H](N=O)[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587574984 GI Annotated Anodyne C[C@H](N=O)[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587574986 GI Annotated Anodyne Cn1c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cnc1-c1ccccc1 ZINC000587575199 GI Annotated Anodyne Cn1c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cnc1-c1ccccc1 ZINC000587575200 GI Annotated Anodyne Cn1c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cnc1-c1ccccc1 ZINC000587575201 GI Annotated Anodyne Cn1c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cnc1-c1ccccc1 ZINC000587575202 GI Annotated Anodyne C[C@]1(CC(=O)Nc2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587575470 GI Annotated Anodyne C[C@]1(CC(=O)Nc2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587575471 GI Annotated Anodyne C[C@@]1(CC(=O)Nc2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587575472 GI Annotated Anodyne C[C@@]1(CC(=O)Nc2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587575473 GI Annotated Anodyne CC(=O)Nc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587575498 GI Annotated Anodyne CC(=O)Nc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587575499 GI Annotated Anodyne CC(=O)Nc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587575500 GI Annotated Anodyne CC(=O)Nc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587575501 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1nccn1Cc1ccccc1 ZINC000587575647 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1nccn1Cc1ccccc1 ZINC000587575651 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1nccn1Cc1ccccc1 ZINC000587575653 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1nccn1Cc1ccccc1 ZINC000587575654 GI Annotated Anodyne Cc1ccc([N+](=O)[O-])c([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587575667 GI Annotated Bother Cc1ccc([N+](=O)[O-])c([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587575671 GI Annotated Bother COCCn1c(C)cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587575672 GI Annotated Anodyne Cc1ccc([N+](=O)[O-])c([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587575673 GI Annotated Bother Cc1ccc([N+](=O)[O-])c([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587575674 GI Annotated Bother Cc1cccc([N+](=O)[O-])c1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587575675 GI Annotated Bother COCCn1c(C)cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587575676 GI Annotated Anodyne Cc1cccc([N+](=O)[O-])c1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587575677 GI Annotated Bother COCCn1c(C)cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587575678 GI Annotated Anodyne Cc1cccc([N+](=O)[O-])c1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587575679 GI Annotated Bother COCCn1c(C)cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587575680 GI Annotated Anodyne Cc1cccc([N+](=O)[O-])c1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587575681 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCc1c([N+](=O)[O-])cccc12 ZINC000587575706 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCc1c([N+](=O)[O-])cccc12 ZINC000587575707 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCc1c([N+](=O)[O-])cccc12 ZINC000587575708 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCc1c([N+](=O)[O-])cccc12 ZINC000587575709 GI Annotated Bother Cc1ccc([N+](=O)[O-])c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587575892 GI Annotated Bother Cc1ccc([N+](=O)[O-])c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587575894 GI Annotated Bother Cc1ccc([N+](=O)[O-])c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587575896 GI Annotated Bother Cc1ccc([N+](=O)[O-])c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587575898 GI Annotated Bother Cn1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)nc1-c1ccccc1 ZINC000587575949 GI Annotated Anodyne Cn1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)nc1-c1ccccc1 ZINC000587575950 GI Annotated Anodyne Cn1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)nc1-c1ccccc1 ZINC000587575951 GI Annotated Anodyne Cn1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)nc1-c1ccccc1 ZINC000587575952 GI Annotated Anodyne COc1ccc([N+](=O)[O-])c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587576096 GI Annotated Bother COc1ccc([N+](=O)[O-])c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587576098 GI Annotated Bother COc1ccc([N+](=O)[O-])c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587576099 GI Annotated Bother COc1ccc([N+](=O)[O-])c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587576101 GI Annotated Bother Cc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587576103 GI Annotated Bother Cc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587576105 GI Annotated Bother Cc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587576106 GI Annotated Bother Cc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587576108 GI Annotated Bother CNc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587576299 GI Annotated Bother CNc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587576300 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccn1-c1ccccn1 ZINC000587576304 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccn1-c1ccccn1 ZINC000587576305 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccn1-c1ccccn1 ZINC000587576306 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccn1-c1ccccn1 ZINC000587576307 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(Cn1ccnc1)c1ccccc1 ZINC000587576312 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(Cn1ccnc1)c1ccccc1 ZINC000587576313 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(Cn1ccnc1)c1ccccc1 ZINC000587576314 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(Cn1ccnc1)c1ccccc1 ZINC000587576315 GI Annotated Anodyne CNc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587576338 GI Annotated Bother CNc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587576340 GI Annotated Bother Cc1cccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1[N+](=O)[O-] ZINC000587576480 GI Annotated Bother Cc1cccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1[N+](=O)[O-] ZINC000587576482 GI Annotated Bother Cc1cccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1[N+](=O)[O-] ZINC000587576484 GI Annotated Bother Cc1cccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1[N+](=O)[O-] ZINC000587576486 GI Annotated Bother CC1=C[C@@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c2ccc(N)cc2O1 ZINC000587576500 GI Annotated Anodyne CC1=C[C@@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c2ccc(N)cc2O1 ZINC000587576505 GI Annotated Anodyne CC1=C[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c2ccc(N)cc2O1 ZINC000587576508 GI Annotated Anodyne CC1=C[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c2ccc(N)cc2O1 ZINC000587576511 GI Annotated Anodyne Cc1c([N+](=O)[O-])cccc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587576750 GI Annotated Bother Cc1c([N+](=O)[O-])cccc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587576752 GI Annotated Bother Cc1c([N+](=O)[O-])cccc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587576754 GI Annotated Bother Cc1c([N+](=O)[O-])cccc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587576757 GI Annotated Bother CCn1c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)nc2ccccc21 ZINC000587576783 GI Annotated Anodyne COc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c([N+](=O)[O-])c1 ZINC000587576786 GI Annotated Bother COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c([N+](=O)[O-])c1 ZINC000587576788 GI Annotated Bother COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c([N+](=O)[O-])c1 ZINC000587576790 GI Annotated Bother COc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c([N+](=O)[O-])c1 ZINC000587576792 GI Annotated Bother CCn1c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)nc2ccccc21 ZINC000587576800 GI Annotated Anodyne CCn1c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)nc2ccccc21 ZINC000587576802 GI Annotated Anodyne CCn1c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)nc2ccccc21 ZINC000587576804 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccn1Cc1cccnc1 ZINC000587576915 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccn1Cc1cccnc1 ZINC000587576918 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccn1Cc1cccnc1 ZINC000587576921 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccn1Cc1cccnc1 ZINC000587576922 GI Annotated Anodyne CC(C)[C@]1(c2ccccc2N)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587576934 GI Annotated Anodyne CC(C)[C@]1(c2ccccc2N)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587576935 GI Annotated Anodyne COc1ccc([N+](=O)[O-])cc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587576944 GI Annotated Bother COc1ccc([N+](=O)[O-])cc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587576945 GI Annotated Bother COc1ccc([N+](=O)[O-])cc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587576946 GI Annotated Bother COc1ccc([N+](=O)[O-])cc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587576947 GI Annotated Bother CC(C)[C@@]1(c2ccccc2N)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587577006 GI Annotated Anodyne CC(C)[C@@]1(c2ccccc2N)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587577008 GI Annotated Anodyne C[C@@]1(c2ccc(-n3ccnc3)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587577063 GI Annotated Anodyne C[C@@]1(c2ccc(-n3ccnc3)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587577065 GI Annotated Anodyne C[C@]1(c2ccc(-n3ccnc3)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587577066 GI Annotated Anodyne C[C@]1(c2ccc(-n3ccnc3)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587577067 GI Annotated Anodyne C[C@@]1(c2ccccc2-n2ccnc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587577105 GI Annotated Anodyne C[C@@]1(c2ccccc2-n2ccnc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587577107 GI Annotated Anodyne C[C@]1(c2ccccc2-n2ccnc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587577109 GI Annotated Anodyne C[C@]1(c2ccccc2-n2ccnc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587577111 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccn1-c1ccncc1 ZINC000587577128 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccn1-c1ccncc1 ZINC000587577131 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccn1-c1ccncc1 ZINC000587577133 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccn1-c1ccncc1 ZINC000587577135 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587577159 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587577160 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587577161 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587577162 GI Annotated Anodyne Cc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587577266 GI Annotated Bother Cc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587577267 GI Annotated Bother Cc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587577268 GI Annotated Bother Cc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1[N+](=O)[O-] ZINC000587577269 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cncn1Cc1ccccc1 ZINC000587577444 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cncn1Cc1ccccc1 ZINC000587577446 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cncn1Cc1ccccc1 ZINC000587577448 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cncn1Cc1ccccc1 ZINC000587577450 GI Annotated Anodyne Cn1ccnc1[C@@H]1CCC[C@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587577668 GI Annotated Anodyne Cn1ccnc1[C@@H]1CCC[C@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587577669 GI Annotated Anodyne Cn1ccnc1[C@@H]1CCC[C@@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587577670 GI Annotated Anodyne Cn1ccnc1[C@@H]1CCC[C@@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587577672 GI Annotated Anodyne C[C@]1(c2ccccc2[N+](=O)[O-])Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587577688 GI Annotated Bother C[C@@]1(c2ccccc2[N+](=O)[O-])Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587577691 GI Annotated Bother C[C@@]1(c2ccccc2[N+](=O)[O-])Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587577694 GI Annotated Bother C[C@]1(c2ccccc2[N+](=O)[O-])Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587577696 GI Annotated Bother CCOc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1N ZINC000587577765 GI Annotated Anodyne CCOc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1N ZINC000587577766 GI Annotated Anodyne CCOc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1N ZINC000587577767 GI Annotated Anodyne CCOc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1N ZINC000587577768 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccn1-c1cccnc1 ZINC000587578025 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccn1-c1cccnc1 ZINC000587578026 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccn1-c1cccnc1 ZINC000587578027 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccn1-c1cccnc1 ZINC000587578028 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccn1Cc1ccccn1 ZINC000587578121 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccn1Cc1ccccn1 ZINC000587578122 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccn1Cc1ccccn1 ZINC000587578123 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccn1Cc1ccccn1 ZINC000587578124 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587578206 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587578207 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587578208 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587578209 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCc1ccc([N+](=O)[O-])cc12 ZINC000587578246 GI Annotated Bother O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCc1ccc([N+](=O)[O-])cc12 ZINC000587578247 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCc1ccc([N+](=O)[O-])cc12 ZINC000587578248 GI Annotated Bother O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCc1ccc([N+](=O)[O-])cc12 ZINC000587578249 GI Annotated Bother COc1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1[N+](=O)[O-] ZINC000587578277 GI Annotated Bother COc1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1[N+](=O)[O-] ZINC000587578278 GI Annotated Bother COc1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1[N+](=O)[O-] ZINC000587578280 GI Annotated Bother COc1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1[N+](=O)[O-] ZINC000587578282 GI Annotated Bother Cc1cc([N+](=O)[O-])ccc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587578283 GI Annotated Bother Cc1cc([N+](=O)[O-])ccc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587578284 GI Annotated Bother Cc1cc([N+](=O)[O-])ccc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587578286 GI Annotated Bother Cc1cc([N+](=O)[O-])ccc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587578287 GI Annotated Bother Cc1ccc([N+](=O)[O-])cc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587578313 GI Annotated Bother Cc1ccc([N+](=O)[O-])cc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587578315 GI Annotated Bother Cc1ccc([N+](=O)[O-])cc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587578316 GI Annotated Bother Cc1ccc([N+](=O)[O-])cc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587578317 GI Annotated Bother Cn1ncc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1-c1ccccc1 ZINC000587578402 GI Annotated Anodyne Cn1ncc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1-c1ccccc1 ZINC000587578405 GI Annotated Anodyne Cn1ncc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1-c1ccccc1 ZINC000587578409 GI Annotated Anodyne Cn1ncc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1-c1ccccc1 ZINC000587578414 GI Annotated Anodyne CCn1nc(C)c([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587578454 GI Annotated Anodyne CCn1nc(C)c([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587578471 GI Annotated Anodyne CCn1nc(C)c([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587578474 GI Annotated Anodyne CCn1nc(C)c([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587578478 GI Annotated Anodyne Cn1ncc2cccc([C@@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c21 ZINC000587578489 GI Annotated Anodyne Cn1ncc2cccc([C@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c21 ZINC000587578491 GI Annotated Anodyne Cn1ncc2cccc([C@@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c21 ZINC000587578493 GI Annotated Anodyne Cn1ncc2cccc([C@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c21 ZINC000587578495 GI Annotated Anodyne CCCCCn1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587578507 GI Annotated Anodyne CCCCCn1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587578513 GI Annotated Anodyne CCCCCn1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587578515 GI Annotated Anodyne CCCCCn1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587578517 GI Annotated Anodyne Cn1cc(-c2cccc([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c2)cn1 ZINC000587578658 GI Annotated Anodyne Cn1cc(-c2cccc([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c2)cn1 ZINC000587578660 GI Annotated Anodyne Cn1cc(-c2cccc([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c2)cn1 ZINC000587578661 GI Annotated Anodyne Cn1cc(-c2cccc([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c2)cn1 ZINC000587578662 GI Annotated Anodyne CC1(C)[C@@]2(N)CC[C@@]1(C)[C@@]1(C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587578723 GI Annotated Anodyne CC1(C)[C@@]2(N)CC[C@@]1(C)[C@]1(C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587578724 GI Annotated Anodyne CC1(C)[C@@]2(N)CC[C@@]1(C)[C@@]1(C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587578725 GI Annotated Anodyne CC1(C)[C@@]2(N)CC[C@@]1(C)[C@]1(C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587578726 GI Annotated Anodyne C[C@@]1(c2ccnn2-c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587578850 GI Annotated Anodyne C[C@@]1(c2ccnn2-c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587578851 GI Annotated Anodyne C[C@]1(c2ccnn2-c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587578852 GI Annotated Anodyne C[C@]1(c2ccnn2-c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587578853 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccn1C[C@@H]1CCCO1 ZINC000587578886 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccn1C[C@@H]1CCCO1 ZINC000587578887 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccn1C[C@H]1CCCO1 ZINC000587578889 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccn1C[C@H]1CCCO1 ZINC000587578890 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cn(-c2ccccc2)cn1 ZINC000587579243 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cn(-c2ccccc2)cn1 ZINC000587579244 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cn(-c2ccccc2)cn1 ZINC000587579245 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cn(-c2ccccc2)cn1 ZINC000587579247 GI Annotated Anodyne CCn1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C(C)C)n1 ZINC000587579261 GI Annotated Anodyne CCn1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C(C)C)n1 ZINC000587579262 GI Annotated Anodyne CCn1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C(C)C)n1 ZINC000587579263 GI Annotated Anodyne CCn1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C(C)C)n1 ZINC000587579264 GI Annotated Anodyne CC(=O)Nc1cccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587579508 GI Annotated Anodyne CC(=O)Nc1cccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587579509 GI Annotated Anodyne CC(=O)Nc1cccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587579510 GI Annotated Anodyne CC(=O)Nc1cccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587579511 GI Annotated Anodyne C=C(C)Cn1nc(C)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587579553 GI Annotated Mild C=C(C)Cn1nc(C)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587579558 GI Annotated Mild C=C(C)Cn1nc(C)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587579560 GI Annotated Mild C=C(C)Cn1nc(C)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587579563 GI Annotated Mild Cn1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C(C)(C)C)n1 ZINC000587579986 GI Annotated Anodyne Cn1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C(C)(C)C)n1 ZINC000587579989 GI Annotated Anodyne Cn1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C(C)(C)C)n1 ZINC000587579993 GI Annotated Anodyne Cn1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C(C)(C)C)n1 ZINC000587579994 GI Annotated Anodyne Cn1nc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1-c1ccccc1 ZINC000587580082 GI Annotated Anodyne Cn1nc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1-c1ccccc1 ZINC000587580084 GI Annotated Anodyne Cn1nc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1-c1ccccc1 ZINC000587580086 GI Annotated Anodyne Cn1nc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1-c1ccccc1 ZINC000587580088 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(Cn2cccn2)cc1 ZINC000587580095 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(Cn2cccn2)cc1 ZINC000587580097 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(Cn2cccn2)cc1 ZINC000587580099 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(Cn2cccn2)cc1 ZINC000587580100 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnn(C2CCCC2)c1 ZINC000587580328 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnn(C2CCCC2)c1 ZINC000587580339 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnn(C2CCCC2)c1 ZINC000587580342 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnn(C2CCCC2)c1 ZINC000587580345 GI Annotated Anodyne Cn1cc([C@]2(c3ccccc3)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587580384 GI Annotated Anodyne Cn1cc([C@]2(c3ccccc3)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587580395 GI Annotated Anodyne Cn1cc([C@@]2(c3ccccc3)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587580398 GI Annotated Anodyne Cn1cc([C@@]2(c3ccccc3)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587580400 GI Annotated Anodyne Cn1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(-c2ccccc2)n1 ZINC000587580506 GI Annotated Anodyne Cn1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(-c2ccccc2)n1 ZINC000587580508 GI Annotated Anodyne Cn1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(-c2ccccc2)n1 ZINC000587580510 GI Annotated Anodyne Cn1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(-c2ccccc2)n1 ZINC000587580512 GI Annotated Anodyne Cn1nc(C(C)(C)C)cc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587580776 GI Annotated Anodyne Cn1nc(C(C)(C)C)cc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587580778 GI Annotated Anodyne Cn1nc(C(C)(C)C)cc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587580780 GI Annotated Anodyne Cn1nc(C(C)(C)C)cc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587580782 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC12CCN(c1ccccc1)CC2 ZINC000587580820 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC12CCN(c1ccccc1)CC2 ZINC000587580822 GI Annotated Anodyne Cc1cc(-n2cccc2[C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)no1 ZINC000587580845 GI Annotated Anodyne Cc1cc(-n2cccc2[C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)no1 ZINC000587580848 GI Annotated Anodyne Cc1cc(-n2cccc2[C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)no1 ZINC000587580850 GI Annotated Anodyne Cc1cc(-n2cccc2[C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)no1 ZINC000587580853 GI Annotated Anodyne C[C@@]1(c2ccccc2-n2cccn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587580897 GI Annotated Anodyne C[C@@]1(c2ccccc2-n2cccn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587580898 GI Annotated Anodyne C[C@]1(c2ccccc2-n2cccn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587580900 GI Annotated Anodyne C[C@]1(c2ccccc2-n2cccn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587580902 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(-n2cccn2)cc1 ZINC000587581137 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(-n2cccn2)cc1 ZINC000587581139 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(-n2cccn2)cc1 ZINC000587581141 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(-n2cccn2)cc1 ZINC000587581142 GI Annotated Anodyne Cn1ncc2c([C@@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cccc21 ZINC000587581198 GI Annotated Anodyne Cn1ncc2c([C@@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cccc21 ZINC000587581199 GI Annotated Anodyne Cn1ncc2c([C@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cccc21 ZINC000587581200 GI Annotated Anodyne Cn1ncc2c([C@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cccc21 ZINC000587581201 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)c1 ZINC000587581256 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)c1 ZINC000587581257 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)c1 ZINC000587581258 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)c1 ZINC000587581259 GI Annotated Anodyne CC(=O)c1cc(N)cc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587581260 GI Annotated Anodyne CC(=O)c1cc(N)cc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587581261 GI Annotated Anodyne CC(=O)c1cc(N)cc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587581262 GI Annotated Anodyne CC(=O)c1cc(N)cc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587581263 GI Annotated Anodyne CN1CCC[C@@H]1[C@@H]1CCCC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587581372 GI Annotated Anodyne CN1CCC[C@@H]1[C@@H]1CCCC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587581375 GI Annotated Anodyne CN1CCC[C@@H]1[C@@H]1CCCC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587581377 GI Annotated Anodyne CN1CCC[C@@H]1[C@@H]1CCCC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587581379 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccn(Cc2ccccc2)n1 ZINC000587581436 GI Annotated Anodyne CC(C)CCN1CCC2(CC1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587581437 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccn(Cc2ccccc2)n1 ZINC000587581438 GI Annotated Anodyne CC(C)CCN1CCC2(CC1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587581439 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccn(Cc2ccccc2)n1 ZINC000587581441 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccn(Cc2ccccc2)n1 ZINC000587581442 GI Annotated Anodyne Cn1cc2cc([C@@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)ccc2n1 ZINC000587581458 GI Annotated Anodyne Cn1cc2cc([C@@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)ccc2n1 ZINC000587581459 GI Annotated Anodyne Cn1cc2cc([C@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)ccc2n1 ZINC000587581460 GI Annotated Anodyne Cn1cc2cc([C@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)ccc2n1 ZINC000587581461 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccccc1Cn1cccn1 ZINC000587581518 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccccc1Cn1cccn1 ZINC000587581519 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccccc1Cn1cccn1 ZINC000587581520 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccccc1Cn1cccn1 ZINC000587581521 GI Annotated Anodyne C[C@@H]1CCCN(CC(C)(C)[C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C1 ZINC000587581665 GI Annotated Anodyne C[C@@H]1CCCN(CC(C)(C)[C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C1 ZINC000587581670 GI Annotated Anodyne C[C@@H]1CCCN(CC(C)(C)[C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C1 ZINC000587581671 GI Annotated Anodyne C[C@@H]1CCCN(CC(C)(C)[C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C1 ZINC000587581672 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC12CCN(C1CCCC1)CC2 ZINC000587581691 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC12CCN(C1CCCC1)CC2 ZINC000587581695 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(N)c1C ZINC000587581729 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(N)c1C ZINC000587581731 GI Annotated Anodyne Cn1ncc2cc([C@@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)ccc21 ZINC000587581746 GI Annotated Anodyne Cn1ncc2cc([C@@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)ccc21 ZINC000587581747 GI Annotated Anodyne Cn1ncc2cc([C@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)ccc21 ZINC000587581748 GI Annotated Anodyne Cn1ncc2cc([C@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)ccc21 ZINC000587581749 GI Annotated Anodyne Cn1nc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1-c1ccco1 ZINC000587581750 GI Annotated Anodyne Cn1nc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1-c1ccco1 ZINC000587581751 GI Annotated Anodyne Cn1nc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1-c1ccco1 ZINC000587581752 GI Annotated Anodyne Cn1nc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1-c1ccco1 ZINC000587581753 GI Annotated Anodyne Cn1nccc1[C@@H]1CCC[C@@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587581754 GI Annotated Anodyne Cn1nccc1[C@@H]1CCC[C@@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587581755 GI Annotated Anodyne Cn1nccc1[C@@H]1CCC[C@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587581756 GI Annotated Anodyne Cn1nccc1[C@@H]1CCC[C@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587581757 GI Annotated Anodyne Cn1cc([C@@H]2C[C@]3(Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)C2(C)C)cn1 ZINC000587581770 GI Annotated Anodyne Cn1cc([C@@H]2C[C@@]3(Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)C2(C)C)cn1 ZINC000587581771 GI Annotated Anodyne Cn1cc([C@@H]2C[C@@]3(Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)C2(C)C)cn1 ZINC000587581772 GI Annotated Anodyne Cn1cc([C@@H]2C[C@]3(Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)C2(C)C)cn1 ZINC000587581773 GI Annotated Anodyne Cn1nc(-c2ccccc2)cc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587581786 GI Annotated Anodyne Cn1nc(-c2ccccc2)cc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587581787 GI Annotated Anodyne Cn1nc(-c2ccccc2)cc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587581788 GI Annotated Anodyne Cn1nc(-c2ccccc2)cc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587581789 GI Annotated Anodyne Cn1cc2cccc([C@@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c2n1 ZINC000587581790 GI Annotated Anodyne Cn1cc2cccc([C@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c2n1 ZINC000587581791 GI Annotated Anodyne Cn1cc2cccc([C@@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c2n1 ZINC000587581792 GI Annotated Anodyne Cn1cc2cccc([C@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c2n1 ZINC000587581793 GI Annotated Anodyne CN1C(C)(C)CC2(CC1(C)C)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587581848 GI Annotated Anodyne CN1C(C)(C)CC2(CC1(C)C)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587581849 GI Annotated Anodyne CC1CCN(CC(C)(C)[C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CC1 ZINC000587581854 GI Annotated Anodyne CC1CCN(CC(C)(C)[C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CC1 ZINC000587581855 GI Annotated Anodyne CC1CCN(CC(C)(C)[C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CC1 ZINC000587581856 GI Annotated Anodyne CC1CCN(CC(C)(C)[C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CC1 ZINC000587581857 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(N)c1C ZINC000587581859 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(N)c1C ZINC000587581860 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582025 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582026 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582027 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582028 GI Annotated Anodyne CC(C)n1ncc2c1CCC[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582042 GI Annotated Anodyne CC(C)n1ncc2c1CCC[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582043 GI Annotated Anodyne CC(C)n1ncc2c1CCC[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582044 GI Annotated Anodyne CC(C)n1ncc2c1CCC[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582045 GI Annotated Anodyne Cn1nc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c2ccccc21 ZINC000587582070 GI Annotated Anodyne Cn1nc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c2ccccc21 ZINC000587582071 GI Annotated Anodyne Cn1nc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c2ccccc21 ZINC000587582072 GI Annotated Anodyne Cn1nc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c2ccccc21 ZINC000587582073 GI Annotated Anodyne CC(C)(C)[C@@]1(Cn2cccn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582110 GI Annotated Anodyne CC(C)(C)[C@@]1(Cn2cccn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582111 GI Annotated Anodyne CC(C)(C)[C@]1(Cn2cccn2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582112 GI Annotated Anodyne CC(C)(C)[C@]1(Cn2cccn2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582113 GI Annotated Anodyne C[C@@]1(c2cnn(-c3ccccc3)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582360 GI Annotated Anodyne C[C@@]1(c2cnn(-c3ccccc3)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582361 GI Annotated Anodyne C[C@]1(c2cnn(-c3ccccc3)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582362 GI Annotated Anodyne C[C@]1(c2cnn(-c3ccccc3)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582363 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccnn1-c1ccccc1 ZINC000587582380 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccnn1-c1ccccc1 ZINC000587582381 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccnn1-c1ccccc1 ZINC000587582382 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccnn1-c1ccccc1 ZINC000587582383 GI Annotated Anodyne CCC(CC)N1CCC2(CC1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587582516 GI Annotated Anodyne CCC(CC)N1CCC2(CC1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587582517 GI Annotated Anodyne CCCCn1nc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1C ZINC000587582600 GI Annotated Anodyne CCCCn1nc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1C ZINC000587582601 GI Annotated Anodyne CCCCn1nc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1C ZINC000587582602 GI Annotated Anodyne CCCCn1nc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1C ZINC000587582603 GI Annotated Anodyne Cc1nn(C(C)C)c(C)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582636 GI Annotated Anodyne Cc1nn(C(C)C)c(C)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582637 GI Annotated Anodyne Cc1nn(C(C)C)c(C)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582638 GI Annotated Anodyne Cc1nn(C(C)C)c(C)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582639 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccnn1C1CCCC1 ZINC000587582752 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccnn1C1CCCC1 ZINC000587582753 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccnn1C1CCCC1 ZINC000587582754 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccnn1C1CCCC1 ZINC000587582755 GI Annotated Anodyne C[C@@]1(c2ccc(-n3cccn3)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582764 GI Annotated Anodyne C[C@@]1(c2ccc(-n3cccn3)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582765 GI Annotated Anodyne C[C@]1(c2ccc(-n3cccn3)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587582766 GI Annotated Anodyne C[C@]1(c2ccc(-n3cccn3)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587582767 GI Annotated Anodyne CC(C)n1ccc(C[C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587582828 GI Annotated Anodyne CC(C)n1ccc(C[C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)n1 ZINC000587582829 GI Annotated Anodyne CC(C)n1ccc(C[C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587582830 GI Annotated Anodyne CC(C)n1ccc(C[C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)n1 ZINC000587582831 GI Annotated Anodyne CCCn1cc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)n1 ZINC000587583012 GI Annotated Anodyne CCCn1cc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)n1 ZINC000587583013 GI Annotated Anodyne CCCn1cc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)n1 ZINC000587583014 GI Annotated Anodyne CCCn1cc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)n1 ZINC000587583015 GI Annotated Anodyne CCn1ncc([C@@]2(C(C)C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587583148 GI Annotated Anodyne CCn1ncc([C@@]2(C(C)C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587583149 GI Annotated Anodyne CCn1ncc([C@]2(C(C)C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587583150 GI Annotated Anodyne CCn1ncc([C@]2(C(C)C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587583151 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccc(Cn2cccn2)c1 ZINC000587583156 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccc(Cn2cccn2)c1 ZINC000587583157 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccc(Cn2cccn2)c1 ZINC000587583158 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccc(Cn2cccn2)c1 ZINC000587583159 GI Annotated Anodyne Cn1cc2ccc([C@@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cc2n1 ZINC000587583188 GI Annotated Anodyne Cn1cc2ccc([C@@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cc2n1 ZINC000587583189 GI Annotated Anodyne Cn1cc2ccc([C@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cc2n1 ZINC000587583190 GI Annotated Anodyne Cn1cc2ccc([C@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cc2n1 ZINC000587583191 GI Annotated Anodyne CC[C@]1(c2c(C)nn(C)c2C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587583356 GI Annotated Anodyne CC[C@@]1(c2c(C)nn(C)c2C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587583357 GI Annotated Anodyne CC[C@]1(c2c(C)nn(C)c2C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587583358 GI Annotated Anodyne CC[C@@]1(c2c(C)nn(C)c2C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587583359 GI Annotated Anodyne C=CCn1nc(C)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587583364 GI Annotated Mild C=CCn1nc(C)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587583365 GI Annotated Mild C=CCn1nc(C)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587583366 GI Annotated Mild C=CCn1nc(C)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587583367 GI Annotated Mild O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccn(-c2ccccc2)n1 ZINC000587583412 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccn(-c2ccccc2)n1 ZINC000587583413 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccn(-c2ccccc2)n1 ZINC000587583414 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccn(-c2ccccc2)n1 ZINC000587583415 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnn(Cc2ccccc2)c1 ZINC000587583428 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnn(Cc2ccccc2)c1 ZINC000587583429 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnn(Cc2ccccc2)c1 ZINC000587583430 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnn(Cc2ccccc2)c1 ZINC000587583431 GI Annotated Anodyne Cc1ccnc2c1c([C@H]1Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)cn2C ZINC000587583436 GI Annotated Anodyne Cc1ccnc2c1c([C@@H]1Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)cn2C ZINC000587583437 GI Annotated Anodyne Cc1ccnc2c1c([C@H]1Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)cn2C ZINC000587583438 GI Annotated Anodyne Cc1ccnc2c1c([C@@H]1Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)cn2C ZINC000587583439 GI Annotated Anodyne CCn1nc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c2ccccc21 ZINC000587583444 GI Annotated Anodyne CCn1nc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c2ccccc21 ZINC000587583445 GI Annotated Anodyne CCn1nc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c2ccccc21 ZINC000587583446 GI Annotated Anodyne CCn1nc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c2ccccc21 ZINC000587583447 GI Annotated Anodyne CC(C)=CCN1CCC2(CC1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587583598 GI Annotated Anodyne CC(C)=CCN1CCC2(CC1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587583603 GI Annotated Anodyne CCn1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C2CC2)n1 ZINC000587583666 GI Annotated Anodyne CCn1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C2CC2)n1 ZINC000587583667 GI Annotated Anodyne CCn1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C2CC2)n1 ZINC000587583668 GI Annotated Anodyne CCn1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C2CC2)n1 ZINC000587583669 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnn(-c2ccccc2)c1 ZINC000587583682 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnn(-c2ccccc2)c1 ZINC000587583683 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnn(-c2ccccc2)c1 ZINC000587583684 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnn(-c2ccccc2)c1 ZINC000587583685 GI Annotated Anodyne CCn1cc([C@@]2(CC)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)n1 ZINC000587583686 GI Annotated Anodyne CCn1cc([C@]2(CC)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)n1 ZINC000587583687 GI Annotated Anodyne CCn1cc([C@@]2(CC)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)n1 ZINC000587583688 GI Annotated Anodyne CCn1cc([C@]2(CC)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)n1 ZINC000587583689 GI Annotated Anodyne CCn1ncc([C@@]2(CC)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587583694 GI Annotated Anodyne CCn1ncc([C@]2(CC)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587583695 GI Annotated Anodyne CCn1ncc([C@@]2(CC)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587583696 GI Annotated Anodyne CCn1ncc([C@]2(CC)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587583697 GI Annotated Anodyne Cn1ccc(-c2cccc([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c2)n1 ZINC000587583698 GI Annotated Anodyne Cn1ccc(-c2cccc([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c2)n1 ZINC000587583699 GI Annotated Anodyne Cn1ccc(-c2cccc([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c2)n1 ZINC000587583700 GI Annotated Anodyne Cn1ccc(-c2cccc([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c2)n1 ZINC000587583701 GI Annotated Anodyne CCCn1ncc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587583966 GI Annotated Anodyne CCCn1ncc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587583967 GI Annotated Anodyne CCCn1ncc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587583968 GI Annotated Anodyne CCCn1ncc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587583969 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccc(-n2cccn2)c1 ZINC000587584014 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccc(-n2cccn2)c1 ZINC000587584015 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccc(-n2cccn2)c1 ZINC000587584016 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccc(-n2cccn2)c1 ZINC000587584017 GI Annotated Anodyne Cn1cc2c([C@@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cccc2n1 ZINC000587584022 GI Annotated Anodyne Cn1cc2c([C@@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cccc2n1 ZINC000587584023 GI Annotated Anodyne Cn1cc2c([C@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cccc2n1 ZINC000587584024 GI Annotated Anodyne Cn1cc2c([C@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cccc2n1 ZINC000587584025 GI Annotated Anodyne Cn1cc(-c2ccc([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cc2)cn1 ZINC000587584034 GI Annotated Anodyne Cn1cc(-c2ccc([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cc2)cn1 ZINC000587584035 GI Annotated Anodyne Cn1cc(-c2ccc([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cc2)cn1 ZINC000587584036 GI Annotated Anodyne Cn1cc(-c2ccc([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cc2)cn1 ZINC000587584037 GI Annotated Anodyne CCCn1nc(C)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587584230 GI Annotated Anodyne CCCn1nc(C)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587584231 GI Annotated Anodyne CCCn1nc(C)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587584232 GI Annotated Anodyne CCCn1nc(C)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587584233 GI Annotated Anodyne Cn1ncc2ccc([C@@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cc21 ZINC000587584234 GI Annotated Anodyne Cn1ncc2ccc([C@@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cc21 ZINC000587584236 GI Annotated Anodyne Cn1ncc2ccc([C@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cc21 ZINC000587584238 GI Annotated Anodyne Cn1ncc2ccc([C@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cc21 ZINC000587584239 GI Annotated Anodyne Cc1c([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cnn1C(C)C ZINC000587584285 GI Annotated Anodyne Cc1c([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cnn1C(C)C ZINC000587584287 GI Annotated Anodyne Cc1c([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cnn1C(C)C ZINC000587584288 GI Annotated Anodyne Cc1c([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cnn1C(C)C ZINC000587584289 GI Annotated Anodyne C[C@@H]1Cc2cc([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)ccc2N1C ZINC000587584401 GI Annotated Anodyne C[C@@H]1Cc2cc([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)ccc2N1C ZINC000587584402 GI Annotated Anodyne C[C@@H]1Cc2cc([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)ccc2N1C ZINC000587584403 GI Annotated Anodyne C[C@@H]1Cc2cc([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)ccc2N1C ZINC000587584404 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1CCc1nc2ccccc2o1 ZINC000587584479 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1CCc1nc2ccccc2o1 ZINC000587584480 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1CCc1nc2ccccc2o1 ZINC000587584481 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1CCc1nc2ccccc2o1 ZINC000587584482 GI Annotated Anodyne C[C@]1(c2cnc3cccnc3c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587584527 GI Annotated Anodyne C[C@]1(c2cnc3cccnc3c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587584528 GI Annotated Anodyne C[C@@]1(c2cnc3cccnc3c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587584529 GI Annotated Anodyne C[C@@]1(c2cnc3cccnc3c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587584530 GI Annotated Anodyne Cc1noc(C2CCC3(CC2)Oc2ccccc2C(=O)[C@@H]3C(=O)c2ccco2)n1 ZINC000587585529 GI Annotated Anodyne Cc1noc(C2CCC3(CC2)Oc2ccccc2C(=O)[C@H]3C(=O)c2ccco2)n1 ZINC000587585530 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1nc(-c2ccccc2)no1 ZINC000587585547 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1nc(-c2ccccc2)no1 ZINC000587585548 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1nc(-c2ccccc2)no1 ZINC000587585549 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1nc(-c2ccccc2)no1 ZINC000587585550 GI Annotated Anodyne Cc1nc2c(C)cccn2c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587585585 GI Annotated Anodyne Cc1nc2c(C)cccn2c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587585586 GI Annotated Anodyne Cc1nc2c(C)cccn2c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587585587 GI Annotated Anodyne Cc1nc2c(C)cccn2c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587585588 GI Annotated Anodyne COc1cc(C)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)n1 ZINC000587585769 GI Annotated Anodyne COc1cc(C)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)n1 ZINC000587585770 GI Annotated Anodyne COc1cc(C)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)n1 ZINC000587585771 GI Annotated Anodyne COc1cc(C)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)n1 ZINC000587585772 GI Annotated Anodyne C[C@@]1(c2ccc3nc(O)oc3c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587585899 GI Annotated Anodyne C[C@@]1(c2ccc3nc(O)oc3c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587585900 GI Annotated Anodyne C[C@]1(c2ccc3nc(O)oc3c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587585901 GI Annotated Anodyne C[C@]1(c2ccc3nc(O)oc3c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587585902 GI Annotated Anodyne Cc1cc(CC[C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc(C)n1 ZINC000587586105 GI Annotated Anodyne Cc1cc(CC[C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc(C)n1 ZINC000587586108 GI Annotated Anodyne Cc1cc(CC[C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc(C)n1 ZINC000587586111 GI Annotated Anodyne Cc1cc(CC[C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc(C)n1 ZINC000587586113 GI Annotated Anodyne CC(=O)c1[nH]c(C)c([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587586134 GI Annotated Anodyne CC(=O)c1[nH]c(C)c([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587586135 GI Annotated Anodyne CC(=O)c1[nH]c(C)c([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587586136 GI Annotated Anodyne CC(=O)c1[nH]c(C)c([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587586138 GI Annotated Anodyne CC(C)Oc1ncccc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587586159 GI Annotated Anodyne CC(C)Oc1ncccc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587586160 GI Annotated Anodyne CC(C)Oc1ncccc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587586161 GI Annotated Anodyne CC(C)Oc1ncccc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587586162 GI Annotated Anodyne C=C1C=C(C)n2c([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cnc2N1 ZINC000587586184 GI Annotated Anodyne C=C1C=C(C)n2c([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cnc2N1 ZINC000587586185 GI Annotated Anodyne C=C1C=C(C)n2c([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cnc2N1 ZINC000587586187 GI Annotated Anodyne C=C1C=C(C)n2c([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cnc2N1 ZINC000587586188 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCCC[C@@H]2c1cncnc1 ZINC000587586606 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCCC[C@H]2c1cncnc1 ZINC000587586608 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCC[C@@H]2c1cncnc1 ZINC000587586610 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCC[C@H]2c1cncnc1 ZINC000587586611 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)c1cncnc1 ZINC000587586656 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)c1cncnc1 ZINC000587586658 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)c1cncnc1 ZINC000587586661 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)c1cncnc1 ZINC000587586663 GI Annotated Anodyne N#Cc1cccc2c([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c[nH]c12 ZINC000587586737 GI Annotated Mild N#Cc1cccc2c([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c[nH]c12 ZINC000587586741 GI Annotated Mild N#Cc1cccc2c([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c[nH]c12 ZINC000587586742 GI Annotated Mild N#Cc1cccc2c([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c[nH]c12 ZINC000587586743 GI Annotated Mild CCCOc1ncccc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587586756 GI Annotated Anodyne CCCOc1ncccc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587586757 GI Annotated Anodyne CCCOc1ncccc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587586758 GI Annotated Anodyne CCCOc1ncccc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587586760 GI Annotated Anodyne COc1ccc(CC[C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)n1 ZINC000587586762 GI Annotated Anodyne N#Cc1ccc2[nH]cc([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c2c1 ZINC000587586764 GI Annotated Mild N#Cc1ccc2[nH]cc([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c2c1 ZINC000587586765 GI Annotated Mild N#Cc1ccc2[nH]cc([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c2c1 ZINC000587586766 GI Annotated Mild N#Cc1ccc2[nH]cc([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c2c1 ZINC000587586767 GI Annotated Mild COc1ccc(CC[C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)n1 ZINC000587586769 GI Annotated Anodyne COc1ccc(CC[C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)n1 ZINC000587586771 GI Annotated Anodyne COc1ccc(CC[C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)n1 ZINC000587586773 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(c1ccncc1)c1ccccn1 ZINC000587586853 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(c1ccncc1)c1ccccn1 ZINC000587586854 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(c1ccncc1)c1ccccn1 ZINC000587586855 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(c1ccncc1)c1ccccn1 ZINC000587586856 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnc(O)c2ccccc12 ZINC000587586877 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnc(O)c2ccccc12 ZINC000587586878 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnc(O)c2ccccc12 ZINC000587586879 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnc(O)c2ccccc12 ZINC000587586880 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC12c1ncccc1-c1cccnc12 ZINC000587586913 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC12c1ncccc1-c1cccnc12 ZINC000587586914 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)c1ccncn1 ZINC000587586959 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)c1ccncn1 ZINC000587586960 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)c1ccncn1 ZINC000587586961 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)c1ccncn1 ZINC000587586962 GI Annotated Anodyne Cc1ccc([C@@]2(c3ncc[nH]3)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587587009 GI Annotated Anodyne Cc1ccc([C@@]2(c3ncc[nH]3)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587587011 GI Annotated Anodyne Cc1ccc([C@]2(c3ncc[nH]3)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587587012 GI Annotated Anodyne Cc1ccc([C@]2(c3ncc[nH]3)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587587013 GI Annotated Anodyne CC(C)[C@@]1(Cc2cccnc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587587322 GI Annotated Anodyne CC(C)[C@@]1(Cc2cccnc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587587324 GI Annotated Anodyne CC(C)[C@]1(Cc2cccnc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587587325 GI Annotated Anodyne CC(C)[C@]1(Cc2cccnc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587587326 GI Annotated Anodyne Cc1ccc2nc([C@@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cn2c1 ZINC000587587338 GI Annotated Anodyne Cc1ccc2nc([C@@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cn2c1 ZINC000587587341 GI Annotated Anodyne Cc1ccc2nc([C@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cn2c1 ZINC000587587344 GI Annotated Anodyne Cc1ccc2nc([C@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cn2c1 ZINC000587587347 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(-c2ncon2)cc1 ZINC000587587400 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(-c2ncon2)cc1 ZINC000587587402 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(-c2ncon2)cc1 ZINC000587587404 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(-c2ncon2)cc1 ZINC000587587406 GI Annotated Anodyne Cc1c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c2ccccn2c1C=O ZINC000587587421 GI Annotated Anodyne Cc1c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c2ccccn2c1C=O ZINC000587587422 GI Annotated Anodyne Cc1c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c2ccccn2c1C=O ZINC000587587423 GI Annotated Anodyne Cc1c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c2ccccn2c1C=O ZINC000587587424 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC12c1cccnc1-c1ncccc12 ZINC000587587478 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC12c1cccnc1-c1ncccc12 ZINC000587587479 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)c1ncccn1 ZINC000587587576 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)c1ncccn1 ZINC000587587578 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)c1ncccn1 ZINC000587587581 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)c1ncccn1 ZINC000587587582 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2cccc(O)c2n1 ZINC000587587635 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc2cccc(O)c2n1 ZINC000587587637 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2cccc(O)c2n1 ZINC000587587639 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc2cccc(O)c2n1 ZINC000587587641 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC1(c1ccncc1)c1ccncc1 ZINC000587587745 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC1(c1ccncc1)c1ccncc1 ZINC000587587749 GI Annotated Anodyne CC(=O)c1c(C)[nH]c([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587587780 GI Annotated Anodyne CC(=O)c1c(C)[nH]c([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587587786 GI Annotated Anodyne CC(=O)c1c(C)[nH]c([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587587789 GI Annotated Anodyne CC(=O)c1c(C)[nH]c([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587587791 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnc(-c2ccccc2)[nH]1 ZINC000587587850 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnc(-c2ccccc2)[nH]1 ZINC000587587866 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnc(-c2ccccc2)[nH]1 ZINC000587587868 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnc(-c2ccccc2)[nH]1 ZINC000587587871 GI Annotated Anodyne CCCCc1ncc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587587890 GI Annotated Anodyne CCCCc1ncc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587587892 GI Annotated Anodyne CCCCc1ncc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587587893 GI Annotated Anodyne CCCCc1ncc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587587894 GI Annotated Anodyne CC(C)Oc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587587941 GI Annotated Anodyne CC(C)Oc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587587942 GI Annotated Anodyne CC(C)Oc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587587943 GI Annotated Anodyne CC(C)Oc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587587944 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1c(O)ccc2cccnc12 ZINC000587587965 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1c(O)ccc2cccnc12 ZINC000587587966 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1c(O)ccc2cccnc12 ZINC000587587967 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1c(O)ccc2cccnc12 ZINC000587587969 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1c(O)ccc2ncccc12 ZINC000587588028 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1c(O)ccc2ncccc12 ZINC000587588030 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1c(O)ccc2ncccc12 ZINC000587588032 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1c(O)ccc2ncccc12 ZINC000587588034 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC1(c1ccccn1)c1ccccn1 ZINC000587588117 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC1(c1ccccn1)c1ccccn1 ZINC000587588119 GI Annotated Anodyne CCOc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587588251 GI Annotated Anodyne CCOc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587588252 GI Annotated Anodyne CCOc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587588253 GI Annotated Anodyne CCOc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587588254 GI Annotated Anodyne C[C@H](C#N)C[C@@]1(c2cccnc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587588269 GI Annotated Mild C[C@H](C#N)C[C@@]1(c2cccnc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587588270 GI Annotated Mild C[C@H](C#N)C[C@]1(c2cccnc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587588271 GI Annotated Mild C[C@H](C#N)C[C@]1(c2cccnc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587588272 GI Annotated Mild CC(C)(C)c1ncc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587588339 GI Annotated Anodyne CC(C)(C)c1ncc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587588340 GI Annotated Anodyne CC(C)(C)c1ncc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587588341 GI Annotated Anodyne CC(C)(C)c1ncc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587588342 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc2ccccc2nc1O ZINC000587588347 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc2ccccc2nc1O ZINC000587588348 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc2ccccc2nc1O ZINC000587588349 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc2ccccc2nc1O ZINC000587588350 GI Annotated Anodyne CCc1nc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c2ccccn12 ZINC000587588665 GI Annotated Anodyne CCc1nc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c2ccccn12 ZINC000587588667 GI Annotated Anodyne CCc1nc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c2ccccn12 ZINC000587588668 GI Annotated Anodyne CCc1nc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c2ccccn12 ZINC000587588671 GI Annotated Anodyne Cc1ccc2nc(C)c([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)n2c1 ZINC000587588737 GI Annotated Anodyne Cc1ccc2nc(C)c([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)n2c1 ZINC000587588739 GI Annotated Anodyne Cc1ccc2nc(C)c([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)n2c1 ZINC000587588740 GI Annotated Anodyne Cc1ccc2nc(C)c([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)n2c1 ZINC000587588744 GI Annotated Anodyne Cc1nc2ccccn2c1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587588778 GI Annotated Anodyne Cc1nc2ccccn2c1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587588780 GI Annotated Anodyne Cc1nc2ccccn2c1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587588781 GI Annotated Anodyne Cc1nc2ccccn2c1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587588783 GI Annotated Anodyne Cc1ccc2nc([C@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)[nH]c2c1 ZINC000587588806 GI Annotated Anodyne Cc1ccc2nc([C@@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)[nH]c2c1 ZINC000587588809 GI Annotated Anodyne Cc1ccc2nc([C@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)[nH]c2c1 ZINC000587588813 GI Annotated Anodyne Cc1ccc2nc([C@@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)[nH]c2c1 ZINC000587588815 GI Annotated Anodyne N#Cc1ccc2c([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c[nH]c2c1 ZINC000587588846 GI Annotated Mild N#Cc1ccc2c([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c[nH]c2c1 ZINC000587588847 GI Annotated Mild N#Cc1ccc2c([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c[nH]c2c1 ZINC000587588848 GI Annotated Mild N#Cc1ccc2c([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c[nH]c2c1 ZINC000587588849 GI Annotated Mild C[C@]1(c2cnc3ccccc3n2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587588899 GI Annotated Anodyne C[C@]1(c2cnc3ccccc3n2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587588900 GI Annotated Anodyne C[C@@]1(c2cnc3ccccc3n2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587588901 GI Annotated Anodyne C[C@@]1(c2cnc3ccccc3n2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587588902 GI Annotated Anodyne Cc1nc2ccccc2nc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587588963 GI Annotated Anodyne Cc1nc2ccccc2nc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587588964 GI Annotated Anodyne Cc1nc2ccccc2nc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587588965 GI Annotated Anodyne Cc1nc2ccccc2nc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587588966 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC1(c1cccnc1)c1cccnc1 ZINC000587589215 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC1(c1cccnc1)c1cccnc1 ZINC000587589216 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(-c2nnco2)cc1 ZINC000587589259 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(-c2nnco2)cc1 ZINC000587589260 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(-c2nnco2)cc1 ZINC000587589261 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(-c2nnco2)cc1 ZINC000587589262 GI Annotated Anodyne Cc1ccn2c([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c(C)nc2c1 ZINC000587589273 GI Annotated Anodyne Cc1ccn2c([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c(C)nc2c1 ZINC000587589274 GI Annotated Anodyne Cc1ccn2c([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c(C)nc2c1 ZINC000587589275 GI Annotated Anodyne Cc1ccn2c([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c(C)nc2c1 ZINC000587589276 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(c1cccnc1)c1ccccn1 ZINC000587589332 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(c1cccnc1)c1ccccn1 ZINC000587589334 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(c1cccnc1)c1ccccn1 ZINC000587589335 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(c1cccnc1)c1ccccn1 ZINC000587589337 GI Annotated Anodyne CCC[C@]1(c2c(C)n[nH]c2C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587589425 GI Annotated Anodyne CCC[C@@]1(c2c(C)n[nH]c2C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587589428 GI Annotated Anodyne CCC[C@]1(c2c(C)n[nH]c2C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587589430 GI Annotated Anodyne CCC[C@@]1(c2c(C)n[nH]c2C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587589431 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2cccnc2c1O ZINC000587589527 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc2cccnc2c1O ZINC000587589528 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc2cccnc2c1O ZINC000587589529 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2cccnc2c1O ZINC000587589530 GI Annotated Anodyne CC(C)Oc1ncccc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587589617 GI Annotated Anodyne CC(C)Oc1ncccc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587589618 GI Annotated Anodyne CC(C)Oc1ncccc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587589619 GI Annotated Anodyne CC(C)Oc1ncccc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587589620 GI Annotated Anodyne CCOCOc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587589841 GI Annotated Anodyne CCOCOc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587589842 GI Annotated Anodyne CCOCOc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587589843 GI Annotated Anodyne CCOCOc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587589844 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnc(-c2ccco2)nc1 ZINC000587589891 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnc(-c2ccco2)nc1 ZINC000587589892 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnc(-c2ccco2)nc1 ZINC000587589893 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnc(-c2ccco2)nc1 ZINC000587589894 GI Annotated Anodyne Cc1c(C=O)c2ccccn2c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590077 GI Annotated Anodyne Cc1c(C=O)c2ccccn2c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590078 GI Annotated Anodyne Cc1c(C=O)c2ccccn2c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590079 GI Annotated Anodyne Cc1c(C=O)c2ccccn2c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590080 GI Annotated Anodyne CCC[C@@]1(c2c[nH]c(C(=O)O)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590115 GI Annotated Anodyne CCC[C@@]1(c2c[nH]c(C(=O)O)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590116 GI Annotated Anodyne CCC[C@]1(c2c[nH]c(C(=O)O)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590117 GI Annotated Anodyne CCC[C@]1(c2c[nH]c(C(=O)O)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590118 GI Annotated Anodyne COC(=O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)c1 ZINC000587590224 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)c1 ZINC000587590240 GI Annotated Anodyne COC(=O)c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)c1 ZINC000587590241 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)c1 ZINC000587590244 GI Annotated Anodyne COc1cccc(OC)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590319 GI Annotated Anodyne COc1cccc(OC)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590320 GI Annotated Anodyne COc1cccc(OC)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590321 GI Annotated Anodyne COc1cccc(OC)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590322 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)c1ncco1 ZINC000587590355 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)c1ncco1 ZINC000587590356 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)c1ncco1 ZINC000587590357 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)c1ncco1 ZINC000587590358 GI Annotated Anodyne C=C1C=C(C)n2ncc([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c2N1 ZINC000587590415 GI Annotated Anodyne C=C1C=C(C)n2ncc([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c2N1 ZINC000587590416 GI Annotated Anodyne C=C1C=C(C)n2ncc([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c2N1 ZINC000587590417 GI Annotated Anodyne C=C1C=C(C)n2ncc([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c2N1 ZINC000587590418 GI Annotated Anodyne COc1cccc(OC)c1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590552 GI Annotated Anodyne COc1cccc(OC)c1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590555 GI Annotated Anodyne COc1cccc(OC)c1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590558 GI Annotated Anodyne COc1cccc(OC)c1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590561 GI Annotated Anodyne C/C=C\CC[C@]1(CC(=O)OC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590612 GI Annotated Anodyne C/C=C/CC[C@]1(CC(=O)OC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587590622 GI Annotated Anodyne C/C=C/CC[C@]1(CC(=O)OC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590625 GI Annotated Anodyne C/C=C\CC[C@]1(CC(=O)OC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587590626 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ncc(-c2ccccc2)[nH]1 ZINC000587590645 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ncc(-c2ccccc2)[nH]1 ZINC000587590646 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ncc(-c2ccccc2)[nH]1 ZINC000587590648 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ncc(-c2ccccc2)[nH]1 ZINC000587590649 GI Annotated Anodyne C[C@@H]1C[C@@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[C@@H]2CCCC[C@H]2N1 ZINC000587590807 GI Annotated Anodyne C[C@@H]1C[C@@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[C@@H]2CCCC[C@H]2N1 ZINC000587590808 GI Annotated Anodyne C[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[C@@H]2CCCC[C@H]2N1 ZINC000587590809 GI Annotated Anodyne C[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[C@@H]2CCCC[C@H]2N1 ZINC000587590810 GI Annotated Anodyne COc1cc(C)c(CC[C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587590852 GI Annotated Anodyne COc1cc(C)c(CC[C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587590853 GI Annotated Anodyne COc1cc(C)c(CC[C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587590854 GI Annotated Anodyne COc1cc(C)c(CC[C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587590855 GI Annotated Anodyne COc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(OC)c1C ZINC000587590960 GI Annotated Anodyne COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(OC)c1C ZINC000587590964 GI Annotated Anodyne COc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(OC)c1C ZINC000587590966 GI Annotated Anodyne COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(OC)c1C ZINC000587590968 GI Annotated Anodyne COc1ccc(OC)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587591152 GI Annotated Anodyne COc1ccc(OC)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587591154 GI Annotated Anodyne COc1ccc(OC)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587591156 GI Annotated Anodyne COc1ccc(OC)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587591157 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1c[nH]nc1-c1ccccc1 ZINC000587591280 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1c[nH]nc1-c1ccccc1 ZINC000587591281 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1c[nH]nc1-c1ccccc1 ZINC000587591282 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1c[nH]nc1-c1ccccc1 ZINC000587591283 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)c1ncc[nH]1 ZINC000587591372 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)c1ncc[nH]1 ZINC000587591374 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)c1ncc[nH]1 ZINC000587591376 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)c1ncc[nH]1 ZINC000587591378 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(Cc2ccc[nH]2)[nH]1 ZINC000587591641 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(Cc2ccc[nH]2)[nH]1 ZINC000587591645 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(Cc2ccc[nH]2)[nH]1 ZINC000587591646 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(Cc2ccc[nH]2)[nH]1 ZINC000587591648 GI Annotated Anodyne COC(=O)c1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587591708 GI Annotated Anodyne COC(=O)c1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587591709 GI Annotated Anodyne COC(=O)c1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587591711 GI Annotated Anodyne COC(=O)c1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587591712 GI Annotated Anodyne C[C@]1(COCc2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587591780 GI Annotated Anodyne C[C@]1(COCc2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587591785 GI Annotated Anodyne C[C@@]1(COCc2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587591787 GI Annotated Anodyne C[C@@]1(COCc2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587591789 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12Cc1[nH]c3ccccc3c1C2 ZINC000587591872 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12Cc1[nH]c3ccccc3c1C2 ZINC000587591873 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12Cc1[nH]c3ccccc3c1C2 ZINC000587591875 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12Cc1[nH]c3ccccc3c1C2 ZINC000587591879 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(N2CCCC2)nc1 ZINC000587591933 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(N2CCCC2)nc1 ZINC000587591937 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(N2CCCC2)nc1 ZINC000587591940 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(N2CCCC2)nc1 ZINC000587591942 GI Annotated Anodyne CCN1CCc2cc([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)ccc21 ZINC000587591988 GI Annotated Anodyne CCN1CCc2cc([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)ccc21 ZINC000587591989 GI Annotated Anodyne CCN1CCc2cc([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)ccc21 ZINC000587591990 GI Annotated Anodyne CCN1CCc2cc([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)ccc21 ZINC000587591991 GI Annotated Anodyne CCc1cc(OC)c(O)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587592194 GI Annotated Anodyne CCc1cc(OC)c(O)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587592197 GI Annotated Anodyne CCc1cc(OC)c(O)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587592198 GI Annotated Anodyne CCc1cc(OC)c(O)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587592199 GI Annotated Anodyne COC(=O)c1cccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587592267 GI Annotated Anodyne COC(=O)c1cccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587592269 GI Annotated Anodyne COC(=O)c1cccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587592270 GI Annotated Anodyne COC(=O)c1cccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587592272 GI Annotated Anodyne Cc1cnc2[nH]cc([C@@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c2c1 ZINC000587592512 GI Annotated Anodyne Cc1cnc2[nH]cc([C@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c2c1 ZINC000587592514 GI Annotated Anodyne Cc1cnc2[nH]cc([C@@]3(C)Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c2c1 ZINC000587592515 GI Annotated Anodyne Cc1cnc2[nH]cc([C@]3(C)Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c2c1 ZINC000587592517 GI Annotated Anodyne C[C@]1(c2ccc3[nH]c(O)cc3c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587592519 GI Annotated Anodyne C[C@]1(c2ccc3[nH]c(O)cc3c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587592524 GI Annotated Anodyne CCOc1ccc(C(=O)[C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587592553 GI Annotated Anodyne CCOc1ccc(C(=O)[C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587592555 GI Annotated Anodyne CCOc1ccc(C(=O)[C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587592556 GI Annotated Anodyne CCOc1ccc(C(=O)[C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587592558 GI Annotated Anodyne CCOC(=O)[C@H](CC)[C@@]1(C(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587592611 GI Annotated Anodyne CCOC(=O)[C@H](CC)[C@]1(C(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587592613 GI Annotated Anodyne CCOC(=O)[C@H](CC)[C@]1(C(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587592614 GI Annotated Anodyne CCOC(=O)[C@H](CC)[C@@]1(C(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587592616 GI Annotated Anodyne CCOC(=O)C1([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CCCC1 ZINC000587592647 GI Annotated Anodyne CCOC(=O)C1([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CCCC1 ZINC000587592650 GI Annotated Anodyne CCOC(=O)C1([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CCCC1 ZINC000587592653 GI Annotated Anodyne CCOC(=O)C1([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CCCC1 ZINC000587592655 GI Annotated Anodyne COc1cc(C)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1OC ZINC000587592713 GI Annotated Anodyne COc1cc(C)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1OC ZINC000587592714 GI Annotated Anodyne COc1cc(C)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1OC ZINC000587592715 GI Annotated Anodyne COc1cc(C)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1OC ZINC000587592716 GI Annotated Anodyne COC(=O)[C@@H]1CCC(C)(C)C[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587592751 GI Annotated Anodyne COC(=O)[C@@H]1CCC(C)(C)C[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587592752 GI Annotated Anodyne COC(=O)[C@@H]1CCC(C)(C)C[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587592753 GI Annotated Anodyne COC(=O)[C@@H]1CCC(C)(C)C[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587592754 GI Annotated Anodyne C[C@@]1(c2ccc3[nH]c(O)cc3c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587592884 GI Annotated Anodyne C[C@@]1(c2ccc3[nH]c(O)cc3c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587592886 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccc(-c2ncon2)c1 ZINC000587592968 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccc(-c2ncon2)c1 ZINC000587592970 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccc(-c2ncon2)c1 ZINC000587592971 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccc(-c2ncon2)c1 ZINC000587592972 GI Annotated Anodyne CCCCCOC(=O)C[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587593096 GI Annotated Anodyne CCCCCOC(=O)C[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587593098 GI Annotated Anodyne CCCCCOC(=O)C[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587593100 GI Annotated Anodyne CCCCCOC(=O)C[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587593101 GI Annotated Anodyne CN1CCCc2cc([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)ccc21 ZINC000587593167 GI Annotated Anodyne CN1CCCc2cc([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)ccc21 ZINC000587593168 GI Annotated Anodyne CN1CCCc2cc([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)ccc21 ZINC000587593169 GI Annotated Anodyne CN1CCCc2cc([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)ccc21 ZINC000587593170 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1OC ZINC000587593284 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1OC ZINC000587593285 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1OC ZINC000587593286 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1OC ZINC000587593287 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1n[nH]cc1-c1ccccc1 ZINC000587593321 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1n[nH]cc1-c1ccccc1 ZINC000587593323 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1n[nH]cc1-c1ccccc1 ZINC000587593325 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1n[nH]cc1-c1ccccc1 ZINC000587593327 GI Annotated Anodyne CCOC(=O)C[C@@]1(CCC(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587593455 GI Annotated Anodyne CCOC(=O)C[C@@]1(CCC(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587593456 GI Annotated Anodyne CCOC(=O)C[C@]1(CCC(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587593457 GI Annotated Anodyne CCOC(=O)C[C@]1(CCC(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587593458 GI Annotated Anodyne COCCOc1ccccc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587593467 GI Annotated Anodyne COCCOc1ccccc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587593468 GI Annotated Anodyne COCCOc1ccccc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587593469 GI Annotated Anodyne COCCOc1ccccc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587593470 GI Annotated Anodyne CCOc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(O)c1 ZINC000587593495 GI Annotated Anodyne CCOc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(O)c1 ZINC000587593496 GI Annotated Anodyne CCOc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(O)c1 ZINC000587593497 GI Annotated Anodyne CCOc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(O)c1 ZINC000587593498 GI Annotated Anodyne CCC[C@]1([C@H](CC)C(=O)OC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587593584 GI Annotated Anodyne CCC[C@]1([C@@H](CC)C(=O)OC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587593586 GI Annotated Anodyne CCC[C@]1([C@@H](CC)C(=O)OC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587593589 GI Annotated Anodyne CCC[C@]1([C@H](CC)C(=O)OC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587593590 GI Annotated Anodyne CCOC(=O)CC1CCC2(CC1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587593811 GI Annotated Anodyne CCOC(=O)CC1CCC2(CC1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587593814 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C)CC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587593934 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C)CC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587593935 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C)CC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587593937 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C)CC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587593938 GI Annotated Anodyne Cc1[nH]nc2c1[C@@]1(CC(C)(C)C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594114 GI Annotated Anodyne Cc1[nH]nc2c1[C@]1(CC(C)(C)C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594116 GI Annotated Anodyne Cc1[nH]nc2c1[C@@]1(CC(C)(C)C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594118 GI Annotated Anodyne Cc1[nH]nc2c1[C@]1(CC(C)(C)C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594120 GI Annotated Anodyne COc1cc(C)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(OC)c1 ZINC000587594179 GI Annotated Anodyne COc1cc(C)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(OC)c1 ZINC000587594181 GI Annotated Anodyne COc1cc(C)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(OC)c1 ZINC000587594182 GI Annotated Anodyne COc1cc(C)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(OC)c1 ZINC000587594184 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(N2CCCC2)o1 ZINC000587594210 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc(N2CCCC2)o1 ZINC000587594213 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc(N2CCCC2)o1 ZINC000587594215 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc(N2CCCC2)o1 ZINC000587594218 GI Annotated Anodyne COCOc1cccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587594243 GI Annotated Anodyne COCOc1cccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587594244 GI Annotated Anodyne COCOc1cccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587594245 GI Annotated Anodyne COCOc1cccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587594246 GI Annotated Anodyne CCOc1ccc(O)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587594401 GI Annotated Anodyne CCOc1ccc(O)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587594402 GI Annotated Anodyne COCOc1ccccc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594544 GI Annotated Anodyne COCOc1ccccc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594547 GI Annotated Anodyne COCOc1ccccc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594549 GI Annotated Anodyne COCOc1ccccc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594550 GI Annotated Anodyne COc1ccc(OC)c([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587594558 GI Annotated Anodyne COc1ccc(OC)c([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587594561 GI Annotated Anodyne COc1ccc(OC)c([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587594564 GI Annotated Anodyne COc1ccc(OC)c([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587594567 GI Annotated Anodyne CC[C@]1(c2ccc(O)c(OC)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594617 GI Annotated Anodyne CC[C@]1(c2ccc(O)c(OC)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594619 GI Annotated Anodyne CC[C@@]1(c2ccc(O)c(OC)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594621 GI Annotated Anodyne CC[C@@]1(c2ccc(O)c(OC)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594622 GI Annotated Anodyne CCOc1ccc(O)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587594699 GI Annotated Anodyne CCOc1ccc(O)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587594700 GI Annotated Anodyne CCOC(=O)C[C@]1([C@@H](C)CC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594777 GI Annotated Anodyne CCOC(=O)C[C@]1([C@H](C)CC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594778 GI Annotated Anodyne CCOC(=O)C[C@]1([C@@H](C)CC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594779 GI Annotated Anodyne CCOC(=O)C[C@]1([C@H](C)CC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594780 GI Annotated Anodyne CC/C=C\CCOC(=O)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594785 GI Annotated Anodyne CC/C=C/CCOC(=O)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594786 GI Annotated Anodyne CC/C=C\CCOC(=O)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594787 GI Annotated Anodyne CC/C=C/CCOC(=O)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594788 GI Annotated Anodyne CCCCOC(=O)CC[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594793 GI Annotated Anodyne CCCCOC(=O)CC[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587594794 GI Annotated Anodyne CCCCOC(=O)CC[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594795 GI Annotated Anodyne CCCCOC(=O)CC[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587594796 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCCN(C1CCCC1)C2 ZINC000587594969 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCCN(C1CCCC1)C2 ZINC000587594972 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCCN(C1CCCC1)C2 ZINC000587594975 GI Annotated Anodyne COC(=O)c1cc(C)cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587594976 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCN(C1CCCC1)C2 ZINC000587594978 GI Annotated Anodyne COC(=O)c1cc(C)cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587594979 GI Annotated Anodyne COC(=O)c1cc(C)cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587594980 GI Annotated Anodyne COC(=O)c1cc(C)cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587594983 GI Annotated Anodyne COCc1ccc(OC)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587595005 GI Annotated Anodyne COCc1ccc(OC)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587595007 GI Annotated Anodyne COCc1ccc(OC)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587595008 GI Annotated Anodyne COCc1ccc(OC)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587595010 GI Annotated Anodyne COc1ccc2c(c1)NCC[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595075 GI Annotated Anodyne COc1ccc2c(c1)NCC[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595076 GI Annotated Anodyne COc1ccc2c(c1)NCC[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595079 GI Annotated Anodyne COc1ccc2c(c1)NCC[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595081 GI Annotated Anodyne CCCCOC(=O)[C@@H]1CCC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587595174 GI Annotated Anodyne CCCCOC(=O)[C@@H]1CCC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587595175 GI Annotated Anodyne CCCCOC(=O)[C@@H]1CCC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587595176 GI Annotated Anodyne CCCCOC(=O)[C@@H]1CCC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587595177 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[C@H](C)C1 ZINC000587595198 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)[C@@H](C)C1 ZINC000587595199 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[C@@H](C)C1 ZINC000587595200 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)[C@H](C)C1 ZINC000587595201 GI Annotated Anodyne CCOC(=O)C[C@]1(C(C)(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595202 GI Annotated Anodyne CCOC(=O)C[C@]1(C(C)(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595203 GI Annotated Anodyne CCOC(=O)C[C@@]1(C(C)(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595204 GI Annotated Anodyne CCOC(=O)C[C@@]1(C(C)(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595205 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCCC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587595206 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCCC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587595207 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCCC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587595208 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCCC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587595209 GI Annotated Anodyne CCOC(=O)C[C@]1(CC(C)(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595214 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC(C)(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595215 GI Annotated Anodyne CCOC(=O)C[C@]1(CC(C)(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595216 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC(C)(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595217 GI Annotated Anodyne C[C@H](C[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1)C(=O)OC(C)(C)C ZINC000587595392 GI Annotated Anodyne C[C@H](C[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1)C(=O)OC(C)(C)C ZINC000587595394 GI Annotated Anodyne C[C@H](C[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1)C(=O)OC(C)(C)C ZINC000587595395 GI Annotated Anodyne C[C@H](C[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1)C(=O)OC(C)(C)C ZINC000587595397 GI Annotated Anodyne C#CCOc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587595481 GI Annotated Mild C#CCOc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587595484 GI Annotated Mild C#CCOc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587595485 GI Annotated Mild C#CCOc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587595486 GI Annotated Mild CCOC(=O)[C@@H]1CC[C@@H]([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CC1 ZINC000587595640 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@@H]([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CC1 ZINC000587595642 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@@H]([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)CC1 ZINC000587595643 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@@H]([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)CC1 ZINC000587595644 GI Annotated Anodyne COc1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(OC)cc1C ZINC000587595735 GI Annotated Anodyne COc1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(OC)cc1C ZINC000587595736 GI Annotated Anodyne COc1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(OC)cc1C ZINC000587595737 GI Annotated Anodyne COc1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(OC)cc1C ZINC000587595738 GI Annotated Anodyne COc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)c1OC ZINC000587595755 GI Annotated Anodyne COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)c1OC ZINC000587595756 GI Annotated Anodyne COc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)c1OC ZINC000587595757 GI Annotated Anodyne COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)c1OC ZINC000587595758 GI Annotated Anodyne CC(C)C[C@]1([C@@H]2CCCNC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595811 GI Annotated Anodyne CC(C)C[C@]1([C@H]2CCCNC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595813 GI Annotated Anodyne CC(C)C[C@]1([C@H]2CCCNC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595815 GI Annotated Anodyne CC(C)C[C@]1([C@@H]2CCCNC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595817 GI Annotated Anodyne CC(C)CCOC(=O)C[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595937 GI Annotated Anodyne CC(C)CCOC(=O)C[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595938 GI Annotated Anodyne CC(C)CCOC(=O)C[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595939 GI Annotated Anodyne CC(C)CCOC(=O)C[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595940 GI Annotated Anodyne CCOC(=O)[C@]1(CC(C)(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595949 GI Annotated Anodyne CCOC(=O)[C@@]1(CC(C)(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587595950 GI Annotated Anodyne CCOC(=O)[C@]1(CC(C)(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595951 GI Annotated Anodyne CCOC(=O)[C@@]1(CC(C)(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587595953 GI Annotated Anodyne C#CCCOc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587595991 GI Annotated Mild C#CCCOc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587595992 GI Annotated Mild C#CCCOc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587595994 GI Annotated Mild C#CCCOc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587595995 GI Annotated Mild CCOC(=O)[C@@H]1CCCCC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587596008 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCCC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587596009 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCCC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587596011 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCCC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587596012 GI Annotated Anodyne COc1cc(C)c(O)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587596056 GI Annotated Anodyne COc1cc(C)c(O)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587596070 GI Annotated Anodyne COc1cc(C)c(O)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1C ZINC000587596072 GI Annotated Anodyne COc1cc(C)c(O)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1C ZINC000587596073 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(-c2ccccc2)[nH]n1 ZINC000587596218 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(-c2ccccc2)[nH]n1 ZINC000587596219 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(-c2ccccc2)[nH]n1 ZINC000587596221 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(-c2ccccc2)[nH]n1 ZINC000587596223 GI Annotated Anodyne C[C@]1(COc2cccc(C=O)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596281 GI Annotated Anodyne C[C@]1(COc2cccc(C=O)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596282 GI Annotated Anodyne C[C@@]1(COc2cccc(C=O)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596283 GI Annotated Anodyne C[C@@]1(COc2cccc(C=O)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596284 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCN2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596307 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCN2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596308 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCN2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596309 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCN2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596310 GI Annotated Anodyne CCOC(=O)C[C@]1(C2CCCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596462 GI Annotated Anodyne CCOC(=O)C[C@]1(C2CCCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596465 GI Annotated Anodyne COC(=O)CCCC[C@H](C)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596480 GI Annotated Anodyne COC(=O)CCCC[C@H](C)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596481 GI Annotated Anodyne COC(=O)CCCC[C@H](C)[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596482 GI Annotated Anodyne COC(=O)CCCC[C@H](C)[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596484 GI Annotated Anodyne CC(C)(C)N1C[C@@H]2CC[C@H](C1)C21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596637 GI Annotated Anodyne CC(C)(C)N1C[C@@H]2CC[C@H](C1)C21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596640 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2CCCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596778 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2CCCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596779 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1CCOCc1ccccc1 ZINC000587596800 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1CCOCc1ccccc1 ZINC000587596801 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1CCOCc1ccccc1 ZINC000587596802 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1CCOCc1ccccc1 ZINC000587596803 GI Annotated Anodyne CCOC(=O)C(CC)(CC)[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596824 GI Annotated Anodyne CCOC(=O)C(CC)(CC)[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596825 GI Annotated Anodyne CCOC(=O)C(CC)(CC)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596826 GI Annotated Anodyne CCOC(=O)C(CC)(CC)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596827 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C[C@@H]1C)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587596857 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C[C@H]1C)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587596860 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C[C@H]1C)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587596862 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C[C@@H]1C)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587596864 GI Annotated Anodyne C=C1CC([C@@]2(CCCOC)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C1 ZINC000587596881 GI Annotated Mild C=C1CC([C@@]2(CCCOC)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C1 ZINC000587596885 GI Annotated Mild C=C1CC([C@]2(CCCOC)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C1 ZINC000587596886 GI Annotated Mild C=C1CC([C@]2(CCCOC)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C1 ZINC000587596888 GI Annotated Mild CCC[C@H](C(=O)OCC)[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596898 GI Annotated Anodyne CCC[C@H](C(=O)OCC)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596900 GI Annotated Anodyne CCC[C@H](C(=O)OCC)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587596902 GI Annotated Anodyne CCC[C@H](C(=O)OCC)[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587596903 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccnc(N2CCCC2)c1 ZINC000587596990 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccnc(N2CCCC2)c1 ZINC000587596991 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccnc(N2CCCC2)c1 ZINC000587596992 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccnc(N2CCCC2)c1 ZINC000587596993 GI Annotated Anodyne CC(=O)COc1cccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587597076 GI Annotated Anodyne CC(=O)COc1cccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587597079 GI Annotated Anodyne CC(=O)COc1cccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587597082 GI Annotated Anodyne CC(=O)COc1cccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587597083 GI Annotated Anodyne C[C@H](Oc1ccccc1O)[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597151 GI Annotated Anodyne C[C@H](Oc1ccccc1O)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597152 GI Annotated Anodyne C[C@H](Oc1ccccc1O)[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597153 GI Annotated Anodyne C[C@H](Oc1ccccc1O)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597154 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@H](C)C[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587597184 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@H](C)C[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587597186 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@H](C)C[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587597187 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@H](C)C[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587597188 GI Annotated Anodyne CCCC[C@H](C(=O)OCC)[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597195 GI Annotated Anodyne CCCC[C@H](C(=O)OCC)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597196 GI Annotated Anodyne CCCC[C@H](C(=O)OCC)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597197 GI Annotated Anodyne CCCC[C@H](C(=O)OCC)[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597199 GI Annotated Anodyne CCC[C@H](C)OC(=O)C[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597203 GI Annotated Anodyne CCC[C@H](C)OC(=O)C[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597210 GI Annotated Anodyne COCCOc1cccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587597211 GI Annotated Anodyne COCCOc1cccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587597212 GI Annotated Anodyne CCC[C@H](C)OC(=O)C[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597213 GI Annotated Anodyne COCCOc1cccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587597214 GI Annotated Anodyne COCCOc1cccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587597215 GI Annotated Anodyne CCC[C@H](C)OC(=O)C[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597217 GI Annotated Anodyne CCC[C@]1([C@@H](C)C(=O)OCC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597263 GI Annotated Anodyne CCC[C@]1([C@H](C)C(=O)OCC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597264 GI Annotated Anodyne CCC[C@]1([C@H](C)C(=O)OCC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597265 GI Annotated Anodyne CCC[C@]1([C@@H](C)C(=O)OCC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597266 GI Annotated Anodyne CCCCC[C@]1(C(=O)OCC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597493 GI Annotated Anodyne CCCCC[C@]1(C(=O)OCC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597494 GI Annotated Anodyne CCCCC[C@@]1(C(=O)OCC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597495 GI Annotated Anodyne CCCCC[C@@]1(C(=O)OCC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597497 GI Annotated Anodyne COc1cc(C[C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1O ZINC000587597500 GI Annotated Anodyne COc1cc(C[C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1O ZINC000587597501 GI Annotated Anodyne COc1cc(C[C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1O ZINC000587597504 GI Annotated Anodyne COc1cc(C[C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1O ZINC000587597505 GI Annotated Anodyne CCCC[C@]1(CC(=O)OCC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597517 GI Annotated Anodyne CCCC[C@@]1(CC(=O)OCC)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597519 GI Annotated Anodyne CCCC[C@]1(CC(=O)OCC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597521 GI Annotated Anodyne CCCC[C@@]1(CC(=O)OCC)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597523 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC2CCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597700 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC2CCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597701 GI Annotated Anodyne CCOC(=O)C[C@]1(CC2CCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587597703 GI Annotated Anodyne CCOC(=O)C[C@]1(CC2CCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587597705 GI Annotated Anodyne Cc1ccc(-c2n[nH]cc2[C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)o1 ZINC000587597920 GI Annotated Anodyne Cc1ccc(-c2n[nH]cc2[C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)o1 ZINC000587597928 GI Annotated Anodyne Cc1ccc(-c2n[nH]cc2[C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)o1 ZINC000587597931 GI Annotated Anodyne Cc1ccc(-c2n[nH]cc2[C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)o1 ZINC000587597934 GI Annotated Anodyne C#CCCOc1ccccc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587598371 GI Annotated Mild C#CCCOc1ccccc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587598373 GI Annotated Mild C#CCCOc1ccccc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587598374 GI Annotated Mild C#CCCOc1ccccc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587598376 GI Annotated Mild COCC[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587598377 GI Annotated Anodyne COCC[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587598380 GI Annotated Anodyne COCC[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587598382 GI Annotated Anodyne COCC[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587598383 GI Annotated Anodyne CCOC(=O)C1(C)CCC2(CC1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587598420 GI Annotated Anodyne CCOC(=O)C1(C)CCC2(CC1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587598423 GI Annotated Anodyne CCOc1cccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1O ZINC000587598723 GI Annotated Anodyne CCOc1cccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1O ZINC000587598724 GI Annotated Anodyne CCOc1cccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1O ZINC000587598725 GI Annotated Anodyne CCOc1cccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1O ZINC000587598726 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CC[C@@H]2OCc1ccccc1 ZINC000587598942 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CC[C@H]2OCc1ccccc1 ZINC000587598944 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CC[C@@H]2OCc1ccccc1 ZINC000587598946 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CC[C@H]2OCc1ccccc1 ZINC000587598948 GI Annotated Anodyne CC(C)N1C[C@@H]2CCC[C@H](C1)C21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587599053 GI Annotated Anodyne CC(C)N1C[C@@H]2CCC[C@H](C1)C21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587599054 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@H]([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C1 ZINC000587599125 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@H]([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C1 ZINC000587599126 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@H]([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C1 ZINC000587599127 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@H]([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C1 ZINC000587599128 GI Annotated Anodyne CCOc1cc(O)cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587599234 GI Annotated Anodyne CCOc1cc(O)cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587599236 GI Annotated Anodyne CCOc1cc(O)cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587599238 GI Annotated Anodyne CCOc1cc(O)cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587599239 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587599267 GI Annotated Anodyne CCOC(=O)C[C@]1(CC(C)C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587599269 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587599317 GI Annotated Anodyne CCOC(=O)C[C@]1(CC(C)C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587599319 GI Annotated Anodyne COc1cccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1OC ZINC000587599336 GI Annotated Anodyne COc1cccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1OC ZINC000587599337 GI Annotated Anodyne COc1cccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1OC ZINC000587599339 GI Annotated Anodyne COc1cccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1OC ZINC000587599341 GI Annotated Anodyne COc1cccc2c1C[C@]1(CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587599348 GI Annotated Anodyne COc1cccc2c1C[C@]1(CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587599352 GI Annotated Anodyne COc1cccc2c1C[C@@]1(CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587599354 GI Annotated Anodyne COc1cccc2c1C[C@@]1(CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587599356 GI Annotated Anodyne CCOC(=O)[C@]1(C2CCCCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587599361 GI Annotated Anodyne CCOC(=O)[C@@]1(C2CCCCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587599362 GI Annotated Anodyne CCOC(=O)[C@]1(C2CCCCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587599364 GI Annotated Anodyne CCOC(=O)[C@@]1(C2CCCCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587599366 GI Annotated Anodyne COCCOc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587599612 GI Annotated Anodyne COCCOc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587599614 GI Annotated Anodyne COCCOc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587599616 GI Annotated Anodyne COCCOc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587599618 GI Annotated Anodyne COc1ccc(CC[C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587599839 GI Annotated Anodyne COc1ccc(CC[C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587599840 GI Annotated Anodyne COc1ccc(CC[C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587599841 GI Annotated Anodyne COc1ccc(CC[C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587599842 GI Annotated Anodyne CC(=O)Oc1cccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587599843 GI Annotated Anodyne CC(=O)Oc1cccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587599844 GI Annotated Anodyne CC(=O)Oc1cccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587599845 GI Annotated Anodyne CC(=O)Oc1cccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587599846 GI Annotated Anodyne CC(=O)Oc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587599915 GI Annotated Anodyne CC(=O)Oc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587599916 GI Annotated Anodyne CC(=O)Oc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587599917 GI Annotated Anodyne CC(=O)Oc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587599918 GI Annotated Anodyne COc1cc(OC)cc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587600228 GI Annotated Anodyne COc1cc(OC)cc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587600229 GI Annotated Anodyne COc1cc(OC)cc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587600230 GI Annotated Anodyne COc1cc(OC)cc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587600232 GI Annotated Anodyne COc1cc(OC)cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587600535 GI Annotated Anodyne COc1cc(OC)cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587600536 GI Annotated Anodyne COc1cc(OC)cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587600537 GI Annotated Anodyne COc1cc(OC)cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587600538 GI Annotated Anodyne COc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1OC ZINC000587600680 GI Annotated Anodyne COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1OC ZINC000587600681 GI Annotated Anodyne COc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1OC ZINC000587600683 GI Annotated Anodyne COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1OC ZINC000587600685 GI Annotated Anodyne COc1ccccc1C[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587600702 GI Annotated Anodyne COc1ccccc1C[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587600704 GI Annotated Anodyne COc1ccccc1C[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587600705 GI Annotated Anodyne COc1ccccc1C[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587600707 GI Annotated Anodyne O=C(O)/C=C/c1ccccc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587600777 GI Annotated Anodyne O=C(O)/C=C/c1ccccc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587600778 GI Annotated Anodyne O=C(O)/C=C/c1ccccc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587600779 GI Annotated Anodyne O=C(O)/C=C/c1ccccc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587600780 GI Annotated Anodyne C[C@]12CC(=O)C[C@@]1(C)C[C@@]1(C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587600890 GI Annotated Anodyne C[C@]12CC(=O)C[C@@]1(C)C[C@]1(C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587600894 GI Annotated Anodyne C[C@]12CC(=O)C[C@@]1(C)C[C@@]1(C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587600897 GI Annotated Anodyne C[C@]12CC(=O)C[C@@]1(C)C[C@]1(C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587600900 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C)C(=O)[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587600966 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C)C(=O)[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587600969 GI Annotated Anodyne CC1(C)[C@H]2CC[C@]1(C)C(=O)[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587600972 GI Annotated Anodyne CC1(C)[C@H]2CC[C@]1(C)C(=O)[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587600975 GI Annotated Anodyne CC1(C)[C@H]2CC[C@]1(C)C(=O)[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587600978 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C)C(=O)[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587600980 GI Annotated Anodyne CC1(C)[C@H]2CC[C@]1(C)C(=O)[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587600984 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C)C(=O)[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587600989 GI Annotated Anodyne COc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(OC)c1 ZINC000587601012 GI Annotated Anodyne COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(OC)c1 ZINC000587601014 GI Annotated Anodyne COc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(OC)c1 ZINC000587601015 GI Annotated Anodyne COc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(OC)c1 ZINC000587601016 GI Annotated Anodyne COc1ccc2c(c1)C[C@]1(CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587601058 GI Annotated Anodyne COc1ccc2c(c1)C[C@]1(CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587601059 GI Annotated Anodyne COc1ccc2c(c1)C[C@@]1(CC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587601060 GI Annotated Anodyne COc1ccc2c(c1)C[C@@]1(CC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587601061 GI Annotated Anodyne O=Cc1cccc([C@]2(C3CC3)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587601160 GI Annotated Anodyne O=Cc1cccc([C@]2(C3CC3)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587601161 GI Annotated Anodyne O=Cc1cccc([C@@]2(C3CC3)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587601162 GI Annotated Anodyne O=Cc1cccc([C@@]2(C3CC3)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587601163 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(OC)c1 ZINC000587601227 GI Annotated Anodyne COc1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(OC)c1 ZINC000587601229 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(OC)c1 ZINC000587601232 GI Annotated Anodyne COc1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(OC)c1 ZINC000587601234 GI Annotated Anodyne CCC(=O)Oc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587601291 GI Annotated Anodyne CCC(=O)Oc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587601294 GI Annotated Anodyne CCC(=O)Oc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587601295 GI Annotated Anodyne CCC(=O)Oc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587601297 GI Annotated Anodyne COc1ccc2c(c1)CC[C@@]1(C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587601328 GI Annotated Anodyne COc1ccc2c(c1)CC[C@@]1(C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587601329 GI Annotated Anodyne COc1ccc2c(c1)CC[C@]1(C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587601330 GI Annotated Anodyne COc1ccc2c(c1)CC[C@]1(C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587601331 GI Annotated Anodyne O=C(O)CC[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587601369 GI Annotated Anodyne O=C(O)CC[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587601370 GI Annotated Anodyne O=C(O)CC[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587601371 GI Annotated Anodyne O=C(O)CC[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587601372 GI Annotated Anodyne O=C(O)/C=C/c1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587601617 GI Annotated Anodyne O=C(O)/C=C/c1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587601619 GI Annotated Anodyne O=C(O)/C=C/c1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587601620 GI Annotated Anodyne O=C(O)/C=C/c1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587601621 GI Annotated Anodyne CCO[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C12CCCC2 ZINC000587601861 GI Annotated Anodyne CCO[C@@H]1C[C@@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C12CCCC2 ZINC000587601867 GI Annotated Anodyne CCO[C@@H]1C[C@@]2(Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C12CCCC2 ZINC000587601869 GI Annotated Anodyne CCO[C@@H]1C[C@]2(Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C12CCCC2 ZINC000587601872 GI Annotated Anodyne COc1cccc(C[C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587602126 GI Annotated Anodyne COc1cccc(C[C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587602127 GI Annotated Anodyne COc1cccc(C[C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587602128 GI Annotated Anodyne COc1cccc(C[C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587602129 GI Annotated Anodyne COc1cccc2c1CC[C@@]1(C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587602134 GI Annotated Anodyne COc1cccc2c1CC[C@@]1(C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587602135 GI Annotated Anodyne COc1cccc2c1CC[C@]1(C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587602136 GI Annotated Anodyne COc1cccc2c1CC[C@]1(C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587602137 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC12CC(OCc1ccccc1)C2 ZINC000587602158 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC12CC(OCc1ccccc1)C2 ZINC000587602159 GI Annotated Anodyne CC(=O)Oc1cccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587602890 GI Annotated Anodyne CC(=O)Oc1cccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587602893 GI Annotated Anodyne CC(=O)Oc1cccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587602896 GI Annotated Anodyne CC(=O)Oc1cccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587602899 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C(=O)O)[C@@]1(C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587602930 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C(=O)O)[C@]1(C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587602934 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C(=O)O)[C@]1(C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587602937 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C(=O)O)[C@@]1(C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587602940 GI Annotated Anodyne O=C(O)CC[C@@H]1CCCC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587603639 GI Annotated Anodyne O=C(O)CC[C@@H]1CCCC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587603641 GI Annotated Anodyne O=C(O)CC[C@@H]1CCCC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587603643 GI Annotated Anodyne O=C(O)CC[C@@H]1CCCC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587603645 GI Annotated Anodyne O=C(O)CCc1cccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587603742 GI Annotated Anodyne O=C(O)CCc1cccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587603743 GI Annotated Anodyne O=C(O)CCc1cccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587603744 GI Annotated Anodyne O=C(O)CCc1cccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587603745 GI Annotated Anodyne CC1(C)[C@@H](CC(=O)O)C[C@H]1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587604462 GI Annotated Anodyne CC1(C)[C@@H](CC(=O)O)C[C@H]1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587604463 GI Annotated Anodyne CC1(C)[C@@H](CC(=O)O)C[C@H]1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587604464 GI Annotated Anodyne CC1(C)[C@@H](CC(=O)O)C[C@H]1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587604465 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(CC1CCCCC1)C(=O)O ZINC000587604536 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(CC1CCCCC1)C(=O)O ZINC000587604537 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(CC1CCCCC1)C(=O)O ZINC000587604538 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(CC1CCCCC1)C(=O)O ZINC000587604539 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C)[C@@]1(Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)C2=O ZINC000587604658 GI Annotated Anodyne CC1(C)[C@H]2CC[C@]1(C)[C@]1(Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)C2=O ZINC000587604659 GI Annotated Anodyne CC1(C)[C@H]2CC[C@@]1(C)[C@@]1(Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)C2=O ZINC000587604660 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C)[C@]1(Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)C2=O ZINC000587604661 GI Annotated Anodyne CC1(C)[C@H]2CC[C@]1(C)[C@@]1(Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)C2=O ZINC000587604662 GI Annotated Anodyne CC1(C)[C@H]2CC[C@]1(C)[C@]1(Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)C2=O ZINC000587604663 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C)[C@]1(Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)C2=O ZINC000587604664 GI Annotated Anodyne CC1(C)[C@H]2CC[C@@]1(C)[C@@]1(Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)C2=O ZINC000587604665 GI Annotated Anodyne CC1(C)[C@H]2CC[C@@]1(C)[C@]1(Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)C2=O ZINC000587604666 GI Annotated Anodyne CC1(C)[C@@H]2CC[C@@]1(C)[C@@]1(Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)C2=O ZINC000587604667 GI Annotated Anodyne CC1(C)[C@H]2CC[C@@]1(C)[C@]1(Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)C2=O ZINC000587604668 GI Annotated Anodyne CC1(C)[C@H]2CC[C@]1(C)[C@@]1(Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)C2=O ZINC000587604669 GI Annotated Anodyne C[C@]12CCC(=O)C=C1CC[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587604980 GI Annotated Mild C[C@]12CCC(=O)C=C1CC[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587604985 GI Annotated Mild C[C@]12CCC(=O)C=C1CC[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587604986 GI Annotated Mild C[C@]12CCC(=O)C=C1CC[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587604988 GI Annotated Mild C[S@](=O)c1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587605054 GI Annotated Anodyne C[S@](=O)c1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587605055 GI Annotated Anodyne C[S@](=O)c1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587605056 GI Annotated Anodyne C[S@](=O)c1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587605058 GI Annotated Anodyne C[C@H](CCCCC(=O)O)[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587605101 GI Annotated Anodyne C[C@H](CCCCC(=O)O)[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587605102 GI Annotated Anodyne C[C@H](CCCCC(=O)O)[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587605103 GI Annotated Anodyne C[C@H](CCCCC(=O)O)[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587605104 GI Annotated Anodyne CC(C)C1=CC=CC(=O)[C@@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587605260 GI Annotated Mild CC(C)C1=CC=CC(=O)[C@@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587605261 GI Annotated Mild CC(C)C1=CC=CC(=O)[C@]2(C1)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587605262 GI Annotated Mild CC(C)C1=CC=CC(=O)[C@]2(C1)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587605263 GI Annotated Mild C[C@]1(CCc2ccc(O)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587605563 GI Annotated Anodyne C[C@]1(CCc2ccc(O)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587605564 GI Annotated Anodyne C[C@@]1(CCc2ccc(O)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587605565 GI Annotated Anodyne C[C@@]1(CCc2ccc(O)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587605566 GI Annotated Anodyne C[C@]1(CCc2ccc(O)c(O)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587605919 GI Annotated Clean C[C@]1(CCc2ccc(O)c(O)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587605920 GI Annotated Clean C[C@@]1(CCc2ccc(O)c(O)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587605921 GI Annotated Clean C[C@@]1(CCc2ccc(O)c(O)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587605922 GI Annotated Clean Cc1cc(C(=O)O)cc(C)c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587605957 GI Annotated Anodyne Cc1cc(C(=O)O)cc(C)c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587605958 GI Annotated Anodyne Cc1cc(C(=O)O)cc(C)c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587605959 GI Annotated Anodyne Cc1cc(C(=O)O)cc(C)c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587605960 GI Annotated Anodyne Cc1ccc(C(=O)O)cc1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587605983 GI Annotated Anodyne Cc1ccc(C(=O)O)cc1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587605984 GI Annotated Anodyne Cc1ccc(C(=O)O)cc1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587605985 GI Annotated Anodyne Cc1ccc(C(=O)O)cc1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587605986 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12[C@H]1CCO[C@H]1C21CCCC1 ZINC000587606134 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12[C@H]1CCO[C@H]1C21CCCC1 ZINC000587606135 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12[C@H]1CCO[C@H]1C21CCCC1 ZINC000587606136 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12[C@H]1CCO[C@H]1C21CCCC1 ZINC000587606137 GI Annotated Anodyne C[C@]1(c2ccc3c(c2)OCCO3)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587606204 GI Annotated Anodyne C[C@]1(c2ccc3c(c2)OCCO3)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587606205 GI Annotated Anodyne C[C@@]1(c2ccc3c(c2)OCCO3)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587606206 GI Annotated Anodyne C[C@@]1(c2ccc3c(c2)OCCO3)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587606207 GI Annotated Anodyne C[C@@H]1C(C)(C)[C@H](C(=O)O)CC[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587606218 GI Annotated Anodyne C[C@@H]1C(C)(C)[C@H](C(=O)O)CC[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587606219 GI Annotated Anodyne C[C@@H]1C(C)(C)[C@H](C(=O)O)CC[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587606220 GI Annotated Anodyne C[C@@H]1C(C)(C)[C@H](C(=O)O)CC[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587606221 GI Annotated Anodyne C[C@H](O)Cc1cccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587606319 GI Annotated Anodyne C[C@H](O)Cc1cccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587606324 GI Annotated Anodyne C[C@H](O)Cc1cccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587606325 GI Annotated Anodyne C[C@H](O)Cc1cccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587606326 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1C[C@@H]1CCCCC12OCCO2 ZINC000587606418 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1C[C@H]1CCCCC12OCCO2 ZINC000587606419 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1C[C@H]1CCCCC12OCCO2 ZINC000587606420 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1C[C@@H]1CCCCC12OCCO2 ZINC000587606421 GI Annotated Anodyne Cc1cc2c(cc1[C@H]1Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)OCCO2 ZINC000587606841 GI Annotated Anodyne Cc1cc2c(cc1[C@H]1Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)OCCO2 ZINC000587606842 GI Annotated Anodyne Cc1cc2c(cc1[C@@H]1Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)OCCO2 ZINC000587606843 GI Annotated Anodyne Cc1cc2c(cc1[C@@H]1Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)OCCO2 ZINC000587606844 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccc2c1OCCCO2 ZINC000587607093 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccc2c1OCCCO2 ZINC000587607094 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccc2c1OCCCO2 ZINC000587607095 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccc2c1OCCCO2 ZINC000587607096 GI Annotated Anodyne COc1ccc2c(c1)OCC[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587607114 GI Annotated Anodyne COc1ccc2c(c1)OCC[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587607117 GI Annotated Anodyne COc1ccc2c(c1)OCC[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587607118 GI Annotated Anodyne COc1ccc2c(c1)OCC[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587607119 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1CC1CCC2(CC1)OCCO2 ZINC000587607132 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1CC1CCC2(CC1)OCCO2 ZINC000587607134 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1CC1CCC2(CC1)OCCO2 ZINC000587607136 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1CC1CCC2(CC1)OCCO2 ZINC000587607137 GI Annotated Anodyne C[C@](O)(C[C@@H]1C[C@H]2CC[C@H]1C2)[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587607313 GI Annotated Anodyne C[C@](O)(C[C@@H]1C[C@H]2CC[C@H]1C2)[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587607314 GI Annotated Anodyne C[C@](O)(C[C@@H]1C[C@H]2CC[C@H]1C2)[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587607315 GI Annotated Anodyne C[C@](O)(C[C@@H]1C[C@H]2CC[C@H]1C2)[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587607316 GI Annotated Anodyne CC1(C)C[C@]2(CC[C@H]1C(=O)O)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587607433 GI Annotated Anodyne CC1(C)C[C@]2(CC[C@H]1C(=O)O)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587607436 GI Annotated Anodyne CC1(C)C[C@]2(CC[C@@H]1C(=O)O)Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587607438 GI Annotated Anodyne CC1(C)C[C@]2(CC[C@@H]1C(=O)O)Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587607441 GI Annotated Anodyne CC[C@]1(c2ccc(C(=O)O)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587607450 GI Annotated Anodyne CC[C@@]1(c2ccc(C(=O)O)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587607451 GI Annotated Anodyne CC[C@]1(c2ccc(C(=O)O)cc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587607455 GI Annotated Anodyne CC[C@@]1(c2ccc(C(=O)O)cc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587607457 GI Annotated Anodyne CC(C)(O)c1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587607460 GI Annotated Anodyne CC(C)(O)c1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587607464 GI Annotated Anodyne CC(C)(O)c1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587607466 GI Annotated Anodyne CC(C)(O)c1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587607470 GI Annotated Anodyne Cc1c(C)c(O)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)c1O ZINC000587607848 GI Annotated Anodyne Cc1c(C)c(O)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)c1O ZINC000587607851 GI Annotated Anodyne Cc1c(C)c(O)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)c1O ZINC000587607857 GI Annotated Anodyne Cc1c(C)c(O)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)c1O ZINC000587607862 GI Annotated Anodyne CC1(C)[C@H]2CC[C@@]1(C(=O)O)[C@@]1(C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587608031 GI Annotated Anodyne CC[C@]1(c2ccc3c(c2)OCO3)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587608033 GI Annotated Anodyne CC1(C)[C@H]2CC[C@@]1(C(=O)O)[C@]1(C2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587608034 GI Annotated Anodyne CC[C@]1(c2ccc3c(c2)OCO3)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587608035 GI Annotated Anodyne CC[C@@]1(c2ccc3c(c2)OCO3)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587608036 GI Annotated Anodyne CC[C@@]1(c2ccc3c(c2)OCO3)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587608037 GI Annotated Anodyne CC1(C)[C@H]2CC[C@@]1(C(=O)O)[C@]1(C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587608038 GI Annotated Anodyne CC1(C)[C@H]2CC[C@@]1(C(=O)O)[C@@]1(C2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587608040 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1CCc1ccc2c(c1)CCO2 ZINC000587608292 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1CCc1ccc2c(c1)CCO2 ZINC000587608294 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1CCc1ccc2c(c1)CCO2 ZINC000587608295 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1CCc1ccc2c(c1)CCO2 ZINC000587608297 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2OC12CCC1(CCOCC1)CC2 ZINC000587608381 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2OC12CCC1(CCOCC1)CC2 ZINC000587608382 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587608611 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587608612 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587608613 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587608614 GI Annotated Anodyne O=C(O)C1C[C@@H]2CCC[C@H](C1)C21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587609238 GI Annotated Anodyne O=C(O)C1C[C@@H]2CCC[C@H](C1)C21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587609239 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]1(c1ncc[nH]1)c1cccs1 ZINC000587609358 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(c1ncc[nH]1)c1cccs1 ZINC000587609368 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]1(c1ncc[nH]1)c1cccs1 ZINC000587609369 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(c1ncc[nH]1)c1cccs1 ZINC000587609370 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCc1ccc3c(c12)CCO3 ZINC000587609602 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCc1ccc3c(c12)CCO3 ZINC000587609603 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCc1ccc3c(c12)CCO3 ZINC000587609604 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCc1ccc3c(c12)CCO3 ZINC000587609605 GI Annotated Anodyne O=C(O)CC[C@]1(c2cccs2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587609870 GI Annotated Anodyne O=C(O)CC[C@@]1(c2cccs2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587609879 GI Annotated Anodyne O=C(O)CC[C@@]1(c2cccs2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587609880 GI Annotated Anodyne O=C(O)CC[C@]1(c2cccs2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587609882 GI Annotated Anodyne C[C@@]1(c2cc(C(=O)O)cs2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587609948 GI Annotated Anodyne C[C@]1(c2cc(C(=O)O)cs2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587609964 GI Annotated Anodyne C[C@]1(c2cc(C(=O)O)cs2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587609965 GI Annotated Anodyne C[C@@]1(c2cc(C(=O)O)cs2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587609967 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cc(-n2ccnc2)cs1 ZINC000587610002 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cc(-n2ccnc2)cs1 ZINC000587610003 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cc(-n2ccnc2)cs1 ZINC000587610004 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cc(-n2ccnc2)cs1 ZINC000587610005 GI Annotated Anodyne COc1cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1S ZINC000587610200 GI Annotated Anodyne COc1cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1S ZINC000587610213 GI Annotated Anodyne COc1cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1S ZINC000587610215 GI Annotated Anodyne COc1cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1S ZINC000587610219 GI Annotated Anodyne C[C@@]1(c2csc(C(=O)O)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587610250 GI Annotated Anodyne C[C@]1(c2csc(C(=O)O)c2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587610254 GI Annotated Anodyne C[C@]1(c2csc(C(=O)O)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587610257 GI Annotated Anodyne C[C@@]1(c2csc(C(=O)O)c2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587610260 GI Annotated Anodyne CSc1ccc([C@@]2(C=O)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587610370 GI Annotated Mild CSc1ccc([C@]2(C=O)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587610373 GI Annotated Mild CSc1ccc([C@@]2(C=O)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587610375 GI Annotated Mild CSc1ccc([C@]2(C=O)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587610377 GI Annotated Mild O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000587610553 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2c(c1)OCCCO2 ZINC000587610555 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc2c(c1)OCCCO2 ZINC000587610556 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc2c(c1)OCCCO2 ZINC000587610558 GI Annotated Anodyne CSc1nc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1C#N ZINC000587610633 GI Annotated Mild CSc1nc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)ccc1C#N ZINC000587610634 GI Annotated Mild CSc1nc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1C#N ZINC000587610636 GI Annotated Mild CSc1nc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)ccc1C#N ZINC000587610638 GI Annotated Mild Cc1cc(C(=O)O)cc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587610723 GI Annotated Anodyne Cc1cc(C(=O)O)cc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587610726 GI Annotated Anodyne Cc1cc(C(=O)O)cc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587610728 GI Annotated Anodyne Cc1cc(C(=O)O)cc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587610731 GI Annotated Anodyne COC(=O)c1csc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587610788 GI Annotated Anodyne COC(=O)c1csc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587610790 GI Annotated Anodyne COC(=O)c1csc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587610792 GI Annotated Anodyne COC(=O)c1csc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587610797 GI Annotated Anodyne O=C(O)C1CC2(CCC3(CC2)Oc2ccccc2C(=O)[C@H]3C(=O)c2ccco2)C1 ZINC000587611245 GI Annotated Anodyne O=C(O)C1CC2(CCC3(CC2)Oc2ccccc2C(=O)[C@@H]3C(=O)c2ccco2)C1 ZINC000587611246 GI Annotated Anodyne C[C@H](O)[C@@]1(C2(C)CCCCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587611263 GI Annotated Anodyne C[C@H](O)[C@]1(C2(C)CCCCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587611265 GI Annotated Anodyne C[C@H](O)[C@@]1(C2(C)CCCCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587611267 GI Annotated Anodyne C[C@H](O)[C@]1(C2(C)CCCCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587611269 GI Annotated Anodyne CCOCc1ncc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)s1 ZINC000587611429 GI Annotated Anodyne CCOCc1ncc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)s1 ZINC000587611433 GI Annotated Anodyne CCOCc1ncc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)s1 ZINC000587611435 GI Annotated Anodyne CCOCc1ncc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)s1 ZINC000587611436 GI Annotated Anodyne COc1cccc2c1OCC[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587611441 GI Annotated Anodyne COc1cccc2c1OCC[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587611442 GI Annotated Anodyne COc1cccc2c1OCC[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587611443 GI Annotated Anodyne COc1cccc2c1OCC[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587611444 GI Annotated Anodyne CCN(CC)c1ncc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)s1 ZINC000587611449 GI Annotated Anodyne CCN(CC)c1ncc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)s1 ZINC000587611450 GI Annotated Anodyne CCN(CC)c1ncc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)s1 ZINC000587611451 GI Annotated Anodyne CCN(CC)c1ncc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)s1 ZINC000587611452 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587611474 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587611475 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587611476 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587611477 GI Annotated Anodyne CC(C)(O)[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587611760 GI Annotated Anodyne CC(C)(O)[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587611764 GI Annotated Anodyne CC(C)(O)[C@]1(c2ccccc2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587611766 GI Annotated Anodyne CC(C)(O)[C@@]1(c2ccccc2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587611769 GI Annotated Anodyne Cc1cc2c(cc1[C@H]1Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)OCO2 ZINC000587612138 GI Annotated Anodyne Cc1cc2c(cc1[C@@H]1Oc3ccccc3C(=O)[C@@H]1C(=O)c1ccco1)OCO2 ZINC000587612139 GI Annotated Anodyne Cc1cc2c(cc1[C@H]1Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)OCO2 ZINC000587612140 GI Annotated Anodyne Cc1cc2c(cc1[C@@H]1Oc3ccccc3C(=O)[C@H]1C(=O)c1ccco1)OCO2 ZINC000587612141 GI Annotated Anodyne CN(C)Cc1csc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587612295 GI Annotated Anodyne CN(C)Cc1csc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587612296 GI Annotated Anodyne CN(C)Cc1csc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587612298 GI Annotated Anodyne CN(C)Cc1csc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587612300 GI Annotated Anodyne CC1(C)[C@H]2CC[C@@](C(=O)O)(C2)[C@@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587612402 GI Annotated Anodyne CC1(C)[C@H]2CC[C@@](C(=O)O)(C2)[C@]12Oc1ccccc1C(=O)[C@H]2C(=O)c1ccco1 ZINC000587612403 GI Annotated Anodyne CC1(C)[C@H]2CC[C@@](C(=O)O)(C2)[C@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587612404 GI Annotated Anodyne CC1(C)[C@H]2CC[C@@](C(=O)O)(C2)[C@@]12Oc1ccccc1C(=O)[C@@H]2C(=O)c1ccco1 ZINC000587612405 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2oc(=O)ccc2c1 ZINC000587612504 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2oc(=O)ccc2c1 ZINC000587612505 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc2oc(=O)ccc2c1 ZINC000587612506 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc2oc(=O)ccc2c1 ZINC000587612507 GI Annotated Anodyne COc1ccc2c(c1)OC=C[C@@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587612512 GI Annotated Anodyne COc1ccc2c(c1)OC=C[C@@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587612513 GI Annotated Anodyne COc1ccc2c(c1)OC=C[C@]21Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587612514 GI Annotated Anodyne COc1ccc2c(c1)OC=C[C@]21Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587612515 GI Annotated Anodyne CC(=O)SCC[C@@]1(CCl)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587612663 GI Annotated Reactive CC(=O)SCC[C@@]1(CCl)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587612664 GI Annotated Reactive CC(=O)SCC[C@]1(CCl)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587612665 GI Annotated Reactive CC(=O)SCC[C@]1(CCl)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587612666 GI Annotated Reactive O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1coc2ccccc2c1=O ZINC000587612911 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1coc2ccccc2c1=O ZINC000587612913 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1coc2ccccc2c1=O ZINC000587612915 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1coc2ccccc2c1=O ZINC000587612917 GI Annotated Anodyne C[C@]1(c2ccc(CC#N)s2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587612993 GI Annotated Mild C[C@@]1(c2ccc(CC#N)s2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587612997 GI Annotated Mild C[C@@]1(c2ccc(CC#N)s2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587612999 GI Annotated Mild C[C@]1(c2ccc(CC#N)s2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587613001 GI Annotated Mild COc1nc(Cl)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)s1 ZINC000587613148 GI Annotated Anodyne COc1nc(Cl)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)s1 ZINC000587613149 GI Annotated Anodyne COc1nc(Cl)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)s1 ZINC000587613150 GI Annotated Anodyne COc1nc(Cl)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)s1 ZINC000587613151 GI Annotated Anodyne C[C@@]1(c2ccc(C(=O)O)s2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587613255 GI Annotated Anodyne C[C@]1(c2ccc(C(=O)O)s2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587613257 GI Annotated Anodyne C[C@]1(c2ccc(C(=O)O)s2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587613259 GI Annotated Anodyne C[C@@]1(c2ccc(C(=O)O)s2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587613260 GI Annotated Anodyne Cc1cc(C)c([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1C(=O)O ZINC000587613363 GI Annotated Anodyne Cc1cc(C)c([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1C(=O)O ZINC000587613364 GI Annotated Anodyne Cc1cc(C)c([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1C(=O)O ZINC000587613365 GI Annotated Anodyne Cc1cc(C)c([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1C(=O)O ZINC000587613367 GI Annotated Anodyne CN(C)/C=C/[C@]1(c2cccs2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587613514 GI Annotated Anodyne CN(C)/C=C\[C@]1(c2cccs2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587613523 GI Annotated Anodyne CN(C)/C=C\[C@]1(c2cccs2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587613524 GI Annotated Anodyne CN(C)/C=C/[C@]1(c2cccs2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587613526 GI Annotated Anodyne C=C1CC([C@]2(C3CCOCC3)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C1 ZINC000587613548 GI Annotated Mild C=C1CC([C@]2(C3CCOCC3)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C1 ZINC000587613550 GI Annotated Mild C=C1CC([C@@]2(C3CCOCC3)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)C1 ZINC000587613552 GI Annotated Mild C=C1CC([C@@]2(C3CCOCC3)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)C1 ZINC000587613553 GI Annotated Mild CN(C)CC[C@]1(c2cccs2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587613708 GI Annotated Anodyne CN(C)CC[C@@]1(c2cccs2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587613709 GI Annotated Anodyne CN(C)CC[C@]1(c2cccs2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587613710 GI Annotated Anodyne CN(C)CC[C@@]1(c2cccs2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587613711 GI Annotated Anodyne CSc1ccc(C(=O)[C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587613856 GI Annotated Anodyne CSc1ccc(C(=O)[C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587613861 GI Annotated Anodyne CSc1ccc(C(=O)[C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1 ZINC000587613863 GI Annotated Anodyne CSc1ccc(C(=O)[C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1 ZINC000587613864 GI Annotated Anodyne N#Cc1c(N)sc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1Cl ZINC000587614030 GI Annotated Mild N#Cc1c(N)sc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1Cl ZINC000587614034 GI Annotated Mild N#Cc1c(N)sc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1Cl ZINC000587614035 GI Annotated Mild N#Cc1c(N)sc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1Cl ZINC000587614037 GI Annotated Mild CSc1ncc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)n1 ZINC000587614130 GI Annotated Anodyne CSc1ncc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)n1 ZINC000587614156 GI Annotated Anodyne CSc1ncc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c(C)n1 ZINC000587614158 GI Annotated Anodyne CSc1ncc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c(C)n1 ZINC000587614159 GI Annotated Anodyne C[C@@]1(c2scc3c2OCCO3)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587614217 GI Annotated Anodyne C[C@]1(c2scc3c2OCCO3)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587614224 GI Annotated Anodyne C[C@@]1(c2scc3c2OCCO3)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587614226 GI Annotated Anodyne C[C@]1(c2scc3c2OCCO3)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587614227 GI Annotated Anodyne Cc1cc(C(=O)O)sc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587614339 GI Annotated Anodyne Cc1cc(C(=O)O)sc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587614340 GI Annotated Anodyne Cc1cc(C(=O)O)sc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587614341 GI Annotated Anodyne Cc1cc(C(=O)O)sc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587614343 GI Annotated Anodyne COC(=O)c1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)s1 ZINC000587614345 GI Annotated Anodyne COC(=O)c1ccc([C@@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)s1 ZINC000587614347 GI Annotated Anodyne COC(=O)c1ccc([C@]2(C)Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)s1 ZINC000587614349 GI Annotated Anodyne COC(=O)c1ccc([C@]2(C)Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)s1 ZINC000587614351 GI Annotated Anodyne CC(=O)Nc1ccsc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587614385 GI Annotated Anodyne CC(=O)Nc1ccsc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587614388 GI Annotated Anodyne CC(=O)Nc1ccsc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587614390 GI Annotated Anodyne CC(=O)Nc1ccsc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587614392 GI Annotated Anodyne C[C@]1(c2ccsc2C(=O)O)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587614818 GI Annotated Anodyne C[C@]1(c2ccsc2C(=O)O)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587614819 GI Annotated Anodyne C[C@@]1(c2ccsc2C(=O)O)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587614820 GI Annotated Anodyne C[C@@]1(c2ccsc2C(=O)O)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587614821 GI Annotated Anodyne CCOC(=O)c1ccsc1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587614846 GI Annotated Anodyne CCOC(=O)c1ccsc1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587614847 GI Annotated Anodyne CCOC(=O)c1ccsc1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587614848 GI Annotated Anodyne CCOC(=O)c1ccsc1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587614849 GI Annotated Anodyne C[C@@H](O)Cc1cccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587614901 GI Annotated Anodyne C[C@@H](O)Cc1cccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587614902 GI Annotated Anodyne C[C@@H](O)Cc1cccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587614903 GI Annotated Anodyne C[C@@H](O)Cc1cccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587614904 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnc(N2CCCC2)s1 ZINC000587615056 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnc(N2CCCC2)s1 ZINC000587615057 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cnc(N2CCCC2)s1 ZINC000587615058 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cnc(N2CCCC2)s1 ZINC000587615059 GI Annotated Anodyne CCCSc1ncc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587615204 GI Annotated Anodyne CCCSc1ncc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cn1 ZINC000587615205 GI Annotated Anodyne CCCSc1ncc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587615206 GI Annotated Anodyne CCCSc1ncc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cn1 ZINC000587615207 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1[C@]1(c2ccccc2)CCOC1 ZINC000587615232 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1[C@@]1(c2ccccc2)CCOC1 ZINC000587615233 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1[C@]1(c2ccccc2)CCOC1 ZINC000587615234 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1[C@@]1(c2ccccc2)CCOC1 ZINC000587615235 GI Annotated Anodyne CN(C)Cc1csc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587615820 GI Annotated Anodyne CN(C)Cc1csc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587615822 GI Annotated Anodyne CN(C)Cc1csc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)c1 ZINC000587615823 GI Annotated Anodyne CN(C)Cc1csc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)c1 ZINC000587615824 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1nc2c(s1)CCCC2 ZINC000587615938 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1nc2c(s1)CCCC2 ZINC000587615939 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1nc2c(s1)CCCC2 ZINC000587615942 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1nc2c(s1)CCCC2 ZINC000587615944 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnc([C@@H]2CCCO2)s1 ZINC000587616021 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnc([C@H]2CCCO2)s1 ZINC000587616023 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cnc([C@@H]2CCCO2)s1 ZINC000587616025 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cnc([C@H]2CCCO2)s1 ZINC000587616026 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)s1 ZINC000587616039 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)s1 ZINC000587616040 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)s1 ZINC000587616041 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)s1 ZINC000587616042 GI Annotated Anodyne Cc1nc2sccn2c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587616065 GI Annotated Anodyne Cc1nc2sccn2c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587616070 GI Annotated Anodyne Cc1nc2sccn2c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587616071 GI Annotated Anodyne Cc1nc2sccn2c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587616072 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)[C@H]1CCOC1 ZINC000587616869 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)[C@@H]1CCOC1 ZINC000587616870 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]1(c1ccccc1)[C@H]1CCOC1 ZINC000587616871 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]1(c1ccccc1)[C@@H]1CCOC1 ZINC000587616872 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCc1nc(Cl)sc1C2 ZINC000587616918 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CCc1nc(Cl)sc1C2 ZINC000587616919 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CCc1nc(Cl)sc1C2 ZINC000587616920 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CCc1nc(Cl)sc1C2 ZINC000587616921 GI Annotated Anodyne C[C@@]1(c2nc3c(s2)CCC3)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587617002 GI Annotated Anodyne C[C@@]1(c2nc3c(s2)CCC3)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587617112 GI Annotated Anodyne C[C@]1(c2nc3c(s2)CCC3)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587617113 GI Annotated Anodyne C[C@]1(c2nc3c(s2)CCC3)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587617114 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCC[C@H]([C@@H]1CCOC1)C2 ZINC000587617453 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCC[C@H]([C@H]1CCOC1)C2 ZINC000587617454 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCC[C@@H]([C@H]1CCOC1)C2 ZINC000587617455 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCC[C@@H]([C@@H]1CCOC1)C2 ZINC000587617456 GI Annotated Anodyne CCc1oc([C@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1C(=O)OC ZINC000587617461 GI Annotated Anodyne CCc1oc([C@@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1C(=O)OC ZINC000587617462 GI Annotated Anodyne CCc1oc([C@@H]2Oc3ccccc3C(=O)[C@H]2C(=O)c2ccco2)cc1C(=O)OC ZINC000587617463 GI Annotated Anodyne CCc1oc([C@H]2Oc3ccccc3C(=O)[C@@H]2C(=O)c2ccco2)cc1C(=O)OC ZINC000587617464 GI Annotated Anodyne Cc1cn2c([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c(C)nc2s1 ZINC000587617740 GI Annotated Anodyne Cc1cn2c([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)c(C)nc2s1 ZINC000587617748 GI Annotated Anodyne Cc1cn2c([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c(C)nc2s1 ZINC000587617750 GI Annotated Anodyne Cc1cn2c([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)c(C)nc2s1 ZINC000587617753 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CC[C@@H]1SCCS[C@@H]12 ZINC000587617838 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CC[C@H]1SCCS[C@@H]12 ZINC000587617845 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CC[C@H]1SCCS[C@H]12 ZINC000587617847 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CC[C@@H]1SCCS[C@H]12 ZINC000587617849 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2snnc2c1 ZINC000587617868 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc2snnc2c1 ZINC000587617869 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc2snnc2c1 ZINC000587617870 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2snnc2c1 ZINC000587617871 GI Annotated Anodyne CC1(c2ccc([C@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cc2)COC1 ZINC000587617979 GI Annotated Anodyne CC1(c2ccc([C@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cc2)COC1 ZINC000587617980 GI Annotated Anodyne CC1(c2ccc([C@@H]3Oc4ccccc4C(=O)[C@@H]3C(=O)c3ccco3)cc2)COC1 ZINC000587617981 GI Annotated Anodyne CC1(c2ccc([C@@H]3Oc4ccccc4C(=O)[C@H]3C(=O)c3ccco3)cc2)COC1 ZINC000587617982 GI Annotated Anodyne C[C@@]1(c2c(N)sc3c2CCC3)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587618179 GI Annotated Anodyne C[C@@]1(c2c(N)sc3c2CCC3)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587618181 GI Annotated Anodyne C[C@]1(c2c(N)sc3c2CCC3)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587618303 GI Annotated Anodyne C[C@]1(c2c(N)sc3c2CCC3)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587618304 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccc2nsnc12 ZINC000587618656 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccc2nsnc12 ZINC000587618657 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccc2nsnc12 ZINC000587618658 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccc2nsnc12 ZINC000587618659 GI Annotated Anodyne Cc1nc2scc(C)n2c1[C@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587619044 GI Annotated Anodyne Cc1nc2scc(C)n2c1[C@@H]1Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587619047 GI Annotated Anodyne Cc1nc2scc(C)n2c1[C@@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587619048 GI Annotated Anodyne Cc1nc2scc(C)n2c1[C@H]1Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587619050 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@]12CSCc1ccccc12 ZINC000587619183 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@]12CSCc1ccccc12 ZINC000587619184 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@]12CSCc1ccccc12 ZINC000587619278 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CSCc1ccccc12 ZINC000587619280 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2oc(CO)cc2c1 ZINC000587619340 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2oc(CO)cc2c1 ZINC000587619342 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1c(Cl)nc2sccn12 ZINC000587619343 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc2oc(CO)cc2c1 ZINC000587619344 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1c(Cl)nc2sccn12 ZINC000587619345 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc2oc(CO)cc2c1 ZINC000587619346 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1c(Cl)nc2sccn12 ZINC000587619347 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1c(Cl)nc2sccn12 ZINC000587619349 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCC[C@H]2[C@H]1CCOC1 ZINC000587619675 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCC[C@@H]2[C@@H]1CCOC1 ZINC000587619676 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCC[C@H]2[C@@H]1CCOC1 ZINC000587619677 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@]12CCCC[C@@H]2[C@H]1CCOC1 ZINC000587619678 GI Annotated Anodyne Cc1nc2c(s1)[C@]1(CCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587619748 GI Annotated Anodyne Cc1nc2c(s1)[C@]1(CCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587619749 GI Annotated Anodyne Cc1nc2c(s1)[C@@]1(CCC2)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587619750 GI Annotated Anodyne Cc1nc2c(s1)[C@@]1(CCC2)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587619751 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2nsnc2c1 ZINC000587620345 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1ccc2nsnc2c1 ZINC000587620346 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1ccc2nsnc2c1 ZINC000587620348 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1ccc2nsnc2c1 ZINC000587620350 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@@H]1c1cccn1-c1nccs1 ZINC000587620401 GI Annotated Anodyne O=C(c1ccco1)[C@@H]1C(=O)c2ccccc2O[C@H]1c1cccn1-c1nccs1 ZINC000587620402 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@H]1c1cccn1-c1nccs1 ZINC000587620403 GI Annotated Anodyne O=C(c1ccco1)[C@H]1C(=O)c2ccccc2O[C@@H]1c1cccn1-c1nccs1 ZINC000587620404 GI Annotated Anodyne Cc1nc2sccn2c1[C@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587620430 GI Annotated Anodyne Cc1nc2sccn2c1[C@@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587620431 GI Annotated Anodyne Cc1nc2sccn2c1[C@]1(C)Oc2ccccc2C(=O)[C@@H]1C(=O)c1ccco1 ZINC000587620518 GI Annotated Anodyne Cc1nc2sccn2c1[C@@]1(C)Oc2ccccc2C(=O)[C@H]1C(=O)c1ccco1 ZINC000587620519 GI Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1-n1cc(Br)cn1 ZINC000587621136 GI Annotated Anodyne CCOC(=O)c1c(C(F)(F)F)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587621628 GI Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1C(=O)C(F)(F)C(F)(F)F ZINC000587621690 GI Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1-n1nc(Cl)nc1Cl ZINC000587621878 GI Annotated Anodyne CCOC(=O)c1[nH]c2c(c(Br)cc3n[nH]cc32)c1CC(F)(F)F ZINC000587621925 GI Annotated Anodyne FC(F)(F)c1[nH]c2c(c(Br)cc3n[nH]cc32)c1-c1cnccn1 ZINC000587622005 GI Annotated Anodyne CC(C)OC(=O)c1c(C(F)(F)F)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587622055 GI Annotated Anodyne Cn1cc(-c2c(C(F)(F)F)[nH]c3c2c(Br)cc2n[nH]cc23)cn1 ZINC000587622107 GI Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1-n1ccc(C(F)(F)F)n1 ZINC000587622234 GI Annotated Anodyne O=C(O)Cc1c(-c2ccc(F)cc2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587622402 GI Annotated Anodyne COC(=O)c1c(-c2ccc(F)cc2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587622419 GI Annotated Anodyne COC(=O)c1c(-c2ccccc2F)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587622441 GI Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1C(=O)NCc1ccccc1 ZINC000587622460 GI Annotated Anodyne N#Cc1c(-c2ccc([N+](=O)[O-])cc2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587622544 GI Annotated Mild COc1ccc(NC(=O)c2c(C)[nH]c3c2c(Br)cc2n[nH]cc23)cc1 ZINC000587622602 GI Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000587622774 GI Annotated Bother O=C(O)Cc1c(-c2cccc(F)c2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587622791 GI Annotated Anodyne COc1c(-c2cccc([N+](=O)[O-])c2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587622851 GI Annotated Bother Cc1cccnc1NC(=O)c1c(C)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587622889 GI Annotated Anodyne CCc1c(CNC(=O)OC(C)(C)C)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587622906 GI Annotated Anodyne COC(=O)c1c(C2CC(F)(F)C2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587622966 GI Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1C(=O)NCCc1ccccc1 ZINC000587623112 GI Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1CNC(=O)OC(C)(C)C ZINC000587623113 GI Annotated Anodyne CN(C)Cc1c(-c2ccc(O)cc2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587623125 GI Annotated Anodyne N#Cc1c(-c2ccc3c(c2)OCO3)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587623138 GI Annotated Mild Cc1c(CNC(=O)OC(C)(C)C)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587623140 GI Annotated Anodyne COc1cc(OC)cc(-c2[nH]c3c(c(Br)cc4n[nH]cc43)c2C#N)c1 ZINC000587623180 GI Annotated Mild N#Cc1c(-c2cccc([N+](=O)[O-])c2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587623211 GI Annotated Mild Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1C(=O)N1CCCC[C@H]1C ZINC000587623231 GI Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1C(=O)N1CCCC[C@@H]1C ZINC000587623232 GI Annotated Anodyne CCOC(=O)c1c(-c2ccccn2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587623262 GI Annotated Anodyne Cc1c(-c2cc([N+](=O)[O-])ccc2O)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587623286 GI Annotated Bother COC(=O)c1c(-c2ccc(C#N)cc2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587623328 GI Annotated Mild COc1ccc(-c2[nH]c3c(c(Br)cc4n[nH]cc43)c2C#N)cc1OC ZINC000587623399 GI Annotated Mild N#Cc1c(-c2cccc3c2OCCO3)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587623403 GI Annotated Mild CCOC(=O)c1c(-c2ccncc2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587623419 GI Annotated Anodyne Cc1ccc(CNC(=O)c2c(C)[nH]c3c2c(Br)cc2n[nH]cc23)cc1 ZINC000587623539 GI Annotated Anodyne Cc1ccnc(NC(=O)c2c(C)[nH]c3c2c(Br)cc2n[nH]cc23)c1 ZINC000587623579 GI Annotated Anodyne CN(CCc1c(-c2cccnc2)[nH]c2c1c(Br)cc1n[nH]cc12)N=O ZINC000587623588 GI Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1C(=O)N(C)c1ccccc1 ZINC000587623590 GI Annotated Anodyne COC(=O)c1ccc(-c2[nH]c3c(c(Br)cc4n[nH]cc43)c2C#N)cc1 ZINC000587623674 GI Annotated Mild COc1ccccc1NC(=O)c1c(C)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587623681 GI Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1CN(C)C(=O)OC(C)(C)C ZINC000587623708 GI Annotated Anodyne CC(=O)c1c(C)[nH]c(-c2[nH]c3c(c(Br)cc4n[nH]cc43)c2C#N)c1C ZINC000587623764 GI Annotated Mild COC(=O)C(=O)c1c(-c2ccc(OC)cc2F)[nH]c2c(C)cc(Cl)cc12 ZINC000587623999 GI Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1C(=O)N1CCCCCC1 ZINC000587624026 GI Annotated Anodyne CCOC(=O)c1c(-c2cccnc2)[nH]c2c1c(Br)cc1n[nH]cc12 ZINC000587624028 GI Annotated Anodyne Cc1[nH]c2c(c(Br)cc3n[nH]cc32)c1N1Cc2ccccc2C1=O ZINC000587624177 GI Annotated Anodyne Cc1cc(=NC(=O)c2c(C)[nH]c3cc(C(F)(F)F)cc(C(F)(F)F)c23)[nH]o1 ZINC000587625210 GI Annotated Anodyne CC(=O)Cc1[nH]c2c(C)cc(Cl)cc2c1CN1C(=O)c2ccccc2C1=O ZINC000587626266 GI Annotated Anodyne Cc1nn(C)cc1C(=O)c1c(-c2cn(C)nc2C)[nH]c2c(C)cc(Cl)cc12 ZINC000587626727 GI Annotated Anodyne Cc1cc(Cl)cc2c(C(=O)c3cnn(C)c3C)c(-c3cnn(C)c3C)[nH]c12 ZINC000587626941 GI Annotated Anodyne CCOC(=O)Cc1[nH]c2c(C)cc(Cl)cc2c1N1C(=O)c2ccccc2C1=O ZINC000587627039 GI Annotated Anodyne Cc1[nH]c2c(C)cc(Cl)cc2c1C(=O)CCN1C(=O)c2ccccc2C1=O ZINC000587627131 GI Annotated Anodyne CC(=O)c1c(CCN2C(=O)c3ccccc3C2=O)[nH]c2c(C)cc(Cl)cc12 ZINC000587627293 GI Annotated Anodyne CCOC(=O)c1c(CN2C(=O)c3ccccc3C2=O)[nH]c2c(C)cc(Cl)cc12 ZINC000587627324 GI Annotated Anodyne Cc1ccc(-c2[nH]c3c(C)cc(Cl)cc3c2[C@@H](C(=O)O)n2cncn2)cc1 ZINC000587627487 GI Annotated Anodyne Cc1ccc(-c2[nH]c3c(C)cc(Cl)cc3c2[C@H](C(=O)O)n2cncn2)cc1 ZINC000587627488 GI Annotated Anodyne COC(=O)c1c(-c2cnn(C)c2)[nH]c2cc(C(F)(F)F)cc(C(F)(F)F)c12 ZINC000587627655 GI Annotated Anodyne Cc1[nH]c2cc(C(F)(F)F)cc(C(F)(F)F)c2c1C(=O)c1cnn(C)c1 ZINC000587627678 GI Annotated Anodyne Cc1[nH]c2cc(C(F)(F)F)cc(C(F)(F)F)c2c1Cn1cnc([N+](=O)[O-])n1 ZINC000587627838 GI Annotated Bother Cc1[nH]c2cc(C(F)(F)F)cc(C(F)(F)F)c2c1CN1CCN(C)CC1 ZINC000587628199 GI Annotated Anodyne Cn1cc(-c2[nH]c3cc(C(F)(F)F)cc(C(F)(F)F)c3c2CC(=O)O)cn1 ZINC000587628248 GI Annotated Anodyne Cc1[nH]c2cc(C(F)(F)F)cc(C(F)(F)F)c2c1-n1cnc([N+](=O)[O-])n1 ZINC000587628278 GI Annotated Bother COC(=O)c1c(-c2cnccn2)[nH]c2cc(C(F)(F)F)cc(C(F)(F)F)c12 ZINC000587628605 GI Annotated Anodyne O=C1c2ccccc2C(=O)N1Cc1c(CCl)[nH]c2ccc(F)c(Cl)c12 ZINC000587628645 GI Annotated Reactive COC(=O)C(=O)c1c(-c2ccc(OC)cc2F)[nH]c2cc(Cl)c(F)cc12 ZINC000587629229 GI Annotated Anodyne COC(=O)C(=O)c1c(-c2ccc(OC)cc2F)[nH]c2ccc(F)c(Cl)c12 ZINC000587629421 GI Annotated Anodyne COC(=O)c1[nH]c2cc(Cl)c(F)cc2c1C(=O)c1ccc(OC)cc1F ZINC000587629455 GI Annotated Anodyne CS(=O)(=O)c1c(-c2ccc(C(F)(F)F)nc2)[nH]c2ccc(F)c(Cl)c12 ZINC000587629563 GI Annotated Anodyne Cc1[nH]c2cc(Cl)c(F)cc2c1-n1ncc(I)c1C ZINC000587630752 GI Annotated Anodyne Cc1nn(-c2c(C)[nH]c3ccc(F)c(Cl)c23)cc1I ZINC000587630837 GI Annotated Anodyne COC(=O)Cc1[nH]c2ccc(F)c(Cl)c2c1NC(=O)OCc1ccccc1 ZINC000587631029 GI Annotated Anodyne Cc1nn(-c2c(C)[nH]c3cc(Cl)c(F)cc23)cc1I ZINC000587631064 GI Annotated Anodyne Cc1[nH]c2ccc(F)c(Cl)c2c1-n1ncc(I)c1C ZINC000587631071 GI Annotated Anodyne Cc1[nH]c2ccc(F)c(Cl)c2c1C(=O)CCN1C(=O)c2ccccc2C1=O ZINC000587631462 GI Annotated Anodyne COc1ccc(-c2[nH]c3ccc(F)c(Cl)c3c2NC(=O)CCC(=O)O)cc1 ZINC000587631489 GI Annotated Anodyne COC(=O)Cc1[nH]c2cc(Cl)c(F)cc2c1NC(=O)OCc1ccccc1 ZINC000587631612 GI Annotated Anodyne COc1ccc(-c2[nH]c3cc(Cl)c(F)cc3c2NC(=O)CCC(=O)O)cc1 ZINC000587631624 GI Annotated Anodyne Cc1ccc(-c2[nH]c3ccc(F)c(Cl)c3c2[C@H](C(=O)O)n2cncn2)cc1 ZINC000587631656 GI Annotated Anodyne Cc1ccc(-c2[nH]c3ccc(F)c(Cl)c3c2[C@@H](C(=O)O)n2cncn2)cc1 ZINC000587631657 GI Annotated Anodyne CCOC(=O)c1c(C2CN(C(=O)OC(C)(C)C)C2)[nH]c2cc(Cl)c(F)cc12 ZINC000587631936 GI Annotated Anodyne COC(=O)c1[nH]c2cccc(F)c2c1C(=O)c1ccc(Br)cc1 ZINC000587632009 GI Annotated Anodyne CC(=O)c1c(CCN2C(=O)c3ccccc3C2=O)[nH]c2ccc(F)c(Cl)c12 ZINC000587632198 GI Annotated Anodyne CCOC(=O)C(=O)c1c(-c2ccccc2Br)[nH]c2cccc(F)c12 ZINC000587632211 GI Annotated Anodyne CN1CCN(c2c(-c3ccc(Br)cc3)[nH]c3cccc(F)c23)CC1 ZINC000587632220 GI Annotated Anodyne COC(=O)c1[nH]c2cc(Cl)c(F)cc2c1C(=O)c1cn(C)c2ccccc12 ZINC000587632308 GI Annotated Anodyne CCOC(=O)c1c(C2CN(C(=O)OC(C)(C)C)C2)[nH]c2ccc(F)c(Cl)c12 ZINC000587632395 GI Annotated Anodyne CCOC(=O)c1ncn(-c2c(-c3ccc(Cl)cc3)[nH]c3cccc(F)c23)n1 ZINC000587632493 GI Annotated Anodyne Cc1ccc(-c2[nH]c3cc(Cl)c(F)cc3c2[C@H](C(=O)O)n2cncn2)cc1 ZINC000587632504 GI Annotated Anodyne Cc1ccc(-c2[nH]c3cc(Cl)c(F)cc3c2[C@@H](C(=O)O)n2cncn2)cc1 ZINC000587632505 GI Annotated Anodyne COC(=O)c1[nH]c2ccc(F)c(Cl)c2c1C(=O)c1cn(C)c2ccccc12 ZINC000587632543 GI Annotated Anodyne CCOC(=O)C(=O)c1c(-c2ccc(Br)cc2)[nH]c2cccc(F)c12 ZINC000587632585 GI Annotated Anodyne COC(=O)c1[nH]c2cc(F)ccc2c1C(=O)c1ccc(Br)cc1 ZINC000587632624 GI Annotated Anodyne COc1ccc(Br)cc1-c1[nH]c2cc(F)ccc2c1CC(=O)O ZINC000587632765 GI Annotated Anodyne CCOC(=O)c1[nH]c2cc(F)ccc2c1C(=O)c1ccc(Br)cc1 ZINC000587632767 GI Annotated Anodyne CN1CCN(c2c(-c3ccc(Br)cc3)[nH]c3cc(F)ccc23)CC1 ZINC000587632776 GI Annotated Anodyne CCOC(=O)c1[nH]c2cccc(F)c2c1C(=O)c1ccc(Br)cc1 ZINC000587632806 GI Annotated Anodyne COC(=O)C(=O)c1c(-c2ccc(Br)cc2)[nH]c2cccc(F)c12 ZINC000587632811 GI Annotated Anodyne CCOC(=O)c1ncn(-c2c(-c3cccc(Cl)c3)[nH]c3cccc(F)c23)n1 ZINC000587632874 GI Annotated Anodyne CCOC(=O)c1[nH]c2cc(F)ccc2c1C(=O)c1ccccc1Br ZINC000587632955 GI Annotated Anodyne CCOC(=O)c1[nH]c2cccc(F)c2c1C(=O)c1ccccc1Br ZINC000587633051 GI Annotated Anodyne CCOC(=O)c1ncn(-c2c(-c3ccc(Cl)cc3)[nH]c3cc(F)ccc23)n1 ZINC000587633089 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1[nH]c2cc(F)ccc2c1CCCC1OCCO1 ZINC000587634696 GI Annotated Anodyne COC(=O)c1c(-c2cccc(I)c2)[nH]c2cccc(F)c12 ZINC000587634762 GI Annotated Anodyne COC(=O)c1c(-c2cccc(I)c2)[nH]c2cc(F)ccc12 ZINC000587634925 GI Annotated Anodyne CC(C)(C)OC(=O)NCc1[nH]c2cccc(F)c2c1CCCC1OCCO1 ZINC000587636008 GI Annotated Anodyne Cc1c(-c2cc(Br)cc([N+](=O)[O-])c2O)[nH]c2c(C(=O)O)cccc12 ZINC000587636699 GI Annotated Bother O=C(O)c1cccc2c(-n3ccnc3)c(-c3ccccc3Br)[nH]c12 ZINC000587636713 GI Annotated Anodyne Cc1cc(Br)ccc1-c1[nH]c2c(C(=O)O)cccc2c1CC(=O)O ZINC000587636724 GI Annotated Anodyne CCOC(=O)c1c(-c2cccc(Br)c2)[nH]c2c(C(=O)O)cccc12 ZINC000587636797 GI Annotated Anodyne Nc1ccccc1-c1[nH]c2cc(F)ccc2c1CN1C(=O)c2ccccc2C1=O ZINC000587637018 GI Annotated Anodyne C[C@@H](C(=O)O)c1c(-c2cccc(Br)c2)[nH]c2c(C(=O)O)cccc12 ZINC000587637023 GI Annotated Anodyne C[C@H](C(=O)O)c1c(-c2cccc(Br)c2)[nH]c2c(C(=O)O)cccc12 ZINC000587637024 GI Annotated Anodyne Nc1ccccc1-c1[nH]c2cccc(F)c2c1CN1C(=O)c2ccccc2C1=O ZINC000587637115 GI Annotated Anodyne CCOC(=O)c1c(-c2ccccc2Br)[nH]c2c(C(=O)O)cccc12 ZINC000587637149 GI Annotated Anodyne CCOC(=O)c1c(-c2cc(F)c(F)c(OC)c2F)[nH]c2c(C(=O)O)cccc12 ZINC000587637166 GI Annotated Anodyne COc1ccc(C(=O)c2c(C(F)F)[nH]c3c(C(=O)O)cccc23)cc1OC ZINC000587637485 GI Annotated Anodyne NC(=O)c1cc(-c2[nH]c3c(C(=O)O)cccc3c2-c2ccc(Cl)cc2)c[nH]1 ZINC000587637516 GI Annotated Clean CCOC(=O)c1c(-c2cc(F)c(F)c(C)c2F)[nH]c2c(C(=O)O)cccc12 ZINC000587637654 GI Annotated Anodyne CCOC(=O)c1c(-c2cc(F)c(F)c(F)c2F)[nH]c2c(C(=O)O)cccc12 ZINC000587637919 GI Annotated Anodyne COC(=O)c1cc(-c2[nH]c3c(C(=O)O)cccc3c2C)cn1C(=O)OC(C)(C)C ZINC000587637947 GI Annotated Anodyne O=C(O)c1cccc2c(N3C(=O)c4ccccc4C3=O)c(-c3ccccc3)[nH]c12 ZINC000587638222 GI Annotated Anodyne COC(=O)c1[nH]c2c(C(=O)O)cccc2c1C(=O)c1ccc(Cl)cc1Cl ZINC000587638354 GI Annotated Anodyne N#Cc1c(-c2ccc(I)cc2)[nH]c2c(C(=O)O)cccc12 ZINC000587638425 GI Annotated Mild Cn1c(CO)cnc1Sc1c(-c2ccc(F)cc2)[nH]c2c(C(=O)O)cccc12 ZINC000587638434 GI Annotated Anodyne O=C(O)c1cccc2c(C(=O)C(F)(F)C(F)(F)F)c(C(F)(F)F)[nH]c12 ZINC000587638489 GI Annotated Mild O=C(O)c1cccc2c(C(=O)C(F)(F)F)c(C(F)(F)C(F)(F)F)[nH]c12 ZINC000587638541 GI Annotated Mild CCOC(=O)c1c(-c2c(F)c(F)c(F)c(F)c2F)[nH]c2c(C(=O)O)cccc12 ZINC000587638562 GI Annotated Anodyne COC(=O)c1[nH]c2c(C(=O)O)cccc2c1C(=O)c1cc(Cl)ccc1Cl ZINC000587638708 GI Annotated Anodyne O=C(O)c1cccc2c(CCCC3OCCO3)c(Cc3ccc(F)cc3)[nH]c12 ZINC000587638831 GI Annotated Anodyne COC(=O)c1[nH]c2c(C(=O)O)cccc2c1C(=O)c1ccc(Cl)c(Cl)c1 ZINC000587638836 GI Annotated Anodyne O=C(O)c1cccc2c(C(=O)C(F)(F)F)c(-c3ccc4c(c3)OCCO4)[nH]c12 ZINC000587638853 GI Annotated Anodyne COC(=O)C(=O)c1c(-c2ccc(Cl)c(Cl)c2)[nH]c2c(C(=O)O)cccc12 ZINC000587638871 GI Annotated Anodyne N#Cc1c(-c2cccc(I)c2)[nH]c2c(C(=O)O)cccc12 ZINC000587638994 GI Annotated Mild N#Cc1c(-c2ccccc2I)[nH]c2c(C(=O)O)cccc12 ZINC000587639043 GI Annotated Mild COC(=O)C(=O)c1c(-c2cc(Cl)ccc2Cl)[nH]c2c(C(=O)O)cccc12 ZINC000587639098 GI Annotated Anodyne CC[C@@H](C)c1ccc2[nH]c(C(=O)OC)c(N3C(=O)c4ccccc4C3=O)c2c1 ZINC000587640604 GI Annotated Anodyne CC[C@H](C)c1ccc2[nH]c(C(=O)OC)c(N3C(=O)c4ccccc4C3=O)c2c1 ZINC000587640605 GI Annotated Anodyne Cc1c(-c2cc(Br)cc([N+](=O)[O-])c2O)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587643626 GI Annotated Bother CC(=O)c1c(-c2cc(Br)ccc2O)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587643637 GI Annotated Bother O=C(O)Cc1c(-c2ccc(Br)cc2)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587643679 GI Annotated Bother O=C(O)Cc1c(-c2ccccc2Br)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587643879 GI Annotated Bother Cc1c(-c2cc(Br)cc([N+](=O)[O-])c2O)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587644131 GI Annotated Bother CC(=O)c1c(-c2cc(Br)ccc2O)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587644205 GI Annotated Bother Cc1cc(Br)ccc1-c1[nH]c2cccc([N+](=O)[O-])c2c1CC(=O)O ZINC000587644231 GI Annotated Bother COC(=O)c1c(-c2ccc(Br)cc2)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587644267 GI Annotated Bother Cc1cc(Br)ccc1-c1[nH]c2cc([N+](=O)[O-])ccc2c1CC(=O)O ZINC000587644326 GI Annotated Bother O=C(O)Cc1c(CCC(=O)c2ccc(Cl)cc2)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587644614 GI Annotated Bother NC(=O)C1CCN(c2c(-c3ccc(Cl)cc3)[nH]c3cc([N+](=O)[O-])ccc23)CC1 ZINC000587644625 GI Annotated Bother COC(=O)C(=O)c1c(-c2cc(Cl)ccc2Cl)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587644659 GI Annotated Bother O=C(c1c(-c2ccc3c(c2)OCO3)[nH]c2cccc([N+](=O)[O-])c12)C(F)(F)F ZINC000587644674 GI Annotated Bother O=C(c1c(-c2ccc3c(c2)OCCO3)[nH]c2cccc([N+](=O)[O-])c12)C(F)(F)F ZINC000587644675 GI Annotated Bother O=C(c1c(C(F)(F)C(F)(F)F)[nH]c2cc([N+](=O)[O-])ccc12)C(F)(F)F ZINC000587644684 GI Annotated Mild COC(=O)C(=O)c1c(-c2ccc(Cl)c(Cl)c2)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587644720 GI Annotated Bother NC(=O)C1CCN(c2c(-c3ccc(Cl)cc3)[nH]c3cccc([N+](=O)[O-])c23)CC1 ZINC000587644722 GI Annotated Bother NC(=O)c1cc(-c2[nH]c3cc([N+](=O)[O-])ccc3c2-c2ccc(Cl)cc2)c[nH]1 ZINC000587644789 GI Annotated Bother COC(=O)C(=O)c1c(-c2ccc(Cl)cc2Cl)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587644919 GI Annotated Bother COC(=O)C(=O)c1c(-c2ccc(Cl)c(Cl)c2)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587644926 GI Annotated Bother COC(=O)C(=O)c1c(-c2ccc(Cl)cc2Cl)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587644953 GI Annotated Bother NC(=O)c1cc(-c2[nH]c3cccc([N+](=O)[O-])c3c2-c2ccc(Cl)cc2)c[nH]1 ZINC000587644996 GI Annotated Bother O=C(c1c(C(F)(F)F)[nH]c2cccc([N+](=O)[O-])c12)C(F)(F)C(F)(F)F ZINC000587645001 GI Annotated Mild O=C(c1ccc2c(c1)OCO2)c1c(C(F)(F)F)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587645002 GI Annotated Bother O=C(c1c(-c2ccc3c(c2)OCO3)[nH]c2cc([N+](=O)[O-])ccc12)C(F)(F)F ZINC000587645004 GI Annotated Bother COC(=O)C(=O)c1c(-c2cc(Cl)ccc2Cl)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587645104 GI Annotated Bother COC(=O)c1[nH]c2cccc([N+](=O)[O-])c2c1C(=O)c1ccc(Cl)cc1Cl ZINC000587645191 GI Annotated Bother O=C(O)CCC(=O)Nc1c(-c2ccccc2Cl)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587645199 GI Annotated Bother O=C(c1ccc2c(c1)OCCO2)c1c(C(F)(F)F)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587645339 GI Annotated Bother O=C(c1c(C(F)(F)C(F)(F)F)[nH]c2cccc([N+](=O)[O-])c12)C(F)(F)F ZINC000587645381 GI Annotated Mild O=C(c1c(-c2ccc3c(c2)OCCO3)[nH]c2cc([N+](=O)[O-])ccc12)C(F)(F)F ZINC000587645454 GI Annotated Bother O=C(c1c(C(F)(F)F)[nH]c2cc([N+](=O)[O-])ccc12)C(F)(F)C(F)(F)F ZINC000587645589 GI Annotated Mild O=C(c1ccc2c(c1)OCCO2)c1c(C(F)(F)F)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587645591 GI Annotated Bother O=C(c1ccc2c(c1)OCO2)c1c(C(F)(F)F)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587645608 GI Annotated Bother COc1ccc(-c2[nH]c3cc([N+](=O)[O-])ccc3c2C(=O)C(F)F)cc1OC ZINC000587645640 GI Annotated Bother N#Cc1c(-c2ccccc2I)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587645649 GI Annotated Mild N#Cc1c(-c2cccc(I)c2)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587645666 GI Annotated Mild O=[N+]([O-])c1cccc2[nH]c(-c3ccc(I)cc3)c(O)c12 ZINC000587645756 GI Annotated Bother N#Cc1c(-c2ccccc2I)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587645777 GI Annotated Mild Cn1c(CO)cnc1Sc1c(-c2ccc(F)cc2)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587645778 GI Annotated Bother Cn1c(CO)cnc1Sc1c(-c2ccc(F)cc2)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587645784 GI Annotated Bother CS(=O)(=O)c1c(-c2cccc(C(F)(F)F)c2)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587645816 GI Annotated Bother N#Cc1c(-c2ccc(I)cc2)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587645887 GI Annotated Mild N#Cc1c(-c2ccc(I)cc2)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587645894 GI Annotated Mild CS(=O)(=O)c1c(-c2ccccc2C(F)(F)F)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587645948 GI Annotated Bother N#Cc1c(-c2cccc(I)c2)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587646087 GI Annotated Mild COC(=O)Cc1[nH]c2cccc([N+](=O)[O-])c2c1-c1cccc(C(F)(F)F)c1 ZINC000587646104 GI Annotated Bother COc1ccc(C(=O)c2c(C(F)F)[nH]c3cc([N+](=O)[O-])ccc23)cc1OC ZINC000587646223 GI Annotated Bother CS(=O)(=O)c1c(-c2ccccc2C(F)(F)F)[nH]c2cc([N+](=O)[O-])ccc12 ZINC000587646288 GI Annotated Bother COc1ccc(-c2[nH]c3cccc([N+](=O)[O-])c3c2C(=O)C(F)F)cc1OC ZINC000587646561 GI Annotated Bother CS(=O)(=O)c1c(-c2cccc(C(F)(F)F)c2)[nH]c2cccc([N+](=O)[O-])c12 ZINC000587646589 GI Annotated Bother COC(=O)c1cc(-c2[nH]c3cccc([N+](=O)[O-])c3c2C)cn1C(=O)OC(C)(C)C ZINC000587647400 GI Annotated Bother COC(=O)c1cc(-c2[nH]c3cc([N+](=O)[O-])ccc3c2C)cn1C(=O)OC(C)(C)C ZINC000587647850 GI Annotated Bother Cc1cc(C(=O)c2c(C(F)(F)F)[nH]c3ccc(S(C)(=O)=O)cc23)c(C)o1 ZINC000587648585 GI Annotated Anodyne Cc1[nH]c2ccc(S(C)(=O)=O)cc2c1Cc1ccc(Br)cc1 ZINC000587648659 GI Annotated Anodyne Cc1ccc(C(=O)c2c(C(F)(F)F)[nH]c3ccc(S(C)(=O)=O)cc23)s1 ZINC000587648665 GI Annotated Anodyne CCc1ccc(C(=O)c2c(C(F)(F)F)[nH]c3ccc(S(C)(=O)=O)cc23)cc1 ZINC000587648829 GI Annotated Anodyne Cc1ccc(-c2[nH]c3ccc(S(C)(=O)=O)cc3c2C(=O)C(F)(F)F)s1 ZINC000587649172 GI Annotated Anodyne Cc1c(CCc2ccc(Br)cc2)[nH]c2ccc(S(C)(=O)=O)cc12 ZINC000587649218 GI Annotated Anodyne Cc1ccc(C(=O)c2c(C(F)(F)F)[nH]c3ccc(S(C)(=O)=O)cc23)cc1C ZINC000587649221 GI Annotated Anodyne CCc1ccc(C(=O)c2c(C(F)F)[nH]c3ccc(S(C)(=O)=O)cc23)cc1 ZINC000587649418 GI Annotated Anodyne COc1ccc2[nH]c(C)c(Cc3c(C)[nH]c4cc([N+](=O)[O-])ccc34)c(=O)c2c1 ZINC000587649427 GI Annotated Bother CC(C)c1c([C@H](C)NC(=O)OC(C)(C)C)[nH]c2ccc(S(C)(=O)=O)cc12 ZINC000587649776 GI Annotated Anodyne CC(C)(C)c1[nH]c2ccc(S(C)(=O)=O)cc2c1OC(=O)c1ccccc1F ZINC000587649842 GI Annotated Anodyne Cc1ccc(C(=O)c2c(C(F)F)[nH]c3ccc(S(C)(=O)=O)cc23)cc1C ZINC000587649938 GI Annotated Anodyne Cc1cc(-c2[nH]c3ccc(S(C)(=O)=O)cc3c2C(=O)C(F)(F)F)c(C)o1 ZINC000587650090 GI Annotated Anodyne CS(=O)(=O)c1ccc2[nH]c(C(F)(F)F)c(C(=O)/C=C/c3ccccc3)c2c1 ZINC000587650122 GI Annotated Mild CS(=O)(=O)c1ccc2[nH]c(C(F)(F)F)c(C(=O)/C=C\c3ccccc3)c2c1 ZINC000587650123 GI Annotated Mild CC(C)(C)C(=O)c1c(C(F)(F)C(F)(F)F)[nH]c2ccc(S(C)(=O)=O)cc12 ZINC000587650165 GI Annotated Anodyne CS(=O)(=O)c1ccc2[nH]c(-c3ccc(Br)cc3F)c(C#N)c2c1 ZINC000587650169 GI Annotated Mild Cc1[nH]c2ccc(S(C)(=O)=O)cc2c1-c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000587650212 GI Annotated Bother CC(C)(C)c1[nH]c2ccc(S(C)(=O)=O)cc2c1C(=O)C(F)(F)C(F)(F)F ZINC000587650363 GI Annotated Anodyne Cc1cc(-c2[nH]c3ccc(S(C)(=O)=O)cc3c2C#N)c(C)n1CC(F)(F)F ZINC000587650379 GI Annotated Mild O=C(c1ccc(Cl)c(Br)c1)n1ncc2ccc(Cl)cc2c1=O ZINC000587650612 GI Annotated Anodyne O=C(COc1ccc(Cl)cc1Cl)n1ncc2ccc(Cl)cc2c1=O ZINC000587650774 GI Annotated Anodyne C[C@@H](Oc1ccc(Cl)cc1Cl)C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587651007 GI Annotated Anodyne C[C@H](Oc1ccc(Cl)cc1Cl)C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587651008 GI Annotated Anodyne O=C(COc1cccc(Cl)c1Cl)n1ncc2ccc(Cl)cc2c1=O ZINC000587651232 GI Annotated Anodyne O=C(c1ccc(Br)cc1Cl)n1ncc2ccc(Cl)cc2c1=O ZINC000587651290 GI Annotated Anodyne COc1ccc(-c2csc(-n3ncc4ccc(Cl)cc4c3=O)n2)cc1F ZINC000587651298 GI Annotated Anodyne Cc1cc(C(=O)n2ncc3ccc(Cl)cc3c2=O)c(C)n1-c1ccc(F)cc1 ZINC000587651342 GI Annotated Clean Cc1cc(Cl)cc(C)c1O[C@H](C)C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587651352 GI Annotated Anodyne Cc1cc(Cl)cc(C)c1O[C@@H](C)C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587651353 GI Annotated Anodyne O=C(Cc1csc(-c2ccc(F)cc2)n1)n1ncc2ccc(Cl)cc2c1=O ZINC000587651565 GI Annotated Anodyne O=C(COc1cc(Cl)ccc1Cl)n1ncc2ccc(Cl)cc2c1=O ZINC000587651747 GI Annotated Anodyne Cc1cc(O[C@H](C)C(=O)n2ncc3ccc(Cl)cc3c2=O)cc(C)c1Cl ZINC000587651757 GI Annotated Anodyne Cc1cc(O[C@@H](C)C(=O)n2ncc3ccc(Cl)cc3c2=O)cc(C)c1Cl ZINC000587651758 GI Annotated Anodyne Cc1ccc(Cl)c(O[C@H](C)C(=O)n2ncc3ccc(Cl)cc3c2=O)c1 ZINC000587651785 GI Annotated Anodyne Cc1ccc(Cl)c(O[C@@H](C)C(=O)n2ncc3ccc(Cl)cc3c2=O)c1 ZINC000587651786 GI Annotated Anodyne Nc1cc(-c2ccc(F)cc2)sc1C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587651808 GI Annotated Anodyne CCC(C)(C)c1ccc(OCC(=O)n2ncc3ccc(Cl)cc3c2=O)cc1 ZINC000587651925 GI Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1-c1nc2cc(Cl)ccc2nc1Cl ZINC000587652039 GI Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1C(=S)Nc1ccc(C(F)(F)F)cc1 ZINC000587652061 GI Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1C(=S)Nc1ccccc1C(F)(F)F ZINC000587652068 GI Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1-c1nc(C(F)(F)F)nc2ccccc12 ZINC000587652097 GI Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1-c1nc(-c2ccco2)cc(C(F)(F)F)n1 ZINC000587652121 GI Annotated Anodyne C[C@@H](Oc1ccc(C(C)(C)C)cc1)C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587652189 GI Annotated Anodyne C[C@H](Oc1ccc(C(C)(C)C)cc1)C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587652190 GI Annotated Anodyne Cc1cc(Cl)ccc1O[C@H](C)C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587652201 GI Annotated Anodyne Cc1cc(Cl)ccc1O[C@@H](C)C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587652202 GI Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1C(=S)Nc1cccc(C(F)(F)F)c1 ZINC000587652259 GI Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1-c1nnc(-c2ccccc2)n1-c1ccccc1 ZINC000587652317 GI Annotated Anodyne O=C(c1ccc(COc2ccc(F)cc2)o1)n1ncc2ccc(Cl)cc2c1=O ZINC000587652562 GI Annotated Anodyne O=C(c1cc(C2CC2)nc2ccccc12)n1ncc2ccc(Cl)cc2c1=O ZINC000587652688 GI Annotated Anodyne Cc1ccc(C)n1-c1ccccc1C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587652935 GI Annotated Clean Cc1nc2ccccn2c1-c1csc(-n2ncc3ccc(Cl)cc3c2=O)n1 ZINC000587653108 GI Annotated Anodyne O=C(c1cc2c(s1)-c1ccccc1OC2)n1ncc2ccc(Cl)cc2c1=O ZINC000587653428 GI Annotated Anodyne CCc1ccc(-c2nc(C(=O)n3ncc4ccc(Cl)cc4c3=O)cs2)cc1 ZINC000587653459 GI Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1-c1nc2ccc(Br)cc2s1 ZINC000587653484 GI Annotated Anodyne O=C(CSc1cccc2cccnc12)n1ncc2ccc(Cl)cc2c1=O ZINC000587653492 GI Annotated Anodyne CCc1nc(-n2ncc3ccc(Cl)cc3c2=O)c2c3c(sc2n1)CCC3 ZINC000587653556 GI Annotated Anodyne O=C(Cc1nc(-c2ccccc2)cs1)n1ncc2ccc(Cl)cc2c1=O ZINC000587653808 GI Annotated Anodyne CCc1sc(C(=O)n2ncc3ccc(Cl)cc3c2=O)cc1Br ZINC000587653836 GI Annotated Anodyne Cn1c2ccccc2c2cc(C(=O)n3ncc4ccc(Cl)cc4c3=O)sc21 ZINC000587653927 GI Annotated Anodyne Nc1cc(-c2ccccc2)sc1C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587654210 GI Annotated Anodyne O=C(c1cc(Cl)ccn1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587654263 GI Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1-c1nc2c(Br)cccc2s1 ZINC000587654295 GI Annotated Anodyne O=C(CSCc1ccccc1Cl)n1ncc2ccc(Cl)cc2c1=O ZINC000587654526 GI Annotated Anodyne Cc1nc(-c2ccccc2)sc1C(=O)n1ncc2ccc(Cl)cc2c1=O ZINC000587654770 GI Annotated Anodyne Cc1nc(-n2ncc3ccc(Cl)cc3c2=O)c2c3c(sc2n1)CCCC3 ZINC000587654776 GI Annotated Anodyne O=c1c2cc(Cl)ccc2cnn1C(=S)Nc1cccc(Br)c1 ZINC000587655231 GI Annotated Anodyne O=C(c1cc(F)cc(F)c1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655307 GI Annotated Anodyne O=C(c1cccc(F)c1F)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655315 GI Annotated Anodyne O=C(c1ccc(Cl)cn1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655316 GI Annotated Anodyne O=C(c1ccc(F)cc1F)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655499 GI Annotated Anodyne O=C(c1ccnc(Cl)c1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655534 GI Annotated Anodyne Cn1cc(Cl)cc1C(=O)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655566 GI Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1-c1cccc(F)c1[N+](=O)[O-] ZINC000587655572 GI Annotated Bother COc1ccc(-n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)cc1F ZINC000587655595 GI Annotated Anodyne O=C(Nc1ccccc1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655633 GI Annotated Anodyne Cc1c(Cl)nnc(-n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)c1C ZINC000587655707 GI Annotated Anodyne O=C(c1ccccc1F)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655759 GI Annotated Anodyne O=C(c1c(F)cccc1F)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655814 GI Annotated Anodyne O=C(Oc1ccccc1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655861 GI Annotated Anodyne CC(C)c1nccnc1-n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655866 GI Annotated Anodyne Cc1ccccc1C(=O)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587655869 GI Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1-c1ncnc2ccccc12 ZINC000587655880 GI Annotated Anodyne Cc1cccc(C(=O)n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)c1O ZINC000587655925 GI Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1-c1cc(C(F)(F)F)[nH]n1 ZINC000587656042 GI Annotated Anodyne O=C(c1ccc(Cl)nc1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656055 GI Annotated Anodyne O=C(Cc1ccccc1F)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656057 GI Annotated Anodyne Cc1nc(Cl)c(C)c(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)n1 ZINC000587656098 GI Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1-c1ncnc2ccsc12 ZINC000587656101 GI Annotated Anodyne O=C(O)c1ccccc1-n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656177 GI Annotated Anodyne Cc1nc(Cl)c(C)c(-n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)n1 ZINC000587656331 GI Annotated Anodyne O=C(c1cc(F)ccc1F)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656370 GI Annotated Anodyne Cc1nc(Cl)c(-n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)nc1C ZINC000587656412 GI Annotated Anodyne O=C(c1ccncc1Cl)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656418 GI Annotated Anodyne O=C(NCc1ccccc1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656456 GI Annotated Anodyne Cc1ccc(C(=O)n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)c(O)c1 ZINC000587656512 GI Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1-c1ncnc2sccc12 ZINC000587656593 GI Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1-c1ccccc1[N+](=O)[O-] ZINC000587656734 GI Annotated Bother O=C(O)c1ccc(-n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)cc1 ZINC000587656759 GI Annotated Anodyne O=C(Cc1ccccc1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656798 GI Annotated Anodyne CC(C)(C)OC(=O)CCn1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587656837 GI Annotated Anodyne O=C(c1ccc(O)c(Cl)c1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587656911 GI Annotated Anodyne O=C(CCc1ccco1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587657107 GI Annotated Anodyne COc1ccccc1C(=O)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587657117 GI Annotated Anodyne Cc1cc(C(=O)n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)c(C)o1 ZINC000587657139 GI Annotated Anodyne O=C(Cc1ccsc1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587657177 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1ccnc(Br)c1 ZINC000587657243 GI Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1-c1nnc(C2CC2)s1 ZINC000587657262 GI Annotated Anodyne O=C(CNc1ccccc1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587657366 GI Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1-c1ncc2ccccc2n1 ZINC000587657375 GI Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1-c1nccnc1C1CCC1 ZINC000587657412 GI Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1-c1cnc2ccccc2n1 ZINC000587657423 GI Annotated Anodyne Cc1nc(Cl)c(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)nc1C ZINC000587657439 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1ncccc1Br ZINC000587657440 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1cc(Br)ccn1 ZINC000587657474 GI Annotated Anodyne O=C(c1cc(Cl)ccc1O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587657476 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1cncc(Br)c1 ZINC000587657479 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1ccc(Br)nc1 ZINC000587657556 GI Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1-c1ccc2c(c1)OCCO2 ZINC000587657564 GI Annotated Anodyne O=C(c1ccc(Cl)cc1O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587657571 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1cccc(Br)n1 ZINC000587657741 GI Annotated Anodyne O=C(CNc1ccc(F)cc1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587657830 GI Annotated Anodyne COc1cccc(C(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)c1F ZINC000587657914 GI Annotated Anodyne Cc1nc(C)c(C(=O)n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)s1 ZINC000587657943 GI Annotated Anodyne CC(C)CCNC(=S)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587658065 GI Annotated Anodyne COc1c(F)cc(F)cc1-n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658088 GI Annotated Anodyne O=C(c1cc(F)cc(F)c1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658111 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1ncnc2ccc(F)cc12 ZINC000587658131 GI Annotated Anodyne O=C(c1cccc(F)c1F)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658181 GI Annotated Anodyne Cc1ccc(C(=O)n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)s1 ZINC000587658189 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1nccc(C(F)(F)F)n1 ZINC000587658298 GI Annotated Anodyne O=C(CNc1ccccc1F)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658331 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1ccnc(C(F)(F)F)n1 ZINC000587658332 GI Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1C(=S)NC1CCCC1 ZINC000587658404 GI Annotated Anodyne O=c1c2cc(F)c(F)cc2c(-c2ccccc2)nn1C(=S)NC1CCCCC1 ZINC000587658415 GI Annotated Anodyne CSc1nc(C)cc(-n2nc(-c3ccccc3)c3cc(F)c(F)cc3c2=O)n1 ZINC000587658454 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1ccc(C(F)(F)F)nn1 ZINC000587658563 GI Annotated Anodyne O=C(c1ccc(F)cc1F)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658571 GI Annotated Anodyne O=C(CCc1ccccc1O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658590 GI Annotated Anodyne O=C(c1c(F)cccc1F)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658594 GI Annotated Anodyne O=C(CCc1ccc(O)cc1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658607 GI Annotated Anodyne Cc1c(Cl)nnc(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)c1C ZINC000587658625 GI Annotated Anodyne O=C(COc1ccccc1F)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658648 GI Annotated Anodyne C[C@H](Oc1ccccc1)C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658673 GI Annotated Anodyne C[C@@H](Oc1ccccc1)C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658674 GI Annotated Anodyne O=C(Cc1cccs1)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587658765 GI Annotated Anodyne Cc1ccsc1C(=O)n1nc(-c2ccccc2)c2cc(F)c(F)cc2c1=O ZINC000587658829 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1cccc(F)c1[N+](=O)[O-] ZINC000587658835 GI Annotated Bother O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1nnc(C(F)(F)F)s1 ZINC000587658932 GI Annotated Anodyne O=C(Cc1ccc(F)cc1F)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587658935 GI Annotated Anodyne O=C(c1cc(F)ccc1F)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587659219 GI Annotated Anodyne COC(=O)c1ccc(F)c(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)c1 ZINC000587659255 GI Annotated Anodyne Cc1ccccc1NCC(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587659755 GI Annotated Anodyne Nc1ccc2oc(C(=O)n3nc(-c4ccc(F)cc4)c4ccccc4c3=O)cc2c1 ZINC000587659791 GI Annotated Anodyne O=C(c1cccc2ncccc12)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587659815 GI Annotated Anodyne COc1cccc(C(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)c1C ZINC000587659817 GI Annotated Anodyne CC(C)(C)c1ocnc1C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587659889 GI Annotated Anodyne O=C(c1cccc2cccnc12)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587659894 GI Annotated Anodyne O=C(c1ccc2ccccc2n1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587659911 GI Annotated Anodyne O=C(c1cncc2ccccc12)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587659921 GI Annotated Anodyne O=C(CCOc1ccccc1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587659944 GI Annotated Anodyne O=C(c1cccc2cc[nH]c12)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587659998 GI Annotated Anodyne O=C(CCNc1ccccc1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587660244 GI Annotated Anodyne CCc1nc(C)c(C(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)s1 ZINC000587660331 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1C(=S)Nc1ccccc1 ZINC000587660464 GI Annotated Anodyne COc1ccc(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)c([N+](=O)[O-])c1 ZINC000587660563 GI Annotated Bother O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1ccc2cccc(O)c2n1 ZINC000587660566 GI Annotated Anodyne CC(C)(C)[C@H]1OCC[C@@H]1C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587660589 GI Annotated Anodyne O=C(c1cccc2[nH]ccc12)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587660593 GI Annotated Anodyne O=C(COCc1ccccc1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587660652 GI Annotated Anodyne Cc1ccc(NCC(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)cc1 ZINC000587660691 GI Annotated Anodyne O=c1[nH]ccc2cc(-n3nc(-c4ccc(F)cc4)c4ccccc4c3=O)ccc12 ZINC000587660748 GI Annotated Anodyne O=C(NCCc1cccs1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587660861 GI Annotated Anodyne CSc1ncccc1C(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587660879 GI Annotated Anodyne Cc1c(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)cccc1[N+](=O)[O-] ZINC000587660979 GI Annotated Bother O=C(c1cc2ccccc2[nH]1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587660994 GI Annotated Anodyne O=C(Cn1ccc2ccccc21)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661015 GI Annotated Anodyne CCCCN(CCCC)c1ccc(-c2nn(C=O)c(=O)c3ccccc23)c(O)c1 ZINC000587661053 GI Annotated Anodyne O=C(c1c[nH]c2ccccc12)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661068 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1nccc(-c2cccnc2)n1 ZINC000587661073 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1C(=S)NCc1ccccc1 ZINC000587661177 GI Annotated Anodyne O=C(Cc1noc2ccccc12)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661220 GI Annotated Anodyne COc1ccc(Cn2nc(-c3ccc(F)cc3)c3ccccc3c2=O)cc1OC ZINC000587661254 GI Annotated Anodyne COC(=O)c1ccc(C)c(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)c1 ZINC000587661344 GI Annotated Anodyne Cc1ccc(OCC(=O)n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)cc1 ZINC000587661349 GI Annotated Anodyne Cc1ccccc1OCC(=O)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661381 GI Annotated Anodyne O=C(c1ccc2c(c1)CCC2)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661410 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1nccc(-c2ccco2)n1 ZINC000587661601 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1-c1nncc(-c2ccccc2)n1 ZINC000587661622 GI Annotated Anodyne CSc1nc(Cl)cc(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)n1 ZINC000587661624 GI Annotated Anodyne O=C(CSc1ccccn1)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587661655 GI Annotated Anodyne CSc1nc(C)cc(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)n1 ZINC000587662155 GI Annotated Anodyne O=c1c2ccccc2c(-c2ccc(F)cc2)nn1C(=S)NC1CCCCC1 ZINC000587662172 GI Annotated Anodyne Cc1nnc(-n2nc(-c3ccc(F)cc3)c3ccccc3c2=O)n1-c1ccccc1 ZINC000587662335 GI Annotated Anodyne O=C(c1cc2c(s1)CCC2)n1nc(-c2ccc(F)cc2)c2ccccc2c1=O ZINC000587662400 GI Annotated Anodyne CCN(CC)c1ccc(-c2nn(C(=O)C3CCC3)c(=O)c3ccccc23)c(O)c1 ZINC000587665632 GI Annotated Anodyne CCN(CC)c1ccc(-c2nn(CC(F)(F)F)c(=O)c3ccccc23)c(O)c1 ZINC000587665772 GI Annotated Anodyne CCN(CC)c1ccc(-c2nn(C(=O)CC3CC3)c(=O)c3ccccc23)c(O)c1 ZINC000587666819 GI Annotated Anodyne CCCCC(=O)n1nc(-c2ccc(N(CC)CC)cc2O)c2ccccc2c1=O ZINC000587666862 GI Annotated Anodyne CCN(CC)c1ccc(-c2nn(C(=O)CC(C)C)c(=O)c3ccccc23)c(O)c1 ZINC000587666953 GI Annotated Anodyne CCCC(=O)n1nc(-c2ccc(N(CC)CC)cc2O)c2ccccc2c1=O ZINC000587667575 GI Annotated Anodyne CC[C@H](C)C(=O)n1nc(-c2ccc(N(CC)CC)cc2O)c2ccccc2c1=O ZINC000587667805 GI Annotated Anodyne CC[C@@H](C)C(=O)n1nc(-c2ccc(N(CC)CC)cc2O)c2ccccc2c1=O ZINC000587667806 GI Annotated Anodyne CCN(CC)c1ccc(-c2nn(C(=O)C(C)(C)C)c(=O)c3ccccc23)c(O)c1 ZINC000587667987 GI Annotated Anodyne CCOc1ccc(-c2nn(CC(F)(F)F)c(=O)c3ccccc23)cc1OCC ZINC000587668356 GI Annotated Anodyne CCOc1ccc(-c2nn(C(=O)[C@@H]3C[C@@H]3C)c(=O)c3ccccc23)cc1OCC ZINC000587668815 GI Annotated Anodyne CCOc1ccc(-c2nn(C(=O)[C@H]3C[C@H]3C)c(=O)c3ccccc23)cc1OCC ZINC000587668816 GI Annotated Anodyne CCOc1ccc(-c2nn(C(=O)[C@H]3C[C@@H]3C)c(=O)c3ccccc23)cc1OCC ZINC000587668817 GI Annotated Anodyne CCOc1ccc(-c2nn(C(=O)[C@@H]3C[C@H]3C)c(=O)c3ccccc23)cc1OCC ZINC000587668818 GI Annotated Anodyne CCOc1ccc(-c2nn(C[C@@H]3CCCO3)c(=O)c3ccccc23)cc1OCC ZINC000587668871 GI Annotated Anodyne CCOc1ccc(-c2nn(C[C@H]3CCCO3)c(=O)c3ccccc23)cc1OCC ZINC000587668872 GI Annotated Anodyne CCOc1ccc(-c2nn(C(=O)C3CCC3)c(=O)c3ccccc23)cc1OCC ZINC000587669429 GI Annotated Anodyne CCOc1ccc(-c2nn(-c3cccnc3)c(=O)c3ccccc23)cc1OCC ZINC000587670360 GI Annotated Anodyne CCOc1ccc(-c2nn(C(=O)C(C)C)c(=O)c3ccccc23)cc1OCC ZINC000587671156 GI Annotated Anodyne CC(C)[C@@]1(CBr)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587671759 GI Annotated Reactive CC(C)[C@]1(CBr)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587671760 GI Annotated Reactive CC(C)[C@]1(CBr)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587671762 GI Annotated Reactive CC(C)[C@@]1(CBr)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587671763 GI Annotated Reactive CCCC(=O)n1nc(-c2ccc(OCC)c(OCC)c2)c2ccccc2c1=O ZINC000587671876 GI Annotated Anodyne CCOc1ccc(-c2nn(C(=O)CC3CC3)c(=O)c3ccccc23)cc1OCC ZINC000587672743 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(CC(CBr)C2)N1 ZINC000587672803 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2C2(CC(CBr)C2)N1 ZINC000587672804 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CBr)(C2CC2)N1 ZINC000587673525 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CBr)(C2CC2)N1 ZINC000587673526 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@](CBr)(C2CC2)N1 ZINC000587673527 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CBr)(C2CC2)N1 ZINC000587673528 GI Annotated Reactive CC(C)[C@@]1(CBr)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587674279 GI Annotated Reactive CC(C)[C@]1(CBr)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587674280 GI Annotated Reactive CC(C)[C@]1(CBr)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587674281 GI Annotated Reactive CC(C)[C@@]1(CBr)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587674282 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CBr)(C2CC2)N1 ZINC000587674307 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CBr)(C2CC2)N1 ZINC000587674308 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@](CBr)(C2CC2)N1 ZINC000587674309 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CBr)(C2CC2)N1 ZINC000587674310 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2C2(CC(CBr)C2)N1 ZINC000587674681 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2C2(CC(CBr)C2)N1 ZINC000587674682 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2[nH]ccc2Br)N1 ZINC000587675698 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2[nH]ccc2Br)N1 ZINC000587675702 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2[nH]ccc2Br)N1 ZINC000587675703 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2[nH]ccc2Br)N1 ZINC000587675704 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(Br)c[nH]2)N1 ZINC000587679931 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(Br)c[nH]2)N1 ZINC000587679932 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(Br)c[nH]2)N1 ZINC000587679933 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(Br)c[nH]2)N1 ZINC000587679935 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(Br)[nH]2)N1 ZINC000587680313 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(Br)[nH]2)N1 ZINC000587680315 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(Br)[nH]2)N1 ZINC000587680317 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(Br)[nH]2)N1 ZINC000587680319 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(Br)[nH]2)N1 ZINC000587680366 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(Br)[nH]2)N1 ZINC000587680367 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(Br)[nH]2)N1 ZINC000587680368 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(Br)[nH]2)N1 ZINC000587680369 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC=C2Br)N1 ZINC000587680404 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC=C2Br)N1 ZINC000587680405 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC=C2Br)N1 ZINC000587680406 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC=C2Br)N1 ZINC000587680407 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2[nH]ccc2Br)N1 ZINC000587680736 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2[nH]ccc2Br)N1 ZINC000587680737 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2[nH]ccc2Br)N1 ZINC000587680738 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2[nH]ccc2Br)N1 ZINC000587680739 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2ccc(O)cc2)N1 ZINC000587682978 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2ccc(O)cc2)N1 ZINC000587682982 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2ccc(O)cc2)N1 ZINC000587682984 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2ccc(O)cc2)N1 ZINC000587682986 GI Annotated Reactive Cc1nc(C)c([C@@]2(CCl)N[C@H](C)Cc3cc(Br)c(F)cc32)o1 ZINC000587683418 GI Annotated Reactive Cc1nc(C)c([C@@]2(CCl)N[C@@H](C)Cc3cc(Br)c(F)cc32)o1 ZINC000587683419 GI Annotated Reactive Cc1nc(C)c([C@]2(CCl)N[C@H](C)Cc3cc(Br)c(F)cc32)o1 ZINC000587683420 GI Annotated Reactive Cc1nc(C)c([C@]2(CCl)N[C@@H](C)Cc3cc(Br)c(F)cc32)o1 ZINC000587683421 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC[C@@H]2Br)N1 ZINC000587683777 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC[C@H]2Br)N1 ZINC000587683779 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC[C@H]2Br)N1 ZINC000587683780 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC[C@@H]2Br)N1 ZINC000587683781 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2ccc(O)cc2)N1 ZINC000587685340 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2ccc(O)cc2)N1 ZINC000587685342 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2ccc(O)cc2)N1 ZINC000587685344 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2ccc(O)cc2)N1 ZINC000587685347 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(Br)c[nH]2)N1 ZINC000587685580 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(Br)c[nH]2)N1 ZINC000587685581 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(Br)c[nH]2)N1 ZINC000587685582 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(Br)c[nH]2)N1 ZINC000587685583 GI Annotated Anodyne Cc1nc(C)c([C@@]2(CCl)N[C@H](C)Cc3ccc(F)c(Br)c32)o1 ZINC000587685717 GI Annotated Reactive Cc1nc(C)c([C@@]2(CCl)N[C@@H](C)Cc3ccc(F)c(Br)c32)o1 ZINC000587685719 GI Annotated Reactive Cc1nc(C)c([C@]2(CCl)N[C@H](C)Cc3ccc(F)c(Br)c32)o1 ZINC000587685721 GI Annotated Reactive Cc1nc(C)c([C@]2(CCl)N[C@@H](C)Cc3ccc(F)c(Br)c32)o1 ZINC000587685723 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC[C@H]2Br)N1 ZINC000587687220 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC[C@@H]2Br)N1 ZINC000587687221 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC[C@@H]2Br)N1 ZINC000587687223 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC[C@H]2Br)N1 ZINC000587687225 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC=C2Br)N1 ZINC000587687663 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC=C2Br)N1 ZINC000587687664 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC=C2Br)N1 ZINC000587687666 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC=C2Br)N1 ZINC000587687667 GI Annotated Anodyne Cc1noc(C)c1[C@]1(CCl)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587687832 GI Annotated Reactive Cc1noc(C)c1[C@]1(CCl)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587687833 GI Annotated Reactive Cc1noc(C)c1[C@@]1(CCl)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587687834 GI Annotated Reactive Cc1noc(C)c1[C@@]1(CCl)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587687835 GI Annotated Reactive Cc1noc(C)c1[C@@]1(CCl)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587687848 GI Annotated Reactive Cc1noc(C)c1[C@@]1(CCl)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587687849 GI Annotated Reactive Cc1noc(C)c1[C@]1(CCl)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587687850 GI Annotated Reactive Cc1noc(C)c1[C@]1(CCl)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587687851 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(C(Cl)Cl)N1 ZINC000587689422 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(C(Cl)Cl)N1 ZINC000587689423 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(C(Cl)Cl)N1 ZINC000587689424 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(C(Cl)Cl)N1 ZINC000587689425 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(C(Cl)Cl)N1 ZINC000587689446 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(C(Cl)Cl)N1 ZINC000587689447 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(C(Cl)Cl)N1 ZINC000587689448 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(C(Cl)Cl)N1 ZINC000587689449 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2ccc(C#N)cc2)N1 ZINC000587689738 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2ccc(C#N)cc2)N1 ZINC000587689739 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2ccc(C#N)cc2)N1 ZINC000587689740 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2ccc(C#N)cc2)N1 ZINC000587689741 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2ccc(C#N)cc2)N1 ZINC000587690003 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2ccc(C#N)cc2)N1 ZINC000587690004 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2ccc(C#N)cc2)N1 ZINC000587690005 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2ccc(C#N)cc2)N1 ZINC000587690006 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(O)c(O)c(Cl)c2)N1 ZINC000587691045 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(O)c(O)c(Cl)c2)N1 ZINC000587691046 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(O)c(O)c(Cl)c2)N1 ZINC000587691047 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(O)c(O)c(Cl)c2)N1 ZINC000587691048 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(Cl)ccnc2N(C)C)N1 ZINC000587692101 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(Cl)ccnc2N(C)C)N1 ZINC000587692103 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(Cl)ccnc2N(C)C)N1 ZINC000587692105 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(Cl)ccnc2N(C)C)N1 ZINC000587692107 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(Cl)c(O)cc2O)N1 ZINC000587692516 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(Cl)c(O)cc2O)N1 ZINC000587692518 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(Cl)c(O)cc2O)N1 ZINC000587692519 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(Cl)c(O)cc2O)N1 ZINC000587692520 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C(=O)O)(c2ccccc2Cl)N1 ZINC000587692596 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C(=O)O)(c2ccccc2Cl)N1 ZINC000587692599 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C(=O)O)(c2ccccc2Cl)N1 ZINC000587692600 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C(=O)O)(c2ccccc2Cl)N1 ZINC000587692602 GI Annotated Anodyne COc1ccc(Cl)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587693123 GI Annotated Anodyne COc1ccc(Cl)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587693124 GI Annotated Anodyne COc1ccc(Cl)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587693125 GI Annotated Anodyne COc1ccc(Cl)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587693126 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(O)c(O)c(Cl)c2)N1 ZINC000587693145 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(O)c(O)c(Cl)c2)N1 ZINC000587693146 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(O)c(O)c(Cl)c2)N1 ZINC000587693147 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(O)c(O)c(Cl)c2)N1 ZINC000587693148 GI Annotated Clean COc1ncc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1Cl ZINC000587693416 GI Annotated Anodyne COc1ncc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1Cl ZINC000587693420 GI Annotated Anodyne COc1ncc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1Cl ZINC000587693423 GI Annotated Anodyne COc1ncc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1Cl ZINC000587693425 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CO)(c2ccccc2Cl)N1 ZINC000587693551 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CO)(c2ccccc2Cl)N1 ZINC000587693554 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CO)(c2ccccc2Cl)N1 ZINC000587693555 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CO)(c2ccccc2Cl)N1 ZINC000587693557 GI Annotated Anodyne COc1ccc(Cl)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587693798 GI Annotated Anodyne COc1ccc(Cl)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587693802 GI Annotated Anodyne COc1ccc(Cl)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587693806 GI Annotated Anodyne COc1ccc(Cl)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587693807 GI Annotated Anodyne Cc1nc(O)c(Cl)cc1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587694370 GI Annotated Anodyne Cc1nc(O)c(Cl)cc1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587694372 GI Annotated Anodyne Cc1nc(O)c(Cl)cc1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587694375 GI Annotated Anodyne Cc1nc(O)c(Cl)cc1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587694378 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C(=O)O)(c2ccccc2Cl)N1 ZINC000587694876 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C(=O)O)(c2ccccc2Cl)N1 ZINC000587694880 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C(=O)O)(c2ccccc2Cl)N1 ZINC000587694883 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C(=O)O)(c2ccccc2Cl)N1 ZINC000587694886 GI Annotated Anodyne COc1nccc(Cl)c1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587695261 GI Annotated Anodyne COc1nccc(Cl)c1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587695262 GI Annotated Anodyne COc1nccc(Cl)c1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587695263 GI Annotated Anodyne COc1nccc(Cl)c1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587695264 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(Cl)ccnc2N(C)C)N1 ZINC000587695301 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(Cl)ccnc2N(C)C)N1 ZINC000587695302 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(Cl)ccnc2N(C)C)N1 ZINC000587695303 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(Cl)ccnc2N(C)C)N1 ZINC000587695304 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C(=O)O)(c2ccc(Cl)cc2)N1 ZINC000587695503 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C(=O)O)(c2ccc(Cl)cc2)N1 ZINC000587695506 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C(=O)O)(c2ccc(Cl)cc2)N1 ZINC000587695509 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C(=O)O)(c2ccc(Cl)cc2)N1 ZINC000587695522 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CO)(c2ccccc2Cl)N1 ZINC000587696106 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CO)(c2ccccc2Cl)N1 ZINC000587696107 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CO)(c2ccccc2Cl)N1 ZINC000587696108 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CO)(c2ccccc2Cl)N1 ZINC000587696110 GI Annotated Anodyne C[C@H](O)[C@@]1(c2cccc(Cl)c2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587696161 GI Annotated Anodyne C[C@H](O)[C@]1(c2cccc(Cl)c2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587696162 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2cccc(Cl)c2)([C@@H](C)O)N1 ZINC000587696163 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2cccc(Cl)c2)([C@@H](C)O)N1 ZINC000587696164 GI Annotated Anodyne COc1nccc(Cl)c1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587696274 GI Annotated Anodyne COc1nccc(Cl)c1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587696276 GI Annotated Anodyne COc1nccc(Cl)c1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587696278 GI Annotated Anodyne COc1nccc(Cl)c1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587696279 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(Cl)c(O)cc2O)N1 ZINC000587696289 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(Cl)c(O)cc2O)N1 ZINC000587696291 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(Cl)c(O)cc2O)N1 ZINC000587696293 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(Cl)c(O)cc2O)N1 ZINC000587696295 GI Annotated Clean Cc1nc(O)c(Cl)cc1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587696574 GI Annotated Anodyne Cc1nc(O)c(Cl)cc1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587696576 GI Annotated Anodyne Cc1nc(O)c(Cl)cc1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587696578 GI Annotated Anodyne Cc1nc(O)c(Cl)cc1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587696579 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CO)(c2ccc(Cl)cc2)N1 ZINC000587696805 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CO)(c2ccc(Cl)cc2)N1 ZINC000587696806 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CO)(c2ccc(Cl)cc2)N1 ZINC000587696807 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CO)(c2ccc(Cl)cc2)N1 ZINC000587696808 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC#N)(c2cc(Cl)ccn2)N1 ZINC000587697353 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](CC#N)(c2cc(Cl)ccn2)N1 ZINC000587697354 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CC#N)(c2cc(Cl)ccn2)N1 ZINC000587697355 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC#N)(c2cc(Cl)ccn2)N1 ZINC000587697356 GI Annotated Mild CCn1ncc(Cl)c1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587699048 GI Annotated Anodyne CCn1ncc(Cl)c1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587699051 GI Annotated Anodyne CCn1ncc(Cl)c1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587699053 GI Annotated Anodyne CCn1ncc(Cl)c1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587699056 GI Annotated Anodyne CCn1ncc(Cl)c1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587699115 GI Annotated Anodyne CCn1ncc(Cl)c1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587699117 GI Annotated Anodyne CCn1ncc(Cl)c1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587699118 GI Annotated Anodyne CCn1ncc(Cl)c1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587699120 GI Annotated Anodyne CCn1nc(C)c(Cl)c1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587699463 GI Annotated Anodyne CCn1nc(C)c(Cl)c1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587699474 GI Annotated Anodyne CCn1nc(C)c(Cl)c1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587699477 GI Annotated Anodyne CCn1nc(C)c(Cl)c1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587699480 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CO)(c2ccc(Cl)cc2)N1 ZINC000587699576 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CO)(c2ccc(Cl)cc2)N1 ZINC000587699581 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CO)(c2ccc(Cl)cc2)N1 ZINC000587699585 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CO)(c2ccc(Cl)cc2)N1 ZINC000587699588 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC#N)(c2cc(Cl)ccn2)N1 ZINC000587699997 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CC#N)(c2cc(Cl)ccn2)N1 ZINC000587699999 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](CC#N)(c2cc(Cl)ccn2)N1 ZINC000587700000 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC#N)(c2cc(Cl)ccn2)N1 ZINC000587700002 GI Annotated Mild COc1ncc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1Cl ZINC000587700044 GI Annotated Anodyne COc1ncc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1Cl ZINC000587700047 GI Annotated Anodyne COc1ncc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1Cl ZINC000587700048 GI Annotated Anodyne COc1ncc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1Cl ZINC000587700051 GI Annotated Anodyne CC[C@@]1(CC(=O)C(F)(F)F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587700315 GI Annotated Anodyne CC[C@]1(CC(=O)C(F)(F)F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587700317 GI Annotated Anodyne CC[C@@]1(CC(=O)C(F)(F)F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587700318 GI Annotated Anodyne CC[C@]1(CC(=O)C(F)(F)F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587700320 GI Annotated Anodyne CCn1nc(C)c(Cl)c1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587700707 GI Annotated Anodyne CCn1nc(C)c(Cl)c1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587700708 GI Annotated Anodyne CCn1nc(C)c(Cl)c1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587700709 GI Annotated Anodyne CCn1nc(C)c(Cl)c1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587700710 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCNc3nc(Cl)ccc32)N1 ZINC000587701054 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCNc3nc(Cl)ccc32)N1 ZINC000587701068 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCNc3nc(Cl)ccc32)N1 ZINC000587701073 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCNc3nc(Cl)ccc32)N1 ZINC000587701078 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cncc3c(Cl)n[nH]c23)N1 ZINC000587701228 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cncc3c(Cl)n[nH]c23)N1 ZINC000587701242 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cncc3c(Cl)n[nH]c23)N1 ZINC000587701245 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cncc3c(Cl)n[nH]c23)N1 ZINC000587701248 GI Annotated Anodyne COc1ncc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1Cl ZINC000587701304 GI Annotated Anodyne COc1ncc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1Cl ZINC000587701307 GI Annotated Anodyne COc1ncc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1Cl ZINC000587701309 GI Annotated Anodyne COc1ncc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1Cl ZINC000587701311 GI Annotated Anodyne CO/C(C)=C/[C@]1(C(F)(F)F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587701327 GI Annotated Anodyne CO/C(C)=C\[C@]1(C(F)(F)F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587701331 GI Annotated Anodyne CO/C(C)=C\[C@]1(C(F)(F)F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587701333 GI Annotated Anodyne CO/C(C)=C/[C@]1(C(F)(F)F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587701334 GI Annotated Anodyne CC(C)[C@@]1(CC(=O)C(F)(F)F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587702035 GI Annotated Anodyne CC(C)[C@]1(CC(=O)C(F)(F)F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587702037 GI Annotated Anodyne CC(C)[C@@]1(CC(=O)C(F)(F)F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587702038 GI Annotated Anodyne CC(C)[C@]1(CC(=O)C(F)(F)F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587702042 GI Annotated Anodyne COc1ncc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1Cl ZINC000587702423 GI Annotated Anodyne COc1ncc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1Cl ZINC000587702427 GI Annotated Anodyne COc1ncc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1Cl ZINC000587702429 GI Annotated Anodyne COc1ncc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1Cl ZINC000587702433 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(Cl)nnc2Cl)N1 ZINC000587702493 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(Cl)nnc2Cl)N1 ZINC000587702495 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(Cl)nnc2Cl)N1 ZINC000587702497 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(Cl)nnc2Cl)N1 ZINC000587702500 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(C=C(Cl)C(=O)C(Cl)=C2)N1 ZINC000587702552 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2C2(C=C(Cl)C(=O)C(Cl)=C2)N1 ZINC000587702574 GI Annotated Mild COc1ccnc(Cl)c1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587702758 GI Annotated Anodyne COc1ccnc(Cl)c1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587702761 GI Annotated Anodyne COc1ccnc(Cl)c1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587702763 GI Annotated Anodyne COc1ccnc(Cl)c1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587702766 GI Annotated Anodyne CC[C@@]1(CC(=O)C(F)(F)F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587703109 GI Annotated Anodyne CC[C@]1(CC(=O)C(F)(F)F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587703112 GI Annotated Anodyne CC[C@@]1(CC(=O)C(F)(F)F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587703114 GI Annotated Anodyne CC[C@]1(CC(=O)C(F)(F)F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587703117 GI Annotated Anodyne CC(C)C(=O)C[C@@]1(C(F)(F)F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587703206 GI Annotated Anodyne CC(C)C(=O)C[C@]1(C(F)(F)F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587703208 GI Annotated Anodyne CC(C)C(=O)C[C@@]1(C(F)(F)F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587703209 GI Annotated Anodyne CC(C)C(=O)C[C@]1(C(F)(F)F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587703211 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(Cl)ncnc2Cl)N1 ZINC000587704161 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(Cl)ncnc2Cl)N1 ZINC000587704162 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(Cl)ncnc2Cl)N1 ZINC000587704163 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(Cl)ncnc2Cl)N1 ZINC000587704164 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC(=O)C(F)(F)F)(C2CC2)N1 ZINC000587704226 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CC(=O)C(F)(F)F)(C2CC2)N1 ZINC000587704229 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC(=O)C(F)(F)F)(C2CC2)N1 ZINC000587704230 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CC(=O)C(F)(F)F)(C2CC2)N1 ZINC000587704231 GI Annotated Anodyne CC(C)C(=O)C[C@@]1(C(F)(F)F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587704304 GI Annotated Anodyne CC(C)C(=O)C[C@]1(C(F)(F)F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587704305 GI Annotated Anodyne CC(C)C(=O)C[C@@]1(C(F)(F)F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587704306 GI Annotated Anodyne CC(C)C(=O)C[C@]1(C(F)(F)F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587704307 GI Annotated Anodyne C[C@H](O)[C@@]1(c2cccc(Cl)c2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587704458 GI Annotated Anodyne C[C@H](O)[C@]1(c2cccc(Cl)c2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587704459 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2cccc(Cl)c2)([C@@H](C)O)N1 ZINC000587704460 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2cccc(Cl)c2)([C@@H](C)O)N1 ZINC000587704461 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC(=O)C2CC2)(C(F)(F)F)N1 ZINC000587704663 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CC(=O)C2CC2)(C(F)(F)F)N1 ZINC000587704665 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC(=O)C2CC2)(C(F)(F)F)N1 ZINC000587704666 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CC(=O)C2CC2)(C(F)(F)F)N1 ZINC000587704668 GI Annotated Anodyne CC(C)[C@@]1(CC(=O)C(F)(F)F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587704697 GI Annotated Anodyne CC(C)[C@]1(CC(=O)C(F)(F)F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587704698 GI Annotated Anodyne CC(C)[C@@]1(CC(=O)C(F)(F)F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587704699 GI Annotated Anodyne CC(C)[C@]1(CC(=O)C(F)(F)F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587704700 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC(=O)C(F)(F)F)(C2CC2)N1 ZINC000587704733 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CC(=O)C(F)(F)F)(C2CC2)N1 ZINC000587704734 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC(=O)C(F)(F)F)(C2CC2)N1 ZINC000587704735 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CC(=O)C(F)(F)F)(C2CC2)N1 ZINC000587704736 GI Annotated Anodyne CCC(=O)C[C@]1(C(F)(F)F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587705063 GI Annotated Anodyne CCC(=O)C[C@@]1(C(F)(F)F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587705064 GI Annotated Anodyne CCC(=O)C[C@]1(C(F)(F)F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587705065 GI Annotated Anodyne CCC(=O)C[C@@]1(C(F)(F)F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587705066 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3n[nH]c(Cl)c3c2)N1 ZINC000587705313 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3n[nH]c(Cl)c3c2)N1 ZINC000587705314 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3n[nH]c(Cl)c3c2)N1 ZINC000587705315 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3n[nH]c(Cl)c3c2)N1 ZINC000587705316 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(Cl)ncnc2Cl)N1 ZINC000587705687 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(Cl)ncnc2Cl)N1 ZINC000587705688 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(Cl)ncnc2Cl)N1 ZINC000587705689 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(Cl)ncnc2Cl)N1 ZINC000587705690 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3[nH]c(Cl)ncc2-3)N1 ZINC000587705723 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3[nH]c(Cl)ncc2-3)N1 ZINC000587705724 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3[nH]c(Cl)ncc2-3)N1 ZINC000587705725 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3[nH]c(Cl)ncc2-3)N1 ZINC000587705726 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3[nH]cnc(Cl)c2-3)N1 ZINC000587705735 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc3[nH]cnc(Cl)c2-3)N1 ZINC000587705736 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3[nH]cnc(Cl)c2-3)N1 ZINC000587705737 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc3[nH]cnc(Cl)c2-3)N1 ZINC000587705738 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C(=O)O)(c2ccc(Cl)cc2)N1 ZINC000587705927 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C(=O)O)(c2ccc(Cl)cc2)N1 ZINC000587705929 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C(=O)O)(c2ccc(Cl)cc2)N1 ZINC000587705931 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C(=O)O)(c2ccc(Cl)cc2)N1 ZINC000587705933 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=C(Cl)C(=O)C=C2Cl)N1 ZINC000587706351 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C=C(Cl)C(=O)C=C2Cl)N1 ZINC000587706352 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=C(Cl)C(=O)C=C2Cl)N1 ZINC000587706353 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C=C(Cl)C(=O)C=C2Cl)N1 ZINC000587706354 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3n[nH]c(Cl)c3c2)N1 ZINC000587706365 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3n[nH]c(Cl)c3c2)N1 ZINC000587706366 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3n[nH]c(Cl)c3c2)N1 ZINC000587706367 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3n[nH]c(Cl)c3c2)N1 ZINC000587706368 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(C=C(Cl)C(=O)C(Cl)=C2)N1 ZINC000587706433 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2C2(C=C(Cl)C(=O)C(Cl)=C2)N1 ZINC000587706435 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C=C(Cl)C(=O)C=C2Cl)N1 ZINC000587706512 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=C(Cl)C(=O)C=C2Cl)N1 ZINC000587706514 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C=C(Cl)C(=O)C=C2Cl)N1 ZINC000587706516 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=C(Cl)C(=O)C=C2Cl)N1 ZINC000587706518 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(Cl)nnc2Cl)N1 ZINC000587706530 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(Cl)nnc2Cl)N1 ZINC000587706532 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(Cl)nnc2Cl)N1 ZINC000587706533 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(Cl)nnc2Cl)N1 ZINC000587706535 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3[nH]c(Cl)ncc2-3)N1 ZINC000587706556 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3[nH]c(Cl)ncc2-3)N1 ZINC000587706558 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3[nH]c(Cl)ncc2-3)N1 ZINC000587706560 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3[nH]c(Cl)ncc2-3)N1 ZINC000587706562 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC(=O)C2CC2)(C(F)(F)F)N1 ZINC000587706568 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CC(=O)C2CC2)(C(F)(F)F)N1 ZINC000587706569 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC(=O)C2CC2)(C(F)(F)F)N1 ZINC000587706570 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CC(=O)C2CC2)(C(F)(F)F)N1 ZINC000587706571 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C2=COCC2)(C(F)(F)Cl)N1 ZINC000587706648 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C2=COCC2)(C(F)(F)Cl)N1 ZINC000587706650 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C2=COCC2)(C(F)(F)Cl)N1 ZINC000587706651 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C2=COCC2)(C(F)(F)Cl)N1 ZINC000587706652 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3nc(Cl)ccc32)N1 ZINC000587706701 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3nc(Cl)ccc32)N1 ZINC000587706702 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3nc(Cl)ccc32)N1 ZINC000587706703 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3nc(Cl)ccc32)N1 ZINC000587706707 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3ccc(Cl)nc32)N1 ZINC000587706900 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3ccc(Cl)nc32)N1 ZINC000587706901 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3ccc(Cl)nc32)N1 ZINC000587706902 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3ccc(Cl)nc32)N1 ZINC000587706903 GI Annotated Anodyne COc1ccnc(Cl)c1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587707186 GI Annotated Anodyne COc1ccnc(Cl)c1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587707188 GI Annotated Anodyne COc1ccnc(Cl)c1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587707189 GI Annotated Anodyne COc1ccnc(Cl)c1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587707190 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCNc3nc(Cl)ccc32)N1 ZINC000587707200 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCNc3nc(Cl)ccc32)N1 ZINC000587707202 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCNc3nc(Cl)ccc32)N1 ZINC000587707203 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCNc3nc(Cl)ccc32)N1 ZINC000587707204 GI Annotated Anodyne CCO/C=C/[C@]1(C(F)(F)F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587707288 GI Annotated Anodyne CCO/C=C\[C@]1(C(F)(F)F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587707290 GI Annotated Anodyne CCO/C=C/[C@]1(C(F)(F)F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587707291 GI Annotated Anodyne CCO/C=C\[C@]1(C(F)(F)F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587707292 GI Annotated Anodyne CO/C(C)=C/[C@]1(C(F)(F)F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707320 GI Annotated Anodyne CO/C(C)=C\[C@]1(C(F)(F)F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707321 GI Annotated Anodyne CO/C(C)=C\[C@]1(C(F)(F)F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707322 GI Annotated Anodyne CO/C(C)=C/[C@]1(C(F)(F)F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707323 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3ccc(Cl)nc32)N1 ZINC000587707406 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3ccc(Cl)nc32)N1 ZINC000587707407 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3ccc(Cl)nc32)N1 ZINC000587707408 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3ccc(Cl)nc32)N1 ZINC000587707409 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2nc(Cl)cnc2Cl)N1 ZINC000587707414 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2nc(Cl)cnc2Cl)N1 ZINC000587707415 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2nc(Cl)cnc2Cl)N1 ZINC000587707416 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2nc(Cl)cnc2Cl)N1 ZINC000587707417 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2nc(Cl)cnc2Cl)N1 ZINC000587707454 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2nc(Cl)cnc2Cl)N1 ZINC000587707455 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2nc(Cl)cnc2Cl)N1 ZINC000587707456 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2nc(Cl)cnc2Cl)N1 ZINC000587707457 GI Annotated Anodyne CCO/C=C/[C@]1(C(F)(F)F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707576 GI Annotated Anodyne CCO/C=C\[C@]1(C(F)(F)F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707577 GI Annotated Anodyne CCO/C=C\[C@]1(C(F)(F)F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707578 GI Annotated Anodyne CCO/C=C/[C@]1(C(F)(F)F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707579 GI Annotated Anodyne CCC(=O)C[C@]1(C(F)(F)F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707779 GI Annotated Anodyne CCC(=O)C[C@@]1(C(F)(F)F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707781 GI Annotated Anodyne CCC(=O)C[C@]1(C(F)(F)F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707782 GI Annotated Anodyne CCC(=O)C[C@@]1(C(F)(F)F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587707783 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cncc3c(Cl)n[nH]c23)N1 ZINC000587707841 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cncc3c(Cl)n[nH]c23)N1 ZINC000587707846 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cncc3c(Cl)n[nH]c23)N1 ZINC000587707850 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cncc3c(Cl)n[nH]c23)N1 ZINC000587707852 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3nc(Cl)ccc32)N1 ZINC000587708070 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3nc(Cl)ccc32)N1 ZINC000587708071 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3nc(Cl)ccc32)N1 ZINC000587708072 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3nc(Cl)ccc32)N1 ZINC000587708073 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2ccn(C)c2)(C(F)(F)F)N1 ZINC000587708282 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccn(C)c2)(C(F)(F)F)N1 ZINC000587708285 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccn(C)c2)(C(F)(F)F)N1 ZINC000587708288 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccn(C)c2)(C(F)(F)F)N1 ZINC000587708289 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(N1)C(Cl)=CC(=O)C=C2Cl ZINC000587708522 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2C2(N1)C(Cl)=CC(=O)C=C2Cl ZINC000587708523 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2ccncc2)(C(F)(F)F)N1 ZINC000587708646 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccncc2)(C(F)(F)F)N1 ZINC000587708647 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccncc2)(C(F)(F)F)N1 ZINC000587708648 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccncc2)(C(F)(F)F)N1 ZINC000587708649 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccn2)(C(F)(F)F)N1 ZINC000587708650 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccn2)(C(F)(F)F)N1 ZINC000587708651 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccn2)(C(F)(F)F)N1 ZINC000587708652 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccn2)(C(F)(F)F)N1 ZINC000587708653 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(N1)C(Cl)=CC(=O)C=C2Cl ZINC000587708706 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2C2(N1)C(Cl)=CC(=O)C=C2Cl ZINC000587708707 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C2=COCC2)(C(F)(F)Cl)N1 ZINC000587708716 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C2=COCC2)(C(F)(F)Cl)N1 ZINC000587708717 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C2=COCC2)(C(F)(F)Cl)N1 ZINC000587708718 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C2=COCC2)(C(F)(F)Cl)N1 ZINC000587708719 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3[nH]cnc(Cl)c2-3)N1 ZINC000587708728 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc3[nH]cnc(Cl)c2-3)N1 ZINC000587708729 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3[nH]cnc(Cl)c2-3)N1 ZINC000587708730 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc3[nH]cnc(Cl)c2-3)N1 ZINC000587708731 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccn2)(C(F)(F)F)N1 ZINC000587708758 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccn2)(C(F)(F)F)N1 ZINC000587708759 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccn2)(C(F)(F)F)N1 ZINC000587708760 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccn2)(C(F)(F)F)N1 ZINC000587708761 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2ccn(C)c2)(C(F)(F)F)N1 ZINC000587709106 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccn(C)c2)(C(F)(F)F)N1 ZINC000587709107 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccn(C)c2)(C(F)(F)F)N1 ZINC000587709108 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccn(C)c2)(C(F)(F)F)N1 ZINC000587709109 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC[C@@H]2C(=O)C(F)(F)F)N1 ZINC000587709174 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC[C@@H]2C(=O)C(F)(F)F)N1 ZINC000587709175 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC[C@H]2C(=O)C(F)(F)F)N1 ZINC000587709176 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC[C@H]2C(=O)C(F)(F)F)N1 ZINC000587709177 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC[C@@H]2C(=O)C(F)(F)F)N1 ZINC000587709272 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC[C@@H]2C(=O)C(F)(F)F)N1 ZINC000587709273 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC[C@H]2C(=O)C(F)(F)F)N1 ZINC000587709274 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC[C@H]2C(=O)C(F)(F)F)N1 ZINC000587709275 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C2=COCC2)(C(F)(F)F)N1 ZINC000587709336 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C2=COCC2)(C(F)(F)F)N1 ZINC000587709337 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C2=COCC2)(C(F)(F)F)N1 ZINC000587709338 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C2=COCC2)(C(F)(F)F)N1 ZINC000587709339 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]([C@@H]2CCCC2=O)(C(F)(F)F)N1 ZINC000587709960 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]([C@@H]2CCCC2=O)(C(F)(F)F)N1 ZINC000587709961 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]([C@H]2CCCC2=O)(C(F)(F)F)N1 ZINC000587709962 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]([C@H]2CCCC2=O)(C(F)(F)F)N1 ZINC000587709964 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc(C(F)(F)F)nc2)N1 ZINC000587710139 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc(C(F)(F)F)nc2)N1 ZINC000587710144 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc(C(F)(F)F)nc2)N1 ZINC000587710146 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc(C(F)(F)F)nc2)N1 ZINC000587710148 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C2=COCC2)(C(F)(F)F)N1 ZINC000587710244 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C2=COCC2)(C(F)(F)F)N1 ZINC000587710245 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C2=COCC2)(C(F)(F)F)N1 ZINC000587710246 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C2=COCC2)(C(F)(F)F)N1 ZINC000587710247 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2ccncc2)(C(F)(F)F)N1 ZINC000587710298 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccncc2)(C(F)(F)F)N1 ZINC000587710300 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccncc2)(C(F)(F)F)N1 ZINC000587710302 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccncc2)(C(F)(F)F)N1 ZINC000587710304 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]([C@@H]2CCCC2=O)(C(F)(F)F)N1 ZINC000587710888 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]([C@@H]2CCCC2=O)(C(F)(F)F)N1 ZINC000587710889 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]([C@H]2CCCC2=O)(C(F)(F)F)N1 ZINC000587710890 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]([C@H]2CCCC2=O)(C(F)(F)F)N1 ZINC000587710891 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccc[nH]2)(C(F)(F)F)N1 ZINC000587711132 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccc[nH]2)(C(F)(F)F)N1 ZINC000587711149 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2ccc[nH]2)(C(F)(F)F)N1 ZINC000587711151 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccc[nH]2)(C(F)(F)F)N1 ZINC000587711152 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2cc[nH]c2)(C(F)(F)F)N1 ZINC000587711181 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2cc[nH]c2)(C(F)(F)F)N1 ZINC000587711182 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2cc[nH]c2)(C(F)(F)F)N1 ZINC000587711183 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2cc[nH]c2)(C(F)(F)F)N1 ZINC000587711184 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2cc[nH]c2)(C(F)(F)F)N1 ZINC000587711386 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2cc[nH]c2)(C(F)(F)F)N1 ZINC000587711387 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2cc[nH]c2)(C(F)(F)F)N1 ZINC000587711388 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2cc[nH]c2)(C(F)(F)F)N1 ZINC000587711389 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccc[nH]2)(C(F)(F)F)N1 ZINC000587711654 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2ccc[nH]2)(C(F)(F)F)N1 ZINC000587711655 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccc[nH]2)(C(F)(F)F)N1 ZINC000587711656 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccc[nH]2)(C(F)(F)F)N1 ZINC000587711657 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(OC(F)F)nc2)N1 ZINC000587712428 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(OC(F)F)nc2)N1 ZINC000587712429 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(OC(F)F)nc2)N1 ZINC000587712430 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(OC(F)F)nc2)N1 ZINC000587712431 GI Annotated Anodyne Cc1cc([C@@]2(C=O)N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1F ZINC000587712991 GI Annotated Mild Cc1cc([C@@]2(C=O)N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1F ZINC000587713001 GI Annotated Mild Cc1cc([C@]2(C=O)N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1F ZINC000587713002 GI Annotated Mild Cc1cc([C@]2(C=O)N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1F ZINC000587713003 GI Annotated Mild COc1cc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(F)cc1O ZINC000587713314 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(OC(F)F)nc2)N1 ZINC000587713335 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(OC(F)F)nc2)N1 ZINC000587713337 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(OC(F)F)nc2)N1 ZINC000587713339 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(OC(F)F)nc2)N1 ZINC000587713342 GI Annotated Anodyne COc1cc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(F)cc1O ZINC000587713348 GI Annotated Anodyne COc1cc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(F)cc1O ZINC000587713349 GI Annotated Anodyne COc1cc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(F)cc1O ZINC000587713351 GI Annotated Anodyne COc1ccc(F)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1F ZINC000587713419 GI Annotated Anodyne COc1ccc(F)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1F ZINC000587713438 GI Annotated Anodyne COc1ccc(F)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1F ZINC000587713440 GI Annotated Anodyne COc1ccc(F)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1F ZINC000587713442 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587713916 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587713929 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587713930 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587713932 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(F)c(C(=O)O)c2)N1 ZINC000587713941 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(F)c(C(=O)O)c2)N1 ZINC000587713946 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(F)c(C(=O)O)c2)N1 ZINC000587713948 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(F)c(C(=O)O)c2)N1 ZINC000587713950 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(F)c(C(=O)O)c2)N1 ZINC000587714244 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(F)c(C(=O)O)c2)N1 ZINC000587714246 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(F)c(C(=O)O)c2)N1 ZINC000587714248 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(F)c(C(=O)O)c2)N1 ZINC000587714250 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(F)c(F)c2O)N1 ZINC000587714301 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(F)c(F)c2O)N1 ZINC000587714303 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(F)c(F)c2O)N1 ZINC000587714305 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(F)c(F)c2O)N1 ZINC000587714307 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(F)c(F)c2O)N1 ZINC000587714317 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(F)c(F)c2O)N1 ZINC000587714319 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(F)c(F)c2O)N1 ZINC000587714322 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(F)c(F)c2O)N1 ZINC000587714324 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc([N+](=O)[O-])ccc2F)N1 ZINC000587714465 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc([N+](=O)[O-])ccc2F)N1 ZINC000587714468 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc([N+](=O)[O-])ccc2F)N1 ZINC000587714469 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc([N+](=O)[O-])ccc2F)N1 ZINC000587714470 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc(F)cc(F)c2O)N1 ZINC000587714479 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc(F)cc(F)c2O)N1 ZINC000587714480 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc(F)cc(F)c2O)N1 ZINC000587714481 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc(F)cc(F)c2O)N1 ZINC000587714482 GI Annotated Clean COc1cc(F)cc(F)c1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587714513 GI Annotated Anodyne COc1cc(F)cc(F)c1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587714515 GI Annotated Anodyne COc1cc(F)cc(F)c1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587714519 GI Annotated Anodyne COc1cc(F)cc(F)c1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587714523 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2nccc(C(F)(F)F)n2)N1 ZINC000587715062 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2nccc(C(F)(F)F)n2)N1 ZINC000587715063 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2nccc(C(F)(F)F)n2)N1 ZINC000587715065 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2nccc(C(F)(F)F)n2)N1 ZINC000587715067 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc([N+](=O)[O-])ccc2F)N1 ZINC000587715405 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc([N+](=O)[O-])ccc2F)N1 ZINC000587715407 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc([N+](=O)[O-])ccc2F)N1 ZINC000587715409 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc([N+](=O)[O-])ccc2F)N1 ZINC000587715412 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(C(=O)O)ccc2F)N1 ZINC000587715437 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(C(=O)O)ccc2F)N1 ZINC000587715438 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(C(=O)O)ccc2F)N1 ZINC000587715440 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(C(=O)O)ccc2F)N1 ZINC000587715444 GI Annotated Anodyne COC(=O)c1ccc(F)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587715461 GI Annotated Anodyne COC(=O)c1ccc(F)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587715467 GI Annotated Anodyne COC(=O)c1ccc(F)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587715471 GI Annotated Anodyne COC(=O)c1ccc(F)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587715474 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CC(=O)C(F)F)(C2(C)CC2)N1 ZINC000587715653 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC(=O)C(F)F)(C2(C)CC2)N1 ZINC000587715660 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC(=O)C(F)F)(C2(C)CC2)N1 ZINC000587715661 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CC(=O)C(F)F)(C2(C)CC2)N1 ZINC000587715664 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(F)c(C#N)c(F)c2)N1 ZINC000587716020 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(F)c(C#N)c(F)c2)N1 ZINC000587716021 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(F)c(C#N)c(F)c2)N1 ZINC000587716022 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(F)c(C#N)c(F)c2)N1 ZINC000587716023 GI Annotated Mild COc1cc(F)c(F)cc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587716051 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2c(O)cc(F)cc2F)N1 ZINC000587716052 GI Annotated Clean COc1cc(F)c(F)cc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587716053 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2c(O)cc(F)cc2F)N1 ZINC000587716054 GI Annotated Clean COc1cc(F)c(F)cc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587716055 GI Annotated Anodyne COc1cc(F)c(F)cc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587716056 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2c(O)cc(F)cc2F)N1 ZINC000587716057 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2c(O)cc(F)cc2F)N1 ZINC000587716059 GI Annotated Clean COc1cc(F)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1OC ZINC000587716093 GI Annotated Anodyne COc1cc(F)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1OC ZINC000587716116 GI Annotated Anodyne COc1cc(F)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1OC ZINC000587716119 GI Annotated Anodyne COc1cc(F)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1OC ZINC000587716121 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCC[C@@H]2C(=O)C(F)F)N1 ZINC000587716192 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCC[C@@H]2C(=O)C(F)F)N1 ZINC000587716193 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCC[C@H]2C(=O)C(F)F)N1 ZINC000587716194 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCC[C@H]2C(=O)C(F)F)N1 ZINC000587716195 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2nccc(C(F)(F)F)n2)N1 ZINC000587716348 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2nccc(C(F)(F)F)n2)N1 ZINC000587716350 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2nccc(C(F)(F)F)n2)N1 ZINC000587716353 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2nccc(C(F)(F)F)n2)N1 ZINC000587716355 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)([C@H](F)C#N)N1 ZINC000587716712 GI Annotated Mild COc1c(F)ccc(F)c1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587716719 GI Annotated Anodyne COc1c(F)ccc(F)c1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587716723 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)([C@@H](F)C#N)N1 ZINC000587716724 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)([C@H](F)C#N)N1 ZINC000587716727 GI Annotated Mild COc1c(F)ccc(F)c1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587716728 GI Annotated Anodyne COc1c(F)ccc(F)c1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587716731 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)([C@@H](F)C#N)N1 ZINC000587716732 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(Cl)cnn2CCF)N1 ZINC000587716794 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(Cl)cnn2CCF)N1 ZINC000587716808 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(Cl)cnn2CCF)N1 ZINC000587716814 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(Cl)cnn2CCF)N1 ZINC000587716820 GI Annotated Anodyne COc1cc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(F)cc1O ZINC000587716859 GI Annotated Anodyne COc1cc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(F)cc1O ZINC000587716865 GI Annotated Anodyne COc1cc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(F)cc1O ZINC000587716869 GI Annotated Anodyne COc1cc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(F)cc1O ZINC000587716873 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(Cl)cnn2CCF)N1 ZINC000587716914 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(Cl)cnn2CCF)N1 ZINC000587716917 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(Cl)cnn2CCF)N1 ZINC000587716921 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(Cl)cnn2CCF)N1 ZINC000587716924 GI Annotated Anodyne COc1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc(F)c1F ZINC000587716931 GI Annotated Anodyne COc1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc(F)c1F ZINC000587716936 GI Annotated Anodyne COc1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc(F)c1F ZINC000587716939 GI Annotated Anodyne COc1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc(F)c1F ZINC000587716943 GI Annotated Anodyne COc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(F)c1F ZINC000587717461 GI Annotated Anodyne COc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(F)c1F ZINC000587717466 GI Annotated Anodyne COc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(F)c1F ZINC000587717471 GI Annotated Anodyne Cc1cc([C@@]2(C=O)N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1F ZINC000587717474 GI Annotated Mild COc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(F)c1F ZINC000587717475 GI Annotated Anodyne Cc1cc([C@@]2(C=O)N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1F ZINC000587717494 GI Annotated Mild Cc1cc([C@]2(C=O)N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1F ZINC000587717499 GI Annotated Mild Cc1cc([C@]2(C=O)N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1F ZINC000587717502 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2c(N)cc(F)cc2F)N1 ZINC000587717697 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2c(N)cc(F)cc2F)N1 ZINC000587717738 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2c(N)cc(F)cc2F)N1 ZINC000587717741 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2c(N)cc(F)cc2F)N1 ZINC000587717744 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587718000 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587718003 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587718004 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(F)c(C#N)c(F)c2)N1 ZINC000587718005 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587718008 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(F)c(C#N)c(F)c2)N1 ZINC000587718011 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(F)c(C#N)c(F)c2)N1 ZINC000587718018 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(F)c(C#N)c(F)c2)N1 ZINC000587718025 GI Annotated Mild COc1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc(F)c1F ZINC000587718029 GI Annotated Anodyne COc1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc(F)c1F ZINC000587718033 GI Annotated Anodyne COc1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc(F)c1F ZINC000587718037 GI Annotated Anodyne COc1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc(F)c1F ZINC000587718042 GI Annotated Anodyne Cc1cc(C(=O)[C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1F ZINC000587718092 GI Annotated Anodyne Cc1cc(C(=O)[C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1F ZINC000587718095 GI Annotated Anodyne Cc1cc(C(=O)[C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1F ZINC000587718099 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc(F)c(N)c(F)c2)N1 ZINC000587718100 GI Annotated Anodyne Cc1cc(C(=O)[C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1F ZINC000587718103 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc(F)c(N)c(F)c2)N1 ZINC000587718106 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc(F)c(N)c(F)c2)N1 ZINC000587718110 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc(F)c(N)c(F)c2)N1 ZINC000587718113 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(F)c(C#N)c2)N1 ZINC000587718176 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(F)c(C#N)c2)N1 ZINC000587718212 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(F)c(C#N)c2)N1 ZINC000587718214 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(F)c(C#N)c2)N1 ZINC000587718217 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(F)cccc2[N+](=O)[O-])N1 ZINC000587718304 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(F)cccc2[N+](=O)[O-])N1 ZINC000587718306 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(F)cccc2[N+](=O)[O-])N1 ZINC000587718309 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(F)cccc2[N+](=O)[O-])N1 ZINC000587718311 GI Annotated Bother COc1ccc(F)c(F)c1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587718524 GI Annotated Anodyne COc1ccc(F)c(F)c1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587718527 GI Annotated Anodyne COc1ccc(F)c(F)c1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587718532 GI Annotated Anodyne COc1ccc(F)c(F)c1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587718534 GI Annotated Anodyne Cc1c(C(F)(F)F)n[nH]c1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587718542 GI Annotated Anodyne Cc1c(C(F)(F)F)n[nH]c1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587718543 GI Annotated Anodyne Cc1c(C(F)(F)F)n[nH]c1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587718544 GI Annotated Anodyne Cc1c(C(F)(F)F)n[nH]c1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587718545 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)([C@@H](F)C#N)N1 ZINC000587718552 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)([C@H](F)C#N)N1 ZINC000587718554 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)([C@@H](F)C#N)N1 ZINC000587718555 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)([C@H](F)C#N)N1 ZINC000587718557 GI Annotated Mild Cc1c(C(F)(F)F)n[nH]c1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587718558 GI Annotated Anodyne Cc1c(C(F)(F)F)n[nH]c1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587718560 GI Annotated Anodyne Cc1c(C(F)(F)F)n[nH]c1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587718562 GI Annotated Anodyne Cc1c(C(F)(F)F)n[nH]c1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587718564 GI Annotated Anodyne COc1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(F)cc1F ZINC000587718641 GI Annotated Anodyne COc1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(F)cc1F ZINC000587718645 GI Annotated Anodyne COc1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(F)cc1F ZINC000587718648 GI Annotated Anodyne COc1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(F)cc1F ZINC000587718651 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(F)cc(C#N)cc2F)N1 ZINC000587718687 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(F)cc(C#N)cc2F)N1 ZINC000587718692 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(F)cc(C#N)cc2F)N1 ZINC000587718695 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(F)cc(C#N)cc2F)N1 ZINC000587718697 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2c(O)cc(F)cc2F)N1 ZINC000587718712 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2c(O)cc(F)cc2F)N1 ZINC000587718717 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2c(O)cc(F)cc2F)N1 ZINC000587718721 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2c(O)cc(F)cc2F)N1 ZINC000587718725 GI Annotated Clean COC(=O)c1ccc(F)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587718777 GI Annotated Anodyne COC(=O)c1ccc(F)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587718780 GI Annotated Anodyne COC(=O)c1ccc(F)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587718783 GI Annotated Anodyne COC(=O)c1ccc(F)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587718785 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587719165 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587719167 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587719169 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587719171 GI Annotated Bother COc1cc(F)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1OC ZINC000587719322 GI Annotated Anodyne COc1cc(F)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1OC ZINC000587719325 GI Annotated Anodyne COc1cc(F)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1OC ZINC000587719329 GI Annotated Anodyne COc1cc(F)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1OC ZINC000587719332 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](C(=O)c2cc(F)ccc2F)N1 ZINC000587719336 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](C(=O)c2cc(F)ccc2F)N1 ZINC000587719341 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](C(=O)c2cc(F)ccc2F)N1 ZINC000587719342 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](C(=O)c2cc(F)ccc2F)N1 ZINC000587719343 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(F)c(C#N)c2)N1 ZINC000587719344 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(F)c(C#N)c2)N1 ZINC000587719345 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(F)c(C#N)c2)N1 ZINC000587719346 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(F)c(C#N)c2)N1 ZINC000587719347 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(F)ccc(C#N)c2F)N1 ZINC000587719384 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(F)ccc(C#N)c2F)N1 ZINC000587719387 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(F)ccc(C#N)c2F)N1 ZINC000587719389 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(F)ccc(C#N)c2F)N1 ZINC000587719391 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(F)cc(C#N)cc2F)N1 ZINC000587719582 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(F)cc(C#N)cc2F)N1 ZINC000587719585 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(F)cc(C#N)cc2F)N1 ZINC000587719588 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(F)cc(C#N)cc2F)N1 ZINC000587719589 GI Annotated Mild COc1cc(F)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(F)c1 ZINC000587719814 GI Annotated Anodyne COc1cc(F)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(F)c1 ZINC000587719816 GI Annotated Anodyne COc1cc(F)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(F)c1 ZINC000587719818 GI Annotated Anodyne COc1cc(F)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(F)c1 ZINC000587719820 GI Annotated Anodyne COc1cc(F)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1F ZINC000587720086 GI Annotated Anodyne COc1cc(F)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1F ZINC000587720089 GI Annotated Anodyne COc1cc(F)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1F ZINC000587720091 GI Annotated Anodyne COc1cc(F)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1F ZINC000587720094 GI Annotated Anodyne Cc1cc(C(=O)[C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1F ZINC000587720118 GI Annotated Anodyne Cc1cc(C(=O)[C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1F ZINC000587720121 GI Annotated Anodyne Cc1cc(C(=O)[C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1F ZINC000587720124 GI Annotated Anodyne Cc1cc(C(=O)[C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1F ZINC000587720127 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(C(=O)O)ccc2F)N1 ZINC000587720145 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(C(=O)O)ccc2F)N1 ZINC000587720146 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(C(=O)O)ccc2F)N1 ZINC000587720147 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(C(=O)O)ccc2F)N1 ZINC000587720150 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](C(=O)c2cc(F)ccc2F)N1 ZINC000587720190 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](C(=O)c2cc(F)ccc2F)N1 ZINC000587720193 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](C(=O)c2cc(F)ccc2F)N1 ZINC000587720196 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](C(=O)c2cc(F)ccc2F)N1 ZINC000587720199 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C(F)F)([C@@H]2CCCCC2=O)N1 ZINC000587720213 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C(F)F)([C@@H]2CCCCC2=O)N1 ZINC000587720214 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C(F)F)([C@H]2CCCCC2=O)N1 ZINC000587720215 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C(F)F)([C@H]2CCCCC2=O)N1 ZINC000587720216 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587720226 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587720228 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587720230 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(F)c([N+](=O)[O-])c2)N1 ZINC000587720231 GI Annotated Bother COc1c(F)ccc(F)c1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587720512 GI Annotated Anodyne COc1c(F)ccc(F)c1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587720515 GI Annotated Anodyne COc1c(F)ccc(F)c1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587720517 GI Annotated Anodyne COc1c(F)ccc(F)c1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587720518 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C(F)F)([C@@H]2CCCCC2=O)N1 ZINC000587721129 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C(F)F)([C@@H]2CCCCC2=O)N1 ZINC000587721131 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C(F)F)([C@H]2CCCCC2=O)N1 ZINC000587721134 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C(F)F)([C@H]2CCCCC2=O)N1 ZINC000587721137 GI Annotated Anodyne COc1c(F)cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1F ZINC000587721150 GI Annotated Anodyne COc1c(F)cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1F ZINC000587721153 GI Annotated Anodyne COc1c(F)cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1F ZINC000587721154 GI Annotated Anodyne COc1c(F)cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1F ZINC000587721155 GI Annotated Anodyne COc1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc(F)c1O ZINC000587721213 GI Annotated Anodyne COc1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc(F)c1O ZINC000587721239 GI Annotated Anodyne COc1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc(F)c1O ZINC000587721241 GI Annotated Anodyne COc1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc(F)c1O ZINC000587721243 GI Annotated Anodyne COc1ccc(F)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1F ZINC000587721447 GI Annotated Anodyne COc1ccc(F)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1F ZINC000587721448 GI Annotated Anodyne COc1ccc(F)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1F ZINC000587721449 GI Annotated Anodyne COc1ccc(F)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1F ZINC000587721450 GI Annotated Anodyne COC(=O)c1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1F ZINC000587721475 GI Annotated Anodyne COC(=O)c1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1F ZINC000587721476 GI Annotated Anodyne COC(=O)c1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1F ZINC000587721477 GI Annotated Anodyne COC(=O)c1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1F ZINC000587721478 GI Annotated Anodyne COc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(F)c1F ZINC000587721622 GI Annotated Anodyne COc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(F)c1F ZINC000587721623 GI Annotated Anodyne COc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(F)c1F ZINC000587721624 GI Annotated Anodyne COc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(F)c1F ZINC000587721626 GI Annotated Anodyne COc1c(F)cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1F ZINC000587721642 GI Annotated Anodyne COc1c(F)cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1F ZINC000587721645 GI Annotated Anodyne COc1c(F)cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1F ZINC000587721646 GI Annotated Anodyne COc1c(F)cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1F ZINC000587721650 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2c(N)cc(F)cc2F)N1 ZINC000587721652 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2c(N)cc(F)cc2F)N1 ZINC000587721656 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2c(N)cc(F)cc2F)N1 ZINC000587721657 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2c(N)cc(F)cc2F)N1 ZINC000587721658 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc(F)c(O)c(F)c2)N1 ZINC000587721754 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc(F)c(O)c(F)c2)N1 ZINC000587721756 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc([N+](=O)[O-])ccc2F)N1 ZINC000587721914 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc([N+](=O)[O-])ccc2F)N1 ZINC000587721915 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc([N+](=O)[O-])ccc2F)N1 ZINC000587721916 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc([N+](=O)[O-])ccc2F)N1 ZINC000587721917 GI Annotated Bother COC(=O)c1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1F ZINC000587721966 GI Annotated Anodyne COC(=O)c1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1F ZINC000587721967 GI Annotated Anodyne COC(=O)c1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1F ZINC000587721968 GI Annotated Anodyne COC(=O)c1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1F ZINC000587721969 GI Annotated Anodyne COc1ccc(F)c(F)c1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587721970 GI Annotated Anodyne COc1ccc(F)c(F)c1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587721971 GI Annotated Anodyne COc1ccc(F)c(F)c1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587721972 GI Annotated Anodyne COc1ccc(F)c(F)c1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587721973 GI Annotated Anodyne COc1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(F)cc1F ZINC000587721978 GI Annotated Anodyne COc1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(F)cc1F ZINC000587721979 GI Annotated Anodyne COc1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(F)cc1F ZINC000587721980 GI Annotated Anodyne COc1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(F)cc1F ZINC000587721981 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCC[C@@H]2C(=O)C(F)F)N1 ZINC000587722046 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCC[C@@H]2C(=O)C(F)F)N1 ZINC000587722047 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCC[C@H]2C(=O)C(F)F)N1 ZINC000587722048 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCC[C@H]2C(=O)C(F)F)N1 ZINC000587722049 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc(F)c(O)c(F)c2)N1 ZINC000587722091 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc(F)c(O)c(F)c2)N1 ZINC000587722092 GI Annotated Anodyne COc1c(F)cc(F)cc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587722132 GI Annotated Anodyne COc1c(F)cc(F)cc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587722133 GI Annotated Anodyne COc1c(F)cc(F)cc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587722134 GI Annotated Anodyne COc1c(F)cc(F)cc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587722135 GI Annotated Anodyne COc1cc(F)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1F ZINC000587722398 GI Annotated Anodyne COc1cc(F)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1F ZINC000587722399 GI Annotated Anodyne COc1cc(F)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1F ZINC000587722400 GI Annotated Anodyne COc1cc(F)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1F ZINC000587722401 GI Annotated Anodyne COc1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc(F)c1O ZINC000587722572 GI Annotated Anodyne COc1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc(F)c1O ZINC000587722573 GI Annotated Anodyne COc1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc(F)c1O ZINC000587722574 GI Annotated Anodyne COc1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc(F)c1O ZINC000587722575 GI Annotated Anodyne COc1cc(F)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(F)c1 ZINC000587722580 GI Annotated Anodyne COc1cc(F)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(F)c1 ZINC000587722581 GI Annotated Anodyne COc1cc(F)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(F)c1 ZINC000587722582 GI Annotated Anodyne COc1cc(F)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(F)c1 ZINC000587722583 GI Annotated Anodyne COc1cc(F)c(F)cc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587722720 GI Annotated Anodyne COc1cc(F)c(F)cc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587722722 GI Annotated Anodyne COc1cc(F)c(F)cc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587722724 GI Annotated Anodyne COc1cc(F)c(F)cc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587722726 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc(F)cc(F)c2O)N1 ZINC000587722900 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc(F)cc(F)c2O)N1 ZINC000587722901 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc(F)cc(F)c2O)N1 ZINC000587722902 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc(F)cc(F)c2O)N1 ZINC000587722903 GI Annotated Clean COc1c(F)cc(F)cc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587722952 GI Annotated Anodyne COc1c(F)cc(F)cc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587722953 GI Annotated Anodyne COc1c(F)cc(F)cc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587722954 GI Annotated Anodyne COc1c(F)cc(F)cc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587722955 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CC(=O)C(F)F)(C2(C)CC2)N1 ZINC000587723000 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC(=O)C(F)F)(C2(C)CC2)N1 ZINC000587723001 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC(=O)C(F)F)(C2(C)CC2)N1 ZINC000587723002 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CC(=O)C(F)F)(C2(C)CC2)N1 ZINC000587723003 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CC(=O)C2(C)CC2)(C(F)F)N1 ZINC000587723012 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC(=O)C2(C)CC2)(C(F)F)N1 ZINC000587723013 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC(=O)C2(C)CC2)(C(F)F)N1 ZINC000587723014 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CC(=O)C2(C)CC2)(C(F)F)N1 ZINC000587723015 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc(C(F)(F)F)nc2)N1 ZINC000587723032 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc(C(F)(F)F)nc2)N1 ZINC000587723033 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc(C(F)(F)F)nc2)N1 ZINC000587723034 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc(C(F)(F)F)nc2)N1 ZINC000587723035 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CC(=O)C2(C)CC2)(C(F)F)N1 ZINC000587723076 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC(=O)C2(C)CC2)(C(F)F)N1 ZINC000587723077 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC(=O)C2(C)CC2)(C(F)F)N1 ZINC000587723078 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CC(=O)C2(C)CC2)(C(F)F)N1 ZINC000587723079 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(F)ccc(C#N)c2F)N1 ZINC000587723172 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(F)ccc(C#N)c2F)N1 ZINC000587723173 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(F)ccc(C#N)c2F)N1 ZINC000587723174 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(F)ccc(C#N)c2F)N1 ZINC000587723175 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(F)cccc2[N+](=O)[O-])N1 ZINC000587723292 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(F)cccc2[N+](=O)[O-])N1 ZINC000587723293 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(F)cccc2[N+](=O)[O-])N1 ZINC000587723294 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(F)cccc2[N+](=O)[O-])N1 ZINC000587723295 GI Annotated Bother COc1cc(F)cc(F)c1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587723324 GI Annotated Anodyne COc1cc(F)cc(F)c1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587723325 GI Annotated Anodyne COc1cc(F)cc(F)c1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587723326 GI Annotated Anodyne COc1cc(F)cc(F)c1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587723327 GI Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1F ZINC000587723502 GI Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1F ZINC000587723503 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1F ZINC000587723504 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1F ZINC000587723505 GI Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(F)c1 ZINC000587723518 GI Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(F)c1 ZINC000587723519 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(F)c1 ZINC000587723520 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(F)c1 ZINC000587723521 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc(F)c(O)c(F)c2)N1 ZINC000587723648 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc(F)c(O)c(F)c2)N1 ZINC000587723649 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc(F)c(O)c(F)c2)N1 ZINC000587723650 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc(F)c(O)c(F)c2)N1 ZINC000587723651 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc(F)c(N)c(F)c2)N1 ZINC000587723907 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc(F)c(N)c(F)c2)N1 ZINC000587723910 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc(F)c(N)c(F)c2)N1 ZINC000587723912 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc(F)c(N)c(F)c2)N1 ZINC000587723914 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc([N+](=O)[O-])c(F)c2)N1 ZINC000587724160 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc([N+](=O)[O-])c(F)c2)N1 ZINC000587724161 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc([N+](=O)[O-])c(F)c2)N1 ZINC000587724162 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc([N+](=O)[O-])c(F)c2)N1 ZINC000587724163 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(C#N)cc2F)N1 ZINC000587724172 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(C#N)cc2F)N1 ZINC000587724173 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(C#N)cc2F)N1 ZINC000587724174 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(C#N)cc2F)N1 ZINC000587724175 GI Annotated Mild COC(=O)c1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(F)c1 ZINC000587724560 GI Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(F)c1 ZINC000587724561 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(F)c1 ZINC000587724562 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(F)c1 ZINC000587724563 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(C(=O)O)cc2F)N1 ZINC000587724660 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(C(=O)O)cc2F)N1 ZINC000587724661 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(C(=O)O)cc2F)N1 ZINC000587724662 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(C(=O)O)cc2F)N1 ZINC000587724663 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(C(=O)O)cc2F)N1 ZINC000587724688 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(C(=O)O)cc2F)N1 ZINC000587724689 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(C(=O)O)cc2F)N1 ZINC000587724690 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(C(=O)O)cc2F)N1 ZINC000587724691 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(N(C)C)c(F)c2)N1 ZINC000587724704 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(N(C)C)c(F)c2)N1 ZINC000587724705 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(N(C)C)c(F)c2)N1 ZINC000587724706 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(N(C)C)c(F)c2)N1 ZINC000587724707 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc([N+](=O)[O-])c2F)N1 ZINC000587724998 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc([N+](=O)[O-])c2F)N1 ZINC000587725000 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc([N+](=O)[O-])c2F)N1 ZINC000587725001 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc([N+](=O)[O-])c2F)N1 ZINC000587725002 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587725032 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587725033 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587725034 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587725035 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(C(=O)O)c(F)c2)N1 ZINC000587725088 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(C(=O)O)c(F)c2)N1 ZINC000587725089 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(C(=O)O)c(F)c2)N1 ZINC000587725090 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(C(=O)O)c(F)c2)N1 ZINC000587725091 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(C#N)c(F)c2)N1 ZINC000587725252 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(C#N)c(F)c2)N1 ZINC000587725253 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(C#N)c(F)c2)N1 ZINC000587725254 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(C#N)c(F)c2)N1 ZINC000587725255 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc([N+](=O)[O-])cc2F)N1 ZINC000587725272 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc([N+](=O)[O-])cc2F)N1 ZINC000587725273 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc([N+](=O)[O-])cc2F)N1 ZINC000587725274 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc([N+](=O)[O-])cc2F)N1 ZINC000587725275 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](C(=O)c2ccc(F)c(F)c2)N1 ZINC000587725288 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](C(=O)c2ccc(F)c(F)c2)N1 ZINC000587725289 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](C(=O)c2ccc(F)c(F)c2)N1 ZINC000587725290 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](C(=O)c2ccc(F)c(F)c2)N1 ZINC000587725291 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc([N+](=O)[O-])c(F)c2)N1 ZINC000587725516 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc([N+](=O)[O-])c(F)c2)N1 ZINC000587725517 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc([N+](=O)[O-])c(F)c2)N1 ZINC000587725518 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc([N+](=O)[O-])c(F)c2)N1 ZINC000587725519 GI Annotated Bother COC(=O)c1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1F ZINC000587725520 GI Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1F ZINC000587725521 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1F ZINC000587725522 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1F ZINC000587725523 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(C#N)cc2F)N1 ZINC000587725696 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(C#N)cc2F)N1 ZINC000587725697 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(C#N)cc2F)N1 ZINC000587725698 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(C#N)cc2F)N1 ZINC000587725699 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(C#N)c(F)c2)N1 ZINC000587725755 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(C#N)c(F)c2)N1 ZINC000587725757 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(C#N)c(F)c2)N1 ZINC000587725759 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(C#N)c(F)c2)N1 ZINC000587725761 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(C(=O)O)c(F)c2)N1 ZINC000587725944 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(C(=O)O)c(F)c2)N1 ZINC000587725945 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(C(=O)O)c(F)c2)N1 ZINC000587725946 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(C(=O)O)c(F)c2)N1 ZINC000587725947 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587726012 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587726013 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587726014 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587726015 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](C(=O)c2ccc(F)c(F)c2)N1 ZINC000587726065 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](C(=O)c2ccc(F)c(F)c2)N1 ZINC000587726066 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](C(=O)c2ccc(F)c(F)c2)N1 ZINC000587726067 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](C(=O)c2ccc(F)c(F)c2)N1 ZINC000587726068 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(N(C)C)c(F)c2)N1 ZINC000587726249 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(N(C)C)c(F)c2)N1 ZINC000587726250 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(N(C)C)c(F)c2)N1 ZINC000587726252 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(N(C)C)c(F)c2)N1 ZINC000587726253 GI Annotated Clean CC(=O)C[C@]1(c2ccccc2F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587726288 GI Annotated Anodyne CC(=O)C[C@]1(c2ccccc2F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587726289 GI Annotated Anodyne CC(=O)C[C@@]1(c2ccccc2F)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587726290 GI Annotated Anodyne CC(=O)C[C@@]1(c2ccccc2F)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587726291 GI Annotated Anodyne COc1cc(F)cc(OC)c1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587726498 GI Annotated Anodyne COc1cc(F)cc(OC)c1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587726499 GI Annotated Anodyne COc1cc(F)cc(OC)c1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587726500 GI Annotated Anodyne COc1cc(F)cc(OC)c1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587726501 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(C(=O)O)c(F)c2)N1 ZINC000587726721 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(C(=O)O)c(F)c2)N1 ZINC000587726723 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(C(=O)O)c(F)c2)N1 ZINC000587726724 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(C(=O)O)c(F)c2)N1 ZINC000587726726 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(C(=O)O)c(F)c2)N1 ZINC000587726777 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(C(=O)O)c(F)c2)N1 ZINC000587726778 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(C(=O)O)c(F)c2)N1 ZINC000587726779 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(C(=O)O)c(F)c2)N1 ZINC000587726780 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2[nH]c3nccc-3cc2F)N1 ZINC000587726828 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2[nH]c3nccc-3cc2F)N1 ZINC000587726829 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2[nH]c3nccc-3cc2F)N1 ZINC000587726830 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2[nH]c3nccc-3cc2F)N1 ZINC000587726831 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc([N+](=O)[O-])c2F)N1 ZINC000587726961 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc([N+](=O)[O-])c2F)N1 ZINC000587726962 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc([N+](=O)[O-])c2F)N1 ZINC000587726963 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc([N+](=O)[O-])c2F)N1 ZINC000587726964 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc([N+](=O)[O-])c2F)N1 ZINC000587727268 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc([N+](=O)[O-])c2F)N1 ZINC000587727269 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc([N+](=O)[O-])c2F)N1 ZINC000587727270 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc([N+](=O)[O-])c2F)N1 ZINC000587727271 GI Annotated Bother CC(=O)C[C@]1(c2ccccc2F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587727338 GI Annotated Anodyne CC(=O)C[C@]1(c2ccccc2F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587727339 GI Annotated Anodyne CC(=O)C[C@@]1(c2ccccc2F)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587727340 GI Annotated Anodyne CC(=O)C[C@@]1(c2ccccc2F)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587727341 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2nc3ccc(F)cc3[nH]2)N1 ZINC000587727342 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2nc3ccc(F)cc3[nH]2)N1 ZINC000587727343 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2nc3ccc(F)cc3[nH]2)N1 ZINC000587727344 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2nc3ccc(F)cc3[nH]2)N1 ZINC000587727345 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(F)c[nH]c3nccc2-3)N1 ZINC000587727378 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(F)c[nH]c3nccc2-3)N1 ZINC000587727379 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(F)c[nH]c3nccc2-3)N1 ZINC000587727380 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(F)c[nH]c3nccc2-3)N1 ZINC000587727381 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCOc3c(F)ccc(F)c32)N1 ZINC000587727386 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCOc3c(F)ccc(F)c32)N1 ZINC000587727387 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCOc3c(F)ccc(F)c32)N1 ZINC000587727388 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCOc3c(F)ccc(F)c32)N1 ZINC000587727389 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3cc(F)c(O)cc32)N1 ZINC000587727452 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3cc(F)c(O)cc32)N1 ZINC000587727454 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3cc(F)c(O)cc32)N1 ZINC000587727456 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3cc(F)c(O)cc32)N1 ZINC000587727459 GI Annotated Anodyne COc1cc2c(cc1F)[C@@]1(CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587727474 GI Annotated Anodyne COc1cc2c(cc1F)[C@]1(CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587727477 GI Annotated Anodyne COc1cc2c(cc1F)[C@@]1(CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587727480 GI Annotated Anodyne COc1cc2c(cc1F)[C@]1(CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587727482 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(C(=O)c2ccc(F)cc2)N1 ZINC000587727641 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(C(=O)c2ccc(F)cc2)N1 ZINC000587727643 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(C(=O)c2ccc(F)cc2)N1 ZINC000587727645 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(C(=O)c2ccc(F)cc2)N1 ZINC000587727647 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(F)cc([N+](=O)[O-])c2)N1 ZINC000587727658 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(F)cc([N+](=O)[O-])c2)N1 ZINC000587727662 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(F)cc([N+](=O)[O-])c2)N1 ZINC000587727665 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(F)cc([N+](=O)[O-])c2)N1 ZINC000587727668 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc3c(cnn3C)cc2F)N1 ZINC000587727774 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc3c(cnn3C)cc2F)N1 ZINC000587727775 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc3c(cnn3C)cc2F)N1 ZINC000587727776 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc3c(cnn3C)cc2F)N1 ZINC000587727777 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCOc3ccc(F)cc32)N1 ZINC000587727778 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCOc3ccc(F)cc32)N1 ZINC000587727782 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCOc3ccc(F)cc32)N1 ZINC000587727783 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCOc3ccc(F)cc32)N1 ZINC000587727784 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587727908 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587727911 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587727912 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587727915 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(F)cc(C(=O)O)c2)N1 ZINC000587728008 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(F)cc(C(=O)O)c2)N1 ZINC000587728010 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(F)cc(C(=O)O)c2)N1 ZINC000587728011 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(F)cc(C(=O)O)c2)N1 ZINC000587728013 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCN(c3ccc(F)cc3)C2)N1 ZINC000587728173 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCN(c3ccc(F)cc3)C2)N1 ZINC000587728189 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCN(c3ccc(F)cc3)C2)N1 ZINC000587728192 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCN(c3ccc(F)cc3)C2)N1 ZINC000587728194 GI Annotated Anodyne COc1cc(F)cc(OC)c1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587728203 GI Annotated Anodyne COc1cc(F)cc(OC)c1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587728207 GI Annotated Anodyne COc1cc(F)cc(OC)c1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587728210 GI Annotated Anodyne COc1cc(F)cc(OC)c1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587728219 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(F)cc([N+](=O)[O-])c2)N1 ZINC000587728378 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(F)cc([N+](=O)[O-])c2)N1 ZINC000587728383 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(F)cc([N+](=O)[O-])c2)N1 ZINC000587728387 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(F)cc([N+](=O)[O-])c2)N1 ZINC000587728389 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(OCC#N)c2)N1 ZINC000587728473 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(OCC#N)c2)N1 ZINC000587728499 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(OCC#N)c2)N1 ZINC000587728502 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(OCC#N)c2)N1 ZINC000587728507 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC#N)(c2cccc(C#N)c2)N1 ZINC000587728511 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](CC#N)(c2cccc(C#N)c2)N1 ZINC000587728534 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC#N)(c2cccc(C#N)c2)N1 ZINC000587728538 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CC#N)(c2cccc(C#N)c2)N1 ZINC000587728542 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(OCC#N)cc2)N1 ZINC000587728726 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(OCC#N)cc2)N1 ZINC000587728727 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(OCC#N)cc2)N1 ZINC000587728728 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(OCC#N)cc2)N1 ZINC000587728729 GI Annotated Mild COc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1C#N ZINC000587728738 GI Annotated Mild COc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1C#N ZINC000587728739 GI Annotated Mild COc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1C#N ZINC000587728740 GI Annotated Mild COc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1C#N ZINC000587728741 GI Annotated Mild COc1ccc(C#N)cc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587728750 GI Annotated Mild COc1ccc(C#N)cc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587728751 GI Annotated Mild COc1ccc(C#N)cc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587728752 GI Annotated Mild COc1ccc(C#N)cc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587728753 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCCO)(c2ccc(F)cc2)N1 ZINC000587728809 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCCO)(c2ccc(F)cc2)N1 ZINC000587728814 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCCO)(c2ccc(F)cc2)N1 ZINC000587728818 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCCO)(c2ccc(F)cc2)N1 ZINC000587728820 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc([N+](=O)[O-])c2F)N1 ZINC000587728833 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc([N+](=O)[O-])c2F)N1 ZINC000587728834 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc([N+](=O)[O-])c2F)N1 ZINC000587728837 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc([N+](=O)[O-])c2F)N1 ZINC000587728840 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2[nH]c3nccc-3cc2F)N1 ZINC000587728856 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2[nH]c3nccc-3cc2F)N1 ZINC000587728858 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2[nH]c3nccc-3cc2F)N1 ZINC000587728861 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2[nH]c3nccc-3cc2F)N1 ZINC000587728864 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC#N)(c2ccccc2F)N1 ZINC000587729008 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CC#N)(c2ccccc2F)N1 ZINC000587729013 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](CC#N)(c2ccccc2F)N1 ZINC000587729015 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC#N)(c2ccccc2F)N1 ZINC000587729018 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC#N)(c2ccccc2F)N1 ZINC000587729085 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CC#N)(c2ccccc2F)N1 ZINC000587729087 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](CC#N)(c2ccccc2F)N1 ZINC000587729090 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC#N)(c2ccccc2F)N1 ZINC000587729093 GI Annotated Mild COc1cc2c(cc1F)CC[C@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587729145 GI Annotated Anodyne COc1cc2c(cc1F)CC[C@@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587729151 GI Annotated Anodyne COc1cc2c(cc1F)CC[C@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587729153 GI Annotated Anodyne COc1cc2c(cc1F)CC[C@@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587729155 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc3c(cnn3C)cc2F)N1 ZINC000587729290 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc3c(cnn3C)cc2F)N1 ZINC000587729291 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc3c(cnn3C)cc2F)N1 ZINC000587729292 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc3c(cnn3C)cc2F)N1 ZINC000587729293 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2c(F)c[nH]c3nccc2-3)N1 ZINC000587729306 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2c(F)c[nH]c3nccc2-3)N1 ZINC000587729307 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2c(F)c[nH]c3nccc2-3)N1 ZINC000587729308 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2c(F)c[nH]c3nccc2-3)N1 ZINC000587729309 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2nc3ccc(F)cc3[nH]2)N1 ZINC000587729336 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2nc3ccc(F)cc3[nH]2)N1 ZINC000587729337 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2nc3ccc(F)cc3[nH]2)N1 ZINC000587729338 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2nc3ccc(F)cc3[nH]2)N1 ZINC000587729339 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC#N)(c2cccc(C#N)c2)N1 ZINC000587729374 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](CC#N)(c2cccc(C#N)c2)N1 ZINC000587729375 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC#N)(c2cccc(C#N)c2)N1 ZINC000587729376 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CC#N)(c2cccc(C#N)c2)N1 ZINC000587729377 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCC3=C2C[C@H](CC#N)O3)N1 ZINC000587729390 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCC3=C2C[C@@H](CC#N)O3)N1 ZINC000587729399 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCC3=C2C[C@@H](CC#N)O3)N1 ZINC000587729402 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCC3=C2C[C@H](CC#N)O3)N1 ZINC000587729405 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(F)cc(C(=O)O)c2)N1 ZINC000587729427 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(F)cc(C(=O)O)c2)N1 ZINC000587729429 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(F)cc(C(=O)O)c2)N1 ZINC000587729431 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(F)cc(C(=O)O)c2)N1 ZINC000587729433 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2c(F)c[nH]c3nccc2-3)N1 ZINC000587729914 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2c(F)c[nH]c3nccc2-3)N1 ZINC000587729916 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2c(F)c[nH]c3nccc2-3)N1 ZINC000587729918 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2c(F)c[nH]c3nccc2-3)N1 ZINC000587729919 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2n[nH]c3ccc(F)cc23)N1 ZINC000587729932 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2n[nH]c3ccc(F)cc23)N1 ZINC000587729933 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2n[nH]c3ccc(F)cc23)N1 ZINC000587729934 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2n[nH]c3ccc(F)cc23)N1 ZINC000587729935 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC[C@@H]3O[C@H](CC#N)C[C@H]32)N1 ZINC000587729988 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC[C@@H]3O[C@H](CC#N)C[C@@H]32)N1 ZINC000587729989 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC[C@@H]3O[C@@H](CC#N)C[C@H]32)N1 ZINC000587729990 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC[C@@H]3O[C@@H](CC#N)C[C@@H]32)N1 ZINC000587729991 GI Annotated Mild COc1cccc([C@]2(CC#N)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587730000 GI Annotated Mild COc1cccc([C@]2(CC#N)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587730001 GI Annotated Mild COc1cccc([C@@]2(CC#N)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587730002 GI Annotated Mild COc1cccc([C@@]2(CC#N)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587730003 GI Annotated Mild COc1ccccc1[C@]1(CC#N)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587730604 GI Annotated Mild COc1ccccc1[C@]1(CC#N)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587730605 GI Annotated Mild COc1ccccc1[C@@]1(CC#N)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587730606 GI Annotated Mild COc1ccccc1[C@@]1(CC#N)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587730607 GI Annotated Mild CCOc1ccc([C@]2(C#N)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587730632 GI Annotated Mild CCOc1ccc([C@]2(C#N)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587730633 GI Annotated Mild CCOc1ccc([C@@]2(C#N)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587730634 GI Annotated Mild CCOc1ccc([C@@]2(C#N)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587730635 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(C(=O)c2ccc(F)cc2)N1 ZINC000587730770 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(C(=O)c2ccc(F)cc2)N1 ZINC000587730771 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(C(=O)c2ccc(F)cc2)N1 ZINC000587730773 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(C(=O)c2ccc(F)cc2)N1 ZINC000587730775 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCOc3cc(F)ccc32)N1 ZINC000587731127 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCOc3cc(F)ccc32)N1 ZINC000587731128 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCOc3cc(F)ccc32)N1 ZINC000587731129 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCOc3cc(F)ccc32)N1 ZINC000587731130 GI Annotated Anodyne Cc1cc([C@]2(CC#N)N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)o1 ZINC000587731241 GI Annotated Mild Cc1cc([C@@]2(CC#N)N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)o1 ZINC000587731247 GI Annotated Mild Cc1cc([C@@]2(CC#N)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)o1 ZINC000587731249 GI Annotated Mild Cc1cc([C@]2(CC#N)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)o1 ZINC000587731251 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587731288 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587731289 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587731290 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587731291 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587731377 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587731378 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587731380 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(F)cc2[N+](=O)[O-])N1 ZINC000587731382 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC#N)(c2cccc(F)c2)N1 ZINC000587731407 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CC#N)(c2cccc(F)c2)N1 ZINC000587731408 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](CC#N)(c2cccc(F)c2)N1 ZINC000587731409 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC#N)(c2cccc(F)c2)N1 ZINC000587731410 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H]([C@@H](C=O)c2ccc(F)cc2)N1 ZINC000587731512 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@H]([C@H](C=O)c2ccc(F)cc2)N1 ZINC000587731514 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H]([C@H](C=O)c2ccc(F)cc2)N1 ZINC000587731516 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@H]([C@@H](C=O)c2ccc(F)cc2)N1 ZINC000587731518 GI Annotated Mild COc1ccc(C#N)cc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587731546 GI Annotated Mild COc1ccc(C#N)cc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587731547 GI Annotated Mild COc1ccc(C#N)cc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587731548 GI Annotated Mild COc1ccc(C#N)cc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587731549 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](COc2ccc(C#N)cc2)N1 ZINC000587731655 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](COc2ccc(C#N)cc2)N1 ZINC000587731657 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](COc2ccc(C#N)cc2)N1 ZINC000587731659 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@H](COc2ccc(C#N)cc2)N1 ZINC000587731661 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2nc3ccc(F)cc3[nH]2)N1 ZINC000587731844 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2nc3ccc(F)cc3[nH]2)N1 ZINC000587731845 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2nc3ccc(F)cc3[nH]2)N1 ZINC000587731846 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2nc3ccc(F)cc3[nH]2)N1 ZINC000587731847 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C=COc3ccc(F)cc32)N1 ZINC000587731848 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=COc3ccc(F)cc32)N1 ZINC000587731849 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=COc3ccc(F)cc32)N1 ZINC000587731850 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C=COc3ccc(F)cc32)N1 ZINC000587731851 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3cc(F)c(O)cc32)N1 ZINC000587731895 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3cc(F)c(O)cc32)N1 ZINC000587731896 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3cc(F)c(O)cc32)N1 ZINC000587731897 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3cc(F)c(O)cc32)N1 ZINC000587731899 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccccc2OCC#N)N1 ZINC000587732082 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccccc2OCC#N)N1 ZINC000587732083 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccccc2OCC#N)N1 ZINC000587732084 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccccc2OCC#N)N1 ZINC000587732085 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(OCC#N)cc2)N1 ZINC000587732349 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(OCC#N)cc2)N1 ZINC000587732350 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(OCC#N)cc2)N1 ZINC000587732351 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(OCC#N)cc2)N1 ZINC000587732353 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587732366 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587732370 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587732373 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587732376 GI Annotated Bother COc1cc(C#N)ccc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587732408 GI Annotated Mild COc1cc(C#N)ccc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587732411 GI Annotated Mild COc1cc(C#N)ccc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587732413 GI Annotated Mild COc1cc(C#N)ccc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587732415 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(OCC#N)cc2)N1 ZINC000587732460 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(OCC#N)cc2)N1 ZINC000587732462 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(OCC#N)cc2)N1 ZINC000587732465 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(OCC#N)cc2)N1 ZINC000587732468 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(F)c[nH]c3nccc2-3)N1 ZINC000587732512 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(F)c[nH]c3nccc2-3)N1 ZINC000587732515 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(F)c[nH]c3nccc2-3)N1 ZINC000587732518 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(F)c[nH]c3nccc2-3)N1 ZINC000587732520 GI Annotated Anodyne COc1ccc([C@]2(CC#N)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587732690 GI Annotated Mild COc1ccc([C@]2(CC#N)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587732691 GI Annotated Mild COc1ccc([C@@]2(CC#N)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587732692 GI Annotated Mild COc1ccc([C@@]2(CC#N)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587732693 GI Annotated Mild CC(=O)[C@@]1(c2ccc(F)cc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587732938 GI Annotated Anodyne CC(=O)[C@]1(c2ccc(F)cc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587732939 GI Annotated Anodyne CC(=O)[C@]1(c2ccc(F)cc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587732940 GI Annotated Anodyne CC(=O)[C@@]1(c2ccc(F)cc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587732941 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCCO)(c2ccc(F)cc2)N1 ZINC000587733003 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCCO)(c2ccc(F)cc2)N1 ZINC000587733004 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCCO)(c2ccc(F)cc2)N1 ZINC000587733006 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCCO)(c2ccc(F)cc2)N1 ZINC000587733007 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCN(c3ccc(F)cc3)C2)N1 ZINC000587733009 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCN(c3ccc(F)cc3)C2)N1 ZINC000587733010 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCN(c3ccc(F)cc3)C2)N1 ZINC000587733011 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCN(c3ccc(F)cc3)C2)N1 ZINC000587733012 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2cncc(F)c2)(C2CC2)N1 ZINC000587733035 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2cncc(F)c2)(C2CC2)N1 ZINC000587733087 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2cncc(F)c2)(C2CC2)N1 ZINC000587733088 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2cncc(F)c2)(C2CC2)N1 ZINC000587733089 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H]([C@@H](C=O)c2ccc(F)cc2)N1 ZINC000587733369 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H]([C@H](C=O)c2ccc(F)cc2)N1 ZINC000587733372 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@H]([C@@H](C=O)c2ccc(F)cc2)N1 ZINC000587733373 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@H]([C@H](C=O)c2ccc(F)cc2)N1 ZINC000587733375 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC#N)(c2ccc(F)cc2)N1 ZINC000587733386 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CC#N)(c2ccc(F)cc2)N1 ZINC000587733389 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](CC#N)(c2ccc(F)cc2)N1 ZINC000587733390 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC#N)(c2ccc(F)cc2)N1 ZINC000587733393 GI Annotated Mild CC(=O)[C@@]1(c2ccc(F)cc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587733416 GI Annotated Anodyne CC(=O)[C@]1(c2ccc(F)cc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587733418 GI Annotated Anodyne CC(=O)[C@]1(c2ccc(F)cc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587733419 GI Annotated Anodyne CC(=O)[C@@]1(c2ccc(F)cc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587733421 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCC3=C2C[C@H](CC#N)O3)N1 ZINC000587733590 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCC3=C2C[C@@H](CC#N)O3)N1 ZINC000587733591 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCC3=C2C[C@@H](CC#N)O3)N1 ZINC000587733592 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCC3=C2C[C@H](CC#N)O3)N1 ZINC000587733593 GI Annotated Mild COc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1C#N ZINC000587733627 GI Annotated Mild COc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1C#N ZINC000587733629 GI Annotated Mild COc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1C#N ZINC000587733631 GI Annotated Mild COc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1C#N ZINC000587733633 GI Annotated Mild CC(=O)C[C@]1(c2ccc(F)cc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587733670 GI Annotated Anodyne CC(=O)C[C@]1(c2ccc(F)cc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587733671 GI Annotated Anodyne CC(=O)C[C@@]1(c2ccc(F)cc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587733673 GI Annotated Anodyne CC(=O)C[C@@]1(c2ccc(F)cc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587733675 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=COc3cc(F)ccc32)N1 ZINC000587733739 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C=COc3cc(F)ccc32)N1 ZINC000587733743 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C=COc3cc(F)ccc32)N1 ZINC000587733746 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=COc3cc(F)ccc32)N1 ZINC000587733750 GI Annotated Anodyne COc1cc2c(cc1F)CC[C@@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587733835 GI Annotated Anodyne COc1cc2c(cc1F)CC[C@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587733839 GI Annotated Anodyne COc1cc2c(cc1F)CC[C@@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587733845 GI Annotated Anodyne COc1cc2c(cc1F)CC[C@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587733852 GI Annotated Anodyne Cc1cc([C@]2(CC#N)N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)o1 ZINC000587733977 GI Annotated Mild Cc1cc([C@@]2(CC#N)N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)o1 ZINC000587733980 GI Annotated Mild Cc1cc([C@@]2(CC#N)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)o1 ZINC000587733984 GI Annotated Mild Cc1cc([C@]2(CC#N)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)o1 ZINC000587733987 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCOc3cc(F)ccc32)N1 ZINC000587734027 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCOc3cc(F)ccc32)N1 ZINC000587734029 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCOc3cc(F)ccc32)N1 ZINC000587734031 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCOc3cc(F)ccc32)N1 ZINC000587734032 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(F)cc3c2OCOC3)N1 ZINC000587734044 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(F)cc3c2OCOC3)N1 ZINC000587734054 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(F)cc3c2OCOC3)N1 ZINC000587734056 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(F)cc3c2OCOC3)N1 ZINC000587734058 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC#N)(c2ccc(F)cc2)N1 ZINC000587734172 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CC#N)(c2ccc(F)cc2)N1 ZINC000587734174 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](CC#N)(c2ccc(F)cc2)N1 ZINC000587734176 GI Annotated Mild COc1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1C#N ZINC000587734177 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC#N)(c2ccc(F)cc2)N1 ZINC000587734178 GI Annotated Mild COc1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1C#N ZINC000587734179 GI Annotated Mild COc1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1C#N ZINC000587734181 GI Annotated Mild COc1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1C#N ZINC000587734183 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccccc2OCC#N)N1 ZINC000587734308 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccccc2OCC#N)N1 ZINC000587734309 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c[nH]c3ncc(F)cc23)N1 ZINC000587734375 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c[nH]c3ncc(F)cc23)N1 ZINC000587734376 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c[nH]c3ncc(F)cc23)N1 ZINC000587734377 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c[nH]c3ncc(F)cc23)N1 ZINC000587734378 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2cncc(F)c2)(C2CC2)N1 ZINC000587734422 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2cncc(F)c2)(C2CC2)N1 ZINC000587734426 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2cncc(F)c2)(C2CC2)N1 ZINC000587734429 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2cncc(F)c2)(C2CC2)N1 ZINC000587734432 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccccc2OCC#N)N1 ZINC000587734610 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccccc2OCC#N)N1 ZINC000587734611 GI Annotated Mild CCOc1ccc([C@]2(C#N)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587734632 GI Annotated Mild CCOc1ccc([C@]2(C#N)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587734633 GI Annotated Mild CCOc1ccc([C@@]2(C#N)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587734634 GI Annotated Mild CCOc1ccc([C@@]2(C#N)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587734635 GI Annotated Mild COc1cc(C#N)ccc1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587734648 GI Annotated Mild COc1cc(C#N)ccc1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587734649 GI Annotated Mild COc1cc(C#N)ccc1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587734650 GI Annotated Mild COc1cc(C#N)ccc1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587734651 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587734702 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587734705 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587734708 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587734711 GI Annotated Bother COC(=O)c1cc(F)cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587734714 GI Annotated Anodyne COC(=O)c1cc(F)cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587734716 GI Annotated Anodyne COC(=O)c1cc(F)cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587734718 GI Annotated Anodyne COC(=O)c1cc(F)cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587734719 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(OCC#N)cc2)N1 ZINC000587734731 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(OCC#N)cc2)N1 ZINC000587734733 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(OCC#N)cc2)N1 ZINC000587734735 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(OCC#N)cc2)N1 ZINC000587734737 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(OCC#N)c2)N1 ZINC000587734747 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(OCC#N)c2)N1 ZINC000587734749 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(OCC#N)c2)N1 ZINC000587734751 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(OCC#N)c2)N1 ZINC000587734753 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=COc3ccc(F)cc32)N1 ZINC000587734913 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C=COc3ccc(F)cc32)N1 ZINC000587734914 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C=COc3ccc(F)cc32)N1 ZINC000587734915 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=COc3ccc(F)cc32)N1 ZINC000587734916 GI Annotated Anodyne COc1cc2c(cc1F)[C@@]1(CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587734917 GI Annotated Anodyne COc1cc2c(cc1F)[C@]1(CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587734918 GI Annotated Anodyne COc1cc2c(cc1F)[C@@]1(CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587734919 GI Annotated Anodyne COc1cc2c(cc1F)[C@]1(CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587734920 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccccc2OCC#N)N1 ZINC000587735066 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccccc2OCC#N)N1 ZINC000587735068 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccccc2OCC#N)N1 ZINC000587735070 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccccc2OCC#N)N1 ZINC000587735072 GI Annotated Mild COc1ccc([C@]2(CC#N)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587735258 GI Annotated Mild COc1ccc([C@]2(CC#N)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587735260 GI Annotated Mild COc1ccc([C@@]2(CC#N)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587735261 GI Annotated Mild COc1ccc([C@@]2(CC#N)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587735263 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCOc3c(F)ccc(F)c32)N1 ZINC000587735328 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCOc3c(F)ccc(F)c32)N1 ZINC000587735329 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCOc3c(F)ccc(F)c32)N1 ZINC000587735330 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCOc3c(F)ccc(F)c32)N1 ZINC000587735332 GI Annotated Anodyne COc1cc(C#N)ccc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587735376 GI Annotated Mild COc1cc(C#N)ccc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587735378 GI Annotated Mild COc1cc(C#N)ccc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587735380 GI Annotated Mild COc1cc(C#N)ccc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587735382 GI Annotated Mild COc1cc(C#N)ccc1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587735384 GI Annotated Mild COc1cc(C#N)ccc1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587735386 GI Annotated Mild COc1cc(C#N)ccc1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587735388 GI Annotated Mild COc1cc(C#N)ccc1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587735390 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c[nH]c3ncc(F)cc23)N1 ZINC000587735416 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c[nH]c3ncc(F)cc23)N1 ZINC000587735419 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c[nH]c3ncc(F)cc23)N1 ZINC000587735422 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c[nH]c3ncc(F)cc23)N1 ZINC000587735425 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCOc3ccc(F)cc32)N1 ZINC000587735498 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCOc3ccc(F)cc32)N1 ZINC000587735499 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587735547 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587735548 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587735549 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc(F)ccc2[N+](=O)[O-])N1 ZINC000587735550 GI Annotated Bother COc1ccccc1[C@]1(CC#N)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587735699 GI Annotated Mild COc1ccccc1[C@]1(CC#N)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587735700 GI Annotated Mild COc1ccccc1[C@@]1(CC#N)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587735701 GI Annotated Mild COc1ccccc1[C@@]1(CC#N)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587735702 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC[C@@H]3O[C@@H](CC#N)C[C@@H]32)N1 ZINC000587735725 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC[C@@H]3O[C@H](CC#N)C[C@@H]32)N1 ZINC000587735726 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC[C@@H]3O[C@H](CC#N)C[C@H]32)N1 ZINC000587735727 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC[C@@H]3O[C@@H](CC#N)C[C@H]32)N1 ZINC000587735728 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCOc3ccc(F)cc32)N1 ZINC000587735748 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCOc3ccc(F)cc32)N1 ZINC000587735749 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2n[nH]c3ccc(F)cc23)N1 ZINC000587735778 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2n[nH]c3ccc(F)cc23)N1 ZINC000587735779 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2n[nH]c3ccc(F)cc23)N1 ZINC000587735780 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2n[nH]c3ccc(F)cc23)N1 ZINC000587735781 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(F)cc3c2OCOC3)N1 ZINC000587735890 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(F)cc3c2OCOC3)N1 ZINC000587735892 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(F)cc3c2OCOC3)N1 ZINC000587735894 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(F)cc3c2OCOC3)N1 ZINC000587735898 GI Annotated Anodyne COc1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1C#N ZINC000587736015 GI Annotated Mild COc1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1C#N ZINC000587736016 GI Annotated Mild COc1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1C#N ZINC000587736018 GI Annotated Mild COc1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1C#N ZINC000587736019 GI Annotated Mild COc1cccc([C@]2(CC#N)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587736020 GI Annotated Mild COc1cccc([C@]2(CC#N)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587736021 GI Annotated Mild COc1cccc([C@@]2(CC#N)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587736022 GI Annotated Mild COc1cccc([C@@]2(CC#N)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587736023 GI Annotated Mild COc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C#N)c1 ZINC000587736059 GI Annotated Mild COc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C#N)c1 ZINC000587736062 GI Annotated Mild COc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C#N)c1 ZINC000587736063 GI Annotated Mild COc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C#N)c1 ZINC000587736065 GI Annotated Mild CC(=O)C[C@]1(c2ccc(F)cc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587736072 GI Annotated Anodyne CC(=O)C[C@]1(c2ccc(F)cc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587736074 GI Annotated Anodyne CC(=O)C[C@@]1(c2ccc(F)cc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587736077 GI Annotated Anodyne CC(=O)C[C@@]1(c2ccc(F)cc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587736079 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC#N)(c2cccc(F)c2)N1 ZINC000587736097 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CC#N)(c2cccc(F)c2)N1 ZINC000587736099 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](CC#N)(c2cccc(F)c2)N1 ZINC000587736101 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC#N)(c2cccc(F)c2)N1 ZINC000587736103 GI Annotated Mild COC(=O)c1cc(F)cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587736173 GI Annotated Anodyne COC(=O)c1cc(F)cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587736174 GI Annotated Anodyne COC(=O)c1cc(F)cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587736175 GI Annotated Anodyne COC(=O)c1cc(F)cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587736176 GI Annotated Anodyne COc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C#N)c1 ZINC000587736251 GI Annotated Mild COc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C#N)c1 ZINC000587736252 GI Annotated Mild COc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C#N)c1 ZINC000587736253 GI Annotated Mild COc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C#N)c1 ZINC000587736254 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccccc2OCC#N)N1 ZINC000587736283 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccccc2OCC#N)N1 ZINC000587736284 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccccc2OCC#N)N1 ZINC000587736285 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccccc2OCC#N)N1 ZINC000587736286 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2nc3ccc(F)cc3[nH]2)N1 ZINC000587736395 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2nc3ccc(F)cc3[nH]2)N1 ZINC000587736398 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2nc3ccc(F)cc3[nH]2)N1 ZINC000587736400 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2nc3ccc(F)cc3[nH]2)N1 ZINC000587736403 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCNc3ccc(F)cc32)N1 ZINC000587736524 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCNc3ccc(F)cc32)N1 ZINC000587736528 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCNc3ccc(F)cc32)N1 ZINC000587736531 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCNc3ccc(F)cc32)N1 ZINC000587736534 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCNc3ccc(F)cc32)N1 ZINC000587736654 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCNc3ccc(F)cc32)N1 ZINC000587736655 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCNc3ccc(F)cc32)N1 ZINC000587736656 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCNc3ccc(F)cc32)N1 ZINC000587736658 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=COc3cc(F)ccc32)N1 ZINC000587737151 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C=COc3cc(F)ccc32)N1 ZINC000587737154 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C=COc3cc(F)ccc32)N1 ZINC000587737157 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=COc3cc(F)ccc32)N1 ZINC000587737160 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCOc3c(F)cccc32)N1 ZINC000587737166 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCOc3c(F)cccc32)N1 ZINC000587737169 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCOc3c(F)cccc32)N1 ZINC000587737172 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCOc3c(F)cccc32)N1 ZINC000587737175 GI Annotated Anodyne COc1cc(F)c2c(c1)CC[C@@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587737464 GI Annotated Anodyne COc1cc(F)c2c(c1)CC[C@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587737467 GI Annotated Anodyne COc1cc(F)c2c(c1)CC[C@@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587737471 GI Annotated Anodyne COc1cc(F)c2c(c1)CC[C@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587737475 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCOc3cc(F)cc(F)c32)N1 ZINC000587737708 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCOc3cc(F)cc(F)c32)N1 ZINC000587737709 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCOc3cc(F)cc(F)c32)N1 ZINC000587737710 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCOc3cc(F)cc(F)c32)N1 ZINC000587737711 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCOc3c(F)cc(F)cc32)N1 ZINC000587737812 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCOc3c(F)cc(F)cc32)N1 ZINC000587737813 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCOc3c(F)cc(F)cc32)N1 ZINC000587737814 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCOc3c(F)cc(F)cc32)N1 ZINC000587737815 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCOc3c(F)cccc32)N1 ZINC000587737816 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCOc3c(F)cccc32)N1 ZINC000587737817 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCOc3c(F)cccc32)N1 ZINC000587737818 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCOc3c(F)cccc32)N1 ZINC000587737819 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c[nH]c3nc(F)ccc23)N1 ZINC000587737914 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c[nH]c3nc(F)ccc23)N1 ZINC000587737915 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c[nH]c3nc(F)ccc23)N1 ZINC000587737916 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c[nH]c3nc(F)ccc23)N1 ZINC000587737917 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCOc3c(F)cc(F)cc32)N1 ZINC000587738008 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCOc3c(F)cc(F)cc32)N1 ZINC000587738009 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCOc3c(F)cc(F)cc32)N1 ZINC000587738010 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCOc3c(F)cc(F)cc32)N1 ZINC000587738011 GI Annotated Anodyne COc1ccc2c(c1F)CC[C@@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587738142 GI Annotated Anodyne COc1ccc2c(c1F)CC[C@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587738143 GI Annotated Anodyne COc1ccc2c(c1F)CC[C@@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587738144 GI Annotated Anodyne COc1ccc2c(c1F)CC[C@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587738145 GI Annotated Anodyne COc1cc(F)c2c(c1)CC[C@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587738146 GI Annotated Anodyne COc1cc(F)c2c(c1)CC[C@@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587738147 GI Annotated Anodyne COc1cc(F)c2c(c1)CC[C@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587738148 GI Annotated Anodyne COc1cc(F)c2c(c1)CC[C@@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587738149 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCOc3cccc(F)c32)N1 ZINC000587738400 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCOc3cccc(F)c32)N1 ZINC000587738401 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCOc3cccc(F)c32)N1 ZINC000587738402 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCOc3cccc(F)c32)N1 ZINC000587738403 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c[nH]c3nc(F)ccc23)N1 ZINC000587738505 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c[nH]c3nc(F)ccc23)N1 ZINC000587738506 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c[nH]c3nc(F)ccc23)N1 ZINC000587738507 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c[nH]c3nc(F)ccc23)N1 ZINC000587738508 GI Annotated Anodyne CC(C)N(C)c1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587738525 GI Annotated Anodyne CC(C)N(C)c1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587738532 GI Annotated Anodyne CC(C)N(C)c1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587738535 GI Annotated Anodyne CC(C)N(C)c1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587738536 GI Annotated Anodyne COc1ccc2c(c1F)CC[C@@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738549 GI Annotated Anodyne COc1ccc2c(c1F)CC[C@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738550 GI Annotated Anodyne COc1ccc2c(c1F)CC[C@@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738551 GI Annotated Anodyne COc1ccc2c(c1F)CC[C@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587738554 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCOc3cc(F)cc(F)c32)N1 ZINC000587738556 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCOc3cc(F)cc(F)c32)N1 ZINC000587738558 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCOc3cc(F)cc(F)c32)N1 ZINC000587738606 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCOc3cc(F)cc(F)c32)N1 ZINC000587738607 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCNc3c(F)cccc32)N1 ZINC000587738715 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCNc3c(F)cccc32)N1 ZINC000587738718 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCNc3c(F)cccc32)N1 ZINC000587738721 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCNc3c(F)cccc32)N1 ZINC000587738722 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](/C=C/N(C)C)(c2ccccc2)N1 ZINC000587738780 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](/C=C/N(C)C)(c2ccccc2)N1 ZINC000587738781 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](/C=C/N(C)C)(c2ccccc2)N1 ZINC000587738782 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](/C=C/N(C)C)(c2ccccc2)N1 ZINC000587738783 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCNc3c(F)cccc32)N1 ZINC000587738812 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCNc3c(F)cccc32)N1 ZINC000587738813 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCNc3c(F)cccc32)N1 ZINC000587738814 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCNc3c(F)cccc32)N1 ZINC000587738815 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCOc3cccc(F)c32)N1 ZINC000587738913 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCOc3cccc(F)c32)N1 ZINC000587738914 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCOc3cccc(F)c32)N1 ZINC000587738915 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCOc3cccc(F)c32)N1 ZINC000587738916 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(C#N)=COc1ccccc12 ZINC000587738984 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(C#N)=COc1ccccc12 ZINC000587738985 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(C#N)=COc1ccccc12 ZINC000587738986 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(C#N)=COc1ccccc12 ZINC000587738987 GI Annotated Reactive CCN(C)c1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587739358 GI Annotated Anodyne CC(C)NC[C@]1(c2ccccc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587739363 GI Annotated Anodyne CC(C)NC[C@]1(c2ccccc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587739364 GI Annotated Anodyne CC(C)NC[C@@]1(c2ccccc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587739365 GI Annotated Anodyne CC(C)NC[C@@]1(c2ccccc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587739366 GI Annotated Anodyne CCN(C)c1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587739368 GI Annotated Anodyne CCN(C)c1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587739369 GI Annotated Anodyne CCN(C)c1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587739370 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C=COc3cc(C#N)ccc32)N1 ZINC000587739371 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C=COc3cc(C#N)ccc32)N1 ZINC000587739376 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=COc3cc(C#N)ccc32)N1 ZINC000587739377 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=COc3cc(C#N)ccc32)N1 ZINC000587739378 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](/C=C/N(C)C)(c2ccco2)N1 ZINC000587739446 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](/C=C/N(C)C)(c2ccco2)N1 ZINC000587739447 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](/C=C/N(C)C)(c2ccco2)N1 ZINC000587739448 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](/C=C/N(C)C)(c2ccco2)N1 ZINC000587739449 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)c1 ZINC000587739557 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)c1 ZINC000587739560 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)c1 ZINC000587739561 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)c1 ZINC000587739562 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(CC(NC(=O)OC(C)(C)C)C2)N1 ZINC000587739604 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(CC(NC(=O)OC(C)(C)C)C2)N1 ZINC000587739605 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C=COc3cc(C#N)ccc32)N1 ZINC000587740281 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C=COc3cc(C#N)ccc32)N1 ZINC000587740285 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=COc3cc(C#N)ccc32)N1 ZINC000587740289 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=COc3cc(C#N)ccc32)N1 ZINC000587740291 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(CN(C)C)cc2)N1 ZINC000587740316 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(CN(C)C)cc2)N1 ZINC000587740318 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(CN(C)C)cc2)N1 ZINC000587740321 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(CN(C)C)cc2)N1 ZINC000587740322 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(CN(C)C)c2)N1 ZINC000587740368 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(CN(C)C)c2)N1 ZINC000587740370 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(CN(C)C)c2)N1 ZINC000587740371 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(CN(C)C)c2)N1 ZINC000587740372 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587740686 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587740691 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587740692 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587740693 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](/C=C/N(C)C)(c2ccccc2)N1 ZINC000587740722 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](/C=C/N(C)C)(c2ccccc2)N1 ZINC000587740723 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](/C=C/N(C)C)(c2ccccc2)N1 ZINC000587740725 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](/C=C/N(C)C)(c2ccccc2)N1 ZINC000587740727 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](COc2ccc(C#N)cc2)N1 ZINC000587740853 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](COc2ccc(C#N)cc2)N1 ZINC000587740854 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@H](COc2ccc(C#N)cc2)N1 ZINC000587740855 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](COc2ccc(C#N)cc2)N1 ZINC000587740856 GI Annotated Mild Cc1ccc2c(c1)[C@@]1(N[C@@H](C)Cc3cc(Br)c(F)cc31)C(C#N)=CO2 ZINC000587740872 GI Annotated Reactive Cc1ccc2c(c1)[C@@]1(N[C@H](C)Cc3cc(Br)c(F)cc31)C(C#N)=CO2 ZINC000587740873 GI Annotated Reactive Cc1ccc2c(c1)[C@]1(N[C@H](C)Cc3cc(Br)c(F)cc31)C(C#N)=CO2 ZINC000587740874 GI Annotated Reactive Cc1ccc2c(c1)[C@]1(N[C@@H](C)Cc3cc(Br)c(F)cc31)C(C#N)=CO2 ZINC000587740875 GI Annotated Reactive CC(=O)Nc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587741183 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587741188 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587741189 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587741190 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587741365 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587741367 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587741369 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587741371 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(CN(C)C)c2)N1 ZINC000587741484 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(CN(C)C)c2)N1 ZINC000587741486 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(CN(C)C)c2)N1 ZINC000587741488 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(CN(C)C)c2)N1 ZINC000587741491 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](/C=C/N(C)C)(c2ccco2)N1 ZINC000587741641 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](/C=C/N(C)C)(c2ccco2)N1 ZINC000587741643 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](/C=C/N(C)C)(c2ccco2)N1 ZINC000587741646 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](/C=C/N(C)C)(c2ccco2)N1 ZINC000587741647 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](C2(NC(=O)OC(C)(C)C)CC2)N1 ZINC000587741674 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](C2(NC(=O)OC(C)(C)C)CC2)N1 ZINC000587741678 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](C2(NC(=O)OC(C)(C)C)CC2)N1 ZINC000587741681 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](C2(NC(=O)OC(C)(C)C)CC2)N1 ZINC000587741684 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(N=C=O)cc2)N1 ZINC000587741698 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(N=C=O)cc2)N1 ZINC000587741704 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(N=C=O)cc2)N1 ZINC000587741706 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(N=C=O)cc2)N1 ZINC000587741708 GI Annotated Reactive CC(=O)Nc1ccccc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587741753 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587741756 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587741759 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587741762 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(CN(C)C)cc2)N1 ZINC000587741800 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(CN(C)C)cc2)N1 ZINC000587741804 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(CN(C)C)cc2)N1 ZINC000587741806 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(CN(C)C)cc2)N1 ZINC000587741810 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC[C@H]2NC(=O)OC(C)(C)C)N1 ZINC000587741849 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC[C@@H]2NC(=O)OC(C)(C)C)N1 ZINC000587741851 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC[C@@H]2NC(=O)OC(C)(C)C)N1 ZINC000587741855 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC[C@H]2NC(=O)OC(C)(C)C)N1 ZINC000587741856 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(N=C=O)cc2)N1 ZINC000587742046 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(N=C=O)cc2)N1 ZINC000587742048 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(N=C=O)cc2)N1 ZINC000587742050 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(N=C=O)cc2)N1 ZINC000587742053 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC[C@@H]2NC(=O)OC(C)(C)C)N1 ZINC000587742073 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC[C@H]2NC(=O)OC(C)(C)C)N1 ZINC000587742075 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC[C@H]2NC(=O)OC(C)(C)C)N1 ZINC000587742077 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC[C@@H]2NC(=O)OC(C)(C)C)N1 ZINC000587742079 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)c1 ZINC000587742377 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)c1 ZINC000587742379 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)c1 ZINC000587742380 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)c1 ZINC000587742381 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)Nc2ccccc2)N1 ZINC000587742423 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)Nc2ccccc2)N1 ZINC000587742430 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)Nc2ccccc2)N1 ZINC000587742432 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)Nc2ccccc2)N1 ZINC000587742433 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](CN(C)C(=O)OC(C)(C)C)N1 ZINC000587742487 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](CN(C)C(=O)OC(C)(C)C)N1 ZINC000587742488 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](CN(C)C(=O)OC(C)(C)C)N1 ZINC000587742489 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](CN(C)C(=O)OC(C)(C)C)N1 ZINC000587742490 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc(N=C=O)c2)N1 ZINC000587742586 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc(N=C=O)c2)N1 ZINC000587742588 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc(N=C=O)c2)N1 ZINC000587742590 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc(N=C=O)c2)N1 ZINC000587742591 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)Nc2ccccc2)N1 ZINC000587742652 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)Nc2ccccc2)N1 ZINC000587742653 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)Nc2ccccc2)N1 ZINC000587742654 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)Nc2ccccc2)N1 ZINC000587742655 GI Annotated Anodyne CCN(C)c1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587742931 GI Annotated Anodyne CCN(C)c1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587742933 GI Annotated Anodyne CCN(C)c1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587742935 GI Annotated Anodyne CCN(C)c1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587742937 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)c1ccccc1C[C@@H]2N=O ZINC000587742944 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)c1ccccc1C[C@H]2N=O ZINC000587742945 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)c1ccccc1C[C@@H]2N=O ZINC000587742946 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)c1ccccc1C[C@H]2N=O ZINC000587742947 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(C#N)=COc1ccccc12 ZINC000587743095 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(C#N)=COc1ccccc12 ZINC000587743096 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(C#N)=COc1ccccc12 ZINC000587743097 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(C#N)=COc1ccccc12 ZINC000587743098 GI Annotated Reactive CC(C)N(C)c1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587743139 GI Annotated Anodyne CC(C)N(C)c1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587743140 GI Annotated Anodyne CC(C)N(C)c1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587743141 GI Annotated Anodyne CC(C)N(C)c1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587743142 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C2(CC(NC(=O)OC(C)(C)C)C2)N1 ZINC000587743322 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(CC(NC(=O)OC(C)(C)C)C2)N1 ZINC000587743324 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CC[N+](=O)[O-])(c2ccccc2)N1 ZINC000587743357 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC[N+](=O)[O-])(c2ccccc2)N1 ZINC000587743358 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@](CC[N+](=O)[O-])(c2ccccc2)N1 ZINC000587743359 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC[N+](=O)[O-])(c2ccccc2)N1 ZINC000587743360 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccccc2[N+](=O)[O-])N1 ZINC000587743407 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccccc2[N+](=O)[O-])N1 ZINC000587743416 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccccc2[N+](=O)[O-])N1 ZINC000587743418 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccccc2[N+](=O)[O-])N1 ZINC000587743421 GI Annotated Bother COc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c([N+](=O)[O-])c1 ZINC000587743541 GI Annotated Bother COc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c([N+](=O)[O-])c1 ZINC000587743544 GI Annotated Bother COc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c([N+](=O)[O-])c1 ZINC000587743547 GI Annotated Bother CNc1ccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1N ZINC000587743548 GI Annotated Anodyne COc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c([N+](=O)[O-])c1 ZINC000587743550 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)([C@@H](C)N(C)C)N1 ZINC000587743563 GI Annotated Anodyne CNc1ccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1N ZINC000587743564 GI Annotated Anodyne C[C@H](N(C)C)[C@@]1(c2ccccc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587743565 GI Annotated Anodyne CNc1ccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1N ZINC000587743566 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)([C@@H](C)N(C)C)N1 ZINC000587743567 GI Annotated Anodyne CNc1ccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1N ZINC000587743568 GI Annotated Anodyne C[C@H](N(C)C)[C@]1(c2ccccc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587743569 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc(N=C=O)c2)N1 ZINC000587743860 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc(N=C=O)c2)N1 ZINC000587743861 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc(N=C=O)c2)N1 ZINC000587743863 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc(N=C=O)c2)N1 ZINC000587743865 GI Annotated Reactive COc1cccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1[N+](=O)[O-] ZINC000587743898 GI Annotated Bother COc1cccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1[N+](=O)[O-] ZINC000587743900 GI Annotated Bother COc1cccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1[N+](=O)[O-] ZINC000587743901 GI Annotated Bother COc1cccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1[N+](=O)[O-] ZINC000587743902 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)c1ccccc1C[C@@H]2N=O ZINC000587744014 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)c1ccccc1C[C@H]2N=O ZINC000587744015 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)c1ccccc1C[C@H]2N=O ZINC000587744016 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)c1ccccc1C[C@@H]2N=O ZINC000587744017 GI Annotated Anodyne CC(=O)c1cc(N)cc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587744028 GI Annotated Anodyne CC(=O)c1cc(N)cc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587744029 GI Annotated Anodyne CC(=O)c1cc(N)cc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587744031 GI Annotated Anodyne CC(=O)c1cc(N)cc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587744033 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CC[N+](=O)[O-])(c2ccccc2)N1 ZINC000587744064 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC[N+](=O)[O-])(c2ccccc2)N1 ZINC000587744067 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@](CC[N+](=O)[O-])(c2ccccc2)N1 ZINC000587744069 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC[N+](=O)[O-])(c2ccccc2)N1 ZINC000587744071 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3cccc(N)c32)N1 ZINC000587744091 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3cccc(N)c32)N1 ZINC000587744101 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3cccc(N)c32)N1 ZINC000587744105 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3cccc(N)c32)N1 ZINC000587744108 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3cc(N)ccc32)N1 ZINC000587744223 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3cc(N)ccc32)N1 ZINC000587744225 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3cc(N)ccc32)N1 ZINC000587744229 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3cc(N)ccc32)N1 ZINC000587744232 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587744303 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587744306 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587744309 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587744312 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc([N+](=O)[O-])cc2)N1 ZINC000587744393 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc([N+](=O)[O-])cc2)N1 ZINC000587744394 GI Annotated Bother Cc1ccc2c(c1)[C@]1(N[C@@H](C)Cc3ccc(F)c(Br)c31)C(C#N)=CO2 ZINC000587744411 GI Annotated Reactive Cc1ccc2c(c1)[C@]1(N[C@H](C)Cc3ccc(F)c(Br)c31)C(C#N)=CO2 ZINC000587744412 GI Annotated Reactive Cc1ccc2c(c1)[C@@]1(N[C@H](C)Cc3ccc(F)c(Br)c31)C(C#N)=CO2 ZINC000587744413 GI Annotated Reactive Cc1ccc2c(c1)[C@@]1(N[C@@H](C)Cc3ccc(F)c(Br)c31)C(C#N)=CO2 ZINC000587744414 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](CN(C)C(=O)OC(C)(C)C)N1 ZINC000587744423 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](CN(C)C(=O)OC(C)(C)C)N1 ZINC000587744424 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](CN(C)C(=O)OC(C)(C)C)N1 ZINC000587744425 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](CN(C)C(=O)OC(C)(C)C)N1 ZINC000587744426 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)([C@@H](C)N(C)C)N1 ZINC000587744435 GI Annotated Anodyne C[C@H](N(C)C)[C@@]1(c2ccccc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587744436 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)([C@@H](C)N(C)C)N1 ZINC000587744437 GI Annotated Anodyne C[C@H](N(C)C)[C@]1(c2ccccc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587744438 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc([N+](=O)[O-])cc2)N1 ZINC000587744634 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc([N+](=O)[O-])cc2)N1 ZINC000587744637 GI Annotated Bother CC(=O)Nc1ccccc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587744645 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587744646 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587744647 GI Annotated Anodyne CC(=O)Nc1ccccc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587744649 GI Annotated Anodyne CC(=O)c1cc(N)cc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587744718 GI Annotated Anodyne CC(=O)c1cc(N)cc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587744720 GI Annotated Anodyne CC(=O)c1cc(N)cc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587744721 GI Annotated Anodyne CC(=O)c1cc(N)cc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587744723 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](C2(NC(=O)OC(C)(C)C)CC2)N1 ZINC000587744752 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](C2(NC(=O)OC(C)(C)C)CC2)N1 ZINC000587744754 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](C2(NC(=O)OC(C)(C)C)CC2)N1 ZINC000587744755 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](C2(NC(=O)OC(C)(C)C)CC2)N1 ZINC000587744757 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3cc(N)ccc32)N1 ZINC000587744991 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3cc(N)ccc32)N1 ZINC000587744992 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3cc(N)ccc32)N1 ZINC000587744993 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3cc(N)ccc32)N1 ZINC000587744994 GI Annotated Anodyne COc1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1[N+](=O)[O-] ZINC000587745151 GI Annotated Bother COc1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1[N+](=O)[O-] ZINC000587745152 GI Annotated Bother COc1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1[N+](=O)[O-] ZINC000587745154 GI Annotated Bother COc1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1[N+](=O)[O-] ZINC000587745156 GI Annotated Bother COc1ccc([N+](=O)[O-])c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587745498 GI Annotated Bother COc1ccc([N+](=O)[O-])c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587745499 GI Annotated Bother COc1ccc([N+](=O)[O-])c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587745501 GI Annotated Bother COc1ccc([N+](=O)[O-])c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587745502 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc([N+](=O)[O-])cc2)N1 ZINC000587745513 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc([N+](=O)[O-])cc2)N1 ZINC000587745517 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc([N+](=O)[O-])cc2)N1 ZINC000587745520 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc([N+](=O)[O-])cc2)N1 ZINC000587745523 GI Annotated Bother COc1ccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(N)c1C ZINC000587745546 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(N)c1C ZINC000587745550 GI Annotated Anodyne COc1ccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(N)c1C ZINC000587745553 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(N)c1C ZINC000587745556 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@@]3(N)CC[C@@]2(C)C3(C)C)N1 ZINC000587745685 GI Annotated Anodyne Cc1cccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1[N+](=O)[O-] ZINC000587745692 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@@]3(N)CC[C@@]2(C)C3(C)C)N1 ZINC000587745696 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@@]3(N)CC[C@@]2(C)C3(C)C)N1 ZINC000587745698 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@@]3(N)CC[C@@]2(C)C3(C)C)N1 ZINC000587745700 GI Annotated Anodyne Cc1cccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1[N+](=O)[O-] ZINC000587745703 GI Annotated Bother Cc1cccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1[N+](=O)[O-] ZINC000587745706 GI Annotated Bother Cc1cccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1[N+](=O)[O-] ZINC000587745708 GI Annotated Bother COc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c([N+](=O)[O-])c1 ZINC000587745732 GI Annotated Bother COc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c([N+](=O)[O-])c1 ZINC000587745735 GI Annotated Bother COc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c([N+](=O)[O-])c1 ZINC000587745737 GI Annotated Bother COc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c([N+](=O)[O-])c1 ZINC000587745740 GI Annotated Bother CNc1ccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1N ZINC000587745865 GI Annotated Anodyne CNc1ccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1N ZINC000587745868 GI Annotated Anodyne CNc1ccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1N ZINC000587745870 GI Annotated Anodyne CNc1ccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1N ZINC000587745873 GI Annotated Anodyne CC(=O)Nc1ccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587745883 GI Annotated Anodyne CC(=O)Nc1ccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587745885 GI Annotated Anodyne CC(=O)Nc1ccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587745887 GI Annotated Anodyne CC(=O)Nc1ccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587745890 GI Annotated Anodyne COc1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1[N+](=O)[O-] ZINC000587746046 GI Annotated Bother COc1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1[N+](=O)[O-] ZINC000587746047 GI Annotated Bother COc1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1[N+](=O)[O-] ZINC000587746048 GI Annotated Bother COc1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1[N+](=O)[O-] ZINC000587746049 GI Annotated Bother CC(=O)Nc1cccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587746215 GI Annotated Anodyne CC(=O)Nc1cccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587746216 GI Annotated Anodyne CC(=O)Nc1cccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587746217 GI Annotated Anodyne CC(=O)Nc1cccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587746218 GI Annotated Anodyne CC(=O)Nc1ccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587746249 GI Annotated Anodyne CC(=O)Nc1ccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587746250 GI Annotated Anodyne CC(=O)Nc1ccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587746251 GI Annotated Anodyne CC(=O)Nc1ccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587746252 GI Annotated Anodyne CC1=C[C@@]2(N[C@@H](C)Cc3cc(Br)c(F)cc32)c2ccc(N)cc2O1 ZINC000587746317 GI Annotated Anodyne CC1=C[C@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)c2ccc(N)cc2O1 ZINC000587746318 GI Annotated Anodyne CC1=C[C@@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)c2ccc(N)cc2O1 ZINC000587746319 GI Annotated Anodyne CC1=C[C@]2(N[C@@H](C)Cc3cc(Br)c(F)cc32)c2ccc(N)cc2O1 ZINC000587746320 GI Annotated Anodyne COc1ccc([N+](=O)[O-])c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587746337 GI Annotated Bother COc1ccc([N+](=O)[O-])c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587746339 GI Annotated Bother COc1ccc([N+](=O)[O-])c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587746341 GI Annotated Bother COc1ccc([N+](=O)[O-])c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587746343 GI Annotated Bother Cc1cc([N+](=O)[O-])ccc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587746388 GI Annotated Bother Cc1cc([N+](=O)[O-])ccc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587746390 GI Annotated Bother Cc1cc([N+](=O)[O-])ccc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587746392 GI Annotated Bother Cc1cc([N+](=O)[O-])ccc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587746393 GI Annotated Bother CC(=O)Nc1cccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587746450 GI Annotated Anodyne CC(=O)Nc1cccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587746452 GI Annotated Anodyne CC(=O)Nc1cccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587746454 GI Annotated Anodyne CC(=O)Nc1cccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587746456 GI Annotated Anodyne COc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1[N+](=O)[O-] ZINC000587746474 GI Annotated Bother COc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1[N+](=O)[O-] ZINC000587746476 GI Annotated Bother COc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1[N+](=O)[O-] ZINC000587746478 GI Annotated Bother COc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1[N+](=O)[O-] ZINC000587746480 GI Annotated Bother Cc1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1[N+](=O)[O-] ZINC000587746741 GI Annotated Bother Cc1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1[N+](=O)[O-] ZINC000587746743 GI Annotated Bother Cc1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1[N+](=O)[O-] ZINC000587746745 GI Annotated Bother Cc1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1[N+](=O)[O-] ZINC000587746747 GI Annotated Bother Cc1ccc([N+](=O)[O-])cc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587746766 GI Annotated Bother Cc1ccc([N+](=O)[O-])cc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587746768 GI Annotated Bother Cc1ccc([N+](=O)[O-])cc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587746770 GI Annotated Bother Cc1ccc([N+](=O)[O-])cc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587746771 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3ccc(N)cc32)N1 ZINC000587746795 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3ccc(N)cc32)N1 ZINC000587746798 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3ccc(N)cc32)N1 ZINC000587746801 GI Annotated Anodyne CNc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1[N+](=O)[O-] ZINC000587746802 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3ccc(N)cc32)N1 ZINC000587746803 GI Annotated Anodyne CC1=C[C@@]2(N[C@@H](C)Cc3ccc(F)c(Br)c32)c2ccc(N)cc2O1 ZINC000587746823 GI Annotated Anodyne CNc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1[N+](=O)[O-] ZINC000587746824 GI Annotated Bother CNc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1[N+](=O)[O-] ZINC000587746826 GI Annotated Bother CC1=C[C@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)c2ccc(N)cc2O1 ZINC000587746827 GI Annotated Anodyne CNc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1[N+](=O)[O-] ZINC000587746829 GI Annotated Bother CC1=C[C@@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)c2ccc(N)cc2O1 ZINC000587746831 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(/C=N/Nc2ccccc2)N1 ZINC000587746899 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(/C=N/Nc2ccccc2)N1 ZINC000587746900 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(/C=N/Nc2ccccc2)N1 ZINC000587746901 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(/C=N/Nc2ccccc2)N1 ZINC000587746902 GI Annotated Mild CCOc1ccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1N ZINC000587746919 GI Annotated Anodyne CCOc1ccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1N ZINC000587746920 GI Annotated Anodyne CCOc1ccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1N ZINC000587746921 GI Annotated Anodyne CCOc1ccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1N ZINC000587746922 GI Annotated Anodyne CC1=C[C@]2(N[C@@H](C)Cc3ccc(F)c(Br)c32)c2ccc(N)cc2O1 ZINC000587746988 GI Annotated Anodyne Cc1cccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1[N+](=O)[O-] ZINC000587747081 GI Annotated Bother Cc1cccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1[N+](=O)[O-] ZINC000587747083 GI Annotated Bother Cc1cccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1[N+](=O)[O-] ZINC000587747085 GI Annotated Bother Cc1cccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1[N+](=O)[O-] ZINC000587747087 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@@]3(N)CC[C@@]2(C)C3(C)C)N1 ZINC000587747309 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@@]3(N)CC[C@@]2(C)C3(C)C)N1 ZINC000587747312 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@@]3(N)CC[C@@]2(C)C3(C)C)N1 ZINC000587747314 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@@]3(N)CC[C@@]2(C)C3(C)C)N1 ZINC000587747317 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc([N+](=O)[O-])c2)N1 ZINC000587747392 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc([N+](=O)[O-])c2)N1 ZINC000587747394 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc([N+](=O)[O-])c2)N1 ZINC000587747395 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc([N+](=O)[O-])c2)N1 ZINC000587747397 GI Annotated Bother CNc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1[N+](=O)[O-] ZINC000587747413 GI Annotated Bother CNc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1[N+](=O)[O-] ZINC000587747416 GI Annotated Bother CNc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1[N+](=O)[O-] ZINC000587747418 GI Annotated Bother CNc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1[N+](=O)[O-] ZINC000587747420 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc([N+](=O)[O-])c2)N1 ZINC000587747421 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc([N+](=O)[O-])c2)N1 ZINC000587747422 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc([N+](=O)[O-])c2)N1 ZINC000587747423 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc([N+](=O)[O-])c2)N1 ZINC000587747424 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccccc2[N+](=O)[O-])N1 ZINC000587747590 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccccc2[N+](=O)[O-])N1 ZINC000587747591 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccccc2[N+](=O)[O-])N1 ZINC000587747592 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccccc2[N+](=O)[O-])N1 ZINC000587747593 GI Annotated Bother Cc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1[N+](=O)[O-] ZINC000587747704 GI Annotated Bother Cc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1[N+](=O)[O-] ZINC000587747706 GI Annotated Bother Cc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1[N+](=O)[O-] ZINC000587747707 GI Annotated Bother Cc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1[N+](=O)[O-] ZINC000587747709 GI Annotated Bother COc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1[N+](=O)[O-] ZINC000587747786 GI Annotated Bother COc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1[N+](=O)[O-] ZINC000587747787 GI Annotated Bother COc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1[N+](=O)[O-] ZINC000587747788 GI Annotated Bother COc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1[N+](=O)[O-] ZINC000587747789 GI Annotated Bother Cc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1[N+](=O)[O-] ZINC000587747794 GI Annotated Bother Cc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1[N+](=O)[O-] ZINC000587747795 GI Annotated Bother Cc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1[N+](=O)[O-] ZINC000587747796 GI Annotated Bother Cc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1[N+](=O)[O-] ZINC000587747797 GI Annotated Bother Cc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c([N+](=O)[O-])c1 ZINC000587747862 GI Annotated Bother Cc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c([N+](=O)[O-])c1 ZINC000587747864 GI Annotated Bother Cc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c([N+](=O)[O-])c1 ZINC000587747866 GI Annotated Bother Cc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c([N+](=O)[O-])c1 ZINC000587747868 GI Annotated Bother Cc1ccc([N+](=O)[O-])c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587748006 GI Annotated Bother Cc1ccc([N+](=O)[O-])c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587748007 GI Annotated Bother Cc1ccc([N+](=O)[O-])c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587748008 GI Annotated Bother Cc1ccc([N+](=O)[O-])c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587748009 GI Annotated Bother Cc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c([N+](=O)[O-])c1 ZINC000587748123 GI Annotated Bother Cc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c([N+](=O)[O-])c1 ZINC000587748125 GI Annotated Bother Cc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c([N+](=O)[O-])c1 ZINC000587748126 GI Annotated Bother Cc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c([N+](=O)[O-])c1 ZINC000587748128 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2oc3cccnc3c2N)N1 ZINC000587748154 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2oc3cccnc3c2N)N1 ZINC000587748155 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2oc3cccnc3c2N)N1 ZINC000587748156 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2oc3cccnc3c2N)N1 ZINC000587748157 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3cccc(N)c32)N1 ZINC000587748180 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3cccc(N)c32)N1 ZINC000587748181 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3cccc(N)c32)N1 ZINC000587748209 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3cccc(N)c32)N1 ZINC000587748212 GI Annotated Anodyne Cc1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)n1CC#N ZINC000587748658 GI Annotated Mild Cc1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)n1CC#N ZINC000587748659 GI Annotated Mild Cc1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)n1CC#N ZINC000587748660 GI Annotated Mild Cc1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)n1CC#N ZINC000587748661 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2oc3cccnc3c2N)N1 ZINC000587748682 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2oc3cccnc3c2N)N1 ZINC000587748683 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2oc3cccnc3c2N)N1 ZINC000587748684 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2oc3cccnc3c2N)N1 ZINC000587748685 GI Annotated Anodyne COc1cc([N+](=O)[O-])ccc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587748733 GI Annotated Bother COc1cc([N+](=O)[O-])ccc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587748735 GI Annotated Bother COc1cc([N+](=O)[O-])ccc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587748736 GI Annotated Bother COc1cc([N+](=O)[O-])ccc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587748737 GI Annotated Bother Cc1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)n1CC#N ZINC000587748956 GI Annotated Mild Cc1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)n1CC#N ZINC000587748957 GI Annotated Mild Cc1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)n1CC#N ZINC000587748958 GI Annotated Mild Cc1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)n1CC#N ZINC000587748959 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3ccc(N)cc32)N1 ZINC000587749014 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3ccc(N)cc32)N1 ZINC000587749015 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3ccc(N)cc32)N1 ZINC000587749016 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3ccc(N)cc32)N1 ZINC000587749017 GI Annotated Anodyne COc1cccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1[N+](=O)[O-] ZINC000587749059 GI Annotated Bother COc1cccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1[N+](=O)[O-] ZINC000587749061 GI Annotated Bother COc1cccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1[N+](=O)[O-] ZINC000587749062 GI Annotated Bother COc1cccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1[N+](=O)[O-] ZINC000587749063 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(Cc3cccc([N+](=O)[O-])c3C2)N1 ZINC000587749272 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(Cc3cccc([N+](=O)[O-])c3C2)N1 ZINC000587749273 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(Cc3cccc([N+](=O)[O-])c3C2)N1 ZINC000587749274 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(Cc3cccc([N+](=O)[O-])c3C2)N1 ZINC000587749275 GI Annotated Bother Cc1ccc([N+](=O)[O-])c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587749448 GI Annotated Bother Cc1ccc([N+](=O)[O-])c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587749449 GI Annotated Bother Cc1ccc([N+](=O)[O-])c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587749450 GI Annotated Bother Cc1ccc([N+](=O)[O-])c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587749451 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](Cc2ccc([N+](=O)[O-])cc2)N1 ZINC000587749582 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@H](Cc2ccc([N+](=O)[O-])cc2)N1 ZINC000587749583 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](Cc2ccc([N+](=O)[O-])cc2)N1 ZINC000587749584 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](Cc2ccc([N+](=O)[O-])cc2)N1 ZINC000587749585 GI Annotated Bother COc1ccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(N)c1C ZINC000587749644 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(N)c1C ZINC000587749647 GI Annotated Anodyne COc1ccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(N)c1C ZINC000587749649 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(N)c1C ZINC000587749651 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3c([N+](=O)[O-])cccc32)N1 ZINC000587749794 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3c([N+](=O)[O-])cccc32)N1 ZINC000587749795 GI Annotated Bother COc1ccc([N+](=O)[O-])cc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587749800 GI Annotated Bother COc1ccc([N+](=O)[O-])cc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587749801 GI Annotated Bother COc1ccc([N+](=O)[O-])cc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587749802 GI Annotated Bother COc1ccc([N+](=O)[O-])cc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587749803 GI Annotated Bother Cc1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1[N+](=O)[O-] ZINC000587749832 GI Annotated Bother Cc1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1[N+](=O)[O-] ZINC000587749833 GI Annotated Bother Cc1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1[N+](=O)[O-] ZINC000587749835 GI Annotated Bother Cc1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1[N+](=O)[O-] ZINC000587749837 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3c([N+](=O)[O-])cccc32)N1 ZINC000587750057 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3c([N+](=O)[O-])cccc32)N1 ZINC000587750059 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(/C=N/Nc2ccccc2)N1 ZINC000587750077 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(/C=N/Nc2ccccc2)N1 ZINC000587750078 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(/C=N/Nc2ccccc2)N1 ZINC000587750081 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(/C=N/Nc2ccccc2)N1 ZINC000587750087 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@H]([C@H](C)NC(=O)OC(C)(C)C)N1 ZINC000587750640 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H]([C@@H](C)NC(=O)OC(C)(C)C)N1 ZINC000587750659 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)N1 ZINC000587750662 GI Annotated Anodyne C[C@H](NC(=O)OC(C)(C)C)[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587750665 GI Annotated Anodyne C[C@H](NC(=O)OC(C)(C)C)[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587750666 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)N1 ZINC000587750667 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H]([C@@H](C)NC(=O)OC(C)(C)C)N1 ZINC000587750669 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H]([C@H](C)NC(=O)OC(C)(C)C)N1 ZINC000587750671 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](COc2ccc([N+](=O)[O-])cc2)N1 ZINC000587750922 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@H](COc2ccc([N+](=O)[O-])cc2)N1 ZINC000587750924 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](COc2ccc([N+](=O)[O-])cc2)N1 ZINC000587750926 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](COc2ccc([N+](=O)[O-])cc2)N1 ZINC000587750927 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@H]([C@H](C)NC(=O)OC(C)(C)C)N1 ZINC000587751178 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H]([C@@H](C)NC(=O)OC(C)(C)C)N1 ZINC000587751179 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)N1 ZINC000587751181 GI Annotated Anodyne C[C@H](NC(=O)OC(C)(C)C)[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587751183 GI Annotated Anodyne C[C@H](NC(=O)OC(C)(C)C)[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587751184 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H]([C@@H](C)NC(=O)OC(C)(C)C)N1 ZINC000587751186 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H]([C@@H](C)NC(=O)OC(C)(C)C)N1 ZINC000587751188 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H]([C@H](C)NC(=O)OC(C)(C)C)N1 ZINC000587751189 GI Annotated Anodyne CCOc1ccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1N ZINC000587751389 GI Annotated Anodyne CCOc1ccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1N ZINC000587751390 GI Annotated Anodyne CCOc1ccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1N ZINC000587751391 GI Annotated Anodyne CCOc1ccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1N ZINC000587751392 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(Cc3cccc([N+](=O)[O-])c3C2)N1 ZINC000587751411 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(Cc3cccc([N+](=O)[O-])c3C2)N1 ZINC000587751412 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(Cc3cccc([N+](=O)[O-])c3C2)N1 ZINC000587751413 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(Cc3cccc([N+](=O)[O-])c3C2)N1 ZINC000587751414 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](Cc2ccc([N+](=O)[O-])cc2)N1 ZINC000587751459 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@H](Cc2ccc([N+](=O)[O-])cc2)N1 ZINC000587751460 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](Cc2ccc([N+](=O)[O-])cc2)N1 ZINC000587751461 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](Cc2ccc([N+](=O)[O-])cc2)N1 ZINC000587751462 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cn(-c3ccccc3)cn2)N1 ZINC000587751847 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cn(-c3ccccc3)cn2)N1 ZINC000587751850 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cn(-c3ccccc3)cn2)N1 ZINC000587751851 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cn(-c3ccccc3)cn2)N1 ZINC000587751853 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](CCNC(=O)OC(C)(C)C)N1 ZINC000587751959 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](CCNC(=O)OC(C)(C)C)N1 ZINC000587751960 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](CCNC(=O)OC(C)(C)C)N1 ZINC000587751961 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](CCNC(=O)OC(C)(C)C)N1 ZINC000587751962 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3ccc([N+](=O)[O-])cc32)N1 ZINC000587751999 GI Annotated Bother C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3ccc([N+](=O)[O-])cc32)N1 ZINC000587752000 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3ccc([N+](=O)[O-])cc32)N1 ZINC000587752001 GI Annotated Bother C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3ccc([N+](=O)[O-])cc32)N1 ZINC000587752002 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3c([N+](=O)[O-])cccc32)N1 ZINC000587752353 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3c([N+](=O)[O-])cccc32)N1 ZINC000587752355 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3c([N+](=O)[O-])cccc32)N1 ZINC000587752356 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3c([N+](=O)[O-])cccc32)N1 ZINC000587752358 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccn2C[C@H]2CCCO2)N1 ZINC000587752379 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccn2C[C@@H]2CCCO2)N1 ZINC000587752380 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccn2C[C@H]2CCCO2)N1 ZINC000587752381 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccn2C[C@@H]2CCCO2)N1 ZINC000587752382 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC[C@H](c3nccn3C)C2)N1 ZINC000587752415 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC[C@H](c3nccn3C)C2)N1 ZINC000587752416 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC[C@@H](c3nccn3C)C2)N1 ZINC000587752417 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC[C@@H](c3nccn3C)C2)N1 ZINC000587752418 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(N(C)C)c(C#N)c2)N1 ZINC000587752708 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(N(C)C)c(C#N)c2)N1 ZINC000587752709 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(N(C)C)c(C#N)c2)N1 ZINC000587752711 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(N(C)C)c(C#N)c2)N1 ZINC000587752713 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](CCCNC(=O)C2CCCC2)N1 ZINC000587752781 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](CCCNC(=O)C2CCCC2)N1 ZINC000587752786 GI Annotated Anodyne COCCn1c(C)cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587752882 GI Annotated Anodyne COCCn1c(C)cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587752883 GI Annotated Anodyne COCCn1c(C)cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587752884 GI Annotated Anodyne COCCn1c(C)cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587752885 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](COc2ccc([N+](=O)[O-])cc2)N1 ZINC000587752894 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@H](COc2ccc([N+](=O)[O-])cc2)N1 ZINC000587752895 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](COc2ccc([N+](=O)[O-])cc2)N1 ZINC000587752896 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](COc2ccc([N+](=O)[O-])cc2)N1 ZINC000587752897 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cn(-c3ccccc3)cn2)N1 ZINC000587752999 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cn(-c3ccccc3)cn2)N1 ZINC000587753000 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cn(-c3ccccc3)cn2)N1 ZINC000587753001 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cn(-c3ccccc3)cn2)N1 ZINC000587753002 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccccc2-n2ccnc2)N1 ZINC000587753027 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](CCCNC(=O)C2CCCC2)N1 ZINC000587753028 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccccc2-n2ccnc2)N1 ZINC000587753029 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccccc2-n2ccnc2)N1 ZINC000587753030 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccccc2-n2ccnc2)N1 ZINC000587753031 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](CCCNC(=O)C2CCCC2)N1 ZINC000587753044 GI Annotated Anodyne CCN[C@H](C)[C@]1(c2ccccc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587753162 GI Annotated Anodyne CCN[C@H](C)[C@@]1(c2ccccc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587753164 GI Annotated Anodyne CCN[C@H](C)[C@]1(c2ccccc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587753169 GI Annotated Anodyne CCN[C@H](C)[C@@]1(c2ccccc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587753171 GI Annotated Anodyne CCn1nc(C)c([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587753230 GI Annotated Anodyne CCn1nc(C)c([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587753231 GI Annotated Anodyne CCn1nc(C)c([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587753232 GI Annotated Anodyne CCn1nc(C)c([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587753233 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3ccc([N+](=O)[O-])cc32)N1 ZINC000587753288 GI Annotated Bother C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3ccc([N+](=O)[O-])cc32)N1 ZINC000587753290 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3ccc([N+](=O)[O-])cc32)N1 ZINC000587753291 GI Annotated Bother C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3ccc([N+](=O)[O-])cc32)N1 ZINC000587753293 GI Annotated Bother COCCn1c(C)cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587753403 GI Annotated Anodyne COCCn1c(C)cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587753404 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccn2-c2cccnc2)N1 ZINC000587753429 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccn2-c2cccnc2)N1 ZINC000587753430 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccn2-c2cccnc2)N1 ZINC000587753431 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccn2-c2cccnc2)N1 ZINC000587753432 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccn2-c2ccccn2)N1 ZINC000587753441 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccn2-c2ccccn2)N1 ZINC000587753442 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccn2-c2ccccn2)N1 ZINC000587753443 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccn2-c2ccccn2)N1 ZINC000587753444 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccccc2N(C)C)N1 ZINC000587753502 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccccc2N(C)C)N1 ZINC000587753503 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccccc2N(C)C)N1 ZINC000587753504 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccccc2N(C)C)N1 ZINC000587753506 GI Annotated Anodyne COCCn1c(C)cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587753567 GI Annotated Anodyne COCCn1c(C)cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587753569 GI Annotated Anodyne CCc1nn(C)c(CC)c1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587753584 GI Annotated Anodyne CCc1nn(C)c(CC)c1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587753587 GI Annotated Anodyne CCc1nn(C)c(CC)c1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587753590 GI Annotated Anodyne CCc1nn(C)c(CC)c1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587753592 GI Annotated Anodyne C=CCn1nc(C)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587753783 GI Annotated Mild C=CCn1nc(C)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587753784 GI Annotated Mild C=CCn1nc(C)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587753785 GI Annotated Mild C=CCn1nc(C)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587753786 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2nccn2-c2ccccc2)N1 ZINC000587753817 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2nccn2-c2ccccc2)N1 ZINC000587753818 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2nccn2-c2ccccc2)N1 ZINC000587753819 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2nccn2-c2ccccc2)N1 ZINC000587753820 GI Annotated Anodyne CCn1cc([C@@]2(CC)N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587754085 GI Annotated Anodyne CCn1cc([C@@]2(CC)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587754089 GI Annotated Anodyne CCn1cc([C@]2(CC)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587754091 GI Annotated Anodyne CCn1cc([C@]2(CC)N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587754094 GI Annotated Anodyne C=CCn1nc(C)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587754154 GI Annotated Mild C=CCn1nc(C)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587754155 GI Annotated Mild C=CCn1nc(C)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587754156 GI Annotated Mild C=CCn1nc(C)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587754157 GI Annotated Mild Cc1cc(-n2cccc2[C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)no1 ZINC000587754728 GI Annotated Anodyne Cc1cc(-n2cccc2[C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)no1 ZINC000587754729 GI Annotated Anodyne Cc1cc(-n2cccc2[C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)no1 ZINC000587754730 GI Annotated Anodyne Cc1cc(-n2cccc2[C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)no1 ZINC000587754731 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccn2-c2cccnc2)N1 ZINC000587754768 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccn2-c2cccnc2)N1 ZINC000587754769 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccn2-c2cccnc2)N1 ZINC000587754770 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccn2-c2cccnc2)N1 ZINC000587754772 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC[C@@H](c3nccn3C)C2)N1 ZINC000587754773 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(N(C)C)cc2O)N1 ZINC000587754774 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC[C@H](c3nccn3C)C2)N1 ZINC000587754775 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC[C@@H](c3nccn3C)C2)N1 ZINC000587754776 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC[C@H](c3nccn3C)C2)N1 ZINC000587754777 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(N(C)C)cc2O)N1 ZINC000587754779 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(N(C)C)cc2O)N1 ZINC000587754781 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(N(C)C)cc2O)N1 ZINC000587754783 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(-n3ccnc3)cc2)N1 ZINC000587754811 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(-n3ccnc3)cc2)N1 ZINC000587754813 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(-n3ccnc3)cc2)N1 ZINC000587754815 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(-n3ccnc3)cc2)N1 ZINC000587754817 GI Annotated Anodyne Cc1ccnc2c1c([C@@H]1N[C@H](C)Cc3cc(Br)c(F)cc31)cn2C ZINC000587754945 GI Annotated Anodyne Cc1ccnc2c1c([C@@H]1N[C@@H](C)Cc3cc(Br)c(F)cc31)cn2C ZINC000587754946 GI Annotated Anodyne Cc1ccnc2c1c([C@H]1N[C@@H](C)Cc3cc(Br)c(F)cc31)cn2C ZINC000587754947 GI Annotated Anodyne Cc1ccnc2c1c([C@H]1N[C@H](C)Cc3cc(Br)c(F)cc31)cn2C ZINC000587754948 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc(N(C)C)c2)N1 ZINC000587755072 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc(N(C)C)c2)N1 ZINC000587755075 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc(N(C)C)c2)N1 ZINC000587755077 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc(N(C)C)c2)N1 ZINC000587755079 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc(N(C)C)c2)N1 ZINC000587755451 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc(N(C)C)c2)N1 ZINC000587755452 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc(N(C)C)c2)N1 ZINC000587755453 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc(N(C)C)c2)N1 ZINC000587755454 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3c(cnn3C)c2)N1 ZINC000587755481 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3c(cnn3C)c2)N1 ZINC000587755482 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3c(cnn3C)c2)N1 ZINC000587755483 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3c(cnn3C)c2)N1 ZINC000587755484 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3c(cnn3C)c2)N1 ZINC000587755510 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3c(cnn3C)c2)N1 ZINC000587755511 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3c(cnn3C)c2)N1 ZINC000587755512 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3c(cnn3C)c2)N1 ZINC000587755513 GI Annotated Anodyne Cc1ccnc2c1c([C@H]1N[C@H](C)Cc3ccc(F)c(Br)c31)cn2C ZINC000587755557 GI Annotated Anodyne Cc1ccnc2c1c([C@H]1N[C@@H](C)Cc3ccc(F)c(Br)c31)cn2C ZINC000587755560 GI Annotated Anodyne Cc1ccnc2c1c([C@@H]1N[C@@H](C)Cc3ccc(F)c(Br)c31)cn2C ZINC000587755563 GI Annotated Anodyne Cc1ccnc2c1c([C@@H]1N[C@H](C)Cc3ccc(F)c(Br)c31)cn2C ZINC000587755566 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccnn2-c2ccccc2)N1 ZINC000587755616 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccnn2-c2ccccc2)N1 ZINC000587755617 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccnn2-c2ccccc2)N1 ZINC000587755619 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccnn2-c2ccccc2)N1 ZINC000587755620 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccccc2-n2ccnc2)N1 ZINC000587755721 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccccc2-n2ccnc2)N1 ZINC000587755722 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccccc2-n2ccnc2)N1 ZINC000587755724 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccccc2-n2ccnc2)N1 ZINC000587755725 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](CCNC(=O)OC(C)(C)C)N1 ZINC000587755821 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](CCNC(=O)OC(C)(C)C)N1 ZINC000587755822 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](CCNC(=O)OC(C)(C)C)N1 ZINC000587755823 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](CCNC(=O)OC(C)(C)C)N1 ZINC000587755824 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc3c2cnn3C)N1 ZINC000587755877 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc3c2cnn3C)N1 ZINC000587755878 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc3c2cnn3C)N1 ZINC000587755879 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc3c2cnn3C)N1 ZINC000587755880 GI Annotated Anodyne CC(C)n1ncc2c1CCC[C@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587755977 GI Annotated Anodyne CC(C)n1ncc2c1CCC[C@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587755979 GI Annotated Anodyne CC(C)n1ncc2c1CCC[C@@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587755981 GI Annotated Anodyne CC(C)n1ncc2c1CCC[C@@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587755983 GI Annotated Anodyne CCCn1nc(C)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587756000 GI Annotated Anodyne CCCn1nc(C)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587756002 GI Annotated Anodyne CCCn1nc(C)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587756004 GI Annotated Anodyne CCCn1nc(C)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587756005 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(N(C)C)c(C#N)c2)N1 ZINC000587756270 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(N(C)C)c(C#N)c2)N1 ZINC000587756271 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(N(C)C)c(C#N)c2)N1 ZINC000587756272 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(N(C)C)c(C#N)c2)N1 ZINC000587756273 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@](Cn2cccn2)(C(C)(C)C)N1 ZINC000587756340 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](Cn2cccn2)(C(C)(C)C)N1 ZINC000587756342 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](Cn2cccn2)(C(C)(C)C)N1 ZINC000587756344 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](Cn2cccn2)(C(C)(C)C)N1 ZINC000587756345 GI Annotated Anodyne CC[C@]1(c2c(C)nn(C)c2C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756402 GI Annotated Anodyne CC[C@@]1(c2c(C)nn(C)c2C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756405 GI Annotated Anodyne CC[C@@]1(c2c(C)nn(C)c2C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756407 GI Annotated Anodyne CC[C@]1(c2c(C)nn(C)c2C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756409 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(N(C)C)cc2O)N1 ZINC000587756517 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(N(C)C)cc2O)N1 ZINC000587756518 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(N(C)C)cc2O)N1 ZINC000587756519 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(N(C)C)cc2O)N1 ZINC000587756520 GI Annotated Clean CCN[C@H](C)[C@]1(c2ccccc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587756623 GI Annotated Anodyne CCN[C@H](C)[C@@]1(c2ccccc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587756624 GI Annotated Anodyne CCN[C@H](C)[C@]1(c2ccccc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587756625 GI Annotated Anodyne CCN[C@H](C)[C@@]1(c2ccccc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587756626 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccccc2-n2cccn2)N1 ZINC000587756715 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccccc2-n2cccn2)N1 ZINC000587756716 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccccc2-n2cccn2)N1 ZINC000587756718 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccccc2-n2cccn2)N1 ZINC000587756720 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@@H](c3cnn(C)c3)C2(C)C)N1 ZINC000587756753 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@H](c3cnn(C)c3)C2(C)C)N1 ZINC000587756754 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@H](c3cnn(C)c3)C2(C)C)N1 ZINC000587756755 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@@H](c3cnn(C)c3)C2(C)C)N1 ZINC000587756757 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc3cn(C)nc23)N1 ZINC000587756853 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc3cn(C)nc23)N1 ZINC000587756854 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc3cn(C)nc23)N1 ZINC000587756856 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc3cn(C)nc23)N1 ZINC000587756858 GI Annotated Anodyne CC(C)NC[C@]1(c2ccccc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756940 GI Annotated Anodyne CC(C)NC[C@]1(c2ccccc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756941 GI Annotated Anodyne CC(C)NC[C@@]1(c2ccccc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756943 GI Annotated Anodyne CC(C)NC[C@@]1(c2ccccc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587756944 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(N(C)C)cc2)N1 ZINC000587756984 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(N(C)C)cc2)N1 ZINC000587756986 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(N(C)C)cc2)N1 ZINC000587756988 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(N(C)C)cc2)N1 ZINC000587756989 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(-n3ccnc3)c2)N1 ZINC000587757008 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(-n3ccnc3)c2)N1 ZINC000587757010 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(-n3ccnc3)c2)N1 ZINC000587757011 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(-n3ccnc3)c2)N1 ZINC000587757012 GI Annotated Anodyne Cc1cc(-n2cccc2[C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)no1 ZINC000587757014 GI Annotated Anodyne Cc1cc(-n2cccc2[C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)no1 ZINC000587757016 GI Annotated Anodyne Cc1cc(-n2cccc2[C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)no1 ZINC000587757019 GI Annotated Anodyne Cc1cc(-n2cccc2[C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)no1 ZINC000587757021 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccn2-c2ccncc2)N1 ZINC000587757041 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccn2-c2ccncc2)N1 ZINC000587757043 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccn2-c2ccncc2)N1 ZINC000587757046 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccn2-c2ccncc2)N1 ZINC000587757047 GI Annotated Anodyne CC[C@@]1(c2c(C)nn(C)c2C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587757092 GI Annotated Anodyne CC[C@]1(c2c(C)nn(C)c2C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587757093 GI Annotated Anodyne CC[C@]1(c2c(C)nn(C)c2C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587757094 GI Annotated Anodyne CC[C@@]1(c2c(C)nn(C)c2C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587757095 GI Annotated Anodyne CCCn1cc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587757104 GI Annotated Anodyne CCCn1cc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587757105 GI Annotated Anodyne CCCn1cc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587757106 GI Annotated Anodyne CCCn1cc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587757107 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3nn(C)cc3c2)N1 ZINC000587757228 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3nn(C)cc3c2)N1 ZINC000587757229 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3nn(C)cc3c2)N1 ZINC000587757230 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3nn(C)cc3c2)N1 ZINC000587757231 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccccc2N(C)C)N1 ZINC000587757382 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccccc2N(C)C)N1 ZINC000587757385 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccccc2N(C)C)N1 ZINC000587757387 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccccc2N(C)C)N1 ZINC000587757390 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(-n3ccnc3)c2)N1 ZINC000587757458 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(-n3ccnc3)c2)N1 ZINC000587757459 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(-n3ccnc3)c2)N1 ZINC000587757460 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(-n3ccnc3)c2)N1 ZINC000587757462 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccn2-c2ccncc2)N1 ZINC000587757463 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccn2-c2ccncc2)N1 ZINC000587757465 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccn2-c2ccncc2)N1 ZINC000587757466 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccn2-c2ccncc2)N1 ZINC000587757467 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](CCCNC(=O)C2CCCC2)N1 ZINC000587757487 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](CCCNC(=O)C2CCCC2)N1 ZINC000587757488 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](CCCNC(=O)C2CCCC2)N1 ZINC000587757489 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](CCCNC(=O)C2CCCC2)N1 ZINC000587757490 GI Annotated Anodyne CCCn1nc(C)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587757559 GI Annotated Anodyne CCCn1nc(C)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587757560 GI Annotated Anodyne CCCn1nc(C)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587757561 GI Annotated Anodyne CCCn1nc(C)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587757562 GI Annotated Anodyne CCn1cc([C@]2(CC)N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587757584 GI Annotated Anodyne CCn1cc([C@]2(CC)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587757585 GI Annotated Anodyne CCn1cc([C@@]2(CC)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587757586 GI Annotated Anodyne CCn1cc([C@@]2(CC)N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587757588 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2nc3ccccc3n2C)N1 ZINC000587757597 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2nc3ccccc3n2C)N1 ZINC000587757599 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2nc3ccccc3n2C)N1 ZINC000587757601 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2nc3ccccc3n2C)N1 ZINC000587757603 GI Annotated Anodyne C[C@H]1CCCCN1C(=O)C[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587757615 GI Annotated Anodyne C[C@H]1CCCCN1C(=O)C[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587757616 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)N2CCCC[C@H]2C)N1 ZINC000587757617 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)N2CCCC[C@H]2C)N1 ZINC000587757618 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc3nn(C)cc23)N1 ZINC000587757696 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc3nn(C)cc23)N1 ZINC000587757697 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc3nn(C)cc23)N1 ZINC000587757698 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc3nn(C)cc23)N1 ZINC000587757699 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccn2-c2ccccn2)N1 ZINC000587757783 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccn2-c2ccccn2)N1 ZINC000587757787 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccn2-c2ccccn2)N1 ZINC000587757790 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccn2-c2ccccn2)N1 ZINC000587757794 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](C(C)(C)N2C[C@@H](C)O[C@H](C)C2)N1 ZINC000587757840 GI Annotated Anodyne C[C@H]1CN(C(C)(C)[C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)C[C@H](C)O1 ZINC000587757854 GI Annotated Anodyne C[C@H]1CN(C(C)(C)[C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)C[C@@H](C)O1 ZINC000587757857 GI Annotated Anodyne C[C@H]1CN(C(C)(C)[C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)C[C@@H](C)O1 ZINC000587757901 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2nc3ccccc3n2C)N1 ZINC000587758089 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2nc3ccccc3n2C)N1 ZINC000587758090 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2nc3ccccc3n2C)N1 ZINC000587758092 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2nc3ccccc3n2C)N1 ZINC000587758093 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccn2C[C@H]2CCCO2)N1 ZINC000587758373 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccn2C[C@@H]2CCCO2)N1 ZINC000587758375 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccn2C[C@H]2CCCO2)N1 ZINC000587758377 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccn2C[C@@H]2CCCO2)N1 ZINC000587758378 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2nccn2-c2ccccc2)N1 ZINC000587758483 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2nccn2-c2ccccc2)N1 ZINC000587758484 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2nccn2-c2ccccc2)N1 ZINC000587758486 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2nccn2-c2ccccc2)N1 ZINC000587758488 GI Annotated Anodyne CCc1nn(C)c(CC)c1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587758591 GI Annotated Anodyne CCc1nn(C)c(CC)c1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587758593 GI Annotated Anodyne CCc1nn(C)c(CC)c1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587758595 GI Annotated Anodyne CCc1nn(C)c(CC)c1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587758597 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccccc2-n2cccn2)N1 ZINC000587758821 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccccc2-n2cccn2)N1 ZINC000587758825 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccccc2-n2cccn2)N1 ZINC000587758829 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccccc2-n2cccn2)N1 ZINC000587758832 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(N(C)C)cc2)N1 ZINC000587759046 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(N(C)C)cc2)N1 ZINC000587759048 GI Annotated Clean COc1c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C(C)C)nn1C ZINC000587759049 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(N(C)C)cc2)N1 ZINC000587759050 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(N(C)C)cc2)N1 ZINC000587759051 GI Annotated Clean COc1c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C(C)C)nn1C ZINC000587759056 GI Annotated Anodyne COc1c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C(C)C)nn1C ZINC000587759057 GI Annotated Anodyne COc1c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C(C)C)nn1C ZINC000587759058 GI Annotated Anodyne CCCn1cc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587759142 GI Annotated Anodyne CCCn1cc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587759143 GI Annotated Anodyne CCCn1cc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587759144 GI Annotated Anodyne CCCn1cc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587759145 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(-n3ccnc3)cc2)N1 ZINC000587759209 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(-n3ccnc3)cc2)N1 ZINC000587759210 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(-n3ccnc3)cc2)N1 ZINC000587759211 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(-n3ccnc3)cc2)N1 ZINC000587759212 GI Annotated Anodyne CCn1nc(C)c([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587759427 GI Annotated Anodyne CCn1nc(C)c([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587759428 GI Annotated Anodyne CCn1nc(C)c([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587759429 GI Annotated Anodyne CCn1nc(C)c([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587759430 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccnn2[C@@H]2CCCCO2)N1 ZINC000587759443 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccnn2[C@H]2CCCCO2)N1 ZINC000587759447 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccnn2[C@@H]2CCCCO2)N1 ZINC000587759449 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccnn2[C@H]2CCCCO2)N1 ZINC000587759451 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccnn2[C@H]2CCCCO2)N1 ZINC000587759467 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccnn2[C@@H]2CCCCO2)N1 ZINC000587759469 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccnn2[C@H]2CCCCO2)N1 ZINC000587759471 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccnn2[C@@H]2CCCCO2)N1 ZINC000587759473 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3cn(C)nc3c2)N1 ZINC000587759507 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3cn(C)nc3c2)N1 ZINC000587759509 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3cn(C)nc3c2)N1 ZINC000587759511 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3cn(C)nc3c2)N1 ZINC000587759512 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc3cn(C)nc23)N1 ZINC000587759670 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc3cn(C)nc23)N1 ZINC000587759672 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc3cn(C)nc23)N1 ZINC000587759674 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc3cn(C)nc23)N1 ZINC000587759675 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(-n3cccn3)c2)N1 ZINC000587759718 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(-n3cccn3)c2)N1 ZINC000587759719 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(-n3cccn3)c2)N1 ZINC000587759720 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(-n3cccn3)c2)N1 ZINC000587759722 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3cn(C)nc3c2)N1 ZINC000587759743 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3cn(C)nc3c2)N1 ZINC000587759744 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3cn(C)nc3c2)N1 ZINC000587759746 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3cn(C)nc3c2)N1 ZINC000587759748 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC[C@H](c3ccnn3C)C2)N1 ZINC000587759781 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC[C@H](c3ccnn3C)C2)N1 ZINC000587759783 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC[C@@H](c3ccnn3C)C2)N1 ZINC000587759785 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC[C@@H](c3ccnn3C)C2)N1 ZINC000587759786 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H]([C@@H]2CCN2C(=O)OC(C)(C)C)N1 ZINC000587759854 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H]([C@H]2CCN2C(=O)OC(C)(C)C)N1 ZINC000587759855 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H]([C@@H]2CCN2C(=O)OC(C)(C)C)N1 ZINC000587759856 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H]([C@H]2CCN2C(=O)OC(C)(C)C)N1 ZINC000587759857 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](C2CN(C(=O)OC(C)(C)C)C2)N1 ZINC000587760230 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](C2CN(C(=O)OC(C)(C)C)C2)N1 ZINC000587760231 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](C2CN(C(=O)OC(C)(C)C)C2)N1 ZINC000587760232 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](C2CN(C(=O)OC(C)(C)C)C2)N1 ZINC000587760233 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H]([C@H]2CCN2C(=O)OC(C)(C)C)N1 ZINC000587760450 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H]([C@@H]2CCN2C(=O)OC(C)(C)C)N1 ZINC000587760451 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H]([C@H]2CCN2C(=O)OC(C)(C)C)N1 ZINC000587760452 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H]([C@@H]2CCN2C(=O)OC(C)(C)C)N1 ZINC000587760453 GI Annotated Anodyne COc1c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C(C)C)nn1C ZINC000587760576 GI Annotated Anodyne COc1c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C(C)C)nn1C ZINC000587760578 GI Annotated Anodyne COc1c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C(C)C)nn1C ZINC000587760580 GI Annotated Anodyne COc1c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C(C)C)nn1C ZINC000587760581 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(-n3cccn3)cc2)N1 ZINC000587760652 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(-n3cccn3)cc2)N1 ZINC000587760654 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(-n3cccn3)cc2)N1 ZINC000587760656 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(-n3cccn3)cc2)N1 ZINC000587760658 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc3c2cnn3C)N1 ZINC000587760951 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc3c2cnn3C)N1 ZINC000587760952 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc3c2cnn3C)N1 ZINC000587760953 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc3c2cnn3C)N1 ZINC000587760954 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@@H](c3cnn(C)c3)C2(C)C)N1 ZINC000587761003 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@H](c3cnn(C)c3)C2(C)C)N1 ZINC000587761004 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@H](c3cnn(C)c3)C2(C)C)N1 ZINC000587761005 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@@H](c3cnn(C)c3)C2(C)C)N1 ZINC000587761006 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc3nn(C)cc23)N1 ZINC000587761139 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc3nn(C)cc23)N1 ZINC000587761140 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc3nn(C)cc23)N1 ZINC000587761141 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc3nn(C)cc23)N1 ZINC000587761142 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(-n3cccn3)c2)N1 ZINC000587761147 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(-n3cccn3)c2)N1 ZINC000587761148 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(-n3cccn3)c2)N1 ZINC000587761149 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(-n3cccn3)c2)N1 ZINC000587761150 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3nn(C)cc3c2)N1 ZINC000587761155 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3nn(C)cc3c2)N1 ZINC000587761156 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3nn(C)cc3c2)N1 ZINC000587761157 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3nn(C)cc3c2)N1 ZINC000587761158 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(-n3cccn3)cc2)N1 ZINC000587761211 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(-n3cccn3)cc2)N1 ZINC000587761212 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(-n3cccn3)cc2)N1 ZINC000587761213 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(-n3cccn3)cc2)N1 ZINC000587761214 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnn(-c3ccccc3)c2)N1 ZINC000587761415 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnn(-c3ccccc3)c2)N1 ZINC000587761416 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnn(-c3ccccc3)c2)N1 ZINC000587761417 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnn(-c3ccccc3)c2)N1 ZINC000587761418 GI Annotated Anodyne CC(C)n1ncc2c1CCC[C@@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587761427 GI Annotated Anodyne CC(C)n1ncc2c1CCC[C@@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587761428 GI Annotated Anodyne CC(C)n1ncc2c1CCC[C@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587761429 GI Annotated Anodyne CC(C)n1ncc2c1CCC[C@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587761430 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3cnn(C)c3c2)N1 ZINC000587761459 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3cnn(C)c3c2)N1 ZINC000587761460 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3cnn(C)c3c2)N1 ZINC000587761461 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3cnn(C)c3c2)N1 ZINC000587761462 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnn(-c3ccccc3)c2)N1 ZINC000587761511 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnn(-c3ccccc3)c2)N1 ZINC000587761512 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnn(-c3ccccc3)c2)N1 ZINC000587761513 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnn(-c3ccccc3)c2)N1 ZINC000587761514 GI Annotated Anodyne C[C@H]1CCCCN1C(=O)C[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587761557 GI Annotated Anodyne C[C@H]1CCCCN1C(=O)C[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587761558 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)N2CCCC[C@H]2C)N1 ZINC000587761559 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)N2CCCC[C@H]2C)N1 ZINC000587761560 GI Annotated Anodyne CC(C)n1ccc(C[C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587761631 GI Annotated Anodyne CC(C)n1ccc(C[C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587761632 GI Annotated Anodyne CC(C)n1ccc(C[C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587761633 GI Annotated Anodyne CC(C)n1ccc(C[C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)n1 ZINC000587761634 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc3cnn(C)c23)N1 ZINC000587761765 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc3cnn(C)c23)N1 ZINC000587761767 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc3cnn(C)c23)N1 ZINC000587761768 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc3cnn(C)c23)N1 ZINC000587761769 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(C(C)(C)C)nn2C)N1 ZINC000587762039 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(C(C)(C)C)nn2C)N1 ZINC000587762040 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(C(C)(C)C)nn2C)N1 ZINC000587762041 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(C(C)(C)C)nn2C)N1 ZINC000587762042 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3cnn(C)c3c2)N1 ZINC000587762200 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3cnn(C)c3c2)N1 ZINC000587762201 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3cnn(C)c3c2)N1 ZINC000587762202 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3cnn(C)c3c2)N1 ZINC000587762203 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC[C@@H](c3ccnn3C)C2)N1 ZINC000587762352 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC[C@H](c3ccnn3C)C2)N1 ZINC000587762353 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC[C@@H](c3ccnn3C)C2)N1 ZINC000587762354 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC[C@H](c3ccnn3C)C2)N1 ZINC000587762355 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc3cnn(C)c23)N1 ZINC000587762648 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc3cnn(C)c23)N1 ZINC000587762649 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc3cnn(C)c23)N1 ZINC000587762650 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc3cnn(C)c23)N1 ZINC000587762651 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccnn2-c2ccccc2)N1 ZINC000587762656 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccnn2-c2ccccc2)N1 ZINC000587762657 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccnn2-c2ccccc2)N1 ZINC000587762658 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccnn2-c2ccccc2)N1 ZINC000587762659 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](Cn2cccn2)(C(C)(C)C)N1 ZINC000587762708 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](Cn2cccn2)(C(C)(C)C)N1 ZINC000587762709 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](Cn2cccn2)(C(C)(C)C)N1 ZINC000587762710 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](Cn2cccn2)(C(C)(C)C)N1 ZINC000587762711 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2nn(C(C)(C)C)cc2O)N1 ZINC000587762775 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2nn(C(C)(C)C)cc2O)N1 ZINC000587762780 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2nn(C(C)(C)C)cc2O)N1 ZINC000587762782 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2nn(C(C)(C)C)cc2O)N1 ZINC000587762784 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(-c3ccco3)n(C)n2)N1 ZINC000587762852 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(-c3ccco3)n(C)n2)N1 ZINC000587762860 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(-c3ccco3)n(C)n2)N1 ZINC000587762862 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(-c3ccco3)n(C)n2)N1 ZINC000587762864 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](C2CN(C(=O)OC(C)(C)C)C2)N1 ZINC000587762980 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](C2CN(C(=O)OC(C)(C)C)C2)N1 ZINC000587762981 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](C2CN(C(=O)OC(C)(C)C)C2)N1 ZINC000587762982 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](C2CN(C(=O)OC(C)(C)C)C2)N1 ZINC000587762983 GI Annotated Anodyne Cc1c([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cnn1C(C)C ZINC000587763092 GI Annotated Anodyne Cc1c([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cnn1C(C)C ZINC000587763093 GI Annotated Anodyne Cc1c([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cnn1C(C)C ZINC000587763094 GI Annotated Anodyne Cc1c([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cnn1C(C)C ZINC000587763095 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(-c3ccco3)n(C)n2)N1 ZINC000587763536 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(-c3ccco3)n(C)n2)N1 ZINC000587763538 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(-c3ccco3)n(C)n2)N1 ZINC000587763540 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(-c3ccco3)n(C)n2)N1 ZINC000587763542 GI Annotated Anodyne CCn1ncc([C@]2(CC)N[C@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587763600 GI Annotated Anodyne CCn1ncc([C@]2(CC)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587763601 GI Annotated Anodyne CCn1ncc([C@@]2(CC)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587763602 GI Annotated Anodyne CCn1ncc([C@@]2(CC)N[C@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587763603 GI Annotated Anodyne CC(C)n1ccc(C[C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587763608 GI Annotated Anodyne CC(C)n1ccc(C[C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587763609 GI Annotated Anodyne CC(C)n1ccc(C[C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587763610 GI Annotated Anodyne CC(C)n1ccc(C[C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)n1 ZINC000587763611 GI Annotated Anodyne CCn1ncc([C@@]2(CC)N[C@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587763732 GI Annotated Anodyne CCn1ncc([C@@]2(CC)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587763733 GI Annotated Anodyne CCn1ncc([C@]2(CC)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587763734 GI Annotated Anodyne CCn1ncc([C@]2(CC)N[C@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587763735 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2nn(C(C)(C)C)cc2O)N1 ZINC000587763752 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2nn(C(C)(C)C)cc2O)N1 ZINC000587763753 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2nn(C(C)(C)C)cc2O)N1 ZINC000587763754 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2nn(C(C)(C)C)cc2O)N1 ZINC000587763755 GI Annotated Anodyne Cc1c([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cnn1C(C)C ZINC000587763780 GI Annotated Anodyne Cc1c([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cnn1C(C)C ZINC000587763781 GI Annotated Anodyne Cc1c([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cnn1C(C)C ZINC000587763782 GI Annotated Anodyne Cc1c([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cnn1C(C)C ZINC000587763783 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccn(-c3ccccc3)n2)N1 ZINC000587763804 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccn(-c3ccccc3)n2)N1 ZINC000587763805 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccn(-c3ccccc3)n2)N1 ZINC000587763806 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccn(-c3ccccc3)n2)N1 ZINC000587763807 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(C(C)(C)C)nn2C)N1 ZINC000587763903 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(C(C)(C)C)nn2C)N1 ZINC000587763905 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(C(C)(C)C)nn2C)N1 ZINC000587763906 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(C(C)(C)C)nn2C)N1 ZINC000587763908 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccn([C@@H]3CCCCO3)n2)N1 ZINC000587763987 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccn([C@H]3CCCCO3)n2)N1 ZINC000587763989 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccn([C@@H]3CCCCO3)n2)N1 ZINC000587763991 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccn([C@H]3CCCCO3)n2)N1 ZINC000587763992 GI Annotated Anodyne CCn1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C2CC2)n1 ZINC000587764136 GI Annotated Anodyne CCn1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C2CC2)n1 ZINC000587764137 GI Annotated Anodyne CCn1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C2CC2)n1 ZINC000587764138 GI Annotated Anodyne CCn1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C2CC2)n1 ZINC000587764139 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(N3CCCC3)nc2)N1 ZINC000587764302 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(N3CCCC3)nc2)N1 ZINC000587764303 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(N3CCCC3)nc2)N1 ZINC000587764304 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(N3CCCC3)nc2)N1 ZINC000587764305 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(N3CCCC3)nc2)N1 ZINC000587764543 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(N3CCCC3)nc2)N1 ZINC000587764544 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(N3CCCC3)nc2)N1 ZINC000587764545 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(N3CCCC3)nc2)N1 ZINC000587764546 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)N2CCCCCC2)N1 ZINC000587764590 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)N2CCCCCC2)N1 ZINC000587764592 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)N2CCCCCC2)N1 ZINC000587764593 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)N2CCCCCC2)N1 ZINC000587764595 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(C[C@@H]3CC[C@H](C2)N3C2CC2)N1 ZINC000587764671 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(C[C@@H]3CC[C@H](C2)N3C2CC2)N1 ZINC000587764675 GI Annotated Anodyne CCCn1ncc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587764811 GI Annotated Anodyne CCCn1ncc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587764812 GI Annotated Anodyne CCCn1ncc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587764813 GI Annotated Anodyne CCCn1ncc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1C ZINC000587764814 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2nn(C)c3ccccc23)N1 ZINC000587765207 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2nn(C)c3ccccc23)N1 ZINC000587765209 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2nn(C)c3ccccc23)N1 ZINC000587765211 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2nn(C)c3ccccc23)N1 ZINC000587765213 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cn(C)nc2C(C)(C)C)N1 ZINC000587765216 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cn(C)nc2C(C)(C)C)N1 ZINC000587765217 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cn(C)nc2C(C)(C)C)N1 ZINC000587765218 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cn(C)nc2C(C)(C)C)N1 ZINC000587765221 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(CCN(c3ccncc3)CC2)N1 ZINC000587765437 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(CCN(c3ccncc3)CC2)N1 ZINC000587765439 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)N2CCCCCC2)N1 ZINC000587765544 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)N2CCCCCC2)N1 ZINC000587765545 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)N2CCCCCC2)N1 ZINC000587765546 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)N2CCCCCC2)N1 ZINC000587765547 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccnc(N3CCCC3)c2)N1 ZINC000587765592 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccnc(N3CCCC3)c2)N1 ZINC000587765593 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccnc(N3CCCC3)c2)N1 ZINC000587765594 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccnc(N3CCCC3)c2)N1 ZINC000587765595 GI Annotated Anodyne CCn1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C2CC2)n1 ZINC000587765809 GI Annotated Anodyne CCn1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C2CC2)n1 ZINC000587765810 GI Annotated Anodyne CCn1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C2CC2)n1 ZINC000587765811 GI Annotated Anodyne CCn1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C2CC2)n1 ZINC000587765813 GI Annotated Anodyne CCCn1ncc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587765829 GI Annotated Anodyne CCCn1ncc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587765831 GI Annotated Anodyne CCCn1ncc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587765833 GI Annotated Anodyne CCCn1ncc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1C ZINC000587765835 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cn(C)nc2C(C)(C)C)N1 ZINC000587765845 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cn(C)nc2C(C)(C)C)N1 ZINC000587765846 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cn(C)nc2C(C)(C)C)N1 ZINC000587765847 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cn(C)nc2C(C)(C)C)N1 ZINC000587765848 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(CCN(c3ccncc3)CC2)N1 ZINC000587765876 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C2(CCN(c3ccncc3)CC2)N1 ZINC000587765878 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(N3CCCC3)o2)N1 ZINC000587765984 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(N3CCCC3)o2)N1 ZINC000587765985 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(N3CCCC3)o2)N1 ZINC000587765986 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(N3CCCC3)o2)N1 ZINC000587765987 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(CCN(Cc3ccco3)CC2)N1 ZINC000587766235 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(CCN(Cc3ccco3)CC2)N1 ZINC000587766237 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccn(-c3ccccc3)n2)N1 ZINC000587766238 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccn(-c3ccccc3)n2)N1 ZINC000587766241 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccn(-c3ccccc3)n2)N1 ZINC000587766243 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccn(-c3ccccc3)n2)N1 ZINC000587766246 GI Annotated Anodyne CC(C)CCN1CCC2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587766327 GI Annotated Anodyne CC(C)CCN1CCC2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587766330 GI Annotated Anodyne COc1ncc(C)cc1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587766378 GI Annotated Anodyne COc1ncc(C)cc1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587766385 GI Annotated Anodyne COc1ncc(C)cc1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587766392 GI Annotated Anodyne COc1ncc(C)cc1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587766400 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(N3CCCC3)o2)N1 ZINC000587766617 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(N3CCCC3)o2)N1 ZINC000587766619 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(N3CCCC3)o2)N1 ZINC000587766620 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(N3CCCC3)o2)N1 ZINC000587766623 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCN(c3ccccc3)C2)N1 ZINC000587766690 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCN(c3ccccc3)C2)N1 ZINC000587766694 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCN(c3ccccc3)C2)N1 ZINC000587766695 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCN(c3ccccc3)C2)N1 ZINC000587766697 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccn([C@H]3CCCCO3)n2)N1 ZINC000587766711 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccn([C@@H]3CCCCO3)n2)N1 ZINC000587766712 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccn([C@H]3CCCCO3)n2)N1 ZINC000587766713 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccn([C@@H]3CCCCO3)n2)N1 ZINC000587766714 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(CCN(C3CCCC3)CC2)N1 ZINC000587766763 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C2(CCN(C3CCCC3)CC2)N1 ZINC000587766765 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2nn(C)c3ccccc23)N1 ZINC000587766768 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2nn(C)c3ccccc23)N1 ZINC000587766770 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2nn(C)c3ccccc23)N1 ZINC000587766773 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2nn(C)c3ccccc23)N1 ZINC000587766775 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3c(c2)CCN3C)N1 ZINC000587766913 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3c(c2)CCN3C)N1 ZINC000587766914 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3c(c2)CCN3C)N1 ZINC000587766915 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3c(c2)CCN3C)N1 ZINC000587766916 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2C(c2ccccn2)(c2ccccn2)N1 ZINC000587767449 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C(c2ccccn2)(c2ccccn2)N1 ZINC000587767450 GI Annotated Anodyne CCOc1ccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587767467 GI Annotated Anodyne CCOc1ccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587767468 GI Annotated Anodyne CCOc1ccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587767469 GI Annotated Anodyne CCOc1ccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587767470 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3c(c2)CCN3C)N1 ZINC000587767507 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3c(c2)CCN3C)N1 ZINC000587767508 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3c(c2)CCN3C)N1 ZINC000587767509 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3c(c2)CCN3C)N1 ZINC000587767510 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2C2(CCN(C3CCCC3)CC2)N1 ZINC000587767759 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(CCN(C3CCCC3)CC2)N1 ZINC000587767761 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCN(C)c3ccccc32)N1 ZINC000587767776 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCN(C)c3ccccc32)N1 ZINC000587767778 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCN(C)c3ccccc32)N1 ZINC000587767780 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCN(C)c3ccccc32)N1 ZINC000587767781 GI Annotated Anodyne COc1cc(C)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587768035 GI Annotated Anodyne COc1cc(C)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587768068 GI Annotated Anodyne COc1cc(C)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587768070 GI Annotated Anodyne COc1cc(C)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587768073 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](CCc2ccc(CC#N)cn2)N1 ZINC000587768394 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@H](CCc2ccc(CC#N)cn2)N1 ZINC000587768397 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](CCc2ccc(CC#N)cn2)N1 ZINC000587768399 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](CCc2ccc(CC#N)cn2)N1 ZINC000587768400 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCN(C3CCCC3)C2)N1 ZINC000587768793 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCN(C3CCCC3)C2)N1 ZINC000587768795 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCN(C3CCCC3)C2)N1 ZINC000587768796 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCN(C3CCCC3)C2)N1 ZINC000587768798 GI Annotated Anodyne CC(C)Oc1ncccc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587768936 GI Annotated Anodyne CC(C)Oc1ncccc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587768937 GI Annotated Anodyne CC(C)Oc1ncccc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587768938 GI Annotated Anodyne CC(C)Oc1ncccc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587768939 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccnc(N3CCCC3)c2)N1 ZINC000587769233 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccnc(N3CCCC3)c2)N1 ZINC000587769235 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccnc(N3CCCC3)c2)N1 ZINC000587769237 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccnc(N3CCCC3)c2)N1 ZINC000587769238 GI Annotated Anodyne CC(C)CCN1CCC2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587769288 GI Annotated Anodyne CC(C)CCN1CCC2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587769290 GI Annotated Anodyne CC(C)=CCN1CCC2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587769315 GI Annotated Anodyne CC(C)=CCN1CCC2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587769317 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2cccnc2)(c2ccccn2)N1 ZINC000587769367 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2cccnc2)(c2ccccn2)N1 ZINC000587769369 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2cccnc2)(c2ccccn2)N1 ZINC000587769372 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2cccnc2)(c2ccccn2)N1 ZINC000587769375 GI Annotated Anodyne CCc1nc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c2ccccn12 ZINC000587769452 GI Annotated Anodyne CCc1nc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c2ccccn12 ZINC000587769455 GI Annotated Anodyne CCc1nc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c2ccccn12 ZINC000587769457 GI Annotated Anodyne CCc1nc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c2ccccn12 ZINC000587769461 GI Annotated Anodyne CC(C)Oc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587769540 GI Annotated Anodyne CC(C)Oc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587769542 GI Annotated Anodyne CC(C)Oc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587769543 GI Annotated Anodyne CC(C)Oc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587769544 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(CCN(c3ccccn3)CC2)N1 ZINC000587769720 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C2(CCN(c3ccccn3)CC2)N1 ZINC000587769721 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(CCN(Cc3ccco3)CC2)N1 ZINC000587769793 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C2(CCN(Cc3ccco3)CC2)N1 ZINC000587769794 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2cccnc2)(c2ccccn2)N1 ZINC000587769868 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2cccnc2)(c2ccccn2)N1 ZINC000587769871 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2cccnc2)(c2ccccn2)N1 ZINC000587769874 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2cccnc2)(c2ccccn2)N1 ZINC000587769878 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3c(c2)OCCN3C)N1 ZINC000587769909 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3c(c2)OCCN3C)N1 ZINC000587769920 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3c(c2)OCCN3C)N1 ZINC000587769923 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3c(c2)OCCN3C)N1 ZINC000587769927 GI Annotated Clean CC(C)=CCN1CCC2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587770197 GI Annotated Anodyne CC(C)=CCN1CCC2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587770198 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C(c2ccccn2)(c2ccccn2)N1 ZINC000587770378 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C(c2ccccn2)(c2ccccn2)N1 ZINC000587770380 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(CCN(c3ccccn3)CC2)N1 ZINC000587770702 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(CCN(c3ccccn3)CC2)N1 ZINC000587770705 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCN(c3ccccc3)C2)N1 ZINC000587770743 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCN(c3ccccc3)C2)N1 ZINC000587770744 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCN(c3ccccc3)C2)N1 ZINC000587770745 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCN(c3ccccc3)C2)N1 ZINC000587770746 GI Annotated Anodyne COc1cc(C)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587770911 GI Annotated Anodyne COc1cc(C)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587770912 GI Annotated Anodyne COc1cc(C)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587770913 GI Annotated Anodyne COc1cc(C)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587770914 GI Annotated Anodyne Cc1ccc2nc(C)c([C@@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)n2c1 ZINC000587770988 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(N1)[C@H]1CCC[C@H]2CN(C2CC2)C1 ZINC000587771020 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(N1)[C@H]1CCC[C@H]2CN(C2CC2)C1 ZINC000587771022 GI Annotated Anodyne Cc1ccc2nc(C)c([C@@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)n2c1 ZINC000587771029 GI Annotated Anodyne Cc1ccc2nc(C)c([C@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)n2c1 ZINC000587771031 GI Annotated Anodyne Cc1ccc2nc(C)c([C@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)n2c1 ZINC000587771033 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc(O)c3ccccc23)N1 ZINC000587771042 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc(O)c3ccccc23)N1 ZINC000587771068 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc(O)c3ccccc23)N1 ZINC000587771071 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc(O)c3ccccc23)N1 ZINC000587771073 GI Annotated Anodyne Cc1ccc2nc([C@@]3(C)N[C@H](C)Cc4cc(Br)c(F)cc43)cn2c1 ZINC000587771085 GI Annotated Anodyne Cc1ccc2nc([C@@]3(C)N[C@@H](C)Cc4cc(Br)c(F)cc43)cn2c1 ZINC000587771095 GI Annotated Anodyne Cc1ccc2nc([C@]3(C)N[C@H](C)Cc4cc(Br)c(F)cc43)cn2c1 ZINC000587771098 GI Annotated Anodyne Cc1ccc2nc([C@]3(C)N[C@@H](C)Cc4cc(Br)c(F)cc43)cn2c1 ZINC000587771100 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCN(C)c3ccccc32)N1 ZINC000587771127 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCN(C)c3ccccc32)N1 ZINC000587771130 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCN(C)c3ccccc32)N1 ZINC000587771133 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCN(C)c3ccccc32)N1 ZINC000587771136 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)c2cccnc2)N1 ZINC000587771337 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)c2cccnc2)N1 ZINC000587771340 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)c2cccnc2)N1 ZINC000587771343 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)c2cccnc2)N1 ZINC000587771345 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCN(C3CCCC3)C2)N1 ZINC000587771700 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCN(C3CCCC3)C2)N1 ZINC000587771702 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCN(C3CCCC3)C2)N1 ZINC000587771705 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCN(C3CCCC3)C2)N1 ZINC000587771706 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](C(C)(C)N2C[C@@H](C)O[C@H](C)C2)N1 ZINC000587771753 GI Annotated Anodyne C[C@H]1CN(C(C)(C)[C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)C[C@H](C)O1 ZINC000587771755 GI Annotated Anodyne C[C@H]1CN(C(C)(C)[C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)C[C@@H](C)O1 ZINC000587771757 GI Annotated Anodyne C[C@H]1CN(C(C)(C)[C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)C[C@@H](C)O1 ZINC000587771759 GI Annotated Anodyne CC(C)N1C[C@@H]2CCC[C@@H](C1)C21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587771855 GI Annotated Anodyne CC(C)N1C[C@@H]2CCC[C@@H](C1)C21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587771856 GI Annotated Anodyne Cc1cc(C)c([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(O)n1 ZINC000587771863 GI Annotated Anodyne Cc1cc(C)c([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(O)n1 ZINC000587771867 GI Annotated Anodyne Cc1cc(C)c([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(O)n1 ZINC000587771870 GI Annotated Anodyne Cc1cc(C)c([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(O)n1 ZINC000587771874 GI Annotated Anodyne Cc1cc(C)c([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(O)n1 ZINC000587771895 GI Annotated Anodyne Cc1cc(C)c([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(O)n1 ZINC000587771896 GI Annotated Anodyne Cc1cc(C)c([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(O)n1 ZINC000587771897 GI Annotated Anodyne Cc1cc(C)c([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(O)n1 ZINC000587771898 GI Annotated Anodyne CCCOc1ncccc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587772023 GI Annotated Anodyne CCCOc1ncccc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587772026 GI Annotated Anodyne CCCOc1ncccc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587772027 GI Annotated Anodyne CCCOc1ncccc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587772029 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(C[C@@H]3CC[C@H](C2)N3C2CC2)N1 ZINC000587772069 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C2(C[C@@H]3CC[C@H](C2)N3C2CC2)N1 ZINC000587772073 GI Annotated Anodyne Cc1nc2c(C)cccn2c1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587772149 GI Annotated Anodyne Cc1nc2c(C)cccn2c1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587772150 GI Annotated Anodyne Cc1nc2c(C)cccn2c1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587772151 GI Annotated Anodyne Cc1nc2c(C)cccn2c1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587772152 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc(C(C)(C)C)nc2)N1 ZINC000587772154 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc(C(C)(C)C)nc2)N1 ZINC000587772156 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc(C(C)(C)C)nc2)N1 ZINC000587772158 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc(C(C)(C)C)nc2)N1 ZINC000587772160 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccncc2)(c2ccccn2)N1 ZINC000587772497 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2ccncc2)(c2ccccn2)N1 ZINC000587772500 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccncc2)(c2ccccn2)N1 ZINC000587772502 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccncc2)(c2ccccn2)N1 ZINC000587772504 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](CCc2ccc(CC#N)cn2)N1 ZINC000587772618 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@H](CCc2ccc(CC#N)cn2)N1 ZINC000587772621 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](CCc2ccc(CC#N)cn2)N1 ZINC000587772624 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](CCc2ccc(CC#N)cn2)N1 ZINC000587772625 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3c(c2)OCCN3C)N1 ZINC000587773010 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3c(c2)OCCN3C)N1 ZINC000587773014 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3c(c2)OCCN3C)N1 ZINC000587773017 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3c(c2)OCCN3C)N1 ZINC000587773021 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2C2(N1)[C@H]1CC[C@H]2CN(C(C)(C)C)C1 ZINC000587773025 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(N1)[C@H]1CC[C@H]2CN(C(C)(C)C)C1 ZINC000587773026 GI Annotated Anodyne Cc1nc2ccccn2c1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587773057 GI Annotated Anodyne Cc1nc2ccccn2c1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587773058 GI Annotated Anodyne Cc1nc2ccccn2c1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587773060 GI Annotated Anodyne Cc1nc2ccccn2c1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587773061 GI Annotated Anodyne C[C@H](C#N)C[C@@]1(c2cccnc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587773095 GI Annotated Mild C[C@H](C#N)C[C@@]1(c2cccnc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587773096 GI Annotated Mild C[C@H](C#N)C[C@]1(c2cccnc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587773097 GI Annotated Mild C[C@H](C#N)C[C@]1(c2cccnc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587773098 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2C(c2cccnc2)(c2cccnc2)N1 ZINC000587773125 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C(c2cccnc2)(c2cccnc2)N1 ZINC000587773126 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)c2ccccn2)N1 ZINC000587773272 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)c2ccccn2)N1 ZINC000587773274 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)c2ccccn2)N1 ZINC000587773275 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)c2ccccn2)N1 ZINC000587773277 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc(-c3ccccn3)nc2)N1 ZINC000587773396 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc(-c3ccccn3)nc2)N1 ZINC000587773402 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc(-c3ccccn3)nc2)N1 ZINC000587773403 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc(-c3ccccn3)nc2)N1 ZINC000587773404 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C(c2cccnc2)(c2cccnc2)N1 ZINC000587773421 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C(c2cccnc2)(c2cccnc2)N1 ZINC000587773422 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(c2ncco2)N1 ZINC000587773441 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(c2ncco2)N1 ZINC000587773442 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(c2ncco2)N1 ZINC000587773443 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(c2ncco2)N1 ZINC000587773444 GI Annotated Anodyne COc1ncc(C)cc1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587773512 GI Annotated Anodyne COc1ncc(C)cc1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587773513 GI Annotated Anodyne COc1ncc(C)cc1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587773514 GI Annotated Anodyne COc1ncc(C)cc1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587773515 GI Annotated Anodyne CC(C)N1C[C@@H]2CCC[C@@H](C1)C21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587773693 GI Annotated Anodyne CC(C)N1C[C@@H]2CCC[C@@H](C1)C21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587773696 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc(C(C)(C)C)nc2)N1 ZINC000587773840 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc(C(C)(C)C)nc2)N1 ZINC000587773841 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc(C(C)(C)C)nc2)N1 ZINC000587773842 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc(C(C)(C)C)nc2)N1 ZINC000587773843 GI Annotated Anodyne CCOc1ccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587773912 GI Annotated Anodyne CCOc1ccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587773913 GI Annotated Anodyne CCOc1ccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587773914 GI Annotated Anodyne CCOc1ccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587773915 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)c2ccccn2)N1 ZINC000587773924 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)c2ccccn2)N1 ZINC000587773925 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)c2ccccn2)N1 ZINC000587773926 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)c2ccccn2)N1 ZINC000587773927 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)c2cccnc2)N1 ZINC000587774019 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)c2cccnc2)N1 ZINC000587774021 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)c2cccnc2)N1 ZINC000587774023 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)c2cccnc2)N1 ZINC000587774025 GI Annotated Anodyne Cc1nc2ccccn2c1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587774127 GI Annotated Anodyne Cc1nc2ccccn2c1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587774129 GI Annotated Anodyne Cc1nc2ccccn2c1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587774131 GI Annotated Anodyne Cc1nc2ccccn2c1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587774133 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C2(N1)[C@H]1CCC[C@H]2CN(C2CC2)C1 ZINC000587774159 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(N1)[C@H]1CCC[C@H]2CN(C2CC2)C1 ZINC000587774161 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2ccncc2)(c2ccccn2)N1 ZINC000587774260 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccncc2)(c2ccccn2)N1 ZINC000587774261 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccncc2)(c2ccccn2)N1 ZINC000587774262 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccncc2)(c2ccccn2)N1 ZINC000587774263 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc(-c3ccco3)nc2)N1 ZINC000587774288 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc(-c3ccco3)nc2)N1 ZINC000587774289 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc(-c3ccco3)nc2)N1 ZINC000587774290 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc(-c3ccco3)nc2)N1 ZINC000587774291 GI Annotated Anodyne Cc1ccc2nc(C)c([C@@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)n2c1 ZINC000587774292 GI Annotated Anodyne Cc1ccc2nc(C)c([C@@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)n2c1 ZINC000587774293 GI Annotated Anodyne Cc1ccc2nc(C)c([C@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)n2c1 ZINC000587774294 GI Annotated Anodyne Cc1ccc2nc(C)c([C@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)n2c1 ZINC000587774295 GI Annotated Anodyne C=C1C=C(C)n2c([C@@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)cnc2N1 ZINC000587774372 GI Annotated Anodyne C=C1C=C(C)n2c([C@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)cnc2N1 ZINC000587774373 GI Annotated Anodyne C=C1C=C(C)n2c([C@@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)cnc2N1 ZINC000587774374 GI Annotated Anodyne C=C1C=C(C)n2c([C@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)cnc2N1 ZINC000587774375 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](Cc2ccccn2)(C2CC2)N1 ZINC000587774737 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](Cc2ccccn2)(C2CC2)N1 ZINC000587774738 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](Cc2ccccn2)(C2CC2)N1 ZINC000587774739 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](Cc2ccccn2)(C2CC2)N1 ZINC000587774740 GI Annotated Anodyne CCc1nc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c2ccccn12 ZINC000587774757 GI Annotated Anodyne CCc1nc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c2ccccn12 ZINC000587774758 GI Annotated Anodyne CCc1nc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c2ccccn12 ZINC000587774759 GI Annotated Anodyne CCc1nc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c2ccccn12 ZINC000587774760 GI Annotated Anodyne CC(C)Oc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587774761 GI Annotated Anodyne CC(C)Oc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587774762 GI Annotated Anodyne CC(C)Oc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587774763 GI Annotated Anodyne CC(C)Oc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587774764 GI Annotated Anodyne CC(C)Oc1ncccc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587775025 GI Annotated Anodyne CC(C)Oc1ncccc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587775026 GI Annotated Anodyne CC(C)Oc1ncccc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587775027 GI Annotated Anodyne CC(C)Oc1ncccc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587775028 GI Annotated Anodyne COc1cc(CC[C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccn1 ZINC000587775049 GI Annotated Anodyne COc1cc(CC[C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccn1 ZINC000587775050 GI Annotated Anodyne COc1cc(CC[C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccn1 ZINC000587775051 GI Annotated Anodyne COc1cc(CC[C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccn1 ZINC000587775052 GI Annotated Anodyne COc1cc(CC[C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccn1 ZINC000587775321 GI Annotated Anodyne COc1cc(CC[C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccn1 ZINC000587775322 GI Annotated Anodyne COc1cc(CC[C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccn1 ZINC000587775323 GI Annotated Anodyne COc1cc(CC[C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccn1 ZINC000587775324 GI Annotated Anodyne CCCOc1ncccc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587775381 GI Annotated Anodyne CCCOc1ncccc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587775382 GI Annotated Anodyne CCCOc1ncccc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587775383 GI Annotated Anodyne CCCOc1ncccc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587775384 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](Cc2ccccn2)(C2CC2)N1 ZINC000587775389 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](Cc2ccccn2)(C2CC2)N1 ZINC000587775390 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](Cc2ccccn2)(C2CC2)N1 ZINC000587775391 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](Cc2ccccn2)(C2CC2)N1 ZINC000587775392 GI Annotated Anodyne Cc1ccc2nc([C@]3(C)N[C@H](C)Cc4ccc(F)c(Br)c43)cn2c1 ZINC000587775495 GI Annotated Anodyne Cc1ccc2nc([C@]3(C)N[C@@H](C)Cc4ccc(F)c(Br)c43)cn2c1 ZINC000587775496 GI Annotated Anodyne Cc1ccc2nc([C@@]3(C)N[C@H](C)Cc4ccc(F)c(Br)c43)cn2c1 ZINC000587775497 GI Annotated Anodyne Cc1ccc2nc([C@@]3(C)N[C@@H](C)Cc4ccc(F)c(Br)c43)cn2c1 ZINC000587775498 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(c2ncccn2)N1 ZINC000587775514 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(c2ncccn2)N1 ZINC000587775516 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(c2ncccn2)N1 ZINC000587775518 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(c2ncccn2)N1 ZINC000587775519 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(c2ncco2)N1 ZINC000587775576 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(c2ncco2)N1 ZINC000587775579 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(c2ncco2)N1 ZINC000587775581 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(c2ncco2)N1 ZINC000587775583 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc(O)c3ccccc23)N1 ZINC000587775681 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc(O)c3ccccc23)N1 ZINC000587775682 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc(O)c3ccccc23)N1 ZINC000587775683 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc(O)c3ccccc23)N1 ZINC000587775684 GI Annotated Anodyne Cc1ccn2c([C@@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)c(C)nc2c1 ZINC000587775888 GI Annotated Anodyne Cc1ccn2c([C@@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)c(C)nc2c1 ZINC000587775890 GI Annotated Anodyne Cc1ccn2c([C@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)c(C)nc2c1 ZINC000587775891 GI Annotated Anodyne Cc1ccn2c([C@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)c(C)nc2c1 ZINC000587775893 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(N1)[C@H]1CC[C@H]2CN(C(C)(C)C)C1 ZINC000587775895 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3cccnc3c2O)N1 ZINC000587775993 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3cccnc3c2O)N1 ZINC000587775994 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3cccnc3c2O)N1 ZINC000587775995 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3cccnc3c2O)N1 ZINC000587775996 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc(-c3ccccn3)nc2)N1 ZINC000587776021 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc(-c3ccccn3)nc2)N1 ZINC000587776022 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc(-c3ccccn3)nc2)N1 ZINC000587776023 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc(-c3ccccn3)nc2)N1 ZINC000587776024 GI Annotated Anodyne COc1cncc(CC[C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587776025 GI Annotated Anodyne COc1cncc(CC[C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587776026 GI Annotated Anodyne COc1cncc(CC[C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587776027 GI Annotated Anodyne COc1cncc(CC[C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587776028 GI Annotated Anodyne Cc1ccn2c([C@@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)c(C)nc2c1 ZINC000587776033 GI Annotated Anodyne Cc1ccn2c([C@@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)c(C)nc2c1 ZINC000587776034 GI Annotated Anodyne Cc1ccn2c([C@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)c(C)nc2c1 ZINC000587776035 GI Annotated Anodyne Cc1ccn2c([C@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)c(C)nc2c1 ZINC000587776036 GI Annotated Anodyne CCCCc1ncc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587776081 GI Annotated Anodyne CCCCc1ncc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587776083 GI Annotated Anodyne CCCCc1ncc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587776085 GI Annotated Anodyne CCCCc1ncc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587776086 GI Annotated Anodyne Cc1nc2ccccc2nc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587776118 GI Annotated Anodyne Cc1nc2ccccc2nc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587776121 GI Annotated Anodyne Cc1nc2ccccc2nc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587776125 GI Annotated Anodyne Cc1nc2ccccc2nc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587776126 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(N1)[C@H]1CC[C@H]2CN(C(C)(C)C)C1 ZINC000587776146 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C(c2ccncc2)(c2ccncc2)N1 ZINC000587776147 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C(c2ccncc2)(c2ccncc2)N1 ZINC000587776148 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cnc3cccnc3c2)N1 ZINC000587776175 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cnc3cccnc3c2)N1 ZINC000587776176 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cnc3cccnc3c2)N1 ZINC000587776177 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cnc3cccnc3c2)N1 ZINC000587776178 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(c2ccncn2)N1 ZINC000587776224 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(c2ccncn2)N1 ZINC000587776225 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(c2ccncn2)N1 ZINC000587776226 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(c2ccncn2)N1 ZINC000587776227 GI Annotated Anodyne C=C1C=C(C)n2c([C@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)cnc2N1 ZINC000587776404 GI Annotated Anodyne C=C1C=C(C)n2c([C@@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)cnc2N1 ZINC000587776405 GI Annotated Anodyne C=C1C=C(C)n2c([C@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)cnc2N1 ZINC000587776406 GI Annotated Anodyne C=C1C=C(C)n2c([C@@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)cnc2N1 ZINC000587776407 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3cccc(O)c3n2)N1 ZINC000587776452 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3cccc(O)c3n2)N1 ZINC000587776453 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3cccc(O)c3n2)N1 ZINC000587776454 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3cccc(O)c3n2)N1 ZINC000587776455 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3cccnc3c2O)N1 ZINC000587776456 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3cccnc3c2O)N1 ZINC000587776457 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3cccnc3c2O)N1 ZINC000587776458 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3cccnc3c2O)N1 ZINC000587776459 GI Annotated Clean CCCCc1ncc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587776520 GI Annotated Anodyne CCCCc1ncc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587776521 GI Annotated Anodyne CCCCc1ncc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587776522 GI Annotated Anodyne CCCCc1ncc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587776523 GI Annotated Anodyne COc1cncc(CC[C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587776626 GI Annotated Anodyne COc1cncc(CC[C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587776628 GI Annotated Anodyne COc1cncc(CC[C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587776629 GI Annotated Anodyne COc1cncc(CC[C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587776631 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(c2ncccn2)N1 ZINC000587776850 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(c2ncccn2)N1 ZINC000587776853 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(c2ncccn2)N1 ZINC000587776855 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(c2ncccn2)N1 ZINC000587776857 GI Annotated Anodyne C[C@H](C#N)C[C@@]1(c2cccnc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587776868 GI Annotated Mild C[C@H](C#N)C[C@@]1(c2cccnc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587776870 GI Annotated Mild C[C@H](C#N)C[C@]1(c2cccnc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587776871 GI Annotated Mild C[C@H](C#N)C[C@]1(c2cccnc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587776873 GI Annotated Mild Cc1nc2c(C)cccn2c1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587776881 GI Annotated Anodyne Cc1nc2c(C)cccn2c1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587776882 GI Annotated Anodyne Cc1nc2c(C)cccn2c1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587776883 GI Annotated Anodyne Cc1nc2c(C)cccn2c1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587776885 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc(-c3ccco3)nc2)N1 ZINC000587776941 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc(-c3ccco3)nc2)N1 ZINC000587776943 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc(-c3ccco3)nc2)N1 ZINC000587776945 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc(-c3ccco3)nc2)N1 ZINC000587776947 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(O)ccc3cccnc23)N1 ZINC000587776963 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(O)ccc3cccnc23)N1 ZINC000587776993 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(O)ccc3cccnc23)N1 ZINC000587776994 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(O)ccc3cccnc23)N1 ZINC000587776995 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3nc(O)oc3c2)N1 ZINC000587777156 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3nc(O)oc3c2)N1 ZINC000587777162 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3nc(O)oc3c2)N1 ZINC000587777163 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3nc(O)oc3c2)N1 ZINC000587777165 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(N1)c1cccnc1-c1ncccc12 ZINC000587777259 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C2(N1)c1cccnc1-c1ncccc12 ZINC000587777270 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(N1)c1ncccc1-c1cccnc12 ZINC000587777298 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C2(N1)c1ncccc1-c1cccnc12 ZINC000587777299 GI Annotated Anodyne CCOC(=O)Cc1nc2cc(OCc3ccccc3)c(Br)cc2[nH]1 ZINC000587777484 GI Annotated Anodyne CCOc1ccc(OCC)c(-c2nc3c(F)cnc(Br)c3[nH]2)c1 ZINC000587777565 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(c2cncnc2)N1 ZINC000587777758 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(c2cncnc2)N1 ZINC000587777759 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(c2cncnc2)N1 ZINC000587777760 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(c2cncnc2)N1 ZINC000587777762 GI Annotated Anodyne CCCCCOc1cc2nc(COCCOCC)[nH]c2cc1Br ZINC000587777842 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(O)ccc3ncccc23)N1 ZINC000587777929 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(O)ccc3ncccc23)N1 ZINC000587777930 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(O)ccc3ncccc23)N1 ZINC000587777931 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(O)ccc3ncccc23)N1 ZINC000587777932 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCC[C@@H]2c2cncnc2)N1 ZINC000587777986 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCC[C@@H]2c2cncnc2)N1 ZINC000587777987 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCC[C@H]2c2cncnc2)N1 ZINC000587777988 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCC[C@H]2c2cncnc2)N1 ZINC000587777989 GI Annotated Anodyne CCOc1ccc(OCC)c(-c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)c1 ZINC000587778086 GI Annotated Anodyne CCOc1ccc(OCC)c(-c2nc3cc(Br)c(C)nc3[nH]2)c1 ZINC000587778305 GI Annotated Anodyne CCOc1ccc(OCC)c(-c2nc3ccc(Br)c(O)c3[nH]2)c1 ZINC000587778324 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(c2ccncn2)N1 ZINC000587778417 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(c2ccncn2)N1 ZINC000587778418 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(c2ccncn2)N1 ZINC000587778419 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(c2ccncn2)N1 ZINC000587778420 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3nc(O)oc3c2)N1 ZINC000587778681 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3nc(O)oc3c2)N1 ZINC000587778682 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3nc(O)oc3c2)N1 ZINC000587778683 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3nc(O)oc3c2)N1 ZINC000587778684 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)c2ccncc2)N1 ZINC000587778949 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)c2ccncc2)N1 ZINC000587778950 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)c2ccncc2)N1 ZINC000587778951 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)c2ccncc2)N1 ZINC000587778952 GI Annotated Anodyne CCOc1cc(-c2nc3cc(C(=O)OC)cc(Br)c3[nH]2)ccc1C ZINC000587779065 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cnc3cccnc3c2)N1 ZINC000587779163 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cnc3cccnc3c2)N1 ZINC000587779164 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cnc3cccnc3c2)N1 ZINC000587779165 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cnc3cccnc3c2)N1 ZINC000587779168 GI Annotated Anodyne CCOCCOCc1nc2cc(OCCC(C)C)c(Br)cc2[nH]1 ZINC000587779219 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(O)ccc3cccnc23)N1 ZINC000587779411 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(O)ccc3cccnc23)N1 ZINC000587779412 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(O)ccc3cccnc23)N1 ZINC000587779413 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(O)ccc3cccnc23)N1 ZINC000587779414 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cnc3ccccc3n2)N1 ZINC000587779415 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cnc3ccccc3n2)N1 ZINC000587779416 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cnc3ccccc3n2)N1 ZINC000587779417 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cnc3ccccc3n2)N1 ZINC000587779418 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(c2cncnc2)N1 ZINC000587779431 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(c2cncnc2)N1 ZINC000587779432 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(c2cncnc2)N1 ZINC000587779433 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(c2cncnc2)N1 ZINC000587779434 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cnc3ccccc3n2)N1 ZINC000587779447 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cnc3ccccc3n2)N1 ZINC000587779448 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cnc3ccccc3n2)N1 ZINC000587779449 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cnc3ccccc3n2)N1 ZINC000587779450 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)c2ccncc2)N1 ZINC000587779505 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)c2ccncc2)N1 ZINC000587779506 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)c2ccncc2)N1 ZINC000587779507 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)c2ccncc2)N1 ZINC000587779508 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(O)ccc3ncccc23)N1 ZINC000587779521 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(O)ccc3ncccc23)N1 ZINC000587779522 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(O)ccc3ncccc23)N1 ZINC000587779523 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(O)ccc3ncccc23)N1 ZINC000587779524 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc3ccccc3nc2O)N1 ZINC000587779787 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc3ccccc3nc2O)N1 ZINC000587779788 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc3ccccc3nc2O)N1 ZINC000587779789 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc3ccccc3nc2O)N1 ZINC000587779790 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(N1)c1ncccc1-c1cccnc12 ZINC000587779791 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(N1)c1ncccc1-c1cccnc12 ZINC000587779792 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(N1)c1cccnc1-c1ncccc12 ZINC000587779793 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(N1)c1cccnc1-c1ncccc12 ZINC000587779794 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3cccc(O)c3n2)N1 ZINC000587779815 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3cccc(O)c3n2)N1 ZINC000587779816 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3cccc(O)c3n2)N1 ZINC000587779817 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3cccc(O)c3n2)N1 ZINC000587779818 GI Annotated Anodyne CCOc1ccccc1OCc1nc2cc(Br)cc(C(=O)O)c2[nH]1 ZINC000587779847 GI Annotated Anodyne CCOc1ccccc1OCc1nc2c(Br)cnc(Cl)c2[nH]1 ZINC000587779875 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCC[C@@H]2c2cncnc2)N1 ZINC000587780002 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCC[C@@H]2c2cncnc2)N1 ZINC000587780003 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCC[C@H]2c2cncnc2)N1 ZINC000587780004 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCC[C@H]2c2cncnc2)N1 ZINC000587780006 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C(c2ccncc2)(c2ccncc2)N1 ZINC000587780115 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C(c2ccncc2)(c2ccncc2)N1 ZINC000587780116 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc3ccccc3nc2O)N1 ZINC000587780134 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc3ccccc3nc2O)N1 ZINC000587780136 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc3ccccc3nc2O)N1 ZINC000587780137 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc3ccccc3nc2O)N1 ZINC000587780138 GI Annotated Anodyne CCOc1ccccc1OCc1nc2cc(Br)cc([N+](=O)[O-])c2[nH]1 ZINC000587780193 GI Annotated Bother Cc1nc2ccccc2nc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587780299 GI Annotated Anodyne Cc1nc2ccccc2nc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587780300 GI Annotated Anodyne Cc1nc2ccccc2nc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587780301 GI Annotated Anodyne Cc1nc2ccccc2nc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587780302 GI Annotated Anodyne CCOc1ccccc1OCc1nc2c(Cl)c(Br)cnc2[nH]1 ZINC000587780340 GI Annotated Anodyne CCOc1ccccc1OCc1nc2ccc3c(c2[nH]1)C(=O)c1ccccc1C3=O ZINC000587780407 GI Annotated Clean CCOc1ccccc1OCc1nc2ccc(Br)c([N+](=O)[O-])c2[nH]1 ZINC000587780413 GI Annotated Bother CCOc1ccccc1OCc1nc2ccc(I)cc2[nH]1 ZINC000587780424 GI Annotated Anodyne CCOc1ccccc1OCc1nc2cccc(I)c2[nH]1 ZINC000587780460 GI Annotated Anodyne O=[N+]([O-])c1c(Br)ccc2nc(COC/C=C\c3ccccc3)[nH]c12 ZINC000587780847 GI Annotated Bother O=[N+]([O-])c1c(Br)ccc2nc(COC/C=C/c3ccccc3)[nH]c12 ZINC000587780848 GI Annotated Bother O=S(=O)(c1ccc2nc(COC/C=C\c3ccccc3)[nH]c2c1)C(F)(F)F ZINC000587780875 GI Annotated Anodyne O=S(=O)(c1ccc2nc(COC/C=C/c3ccccc3)[nH]c2c1)C(F)(F)F ZINC000587780876 GI Annotated Anodyne O=C(Cc1nc2cc(Cl)cc(Br)c2[nH]1)OCc1ccccc1 ZINC000587781047 GI Annotated Anodyne Ic1cccc2nc(COC/C=C/c3ccccc3)[nH]c12 ZINC000587781111 GI Annotated Anodyne Ic1cccc2nc(COC/C=C\c3ccccc3)[nH]c12 ZINC000587781112 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc(COC/C=C\c3ccccc3)[nH]c12 ZINC000587781114 GI Annotated Anodyne O=C(O)c1cc(Br)cc2nc(COC/C=C/c3ccccc3)[nH]c12 ZINC000587781115 GI Annotated Anodyne Ic1ccc2nc(COC/C=C\c3ccccc3)[nH]c2c1 ZINC000587781311 GI Annotated Anodyne Ic1ccc2nc(COC/C=C/c3ccccc3)[nH]c2c1 ZINC000587781312 GI Annotated Anodyne O=[N+]([O-])c1cc(Br)cc2nc(COC/C=C\c3ccccc3)[nH]c12 ZINC000587781510 GI Annotated Bother O=[N+]([O-])c1cc(Br)cc2nc(COC/C=C/c3ccccc3)[nH]c12 ZINC000587781511 GI Annotated Bother N#Cc1nc(Cl)cc2nc(-c3cc(OCc4ccccc4)ccc3O)[nH]c12 ZINC000587781684 GI Annotated Mild O=C(Cc1nc2cc(Br)cc(Cl)c2[nH]1)OCc1ccccc1 ZINC000587781967 GI Annotated Anodyne Oc1ccc(OCc2ccccc2)cc1-c1nc2nc(Br)c[nH]c-2n1 ZINC000587782065 GI Annotated Anodyne O=C(O)c1cc(F)cc2nc(-c3cc(OCc4ccccc4)ccc3O)[nH]c12 ZINC000587782521 GI Annotated Anodyne O=C(Cc1nc2cc(OC(F)(F)F)c(Cl)cc2[nH]1)OCc1ccccc1 ZINC000587782667 GI Annotated Anodyne Oc1ccc(OCc2ccccc2)cc1-c1nc2cnc(C(F)(F)F)[nH]c-2n1 ZINC000587782963 GI Annotated Anodyne COC(=O)C[C@H](C)Cc1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587783054 GI Annotated Anodyne COC(=O)C[C@H](C)Cc1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587783119 GI Annotated Anodyne COC(=O)C[C@H](C)Cc1nc2cc(OCC(C)C)c(Br)cc2[nH]1 ZINC000587783124 GI Annotated Anodyne COC(=O)C[C@H](C)Cc1nc2cc(OCCC(C)C)c(Br)cc2[nH]1 ZINC000587783217 GI Annotated Anodyne COC(=O)Cc1ccccc1-c1nc2cc(Cl)cc(Br)c2[nH]1 ZINC000587783239 GI Annotated Anodyne CCCCOc1cc2nc(C[C@@H](C)CC(=O)OC)[nH]c2cc1Br ZINC000587783266 GI Annotated Anodyne COc1ccc(-c2nnc(-c3ccc4nc(CCOCC5CC5)[nH]c4c3)o2)cc1 ZINC000587783319 GI Annotated Anodyne COC(=O)C[C@H](C)Cc1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587783380 GI Annotated Anodyne COC(=O)c1cc2nc(CCOCC3CC3)[nH]c2c(F)c1Nc1ccccc1 ZINC000587783451 GI Annotated Anodyne COC(=O)C[C@H](C)Cc1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587783692 GI Annotated Anodyne COc1cc(-c2nc3cc(Br)c(C)c(C)c3[nH]2)cc(OC)c1O ZINC000587784043 GI Annotated Anodyne FC(F)(F)Oc1cc(Br)c2[nH]c(CCOCC3CC3)nc2c1 ZINC000587784105 GI Annotated Anodyne Oc1nc(S)nc2[nH]c(/C=C/c3ccc(OCc4ccccc4)cc3)nc12 ZINC000587784125 GI Annotated Anodyne Oc1nc(S)nc2[nH]c(/C=C\c3ccc(OCc4ccccc4)cc3)nc12 ZINC000587784126 GI Annotated Anodyne N=c1[nH]c2nc(/C=C/c3ccc(OCc4ccccc4)cc3)nc-2c(Cl)[nH]1 ZINC000587784154 GI Annotated Anodyne N=c1[nH]c2nc(/C=C\c3ccc(OCc4ccccc4)cc3)nc-2c(Cl)[nH]1 ZINC000587784155 GI Annotated Anodyne FC(F)(F)Oc1cc(Br)cc2nc(CCOCC3CC3)[nH]c12 ZINC000587784279 GI Annotated Anodyne C(=C\c1nc2ccc(-n3cnnn3)cc2[nH]1)\c1ccc(OCc2ccccc2)cc1 ZINC000587784345 GI Annotated Anodyne C(=C/c1nc2ccc(-n3cnnn3)cc2[nH]1)\c1ccc(OCc2ccccc2)cc1 ZINC000587784347 GI Annotated Anodyne COC(=O)c1ccc2nc(/C=C/c3ccc(OCc4ccccc4)cc3)[nH]c2n1 ZINC000587784365 GI Annotated Anodyne COC(=O)c1ccc2nc(/C=C\c3ccc(OCc4ccccc4)cc3)[nH]c2n1 ZINC000587784366 GI Annotated Anodyne COC(=O)[C@@H]1C[C@@H]1c1ccc(-c2nc3c(F)cc(Br)cc3[nH]2)cc1 ZINC000587784476 GI Annotated Anodyne COC(=O)[C@H]1C[C@@H]1c1ccc(-c2nc3c(F)cc(Br)cc3[nH]2)cc1 ZINC000587784477 GI Annotated Anodyne COC(=O)[C@@H]1C[C@H]1c1ccc(-c2nc3c(F)cc(Br)cc3[nH]2)cc1 ZINC000587784478 GI Annotated Anodyne COC(=O)[C@H]1C[C@H]1c1ccc(-c2nc3c(F)cc(Br)cc3[nH]2)cc1 ZINC000587784479 GI Annotated Anodyne COc1cc(/C=C\c2nc3cc(C)cc(Br)c3[nH]2)cc(O)c1O ZINC000587784629 GI Annotated Clean COc1cc(/C=C/c2nc3cc(C)cc(Br)c3[nH]2)cc(O)c1O ZINC000587784632 GI Annotated Clean FC(F)(F)Oc1cc2nc(CCOCC3CC3)[nH]c2cc1Br ZINC000587784649 GI Annotated Anodyne COc1cc(/C=C\c2nc3cc(C)c(Br)cc3[nH]2)cc(O)c1O ZINC000587784965 GI Annotated Clean COc1cc(/C=C/c2nc3cc(C)c(Br)cc3[nH]2)cc(O)c1O ZINC000587784967 GI Annotated Clean COc1cc(/C=C\c2nc3ccc(Br)c(F)c3[nH]2)cc(O)c1O ZINC000587785006 GI Annotated Clean COc1cc(/C=C/c2nc3ccc(Br)c(F)c3[nH]2)cc(O)c1O ZINC000587785013 GI Annotated Clean COc1cc(-c2nc3cc(C(F)(F)C(F)(F)F)ncc3[nH]2)cc(OC)c1O ZINC000587785025 GI Annotated Anodyne COc1cc(/C=C\c2nc3cc(F)cc(Br)c3[nH]2)cc(O)c1O ZINC000587785033 GI Annotated Clean COc1cc(/C=C/c2nc3cc(F)cc(Br)c3[nH]2)cc(O)c1O ZINC000587785034 GI Annotated Clean COc1cc(/C=C\c2nc3ccc(F)c(Br)c3[nH]2)cc(O)c1O ZINC000587785045 GI Annotated Clean COc1cc(/C=C/c2nc3ccc(F)c(Br)c3[nH]2)cc(O)c1O ZINC000587785046 GI Annotated Clean COC(=O)c1ccnc2[nH]c(/C=C/c3ccc(OCc4ccccc4)cc3)nc12 ZINC000587785211 GI Annotated Anodyne COC(=O)c1ccnc2[nH]c(/C=C\c3ccc(OCc4ccccc4)cc3)nc12 ZINC000587785212 GI Annotated Anodyne COc1cc(/C=C\c2nc3cc4nc5ccccc5nc4cc3[nH]2)cc(O)c1O ZINC000587785304 GI Annotated Clean COc1cc(-c2nc3cc(Cl)cc(Br)c3[nH]2)cc(OC)c1O ZINC000587785309 GI Annotated Anodyne COc1cc(/C=C/c2nc3cc4nc5ccccc5nc4cc3[nH]2)cc(O)c1O ZINC000587785313 GI Annotated Clean COc1cc(/C=C/c2nc3ccc(C(=O)c4ccccc4)cc3[nH]2)cc(O)c1O ZINC000587785418 GI Annotated Clean COc1cc(/C=C\c2nc3ccc(C(=O)c4ccccc4)cc3[nH]2)cc(O)c1O ZINC000587785420 GI Annotated Clean COc1cc(/C=C\c2nc3ccc(Br)c(C)c3[nH]2)cc(O)c1O ZINC000587785604 GI Annotated Clean COc1cc(/C=C/c2nc3ccc(Br)c(C)c3[nH]2)cc(O)c1O ZINC000587785605 GI Annotated Clean COc1ccc(C=O)c(-c2nc3c(F)c(F)c(Br)cc3[nH]2)c1OC ZINC000587785688 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(-c3c(C)cccc3OC)nc2c1 ZINC000587785780 GI Annotated Anodyne COc1ccc(C)cc1C(=O)CCc1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587785782 GI Annotated Anodyne COc1cc(/C=C\c2nc3c4cccnc4c4ncccc4c3[nH]2)cc(O)c1O ZINC000587785854 GI Annotated Clean COc1cc(/C=C/c2nc3c4cccnc4c4ncccc4c3[nH]2)cc(O)c1O ZINC000587785855 GI Annotated Clean COc1cc(/C=C\c2nc3cc(Br)c(F)cc3[nH]2)cc(O)c1O ZINC000587785895 GI Annotated Clean COc1cc(/C=C/c2nc3cc(Br)c(F)cc3[nH]2)cc(O)c1O ZINC000587785897 GI Annotated Clean COc1ccc(-c2nc3c(Br)cnc(Cl)c3[nH]2)c(OC)c1C ZINC000587786032 GI Annotated Anodyne COc1cc(/C=C\c2nc3cc(Br)cc(C)c3[nH]2)cc(O)c1O ZINC000587786230 GI Annotated Clean COc1cc(/C=C/c2nc3cc(Br)cc(C)c3[nH]2)cc(O)c1O ZINC000587786232 GI Annotated Clean COc1ccc(-c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)c(OC)c1C ZINC000587786259 GI Annotated Bother COc1ccc(-c2nc3cc(Br)cc(C(=O)O)c3[nH]2)c(OC)c1C ZINC000587786292 GI Annotated Anodyne COc1cccc(C)c1-c1nc2c(I)cnc(Cl)c2[nH]1 ZINC000587786334 GI Annotated Anodyne COc1cccc(C)c1-c1nc2c(Br)cnc(Br)c2[nH]1 ZINC000587786354 GI Annotated Anodyne COc1cc(/C=C\c2nc3cc(Br)cc(F)c3[nH]2)cc(O)c1O ZINC000587786375 GI Annotated Clean COc1cc(/C=C/c2nc3cc(Br)cc(F)c3[nH]2)cc(O)c1O ZINC000587786376 GI Annotated Clean COc1cc(-c2nc3cc(Br)cc(Cl)c3[nH]2)cc(OC)c1O ZINC000587786461 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(CCC(=O)c3cc(C)ccc3OC)nc2c1 ZINC000587786568 GI Annotated Anodyne COc1ccc(C=O)c(-c2nc3c(C)cc(Br)cc3[nH]2)c1OC ZINC000587786632 GI Annotated Anodyne COc1ccc(C=O)c(-c2nc3c(Cl)cc(Br)cc3[nH]2)c1OC ZINC000587786637 GI Annotated Anodyne COc1ccc(C=O)c(-c2nc3cc(Br)c(C)cc3[nH]2)c1OC ZINC000587786675 GI Annotated Anodyne COc1cc(/C=C\c2nc3cc(Br)c(F)c(F)c3[nH]2)cc(O)c1O ZINC000587786739 GI Annotated Clean COc1cc(/C=C/c2nc3cc(Br)c(F)c(F)c3[nH]2)cc(O)c1O ZINC000587786740 GI Annotated Clean COc1ccc(-c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)c(OC)c1C ZINC000587786852 GI Annotated Bother COc1ccc(-c2nc3cccc(I)c3[nH]2)c(OC)c1C ZINC000587786890 GI Annotated Anodyne COc1cc(/C=C\c2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)cc(O)c1O ZINC000587786933 GI Annotated Mild COc1cc(/C=C/c2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)cc(O)c1O ZINC000587786936 GI Annotated Mild COC(=O)[C@H]1C[C@@H]1c1ccc(-c2nc3c(F)c(Br)ccc3[nH]2)cc1 ZINC000587787029 GI Annotated Anodyne COC(=O)[C@@H]1C[C@H]1c1ccc(-c2nc3c(F)c(Br)ccc3[nH]2)cc1 ZINC000587787030 GI Annotated Anodyne COC(=O)[C@H]1C[C@H]1c1ccc(-c2nc3c(F)c(Br)ccc3[nH]2)cc1 ZINC000587787032 GI Annotated Anodyne COC(=O)[C@@H]1C[C@@H]1c1ccc(-c2nc3c(F)c(Br)ccc3[nH]2)cc1 ZINC000587787034 GI Annotated Anodyne COc1ccc(C=O)c(-c2nc3c(C)c(Br)ccc3[nH]2)c1OC ZINC000587787171 GI Annotated Anodyne COc1ccc(-c2cccc(-c3nc4cnc(C(F)(F)F)[nH]c-4n3)c2)cc1O ZINC000587787243 GI Annotated Anodyne COc1ccc(C=O)c(-c2nc3c(Br)cc(Cl)cc3[nH]2)c1OC ZINC000587787245 GI Annotated Anodyne COc1ccc(-c2cccc(-c3nc4nc(Br)c[nH]c-4n3)c2)cc1O ZINC000587787272 GI Annotated Anodyne COC(=O)[C@H]1C[C@H]1c1ccc(-c2nc3c(Br)cc(C#N)cc3[nH]2)cc1 ZINC000587787394 GI Annotated Mild COC(=O)[C@H]1C[C@@H]1c1ccc(-c2nc3c(Br)cc(C#N)cc3[nH]2)cc1 ZINC000587787395 GI Annotated Mild COC(=O)[C@@H]1C[C@H]1c1ccc(-c2nc3c(Br)cc(C#N)cc3[nH]2)cc1 ZINC000587787396 GI Annotated Mild COC(=O)[C@@H]1C[C@@H]1c1ccc(-c2nc3c(Br)cc(C#N)cc3[nH]2)cc1 ZINC000587787397 GI Annotated Mild COc1ccc(C=O)c(-c2nc3c(C)c(C)c(Br)cc3[nH]2)c1OC ZINC000587787557 GI Annotated Anodyne COc1cccc(-c2nc3c(Br)ccc(Br)c3[nH]2)c1O ZINC000587787566 GI Annotated Anodyne COc1ccc(-c2nc3ccc(I)cc3[nH]2)c(OC)c1C ZINC000587787570 GI Annotated Anodyne COc1ccc(C)cc1C(=O)CCc1nc2ccc(Br)c(O)c2[nH]1 ZINC000587787628 GI Annotated Anodyne COc1ccc(C=O)c(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)c1OC ZINC000587787755 GI Annotated Bother COc1ccc(C)cc1C(=O)CCc1nc2cc(Br)c(C)nc2[nH]1 ZINC000587787787 GI Annotated Anodyne COc1ccc(-c2cccc(-c3nc4cc5c(cc4[nH]3)NC(=O)CC5)c2)cc1O ZINC000587787829 GI Annotated Anodyne COc1ccc(C=O)c(-c2nc3c(Br)cc(C)cc3[nH]2)c1OC ZINC000587787846 GI Annotated Anodyne COc1ccc(C)cc1C(=O)CCc1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587787953 GI Annotated Anodyne COc1ccc(C)cc1C(=O)CCc1nc2cc(C#N)cc(Br)c2[nH]1 ZINC000587788034 GI Annotated Mild COc1ccc(-c2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)c(OC)c1C ZINC000587788113 GI Annotated Clean COc1ccc(C)cc1C(=O)CCc1nc2c(C)c(Br)cnc2[nH]1 ZINC000587788176 GI Annotated Anodyne CCC[C@H](C)OC(=O)C[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587788793 GI Annotated Anodyne CCC[C@H](C)OC(=O)C[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587788794 GI Annotated Anodyne CCC[C@H](C)OC(=O)C[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587788796 GI Annotated Anodyne CCC[C@H](C)OC(=O)C[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587788798 GI Annotated Anodyne COc1ccc2c(c1)NCC[C@@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587789234 GI Annotated Anodyne COc1ccc2c(c1)NCC[C@@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587789235 GI Annotated Anodyne COc1ccc2c(c1)NCC[C@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587789236 GI Annotated Anodyne COc1ccc2c(c1)NCC[C@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587789237 GI Annotated Anodyne CCCCOC(=O)CC[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587789268 GI Annotated Anodyne CCCCOC(=O)CC[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587789278 GI Annotated Anodyne CCCCOC(=O)CC[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587789279 GI Annotated Anodyne CCCCOC(=O)CC[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587789280 GI Annotated Anodyne COCCOc1ccccc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587789422 GI Annotated Anodyne Cc1[nH]c([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)c1C(=O)O ZINC000587789434 GI Annotated Anodyne COCCOc1ccccc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587789436 GI Annotated Anodyne COCCOc1ccccc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587789438 GI Annotated Anodyne Cc1[nH]c([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)c1C(=O)O ZINC000587789440 GI Annotated Anodyne COCCOc1ccccc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587789441 GI Annotated Anodyne Cc1[nH]c([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)c1C(=O)O ZINC000587789442 GI Annotated Anodyne Cc1[nH]c([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)c1C(=O)O ZINC000587789444 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(CC(C(=O)OC(C)(C)C)C2)N1 ZINC000587789453 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(CC(C(=O)OC(C)(C)C)C2)N1 ZINC000587789454 GI Annotated Anodyne COCC[C@]1(c2ccccc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587789480 GI Annotated Anodyne COCC[C@@]1(c2ccccc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587789484 GI Annotated Anodyne COCC[C@]1(c2ccccc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587789486 GI Annotated Anodyne COCC[C@@]1(c2ccccc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587789488 GI Annotated Anodyne CCOC(=O)c1[nH]c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1C ZINC000587789750 GI Annotated Anodyne CCOC(=O)c1[nH]c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1C ZINC000587789753 GI Annotated Anodyne CCOC(=O)c1[nH]c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1C ZINC000587789756 GI Annotated Anodyne CCOC(=O)c1[nH]c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1C ZINC000587789760 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCN2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587789886 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCN2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587789889 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCN2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587789892 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCN2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587789895 GI Annotated Anodyne Cc1[nH]c(C(=O)O)c(C)c1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790067 GI Annotated Anodyne Cc1[nH]c(C(=O)O)c(C)c1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790068 GI Annotated Anodyne Cc1[nH]c(C(=O)O)c(C)c1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790069 GI Annotated Anodyne Cc1[nH]c(C(=O)O)c(C)c1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790070 GI Annotated Anodyne CCCCCOC(=O)C[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790255 GI Annotated Anodyne CCCCCOC(=O)C[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790256 GI Annotated Anodyne CCCCCOC(=O)C[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790257 GI Annotated Anodyne CCCCCOC(=O)C[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790258 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCN2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790490 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCN2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790493 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCN2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790495 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCN2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790497 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(c2ncc[nH]2)N1 ZINC000587790599 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(c2ncc[nH]2)N1 ZINC000587790600 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(c2ncc[nH]2)N1 ZINC000587790601 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(c2ncc[nH]2)N1 ZINC000587790602 GI Annotated Anodyne CC/C=C/CCOC(=O)[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790759 GI Annotated Anodyne CC/C=C\CCOC(=O)[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790760 GI Annotated Anodyne CC/C=C/CCOC(=O)[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790761 GI Annotated Anodyne CC/C=C\CCOC(=O)[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587790762 GI Annotated Anodyne COCCOc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587790849 GI Annotated Anodyne COCCOc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587790851 GI Annotated Anodyne COCCOc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587790853 GI Annotated Anodyne COCCOc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587790854 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(Cc3ccc[nH]3)[nH]2)N1 ZINC000587790867 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(Cc3ccc[nH]3)[nH]2)N1 ZINC000587790868 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(Cc3ccc[nH]3)[nH]2)N1 ZINC000587790869 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(Cc3ccc[nH]3)[nH]2)N1 ZINC000587790870 GI Annotated Anodyne COc1ccc(OC)c(-c2nc3ccc(Br)c(C)c3[nH]2)c1OC ZINC000587791032 GI Annotated Anodyne Cc1cccc2c1NCC[C@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587791089 GI Annotated Anodyne Cc1cccc2c1NCC[C@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587791091 GI Annotated Anodyne Cc1cccc2c1NCC[C@@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587791092 GI Annotated Anodyne Cc1cccc2c1NCC[C@@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587791093 GI Annotated Anodyne COc1ccc2[nH]nc([C@@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)c2c1 ZINC000587791150 GI Annotated Anodyne COc1ccc2[nH]nc([C@@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)c2c1 ZINC000587791151 GI Annotated Anodyne COc1ccc2[nH]nc([C@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)c2c1 ZINC000587791152 GI Annotated Anodyne COc1ccc2[nH]nc([C@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)c2c1 ZINC000587791153 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(Cc3ccc[nH]3)[nH]2)N1 ZINC000587791283 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(Cc3ccc[nH]3)[nH]2)N1 ZINC000587791284 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(Cc3ccc[nH]3)[nH]2)N1 ZINC000587791285 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(Cc3ccc[nH]3)[nH]2)N1 ZINC000587791286 GI Annotated Anodyne COCCOc1ccccc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791332 GI Annotated Anodyne COCCOc1ccccc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791334 GI Annotated Anodyne COCCOc1ccccc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791335 GI Annotated Anodyne COCCOc1ccccc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791336 GI Annotated Anodyne COCCOc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587791337 GI Annotated Anodyne COCCOc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587791338 GI Annotated Anodyne COCCOc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587791340 GI Annotated Anodyne COCCOc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587791342 GI Annotated Anodyne COc1n[nH]c2ccc([C@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)cc12 ZINC000587791473 GI Annotated Anodyne COc1n[nH]c2ccc([C@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)cc12 ZINC000587791475 GI Annotated Anodyne COc1n[nH]c2ccc([C@@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)cc12 ZINC000587791476 GI Annotated Anodyne COc1n[nH]c2ccc([C@@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)cc12 ZINC000587791478 GI Annotated Anodyne Cc1[nH]nc2c1[C@]1(CC(C)(C)C2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587791498 GI Annotated Anodyne Cc1[nH]nc2c1[C@@]1(CC(C)(C)C2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587791499 GI Annotated Anodyne Cc1[nH]nc2c1[C@]1(CC(C)(C)C2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587791500 GI Annotated Anodyne Cc1[nH]nc2c1[C@@]1(CC(C)(C)C2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587791502 GI Annotated Anodyne CC(C)C[C@]1([C@H]2CCCNC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791513 GI Annotated Anodyne CC(C)C[C@]1([C@@H]2CCCNC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791515 GI Annotated Anodyne CC(C)C[C@]1([C@H]2CCCNC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791516 GI Annotated Anodyne CC(C)C[C@]1([C@@H]2CCCNC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791517 GI Annotated Anodyne CC(C)C[C@]1([C@H]2CCCNC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587791525 GI Annotated Anodyne CC(C)C[C@]1([C@@H]2CCCNC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587791528 GI Annotated Anodyne CC(C)C[C@]1([C@H]2CCCNC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587791529 GI Annotated Anodyne CC(C)C[C@]1([C@@H]2CCCNC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587791531 GI Annotated Anodyne Cc1[nH]c(C(=O)O)c(C)c1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791570 GI Annotated Anodyne Cc1[nH]c(C(=O)O)c(C)c1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791573 GI Annotated Anodyne Cc1[nH]c(C(=O)O)c(C)c1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791575 GI Annotated Anodyne Cc1[nH]c(C(=O)O)c(C)c1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791576 GI Annotated Anodyne COc1ccc2c(c1)NCC[C@@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791650 GI Annotated Anodyne Cc1noc(C2CCC3(CC2)N[C@@H](C)Cc2ccc(F)c(Br)c23)n1 ZINC000587791651 GI Annotated Anodyne COc1ccc2c(c1)NCC[C@@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791652 GI Annotated Anodyne COc1ccc2c(c1)NCC[C@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791653 GI Annotated Anodyne COc1ccc2c(c1)NCC[C@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587791655 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)c1ccccc1N[C@@H]2C ZINC000587791657 GI Annotated Anodyne C[C@@H]1Nc2ccccc2C(=O)[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587791658 GI Annotated Anodyne C[C@@H]1Nc2ccccc2C(=O)[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587791661 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)c1ccccc1N[C@@H]2C ZINC000587791664 GI Annotated Anodyne Cc1noc(C2CCC3(CC2)N[C@H](C)Cc2ccc(F)c(Br)c23)n1 ZINC000587791666 GI Annotated Anodyne COc1ccc(C=O)c(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c1OC ZINC000587791817 GI Annotated Bother COc1ccc(OC)c(-c2nc3cc(C)cc(Br)c3[nH]2)c1OC ZINC000587791847 GI Annotated Anodyne CCCCOC(=O)[C@@H]1CCC[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587791875 GI Annotated Anodyne CCCCOC(=O)[C@@H]1CCC[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587791876 GI Annotated Anodyne CCCCOC(=O)[C@@H]1CCC[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587791877 GI Annotated Anodyne CCCCOC(=O)[C@@H]1CCC[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587791878 GI Annotated Anodyne COCCOc1cccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587791911 GI Annotated Anodyne COCCOc1cccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587791912 GI Annotated Anodyne COCCOc1cccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587791913 GI Annotated Anodyne COCCOc1cccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587791914 GI Annotated Anodyne CCOC(=O)[C@]1(CC(C)(C)C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792156 GI Annotated Anodyne CCOC(=O)[C@]1(CC(C)(C)C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792157 GI Annotated Anodyne CCOC(=O)[C@@]1(CC(C)(C)C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792158 GI Annotated Anodyne CCOC(=O)[C@@]1(CC(C)(C)C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792159 GI Annotated Anodyne CCOC(=O)C1([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)CCCC1 ZINC000587792227 GI Annotated Anodyne CCOC(=O)C1([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)CCCC1 ZINC000587792228 GI Annotated Anodyne CCOC(=O)C1([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)CCCC1 ZINC000587792230 GI Annotated Anodyne CCOC(=O)C1([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)CCCC1 ZINC000587792231 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC(C)C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792242 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC(C)C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792243 GI Annotated Anodyne CCOC(=O)C[C@]1(CC(C)C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792244 GI Annotated Anodyne CCOC(=O)C[C@]1(CC(C)C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792245 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCC[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587792247 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCC[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587792249 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCC[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587792251 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCC[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587792253 GI Annotated Anodyne CCOC(=O)C1CCC2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587792286 GI Annotated Anodyne CCOC(=O)C1CCC2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587792288 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@@H](C)N[C@@H]3CCCC[C@H]32)N1 ZINC000587792314 GI Annotated Anodyne C[C@@H]1C[C@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)[C@@H]2CCCC[C@H]2N1 ZINC000587792315 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@@H](C)N[C@@H]3CCCC[C@H]32)N1 ZINC000587792317 GI Annotated Anodyne C[C@@H]1C[C@@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)[C@@H]2CCCC[C@H]2N1 ZINC000587792318 GI Annotated Anodyne CCCCOC(=O)CC[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587792347 GI Annotated Anodyne CCCCOC(=O)CC[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587792348 GI Annotated Anodyne CCCCOC(=O)CC[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587792350 GI Annotated Anodyne CCCCOC(=O)CC[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587792352 GI Annotated Anodyne CC/C=C/CCOC(=O)[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792425 GI Annotated Anodyne CC/C=C\CCOC(=O)[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792426 GI Annotated Anodyne CC/C=C/CCOC(=O)[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792428 GI Annotated Anodyne CC/C=C\CCOC(=O)[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792430 GI Annotated Anodyne CCC[C@]1([C@@H](C)C(=O)OCC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587792707 GI Annotated Anodyne CCC[C@]1([C@@H](C)C(=O)OCC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587792709 GI Annotated Anodyne CCC[C@]1([C@H](C)C(=O)OCC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587792710 GI Annotated Anodyne CCC[C@]1([C@H](C)C(=O)OCC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587792711 GI Annotated Anodyne CCOC(=O)CC1CCC2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587792712 GI Annotated Anodyne CCOC(=O)CC1CCC2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587792713 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(N[C@@H](C)Cc3ccc(F)c(Br)c32)[C@@H](C)C1 ZINC000587792718 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)[C@H](C)C1 ZINC000587792719 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)[C@@H](C)C1 ZINC000587792720 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(N[C@@H](C)Cc3ccc(F)c(Br)c32)[C@H](C)C1 ZINC000587792721 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@@]2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587792724 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@@]2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587792725 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@]2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587792726 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@]2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587792728 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCCC[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587792734 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCCC[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587792737 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCCC[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587792739 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCCC[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587792742 GI Annotated Anodyne CCOC(=O)[C@@H]1[C@H](C)CC=C[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587792752 GI Annotated Anodyne CCOC(=O)[C@@H]1[C@H](C)CC=C[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587792758 GI Annotated Anodyne CCOC(=O)[C@@H]1[C@H](C)CC=C[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587792760 GI Annotated Anodyne CCOC(=O)[C@@H]1[C@H](C)CC=C[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587792761 GI Annotated Anodyne C#CCOc1ccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587792823 GI Annotated Mild C#CCOc1ccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587792827 GI Annotated Mild C#CCOc1ccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587792842 GI Annotated Mild C#CCOc1ccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587792846 GI Annotated Mild COCCOC[C@@]1(C(C)(C)C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792847 GI Annotated Anodyne COCCOC[C@@]1(C(C)(C)C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792850 GI Annotated Anodyne COCCOC[C@]1(C(C)(C)C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792854 GI Annotated Anodyne COCCOC[C@]1(C(C)(C)C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587792857 GI Annotated Anodyne CCOC(=O)c1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)[nH]c1C ZINC000587793052 GI Annotated Anodyne CCOC(=O)c1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)[nH]c1C ZINC000587793055 GI Annotated Anodyne CCOC(=O)c1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)[nH]c1C ZINC000587793058 GI Annotated Anodyne CCOC(=O)c1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)[nH]c1C ZINC000587793060 GI Annotated Anodyne Cc1[nH]c([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)c1C(=O)O ZINC000587793156 GI Annotated Anodyne Cc1[nH]c([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)c1C(=O)O ZINC000587793157 GI Annotated Anodyne Cc1[nH]c([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)c1C(=O)O ZINC000587793158 GI Annotated Anodyne Cc1[nH]c([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)c1C(=O)O ZINC000587793159 GI Annotated Anodyne CCC[C@H](C)OC(=O)C[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587793345 GI Annotated Anodyne CCC[C@H](C)OC(=O)C[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587793346 GI Annotated Anodyne CCC[C@H](C)OC(=O)C[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587793348 GI Annotated Anodyne CCC[C@H](C)OC(=O)C[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587793349 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C=C1C)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587793384 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C=C1C)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587793386 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@@]2(C=C1C)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587793387 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@@]2(C=C1C)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587793388 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC2CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587793389 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC2CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587793390 GI Annotated Anodyne CCOC(=O)C[C@]1(CC2CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587793391 GI Annotated Anodyne CCOC(=O)C[C@]1(CC2CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587793392 GI Annotated Anodyne C=CC[C@H](C(=O)OCC)[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587793397 GI Annotated Mild C=CC[C@H](C(=O)OCC)[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587793398 GI Annotated Mild C=CC[C@H](C(=O)OCC)[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587793399 GI Annotated Mild C=CC[C@H](C(=O)OCC)[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587793400 GI Annotated Mild CCOC(=O)C[C@@]1(C2CCCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587793408 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2CCCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587793410 GI Annotated Anodyne CCOC(=O)C[C@]1(C2CCCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587793412 GI Annotated Anodyne CCOC(=O)C[C@]1(C2CCCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587793414 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3c(c2)CCN3)N1 ZINC000587793745 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3c(c2)CCN3)N1 ZINC000587793747 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3c(c2)CCN3)N1 ZINC000587793749 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3c(c2)CCN3)N1 ZINC000587793751 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3c(c2)CCN3)N1 ZINC000587793793 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3c(c2)CCN3)N1 ZINC000587793794 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3c(c2)CCN3)N1 ZINC000587793795 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3c(c2)CCN3)N1 ZINC000587793796 GI Annotated Anodyne COCCOc1cccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587793995 GI Annotated Anodyne COCCOc1cccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587793999 GI Annotated Anodyne COCCOc1cccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587794001 GI Annotated Anodyne COCCOc1cccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587794005 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(-c3ncon3)c2)N1 ZINC000587794368 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(-c3ncon3)c2)N1 ZINC000587794369 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(-c3ncon3)c2)N1 ZINC000587794370 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(-c3ncon3)c2)N1 ZINC000587794371 GI Annotated Anodyne CCOC(=O)c1[nH]c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1C ZINC000587794421 GI Annotated Anodyne CCOC(=O)c1[nH]c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1C ZINC000587794422 GI Annotated Anodyne CCOC(=O)c1[nH]c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1C ZINC000587794423 GI Annotated Anodyne CCOC(=O)c1[nH]c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1C ZINC000587794424 GI Annotated Anodyne COC[C@@]1(Cc2ccccc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587794551 GI Annotated Anodyne COC[C@]1(Cc2ccccc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587794552 GI Annotated Anodyne COC[C@@]1(Cc2ccccc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587794553 GI Annotated Anodyne COC[C@]1(Cc2ccccc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587794554 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(-c3ncon3)cc2)N1 ZINC000587794627 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(-c3ncon3)cc2)N1 ZINC000587794628 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(-c3ncon3)cc2)N1 ZINC000587794629 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(-c3ncon3)cc2)N1 ZINC000587794631 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC(=O)Nc3ccccc32)N1 ZINC000587794652 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC(=O)Nc3ccccc32)N1 ZINC000587794662 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC(=O)Nc3ccccc32)N1 ZINC000587794665 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC(=O)Nc3ccccc32)N1 ZINC000587794667 GI Annotated Anodyne CCOC(=O)C[C@]1([C@H](C)CC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587794810 GI Annotated Anodyne CCOC(=O)C[C@]1([C@@H](C)CC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587794811 GI Annotated Anodyne CCOC(=O)C[C@]1([C@H](C)CC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587794812 GI Annotated Anodyne CCOC(=O)C[C@]1([C@@H](C)CC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587794813 GI Annotated Anodyne CCOC(=O)C1CCC2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587794836 GI Annotated Anodyne CCOC(=O)C1CCC2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587794837 GI Annotated Anodyne CCOC(=O)C1([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)CCC1 ZINC000587794854 GI Annotated Anodyne CCOC(=O)C1([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)CCC1 ZINC000587794855 GI Annotated Anodyne CCOC(=O)C1([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)CCC1 ZINC000587794856 GI Annotated Anodyne CCOC(=O)C1([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)CCC1 ZINC000587794857 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(-c3cc[nH]n3)o2)N1 ZINC000587795217 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(-c3cc[nH]n3)o2)N1 ZINC000587795219 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(-c3cc[nH]n3)o2)N1 ZINC000587795221 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(-c3cc[nH]n3)o2)N1 ZINC000587795224 GI Annotated Anodyne CCC[C@]1([C@@H](C)C(=O)OCC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795290 GI Annotated Anodyne CCC[C@]1([C@@H](C)C(=O)OCC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795292 GI Annotated Anodyne CCC[C@]1([C@H](C)C(=O)OCC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795294 GI Annotated Anodyne CCC[C@]1([C@H](C)C(=O)OCC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795295 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC2CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795342 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC2CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795344 GI Annotated Anodyne CCOC(=O)C[C@]1(CC2CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795346 GI Annotated Anodyne CCOC(=O)C[C@]1(CC2CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795348 GI Annotated Anodyne Cc1noc(C2CCC3(CC2)N[C@@H](C)Cc2cc(Br)c(F)cc23)n1 ZINC000587795365 GI Annotated Anodyne Cc1noc(C2CCC3(CC2)N[C@H](C)Cc2cc(Br)c(F)cc23)n1 ZINC000587795367 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(-c3nnco3)cc2)N1 ZINC000587795372 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(-c3nnco3)cc2)N1 ZINC000587795374 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(-c3nnco3)cc2)N1 ZINC000587795376 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(-c3nnco3)cc2)N1 ZINC000587795377 GI Annotated Anodyne CCOC(=O)C1(C)CCC2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587795384 GI Annotated Anodyne CCOC(=O)C1(C)CCC2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587795385 GI Annotated Anodyne CCCCC[C@@]1(C(=O)OCC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795412 GI Annotated Anodyne CCCCC[C@@]1(C(=O)OCC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795415 GI Annotated Anodyne C=C1C=C(C)n2ncc([C@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)c2N1 ZINC000587795530 GI Annotated Anodyne C=C1C=C(C)n2ncc([C@@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)c2N1 ZINC000587795535 GI Annotated Anodyne C=C1C=C(C)n2ncc([C@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)c2N1 ZINC000587795537 GI Annotated Anodyne CCOC(=O)c1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)[nH]c1C ZINC000587795558 GI Annotated Anodyne CCOC(=O)c1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)[nH]c1C ZINC000587795559 GI Annotated Anodyne CCOC(=O)c1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)[nH]c1C ZINC000587795560 GI Annotated Anodyne CCOC(=O)c1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)[nH]c1C ZINC000587795561 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C2(CC(C(=O)OC(C)(C)C)C2)N1 ZINC000587795628 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(CC(C(=O)OC(C)(C)C)C2)N1 ZINC000587795629 GI Annotated Anodyne CC(C)CCOC(=O)C[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795672 GI Annotated Anodyne CC(C)CCOC(=O)C[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795673 GI Annotated Anodyne CC(C)CCOC(=O)C[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795674 GI Annotated Anodyne CC(C)CCOC(=O)C[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795675 GI Annotated Anodyne CCCCC[C@]1(C(=O)OCC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795686 GI Annotated Anodyne CCCCC[C@]1(C(=O)OCC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795688 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCCC[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587795699 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCCC[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587795701 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCCC[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587795703 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCCC[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587795705 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C)CC[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587795779 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C)CC[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587795781 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C)CC[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587795783 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C)CC[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587795785 GI Annotated Anodyne C[C@@H]1C[C@@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)[C@@H]2CCCC[C@H]2N1 ZINC000587795817 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@@H](C)N[C@@H]3CCCC[C@H]32)N1 ZINC000587795820 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@@H](C)N[C@@H]3CCCC[C@H]32)N1 ZINC000587795822 GI Annotated Anodyne C[C@@H]1C[C@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)[C@@H]2CCCC[C@H]2N1 ZINC000587795825 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@H](C)C[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587795865 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@H](C)C[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587795871 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@H](C)C[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587795876 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@H](C)C[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587795880 GI Annotated Anodyne CCC[C@@]1(c2c[nH]c(C(=O)O)c2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795938 GI Annotated Anodyne CCC[C@]1(c2c[nH]c(C(=O)O)c2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795941 GI Annotated Anodyne CCC[C@]1(c2c[nH]c(C(=O)O)c2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795944 GI Annotated Anodyne CCC[C@@]1(c2c[nH]c(C(=O)O)c2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587795947 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC(C)(C)Cc3n[nH]cc32)N1 ZINC000587795949 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC(C)(C)Cc3n[nH]cc32)N1 ZINC000587795956 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CC(C)(C)Cc3n[nH]cc32)N1 ZINC000587795958 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC(C)(C)Cc3n[nH]cc32)N1 ZINC000587795963 GI Annotated Anodyne CCC[C@@]1(c2c[nH]c(C(=O)O)c2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795964 GI Annotated Anodyne CCC[C@]1(c2c[nH]c(C(=O)O)c2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795967 GI Annotated Anodyne CCC[C@]1(c2c[nH]c(C(=O)O)c2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795969 GI Annotated Anodyne CCC[C@@]1(c2c[nH]c(C(=O)O)c2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795972 GI Annotated Anodyne CCOC(=O)C[C@@]1(C(C)(C)C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587795999 GI Annotated Anodyne CCOC(=O)C[C@@]1(C(C)(C)C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587796001 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(c2ncc[nH]2)N1 ZINC000587796044 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(c2ncc[nH]2)N1 ZINC000587796045 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(c2ncc[nH]2)N1 ZINC000587796046 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(c2ncc[nH]2)N1 ZINC000587796047 GI Annotated Anodyne C=C1C=C(C)n2ncc([C@@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)c2N1 ZINC000587796081 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(-c3ncon3)cc2)N1 ZINC000587796105 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(-c3ncon3)cc2)N1 ZINC000587796106 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(-c3ncon3)cc2)N1 ZINC000587796109 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(-c3ncon3)cc2)N1 ZINC000587796110 GI Annotated Anodyne C=C1C=C(C)n2ncc([C@@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)c2N1 ZINC000587796137 GI Annotated Anodyne C=C1C=C(C)n2ncc([C@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)c2N1 ZINC000587796139 GI Annotated Anodyne C=C1C=C(C)n2ncc([C@@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)c2N1 ZINC000587796141 GI Annotated Anodyne C=C1C=C(C)n2ncc([C@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)c2N1 ZINC000587796142 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(-c3nnco3)cc2)N1 ZINC000587796168 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(-c3nnco3)cc2)N1 ZINC000587796171 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(-c3nnco3)cc2)N1 ZINC000587796173 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(-c3nnco3)cc2)N1 ZINC000587796175 GI Annotated Anodyne CC(=O)COc1cccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587796313 GI Annotated Anodyne CC(=O)COc1cccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587796314 GI Annotated Anodyne CC(=O)COc1cccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587796315 GI Annotated Anodyne CC(=O)COc1cccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587796317 GI Annotated Anodyne CCOC(=O)C[C@]1(C(C)(C)C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587796364 GI Annotated Anodyne CCOC(=O)C[C@]1(C(C)(C)C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587796365 GI Annotated Anodyne C=CC[C@H](C(=O)OCC)[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587796370 GI Annotated Mild C=CC[C@H](C(=O)OCC)[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587796371 GI Annotated Mild C=CC[C@H](C(=O)OCC)[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587796372 GI Annotated Mild C=CC[C@H](C(=O)OCC)[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587796373 GI Annotated Mild CCOC(=O)[C@@H]1CC[C@]2(C[C@H]1C)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587796406 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C[C@@H]1C)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587796409 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C[C@H]1C)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587796412 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C[C@@H]1C)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587796415 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC(=O)Nc3ccccc32)N1 ZINC000587796721 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC(=O)Nc3ccccc32)N1 ZINC000587796722 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC(=O)Nc3ccccc32)N1 ZINC000587796723 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC(=O)Nc3ccccc32)N1 ZINC000587796724 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(COc2cccc(C=O)c2)N1 ZINC000587796776 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(COc2cccc(C=O)c2)N1 ZINC000587796778 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(COc2cccc(C=O)c2)N1 ZINC000587796779 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(COc2cccc(C=O)c2)N1 ZINC000587796781 GI Annotated Anodyne CCCCOC(=O)[C@@H]1CCC[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587796949 GI Annotated Anodyne CCCCOC(=O)[C@@H]1CCC[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587796950 GI Annotated Anodyne CCCCOC(=O)[C@@H]1CCC[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587796951 GI Annotated Anodyne CCCCOC(=O)[C@@H]1CCC[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587796952 GI Annotated Anodyne CCOC(=O)[C@H](C(C)C)[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797079 GI Annotated Anodyne CCOC(=O)[C@H](C(C)C)[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797093 GI Annotated Anodyne CCOC(=O)[C@H](C(C)C)[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797095 GI Annotated Anodyne CCOC(=O)[C@H](C(C)C)[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797098 GI Annotated Anodyne CCOC(=O)C[C@]1(C2CCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797107 GI Annotated Anodyne CCOC(=O)C[C@]1(C2CCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797108 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2CCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797109 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2CCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797110 GI Annotated Anodyne CCOC(=O)CC[C@]1(C2CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587797161 GI Annotated Anodyne CCOC(=O)CC[C@]1(C2CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587797163 GI Annotated Anodyne CCOC(=O)CC[C@@]1(C2CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587797165 GI Annotated Anodyne CCOC(=O)CC[C@@]1(C2CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587797166 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3c(c2)CNCC3)N1 ZINC000587797406 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3c(c2)CNCC3)N1 ZINC000587797408 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3c(c2)CNCC3)N1 ZINC000587797410 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3c(c2)CNCC3)N1 ZINC000587797413 GI Annotated Anodyne CCOC(=O)[C@@]1(C2CCCCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797649 GI Annotated Anodyne CCOC(=O)[C@@]1(C2CCCCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797651 GI Annotated Anodyne CCOC(=O)[C@]1(C2CCCCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797652 GI Annotated Anodyne CCOC(=O)[C@]1(C2CCCCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797653 GI Annotated Anodyne COc1ccc(OC)c(-c2nc3cc(C)c(Br)cc3[nH]2)c1OC ZINC000587797692 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCC[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587797712 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCC[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587797714 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCC[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587797716 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCC[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587797718 GI Annotated Anodyne COc1ccc(OC)c(-c2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)c1OC ZINC000587797766 GI Annotated Mild C#CCOc1ccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587797816 GI Annotated Mild C#CCOc1ccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587797817 GI Annotated Mild C#CCOc1ccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587797818 GI Annotated Mild C#CCOc1ccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587797819 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(COc2cccc(C=O)c2)N1 ZINC000587797824 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(COc2cccc(C=O)c2)N1 ZINC000587797825 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(COc2cccc(C=O)c2)N1 ZINC000587797826 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(COc2cccc(C=O)c2)N1 ZINC000587797827 GI Annotated Anodyne CC(=O)COc1cccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587797832 GI Annotated Anodyne CC(=O)COc1cccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587797833 GI Annotated Anodyne CC(=O)COc1cccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587797834 GI Annotated Anodyne CC(=O)COc1cccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587797835 GI Annotated Anodyne CCOC(=O)C[C@]1([C@H](C)CC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797967 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)c1ccccc1N[C@@H]2C ZINC000587797969 GI Annotated Anodyne CCOC(=O)C[C@]1([C@@H](C)CC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797970 GI Annotated Anodyne CCOC(=O)C[C@]1([C@H](C)CC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797972 GI Annotated Anodyne C[C@@H]1Nc2ccccc2C(=O)[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587797973 GI Annotated Anodyne CCOC(=O)C[C@]1([C@@H](C)CC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587797975 GI Annotated Anodyne C[C@@H]1Nc2ccccc2C(=O)[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587797978 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)c1ccccc1N[C@@H]2C ZINC000587797981 GI Annotated Anodyne CCOC(=O)C1([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)CCCC1 ZINC000587798041 GI Annotated Anodyne CCOC(=O)C1([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)CCCC1 ZINC000587798044 GI Annotated Anodyne CCOC(=O)C1([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)CCCC1 ZINC000587798046 GI Annotated Anodyne CCOC(=O)C1([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)CCCC1 ZINC000587798049 GI Annotated Anodyne COCCOC[C@@]1(C(C)(C)C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587798089 GI Annotated Anodyne COCCOC[C@@]1(C(C)(C)C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587798092 GI Annotated Anodyne COCCOC[C@]1(C(C)(C)C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587798093 GI Annotated Anodyne COCCOC[C@]1(C(C)(C)C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587798096 GI Annotated Anodyne CC(C)CCOC(=O)C[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798126 GI Annotated Anodyne CC(C)CCOC(=O)C[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798127 GI Annotated Anodyne CC(C)CCOC(=O)C[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798129 GI Annotated Anodyne CC(C)CCOC(=O)C[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798131 GI Annotated Anodyne COC[C@@]1(Cc2ccccc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798208 GI Annotated Anodyne COC[C@]1(Cc2ccccc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798209 GI Annotated Anodyne COC[C@@]1(Cc2ccccc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798210 GI Annotated Anodyne COC[C@]1(Cc2ccccc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798211 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)[C@H](C)C1 ZINC000587798463 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)[C@@H](C)C1 ZINC000587798466 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(N[C@@H](C)Cc3cc(Br)c(F)cc32)[C@@H](C)C1 ZINC000587798468 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(N[C@@H](C)Cc3cc(Br)c(F)cc32)[C@H](C)C1 ZINC000587798470 GI Annotated Anodyne CCOC(=O)[C@@H]1[C@H](C)CC=C[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587798517 GI Annotated Anodyne CCOC(=O)[C@@H]1[C@H](C)CC=C[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587798519 GI Annotated Anodyne COCC[C@]1(c2ccccc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798520 GI Annotated Anodyne CCOC(=O)[C@@H]1[C@H](C)CC=C[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587798521 GI Annotated Anodyne COCC[C@@]1(c2ccccc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798522 GI Annotated Anodyne COCC[C@]1(c2ccccc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798523 GI Annotated Anodyne CCOC(=O)[C@@H]1[C@H](C)CC=C[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587798524 GI Annotated Anodyne COCC[C@@]1(c2ccccc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798530 GI Annotated Anodyne CCCCCOC(=O)C[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798544 GI Annotated Anodyne CCCCCOC(=O)C[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798546 GI Annotated Anodyne CCCCCOC(=O)C[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798547 GI Annotated Anodyne CCCCCOC(=O)C[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798549 GI Annotated Anodyne CCCCC[C@@]1(C(=O)OCC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798622 GI Annotated Anodyne CCCCC[C@@]1(C(=O)OCC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798623 GI Annotated Anodyne CCCCC[C@]1(C(=O)OCC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798624 GI Annotated Anodyne CCCCC[C@]1(C(=O)OCC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798625 GI Annotated Anodyne Cc1[nH]nc2c1[C@@]1(CC(C)(C)C2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798630 GI Annotated Anodyne Cc1[nH]nc2c1[C@]1(CC(C)(C)C2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798631 GI Annotated Anodyne Cc1[nH]nc2c1[C@@]1(CC(C)(C)C2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798632 GI Annotated Anodyne Cc1[nH]nc2c1[C@]1(CC(C)(C)C2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587798633 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(-c3cc[nH]n3)o2)N1 ZINC000587798698 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(-c3cc[nH]n3)o2)N1 ZINC000587798699 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(-c3cc[nH]n3)o2)N1 ZINC000587798700 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(-c3cc[nH]n3)o2)N1 ZINC000587798701 GI Annotated Anodyne COc1n[nH]c2ccc([C@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)cc12 ZINC000587798726 GI Annotated Anodyne COc1n[nH]c2ccc([C@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)cc12 ZINC000587798727 GI Annotated Anodyne CCOC(=O)C1(C)CCC2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587798924 GI Annotated Anodyne CCOC(=O)C1(C)CCC2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587798925 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@H](C)C[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587798938 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@H](C)C[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587798939 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@H](C)C[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587798940 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@H](C)C[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587798941 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C[C@H]1C)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587798946 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C[C@@H]1C)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587798947 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C[C@H]1C)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587798948 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C[C@@H]1C)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587798949 GI Annotated Anodyne CCOC(=O)C1([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)CCC1 ZINC000587798982 GI Annotated Anodyne CCOC(=O)C1([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)CCC1 ZINC000587798983 GI Annotated Anodyne CCOC(=O)C1([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)CCC1 ZINC000587798984 GI Annotated Anodyne CCOC(=O)C1([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)CCC1 ZINC000587798985 GI Annotated Anodyne CCOc1ccc(C(=O)[C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587799012 GI Annotated Anodyne CCOc1ccc(C(=O)[C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587799013 GI Annotated Anodyne CCOc1ccc(C(=O)[C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587799014 GI Annotated Anodyne CCOc1ccc(C(=O)[C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587799015 GI Annotated Anodyne COc1n[nH]c2ccc([C@@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)cc12 ZINC000587799017 GI Annotated Anodyne COc1n[nH]c2ccc([C@@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)cc12 ZINC000587799018 GI Annotated Anodyne COc1ccc(COC[C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587799132 GI Annotated Anodyne COc1ccc(COC[C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587799135 GI Annotated Anodyne COc1ccc2[nH]nc([C@@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)c2c1 ZINC000587799136 GI Annotated Anodyne COc1ccc(COC[C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587799137 GI Annotated Anodyne COc1ccc2[nH]nc([C@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)c2c1 ZINC000587799138 GI Annotated Anodyne COc1ccc(COC[C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587799139 GI Annotated Anodyne COc1ccc2[nH]nc([C@@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)c2c1 ZINC000587799140 GI Annotated Anodyne COc1ccc2[nH]nc([C@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)c2c1 ZINC000587799142 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC(C)(C)Cc3n[nH]cc32)N1 ZINC000587799151 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC(C)(C)Cc3n[nH]cc32)N1 ZINC000587799153 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC(C)(C)Cc3n[nH]cc32)N1 ZINC000587799156 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CC(C)(C)Cc3n[nH]cc32)N1 ZINC000587799158 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCCC[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587799216 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCCC[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587799219 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCCC[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587799221 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCCC[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587799223 GI Annotated Anodyne CCOC(=O)C[C@]1(C2CCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799226 GI Annotated Anodyne CCOC(=O)C[C@]1(C2CCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799227 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2CCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799228 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2CCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799229 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(-c3ncon3)c2)N1 ZINC000587799241 GI Annotated Anodyne CCCC[C@]1(CC(=O)OCC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799242 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(-c3ncon3)c2)N1 ZINC000587799243 GI Annotated Anodyne CCCC[C@]1(CC(=O)OCC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799244 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(-c3ncon3)c2)N1 ZINC000587799245 GI Annotated Anodyne CCCC[C@@]1(CC(=O)OCC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799246 GI Annotated Anodyne CCCC[C@@]1(CC(=O)OCC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799247 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(-c3ncon3)c2)N1 ZINC000587799249 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCC[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587799278 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCC[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587799279 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCC[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587799281 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCC[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587799283 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C=C1C)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587799291 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@]2(C=C1C)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587799292 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@@]2(C=C1C)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587799293 GI Annotated Anodyne CCOC(=O)[C@@H]1CC[C@@]2(C=C1C)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587799294 GI Annotated Anodyne CCOC(=O)C[C@]1(CC2CCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799300 GI Annotated Anodyne CCOC(=O)C[C@]1(CC2CCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799301 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC2CCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799302 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC2CCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799303 GI Annotated Anodyne CCOC(=O)C[C@]1(CC2CCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799309 GI Annotated Anodyne CCOC(=O)C[C@]1(CC2CCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799311 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC2CCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799312 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC2CCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799314 GI Annotated Anodyne COc1ccc(OC)c(-c2nc3c(Br)cnc(Cl)c3[nH]2)c1OC ZINC000587799352 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3c(c2)CNCC3)N1 ZINC000587799492 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3c(c2)CNCC3)N1 ZINC000587799494 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3c(c2)CNCC3)N1 ZINC000587799496 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3c(c2)CNCC3)N1 ZINC000587799498 GI Annotated Anodyne Cc1cccc2c1NCC[C@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799506 GI Annotated Anodyne Cc1cccc2c1NCC[C@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799509 GI Annotated Anodyne Cc1cccc2c1NCC[C@@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799511 GI Annotated Anodyne Cc1cccc2c1NCC[C@@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799513 GI Annotated Anodyne CCOC(=O)CC[C@]1(C2CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799679 GI Annotated Anodyne CCOC(=O)CC[C@]1(C2CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799680 GI Annotated Anodyne CCOC(=O)CC[C@@]1(C2CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799681 GI Annotated Anodyne CCOC(=O)CC[C@@]1(C2CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799682 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2CCCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799837 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2CCCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799838 GI Annotated Anodyne CCOC(=O)C[C@]1(C2CCCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799839 GI Annotated Anodyne CCOC(=O)C[C@]1(C2CCCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799840 GI Annotated Anodyne CCOC(=O)[C@H](C(C)C)[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799879 GI Annotated Anodyne CCOC(=O)[C@H](C(C)C)[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799881 GI Annotated Anodyne CCOC(=O)[C@H](C(C)C)[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799882 GI Annotated Anodyne CCOC(=O)[C@H](C(C)C)[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587799884 GI Annotated Anodyne CCOC(=O)CC1CCC2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587799930 GI Annotated Anodyne CCOC(=O)CC1CCC2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587799931 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2(C)CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799944 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2(C)CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799945 GI Annotated Anodyne CCOC(=O)C[C@]1(C2(C)CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799946 GI Annotated Anodyne CCOC(=O)C[C@]1(C2(C)CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587799947 GI Annotated Anodyne COCc1ccc(OC)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587799974 GI Annotated Anodyne COCc1ccc(OC)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587799975 GI Annotated Anodyne COCc1ccc(OC)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587799976 GI Annotated Anodyne COCc1ccc(OC)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587799977 GI Annotated Anodyne CCOc1ccc(C(=O)[C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587800010 GI Annotated Anodyne CCOc1ccc(C(=O)[C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587800011 GI Annotated Anodyne CCOc1ccc(C(=O)[C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587800012 GI Annotated Anodyne CCOc1ccc(C(=O)[C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587800013 GI Annotated Anodyne CCOc1cccc(O)c1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800064 GI Annotated Clean CCOc1cccc(O)c1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800068 GI Annotated Clean CCOc1cccc(O)c1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800070 GI Annotated Clean CCOc1cccc(O)c1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800072 GI Annotated Clean CCOC(=O)C[C@@]1(C2(C)CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800255 GI Annotated Anodyne CCOC(=O)C[C@@]1(C2(C)CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800256 GI Annotated Anodyne CCOC(=O)C[C@]1(C2(C)CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800257 GI Annotated Anodyne CCOC(=O)C[C@]1(C2(C)CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800258 GI Annotated Anodyne CCC[C@H](C(=O)OCC)[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800276 GI Annotated Anodyne CCC[C@H](C(=O)OCC)[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800277 GI Annotated Anodyne CCC[C@H](C(=O)OCC)[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800279 GI Annotated Anodyne CCC[C@H](C(=O)OCC)[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800280 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCCC[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800286 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCCC[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800287 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCCC[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800288 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCCC[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800290 GI Annotated Anodyne CCOc1ccc(O)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587800314 GI Annotated Clean CCOc1ccc(O)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587800315 GI Annotated Clean CCOc1ccc(O)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587800316 GI Annotated Clean CCOc1ccc(O)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587800317 GI Annotated Clean COCc1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1OC ZINC000587800362 GI Annotated Anodyne COCc1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1OC ZINC000587800363 GI Annotated Anodyne COCc1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1OC ZINC000587800364 GI Annotated Anodyne COCc1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1OC ZINC000587800365 GI Annotated Anodyne COc1ccc(OC[C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587800394 GI Annotated Anodyne COc1ccc(OC[C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587800395 GI Annotated Anodyne COc1ccc(OC[C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587800396 GI Annotated Anodyne COc1ccc(OC[C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587800397 GI Annotated Anodyne CCOC(=O)[C@@]1(C2CCCCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800416 GI Annotated Anodyne CCOC(=O)[C@@]1(C2CCCCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800417 GI Annotated Anodyne CCOC(=O)[C@]1(C2CCCCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800418 GI Annotated Anodyne CCOC(=O)[C@]1(C2CCCCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800419 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC(C)C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800440 GI Annotated Anodyne CCOC(=O)C[C@@]1(CC(C)C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800441 GI Annotated Anodyne CCOC(=O)C[C@]1(CC(C)C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800442 GI Annotated Anodyne CCOC(=O)C[C@]1(CC(C)C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800443 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C)CC[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800476 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C)CC[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800477 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C)CC[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800478 GI Annotated Anodyne CCOC(=O)[C@@H]1C[C@H](C)CC[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800479 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCC[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800492 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCC[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800493 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCC[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800494 GI Annotated Anodyne CCOC(=O)C[C@@H]1CCC[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800495 GI Annotated Anodyne COc1ccc2[nH]c([C@@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)cc2n1 ZINC000587800603 GI Annotated Anodyne COc1ccc2[nH]c([C@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)cc2n1 ZINC000587800604 GI Annotated Anodyne COc1ccc2[nH]c([C@@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)cc2n1 ZINC000587800606 GI Annotated Anodyne COc1ccc2[nH]c([C@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)cc2n1 ZINC000587800608 GI Annotated Anodyne COc1ccc(COC[C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587800702 GI Annotated Anodyne COc1ccc(COC[C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587800704 GI Annotated Anodyne COc1ccc(COC[C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587800706 GI Annotated Anodyne COc1ccc(COC[C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587800708 GI Annotated Anodyne CCC[C@H](C(=O)OCC)[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800760 GI Annotated Anodyne CCC[C@H](C(=O)OCC)[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800761 GI Annotated Anodyne CCC[C@H](C(=O)OCC)[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800762 GI Annotated Anodyne CCC[C@H](C(=O)OCC)[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800763 GI Annotated Anodyne CCOC(=O)C[C@@]1(C(C)(C)C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800796 GI Annotated Anodyne CCOC(=O)C[C@@]1(C(C)(C)C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800797 GI Annotated Anodyne CCOC(=O)C[C@]1(C(C)(C)C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800798 GI Annotated Anodyne CCOC(=O)C[C@]1(C(C)(C)C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587800799 GI Annotated Anodyne CCOC(=O)[C@]1(CC(C)(C)C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800800 GI Annotated Anodyne CCOC(=O)[C@]1(CC(C)(C)C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800801 GI Annotated Anodyne CCOC(=O)[C@@]1(CC(C)(C)C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800802 GI Annotated Anodyne CCOC(=O)[C@@]1(CC(C)(C)C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800803 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@]2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800842 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@@]2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800843 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@@]2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800844 GI Annotated Anodyne CCOC(=O)[C@@H]1CCC[C@]2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587800845 GI Annotated Anodyne CCCC[C@]1(CC(=O)OCC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800850 GI Annotated Anodyne CCCC[C@]1(CC(=O)OCC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800851 GI Annotated Anodyne CCCC[C@@]1(CC(=O)OCC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800852 GI Annotated Anodyne CCCC[C@@]1(CC(=O)OCC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587800853 GI Annotated Anodyne CCOc1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1O ZINC000587800914 GI Annotated Anodyne CCOc1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1O ZINC000587800916 GI Annotated Anodyne CCOc1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1O ZINC000587800918 GI Annotated Anodyne CCOc1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1O ZINC000587800920 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC(C)(C)Cc3nc[nH]c32)N1 ZINC000587801207 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC(C)(C)Cc3nc[nH]c32)N1 ZINC000587801208 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC(C)(C)Cc3nc[nH]c32)N1 ZINC000587801209 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CC(C)(C)Cc3nc[nH]c32)N1 ZINC000587801210 GI Annotated Anodyne CCOc1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1O ZINC000587801313 GI Annotated Anodyne CCOc1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1O ZINC000587801314 GI Annotated Anodyne CCOc1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1O ZINC000587801315 GI Annotated Anodyne CCOc1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1O ZINC000587801316 GI Annotated Anodyne CCOc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1CO ZINC000587801321 GI Annotated Anodyne CCOc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1CO ZINC000587801322 GI Annotated Anodyne CCOc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1CO ZINC000587801323 GI Annotated Anodyne CCOc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1CO ZINC000587801324 GI Annotated Anodyne CCOc1ccc(O)c([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587801337 GI Annotated Clean CCOc1ccc(O)c([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587801338 GI Annotated Clean CCOc1ccc(O)c([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587801339 GI Annotated Clean CCOc1ccc(O)c([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587801340 GI Annotated Clean CCOc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587801545 GI Annotated Clean CCOc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587801546 GI Annotated Clean CCOc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587801547 GI Annotated Clean CCOc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587801548 GI Annotated Clean CCOc1cccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587801581 GI Annotated Clean CCOc1cccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587801582 GI Annotated Clean CCOc1cccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587801583 GI Annotated Clean CCOc1cccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587801584 GI Annotated Clean COc1nccc2[nH]cc([C@@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)c12 ZINC000587801619 GI Annotated Anodyne COc1nccc2[nH]cc([C@@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)c12 ZINC000587801620 GI Annotated Anodyne COc1nccc2[nH]cc([C@H]3N[C@H](C)Cc4cc(Br)c(F)cc43)c12 ZINC000587801621 GI Annotated Anodyne COc1nccc2[nH]cc([C@H]3N[C@@H](C)Cc4cc(Br)c(F)cc43)c12 ZINC000587801622 GI Annotated Anodyne CCOc1cc(O)cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587801634 GI Annotated Anodyne CCOc1cc(O)cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587801635 GI Annotated Anodyne CCOc1cc(O)cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587801636 GI Annotated Anodyne CCOc1cc(O)cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587801638 GI Annotated Anodyne CCOc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1CO ZINC000587801710 GI Annotated Anodyne CCOc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1CO ZINC000587801711 GI Annotated Anodyne CCOc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1CO ZINC000587801712 GI Annotated Anodyne CCOc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1CO ZINC000587801713 GI Annotated Anodyne COCc1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1OC ZINC000587801718 GI Annotated Anodyne COCc1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1OC ZINC000587801719 GI Annotated Anodyne COCc1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1OC ZINC000587801720 GI Annotated Anodyne COCc1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1OC ZINC000587801721 GI Annotated Anodyne CCOc1cccc(O)c1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587801785 GI Annotated Clean CCOc1cccc(O)c1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587801786 GI Annotated Clean CCOc1cccc(O)c1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587801787 GI Annotated Clean CCOc1cccc(O)c1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587801788 GI Annotated Clean CCOc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587801829 GI Annotated Clean CCOc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587801830 GI Annotated Clean CCOc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587801831 GI Annotated Clean CCOc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587801832 GI Annotated Clean CCOc1ccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587801837 GI Annotated Clean CCOc1ccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587801838 GI Annotated Clean CCOc1ccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587801839 GI Annotated Clean CCOc1ccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587801840 GI Annotated Clean CCOc1cccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587802201 GI Annotated Clean CCOc1cccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587802202 GI Annotated Clean CCOc1cccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587802203 GI Annotated Clean CCOc1cccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587802204 GI Annotated Clean COc1cccc(OC[C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587802205 GI Annotated Anodyne COc1cccc(OC[C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587802206 GI Annotated Anodyne COc1cccc(OC[C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587802207 GI Annotated Anodyne COc1cccc(OC[C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587802208 GI Annotated Anodyne COc1ccc2[nH]c([C@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)cc2n1 ZINC000587802359 GI Annotated Anodyne COc1ccc2[nH]c([C@@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)cc2n1 ZINC000587802360 GI Annotated Anodyne COc1ccc2[nH]c([C@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)cc2n1 ZINC000587802361 GI Annotated Anodyne COc1ccc2[nH]c([C@@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)cc2n1 ZINC000587802362 GI Annotated Anodyne CCOc1ccc(O)c([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587802683 GI Annotated Clean CCOc1ccc(O)c([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587802684 GI Annotated Clean CCOc1ccc(O)c([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587802685 GI Annotated Clean CCOc1ccc(O)c([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587802686 GI Annotated Clean CCOc1ccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587802852 GI Annotated Clean CCOc1ccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587802855 GI Annotated Clean CCOc1ccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587802857 GI Annotated Clean CCOc1ccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587802858 GI Annotated Clean COc1ccc(OC[C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587802859 GI Annotated Anodyne COc1ccc(OC[C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587802861 GI Annotated Anodyne COc1ccc(OC[C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587802863 GI Annotated Anodyne COc1ccc(OC[C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587802864 GI Annotated Anodyne CCOc1ccc(O)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587803105 GI Annotated Clean CCOc1ccc(O)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587803106 GI Annotated Clean CCOc1ccc(O)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587803107 GI Annotated Clean CCOc1ccc(O)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587803108 GI Annotated Clean COc1cccc(OC[C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587803125 GI Annotated Anodyne COc1cccc(OC[C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587803126 GI Annotated Anodyne COc1cccc(OC[C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587803127 GI Annotated Anodyne COc1cccc(OC[C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587803128 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(O)[nH]c3ccccc23)N1 ZINC000587803335 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c(O)[nH]c3ccccc23)N1 ZINC000587803336 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(O)[nH]c3ccccc23)N1 ZINC000587803337 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c(O)[nH]c3ccccc23)N1 ZINC000587803338 GI Annotated Anodyne CCC[C@]1([C@H](CC)C(=O)OC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587803401 GI Annotated Anodyne CCC[C@]1([C@@H](CC)C(=O)OC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587803402 GI Annotated Anodyne CCC[C@]1([C@@H](CC)C(=O)OC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587803403 GI Annotated Anodyne CCC[C@]1([C@H](CC)C(=O)OC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587803404 GI Annotated Anodyne COC(=O)C1(C)CCC2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587803406 GI Annotated Anodyne COC(=O)C1(C)CCC2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587803407 GI Annotated Anodyne COCc1ccc(OC)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587803567 GI Annotated Anodyne COCc1ccc(OC)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587803568 GI Annotated Anodyne COCc1ccc(OC)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587803569 GI Annotated Anodyne COCc1ccc(OC)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587803570 GI Annotated Anodyne C/C=C\CC[C@]1(CC(=O)OC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587803676 GI Annotated Anodyne C/C=C\CC[C@]1(CC(=O)OC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587803677 GI Annotated Anodyne C/C=C/CC[C@]1(CC(=O)OC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587803678 GI Annotated Anodyne C/C=C/CC[C@]1(CC(=O)OC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587803679 GI Annotated Anodyne COC(=O)CC1CCC2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587803832 GI Annotated Anodyne COC(=O)CC1CCC2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587803834 GI Annotated Anodyne COC(=O)C1(C)CCC2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587803871 GI Annotated Anodyne COC(=O)C1(C)CCC2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587803873 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(O)[nH]c3ccccc23)N1 ZINC000587804098 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c(O)[nH]c3ccccc23)N1 ZINC000587804101 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(O)[nH]c3ccccc23)N1 ZINC000587804104 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c(O)[nH]c3ccccc23)N1 ZINC000587804107 GI Annotated Anodyne CCOc1cc(O)cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587804396 GI Annotated Anodyne CCOc1cc(O)cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587804397 GI Annotated Anodyne CCOc1cc(O)cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587804398 GI Annotated Anodyne CCOc1cc(O)cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587804399 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c[nH]c3ccc(O)cc23)N1 ZINC000587804497 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c[nH]c3ccc(O)cc23)N1 ZINC000587804498 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c[nH]c3ccc(O)cc23)N1 ZINC000587804499 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c[nH]c3ccc(O)cc23)N1 ZINC000587804500 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC(C)(C)Cc3nc[nH]c32)N1 ZINC000587804553 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC(C)(C)Cc3nc[nH]c32)N1 ZINC000587804568 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC(C)(C)Cc3nc[nH]c32)N1 ZINC000587804572 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CC(C)(C)Cc3nc[nH]c32)N1 ZINC000587804577 GI Annotated Anodyne COc1cccc2c1CC[C@@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587804592 GI Annotated Anodyne COc1cccc2c1CC[C@@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587804595 GI Annotated Anodyne COc1cccc2c1CC[C@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587804599 GI Annotated Anodyne COc1cccc2c1CC[C@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587804604 GI Annotated Anodyne COc1ccc(O)c([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587804699 GI Annotated Clean COc1ccc(O)c([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587804702 GI Annotated Clean COc1ccc(O)c([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587804706 GI Annotated Clean COc1ccc(O)c([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587804708 GI Annotated Clean COc1ccc(OC)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587804711 GI Annotated Anodyne COc1ccc(OC)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587804714 GI Annotated Anodyne COc1ccc(OC)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587804716 GI Annotated Anodyne COc1ccc(OC)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587804719 GI Annotated Anodyne COC(=O)[C@@H]1CCC[C@@]2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587804784 GI Annotated Anodyne COC(=O)[C@@H]1CCC[C@@]2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587804785 GI Annotated Anodyne COC(=O)[C@@H]1CCC[C@]2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587804787 GI Annotated Anodyne COC(=O)[C@@H]1CCC[C@]2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587804788 GI Annotated Anodyne COc1cccc([C@H](C=O)[C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587804826 GI Annotated Mild COc1cccc([C@H](C=O)[C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587804827 GI Annotated Mild COc1cccc([C@H](C=O)[C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587804828 GI Annotated Mild COc1cccc([C@H](C=O)[C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587804829 GI Annotated Mild COc1ccc2c(c1)[C@@]1(CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587804830 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587804831 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587804832 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587804833 GI Annotated Anodyne COc1cccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1OC ZINC000587804872 GI Annotated Anodyne COc1cccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1OC ZINC000587804873 GI Annotated Anodyne COc1cccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1OC ZINC000587804874 GI Annotated Anodyne COc1cccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1OC ZINC000587804875 GI Annotated Anodyne CCc1cc(OC)c(O)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587804928 GI Annotated Clean CCc1cc(OC)c(O)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587804929 GI Annotated Clean CCc1cc(OC)c(O)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587804930 GI Annotated Clean CCc1cc(OC)c(O)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587804931 GI Annotated Clean COc1ccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1O ZINC000587804936 GI Annotated Anodyne COc1ccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1O ZINC000587804937 GI Annotated Anodyne COc1ccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1O ZINC000587804938 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1O ZINC000587804939 GI Annotated Anodyne COCOc1ccccc1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587804964 GI Annotated Anodyne COCOc1ccccc1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587804965 GI Annotated Anodyne COCOc1ccccc1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587804966 GI Annotated Anodyne COCOc1ccccc1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587804967 GI Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)c1 ZINC000587805052 GI Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)c1 ZINC000587805061 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)c1 ZINC000587805063 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)c1 ZINC000587805065 GI Annotated Anodyne COC(=O)CC1CCC2(CC1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587805154 GI Annotated Anodyne COC(=O)CC1CCC2(CC1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587805155 GI Annotated Anodyne COC(=O)[C@@H]1CC[C@@H]([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)CC1 ZINC000587805176 GI Annotated Anodyne COC(=O)[C@@H]1CC[C@@H]([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)CC1 ZINC000587805178 GI Annotated Anodyne COC(=O)[C@@H]1CC[C@@H]([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)CC1 ZINC000587805179 GI Annotated Anodyne COC(=O)[C@@H]1CC[C@@H]([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)CC1 ZINC000587805180 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c[nH]c3cccc(O)c23)N1 ZINC000587805234 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c[nH]c3cccc(O)c23)N1 ZINC000587805238 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c[nH]c3cccc(O)c23)N1 ZINC000587805240 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c[nH]c3cccc(O)c23)N1 ZINC000587805241 GI Annotated Anodyne COc1ccc(O)cc1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587805325 GI Annotated Anodyne COc1ccc(O)cc1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587805326 GI Annotated Anodyne COc1ccc(O)cc1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587805328 GI Annotated Anodyne COc1ccc(O)cc1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587805329 GI Annotated Anodyne COc1cccc(OC)c1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587805330 GI Annotated Anodyne COc1cccc(OC)c1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587805331 GI Annotated Anodyne COc1cccc(OC)c1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587805332 GI Annotated Anodyne COc1cccc(OC)c1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587805334 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587805427 GI Annotated Clean COc1ccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587805428 GI Annotated Clean COc1ccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587805429 GI Annotated Clean COc1ccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587805430 GI Annotated Clean COC(=O)C[C@@H]1CCCC[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587805606 GI Annotated Anodyne COC(=O)C[C@@H]1CCCC[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587805607 GI Annotated Anodyne COC(=O)C[C@@H]1CCCC[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587805608 GI Annotated Anodyne COC(=O)C[C@@H]1CCCC[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587805609 GI Annotated Anodyne COC(=O)[C@@H]1CCCCC[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587805610 GI Annotated Anodyne COC(=O)[C@@H]1CCCCC[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587805612 GI Annotated Anodyne COC(=O)[C@@H]1CCCCC[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587805614 GI Annotated Anodyne COC(=O)[C@@H]1CCCCC[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587805616 GI Annotated Anodyne COc1ccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(OC)c1 ZINC000587805706 GI Annotated Anodyne COc1ccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(OC)c1 ZINC000587805708 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(OC)c1 ZINC000587805710 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(OC)c1 ZINC000587805712 GI Annotated Anodyne COc1ccc2c(c1)C[C@@]1(C2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587805791 GI Annotated Anodyne COc1ccc2c(c1)C[C@@]1(C2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587805803 GI Annotated Anodyne COc1ccc2c(c1)C[C@]1(C2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587805806 GI Annotated Anodyne COc1ccc2c(c1)C[C@]1(C2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587805809 GI Annotated Anodyne COc1ccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1OC ZINC000587805824 GI Annotated Anodyne COc1ccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1OC ZINC000587805827 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1OC ZINC000587805834 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1OC ZINC000587805837 GI Annotated Anodyne COc1cccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1OC ZINC000587805921 GI Annotated Anodyne COc1cccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1OC ZINC000587805923 GI Annotated Anodyne COc1cccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1OC ZINC000587805926 GI Annotated Anodyne COc1cccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1OC ZINC000587805927 GI Annotated Anodyne CC[C@@]1(C2(C(=O)OC)CCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587806100 GI Annotated Anodyne CC[C@@]1(C2(C(=O)OC)CCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587806101 GI Annotated Anodyne CC[C@]1(C2(C(=O)OC)CCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587806102 GI Annotated Anodyne CC[C@]1(C2(C(=O)OC)CCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587806103 GI Annotated Anodyne COc1cc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1O ZINC000587806174 GI Annotated Anodyne COc1cc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1O ZINC000587806175 GI Annotated Anodyne COc1cc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1O ZINC000587806176 GI Annotated Anodyne COc1cc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1O ZINC000587806178 GI Annotated Anodyne COc1cc(OC)cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587806259 GI Annotated Anodyne COc1cc(OC)cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587806261 GI Annotated Anodyne COc1ccc(OC)c([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587806262 GI Annotated Anodyne COc1cc(OC)cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587806263 GI Annotated Anodyne COc1ccc(OC)c([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587806264 GI Annotated Anodyne COc1cc(OC)cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587806265 GI Annotated Anodyne COc1ccc(OC)c([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587806266 GI Annotated Anodyne COc1ccc(OC)c([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587806268 GI Annotated Anodyne COc1ccc(O)cc1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587806269 GI Annotated Anodyne COc1ccc(O)cc1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587806271 GI Annotated Anodyne COc1ccc(O)cc1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587806273 GI Annotated Anodyne COc1ccc(O)cc1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587806275 GI Annotated Anodyne COc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(OC)c1 ZINC000587806517 GI Annotated Anodyne COc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(OC)c1 ZINC000587806518 GI Annotated Anodyne COc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(OC)c1 ZINC000587806519 GI Annotated Anodyne COc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(OC)c1 ZINC000587806520 GI Annotated Anodyne COc1cc(C[C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1O ZINC000587806523 GI Annotated Anodyne COc1cc(C[C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1O ZINC000587806525 GI Annotated Anodyne COc1cc(C[C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1O ZINC000587806527 GI Annotated Anodyne COc1cc(C[C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1O ZINC000587806529 GI Annotated Anodyne COCOc1cccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587806569 GI Annotated Anodyne COCOc1cccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587806574 GI Annotated Anodyne COCOc1cccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587806576 GI Annotated Anodyne COCOc1cccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587806577 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c[nH]c3ccc(O)cc23)N1 ZINC000587806834 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2c[nH]c3ccc(O)cc23)N1 ZINC000587806836 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2c[nH]c3ccc(O)cc23)N1 ZINC000587806838 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2c[nH]c3ccc(O)cc23)N1 ZINC000587806839 GI Annotated Anodyne CC(=O)Oc1cccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587806884 GI Annotated Anodyne CC(=O)Oc1cccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587806885 GI Annotated Anodyne CC(=O)Oc1cccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587806887 GI Annotated Anodyne CC(=O)Oc1cccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587806888 GI Annotated Anodyne COc1ccc(OC)c([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587806956 GI Annotated Anodyne COc1ccc(OC)c([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587806957 GI Annotated Anodyne COc1ccc(OC)c([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587806958 GI Annotated Anodyne COc1ccc(OC)c([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587806959 GI Annotated Anodyne COC(=O)[C@@H]1CC[C@@H]([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)CC1 ZINC000587807008 GI Annotated Anodyne COC(=O)[C@@H]1CC[C@@H]([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)CC1 ZINC000587807010 GI Annotated Anodyne COC(=O)[C@@H]1CC[C@@H]([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)CC1 ZINC000587807012 GI Annotated Anodyne COC(=O)[C@@H]1CC[C@@H]([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)CC1 ZINC000587807013 GI Annotated Anodyne CC[C@]1(c2ccc(OC)cc2O)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587807050 GI Annotated Clean CC[C@]1(c2ccc(OC)cc2O)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587807055 GI Annotated Clean CC[C@@]1(c2ccc(OC)cc2O)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587807058 GI Annotated Clean CC[C@@]1(c2ccc(OC)cc2O)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587807062 GI Annotated Clean COC(=O)c1ccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587807260 GI Annotated Anodyne COC(=O)c1ccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587807262 GI Annotated Anodyne CC[C@]1(c2ccc(O)c(OC)c2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587807341 GI Annotated Anodyne CC[C@]1(c2ccc(O)c(OC)c2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587807342 GI Annotated Anodyne CC[C@@]1(c2ccc(O)c(OC)c2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587807343 GI Annotated Anodyne CC[C@@]1(c2ccc(O)c(OC)c2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587807344 GI Annotated Anodyne CC(=O)Oc1cccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587807502 GI Annotated Anodyne CC(=O)Oc1cccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587807503 GI Annotated Anodyne CC(=O)Oc1cccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587807505 GI Annotated Anodyne CC(=O)Oc1cccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587807506 GI Annotated Anodyne COC(=O)c1ccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587807534 GI Annotated Anodyne COC(=O)c1ccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587807535 GI Annotated Anodyne CCC[C@]1([C@H](CC)C(=O)OC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587807560 GI Annotated Anodyne CCC[C@]1([C@@H](CC)C(=O)OC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587807561 GI Annotated Anodyne CCC[C@]1([C@@H](CC)C(=O)OC)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587807563 GI Annotated Anodyne CCC[C@]1([C@H](CC)C(=O)OC)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587807565 GI Annotated Anodyne COc1ccc([C@H](C=O)[C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587807567 GI Annotated Mild COc1ccc([C@H](C=O)[C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587807570 GI Annotated Mild COc1ccc([C@H](C=O)[C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587807573 GI Annotated Mild COc1ccc([C@H](C=O)[C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587807575 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2c[nH]c3cccc(O)c23)N1 ZINC000587807593 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c[nH]c3cccc(O)c23)N1 ZINC000587807596 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2c[nH]c3cccc(O)c23)N1 ZINC000587807601 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2c[nH]c3cccc(O)c23)N1 ZINC000587807607 GI Annotated Anodyne COc1cc(OC)cc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587807614 GI Annotated Anodyne COc1cc(OC)cc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587807617 GI Annotated Anodyne COc1cc(OC)cc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587807619 GI Annotated Anodyne COc1cc(OC)cc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587807620 GI Annotated Anodyne COCOc1cccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587807621 GI Annotated Anodyne COCOc1cccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587807623 GI Annotated Anodyne COCOc1cccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587807625 GI Annotated Anodyne COCOc1cccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587807628 GI Annotated Anodyne COC(=O)c1cccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587807764 GI Annotated Anodyne COC(=O)c1cccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587807766 GI Annotated Anodyne COC(=O)c1cccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587807768 GI Annotated Anodyne COC(=O)c1cccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587807770 GI Annotated Anodyne COc1cccc(O)c1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587808065 GI Annotated Clean COc1cccc(O)c1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587808066 GI Annotated Clean COc1cccc(O)c1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587808068 GI Annotated Clean COc1cccc(O)c1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587808070 GI Annotated Clean C/C=C\CC[C@]1(CC(=O)OC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808168 GI Annotated Anodyne C/C=C\CC[C@]1(CC(=O)OC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808170 GI Annotated Anodyne C/C=C/CC[C@]1(CC(=O)OC)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808171 GI Annotated Anodyne C/C=C/CC[C@]1(CC(=O)OC)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808173 GI Annotated Anodyne CC[C@]1(c2ccc(O)c(OC)c2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808183 GI Annotated Anodyne CC[C@]1(c2ccc(O)c(OC)c2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808185 GI Annotated Anodyne CC[C@@]1(c2ccc(O)c(OC)c2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808187 GI Annotated Anodyne CC[C@@]1(c2ccc(O)c(OC)c2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808189 GI Annotated Anodyne COc1cc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1O ZINC000587808217 GI Annotated Anodyne COc1cc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1O ZINC000587808218 GI Annotated Anodyne COc1cc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1O ZINC000587808219 GI Annotated Anodyne COc1cc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1O ZINC000587808220 GI Annotated Anodyne COc1nccc2[nH]cc([C@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)c12 ZINC000587808304 GI Annotated Anodyne COc1nccc2[nH]cc([C@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)c12 ZINC000587808305 GI Annotated Anodyne COc1nccc2[nH]cc([C@@H]3N[C@H](C)Cc4ccc(F)c(Br)c43)c12 ZINC000587808306 GI Annotated Anodyne COc1nccc2[nH]cc([C@@H]3N[C@@H](C)Cc4ccc(F)c(Br)c43)c12 ZINC000587808307 GI Annotated Anodyne COc1cccc(OC)c1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808501 GI Annotated Anodyne COc1cccc(OC)c1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808504 GI Annotated Anodyne COc1cccc(OC)c1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808507 GI Annotated Anodyne COc1cccc(OC)c1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808510 GI Annotated Anodyne COC(=O)C[C@]1(C2CCCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808515 GI Annotated Anodyne COC(=O)C[C@]1(C2CCCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808518 GI Annotated Anodyne COC(=O)C[C@@]1(C2CCCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808521 GI Annotated Anodyne COC(=O)C[C@@]1(C2CCCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808524 GI Annotated Anodyne CC[C@]1([C@H](C(=O)OC)C(C)C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808527 GI Annotated Anodyne CC[C@]1([C@H](C(=O)OC)C(C)C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808529 GI Annotated Anodyne CC[C@]1([C@@H](C(=O)OC)C(C)C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808532 GI Annotated Anodyne CC[C@]1([C@@H](C(=O)OC)C(C)C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808535 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808629 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808631 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808632 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808634 GI Annotated Anodyne COc1cccc2c1[C@@]1(CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808679 GI Annotated Anodyne COc1cccc2c1[C@@]1(CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808682 GI Annotated Anodyne COc1cccc2c1[C@]1(CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808686 GI Annotated Anodyne COc1cccc2c1[C@]1(CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808690 GI Annotated Anodyne CC(=O)Oc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587808721 GI Annotated Anodyne CC(=O)Oc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587808724 GI Annotated Anodyne CC(=O)Oc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587808727 GI Annotated Anodyne CC(=O)Oc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587808730 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1O ZINC000587808834 GI Annotated Anodyne COc1ccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1O ZINC000587808835 GI Annotated Anodyne COc1ccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1O ZINC000587808836 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1O ZINC000587808837 GI Annotated Anodyne COc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1OC ZINC000587808858 GI Annotated Anodyne COc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1OC ZINC000587808859 GI Annotated Anodyne COc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1OC ZINC000587808860 GI Annotated Anodyne COc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1OC ZINC000587808861 GI Annotated Anodyne COc1cccc(OC)c1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587808898 GI Annotated Anodyne COc1cccc(OC)c1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587808899 GI Annotated Anodyne COc1cccc(OC)c1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587808900 GI Annotated Anodyne COc1cccc(OC)c1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587808901 GI Annotated Anodyne COc1ccc([C@H](C=O)[C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587808946 GI Annotated Mild COc1ccc([C@H](C=O)[C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587808947 GI Annotated Mild COc1ccc([C@H](C=O)[C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587808948 GI Annotated Mild COc1ccc([C@H](C=O)[C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587808949 GI Annotated Mild COc1ccc2c(c1)CC[C@@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808958 GI Annotated Anodyne COc1ccc2c(c1)CC[C@@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808959 GI Annotated Anodyne COc1ccc2c(c1)CC[C@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808960 GI Annotated Anodyne COc1ccc2c(c1)CC[C@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587808961 GI Annotated Anodyne COC(=O)[C@@H]1CCC(C)(C)C[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587808986 GI Annotated Anodyne COC(=O)[C@@H]1CCC(C)(C)C[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587808988 GI Annotated Anodyne COC(=O)[C@@H]1CCC(C)(C)C[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587808991 GI Annotated Anodyne COC(=O)[C@@H]1CCC(C)(C)C[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587808994 GI Annotated Anodyne COC(=O)[C@@H]1CCCCC[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587809057 GI Annotated Anodyne COC(=O)[C@@H]1CCCCC[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587809058 GI Annotated Anodyne COC(=O)[C@@H]1CCCCC[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587809059 GI Annotated Anodyne COC(=O)[C@@H]1CCCCC[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587809060 GI Annotated Anodyne COC(=O)C[C@@H]1CCCC[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587809065 GI Annotated Anodyne COC(=O)C[C@@H]1CCCC[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587809066 GI Annotated Anodyne COC(=O)C[C@@H]1CCCC[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587809067 GI Annotated Anodyne COC(=O)C[C@@H]1CCCC[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587809069 GI Annotated Anodyne COc1cc(OC)cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587809099 GI Annotated Anodyne COc1cc(OC)cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587809102 GI Annotated Anodyne COc1cc(OC)cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587809104 GI Annotated Anodyne COc1cc(OC)cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587809107 GI Annotated Anodyne COc1ccc2c(c1)CC[C@@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809121 GI Annotated Anodyne COc1ccc2c(c1)CC[C@@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809124 GI Annotated Anodyne COc1ccc2c(c1)CC[C@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809126 GI Annotated Anodyne COc1ccc2c(c1)CC[C@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809129 GI Annotated Anodyne COCOc1ccccc1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587809140 GI Annotated Anodyne COCOc1ccccc1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587809141 GI Annotated Anodyne COCOc1ccccc1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587809143 GI Annotated Anodyne COCOc1ccccc1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587809145 GI Annotated Anodyne COc1cccc(O)c1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587809231 GI Annotated Clean COc1cccc(O)c1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587809233 GI Annotated Clean COc1cccc(O)c1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587809235 GI Annotated Clean COc1cccc(O)c1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587809236 GI Annotated Clean COc1ccc(OC)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587809238 GI Annotated Anodyne COc1ccc(OC)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587809239 GI Annotated Anodyne COc1ccc(OC)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587809241 GI Annotated Anodyne COc1ccc(OC)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587809242 GI Annotated Anodyne COc1cccc(OC)c1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809290 GI Annotated Anodyne COc1cccc(OC)c1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809292 GI Annotated Anodyne COc1cccc(OC)c1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809294 GI Annotated Anodyne COc1cccc(OC)c1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809296 GI Annotated Anodyne COc1cccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587809323 GI Annotated Clean COc1cccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587809324 GI Annotated Clean COc1cccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587809325 GI Annotated Clean COc1cccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587809326 GI Annotated Clean CC[C@]1(c2ccc(OC)cc2O)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587809389 GI Annotated Clean CC[C@]1(c2ccc(OC)cc2O)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587809392 GI Annotated Clean CC[C@@]1(c2ccc(OC)cc2O)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587809395 GI Annotated Clean COC(=O)[C@@H]1CCC(C)(C)C[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587809396 GI Annotated Anodyne CC[C@@]1(c2ccc(OC)cc2O)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587809397 GI Annotated Clean COC(=O)[C@@H]1CCC(C)(C)C[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587809398 GI Annotated Anodyne COC(=O)[C@@H]1CCC(C)(C)C[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587809400 GI Annotated Anodyne COC(=O)[C@@H]1CCC(C)(C)C[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587809402 GI Annotated Anodyne COc1cccc2c1[C@]1(CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809407 GI Annotated Anodyne COc1cccc2c1[C@]1(CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809410 GI Annotated Anodyne COc1cccc2c1[C@@]1(CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809414 GI Annotated Anodyne COc1cccc2c1[C@@]1(CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809417 GI Annotated Anodyne COc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1OC ZINC000587809523 GI Annotated Anodyne COc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1OC ZINC000587809528 GI Annotated Anodyne COc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1OC ZINC000587809531 GI Annotated Anodyne COc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1OC ZINC000587809537 GI Annotated Anodyne COC(=O)[C@@H]1CCC[C@@]2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587809546 GI Annotated Anodyne COC(=O)[C@@H]1CCC[C@@]2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587809550 GI Annotated Anodyne COC(=O)[C@@H]1CCC[C@]2(CC1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587809554 GI Annotated Anodyne COC(=O)[C@@H]1CCC[C@]2(CC1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587809559 GI Annotated Anodyne COc1cc(O)c2c(c1)CC[C@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809644 GI Annotated Clean COc1cc(O)c2c(c1)CC[C@@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809654 GI Annotated Clean COc1cc(O)c2c(c1)CC[C@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809659 GI Annotated Clean COc1cc(O)c2c(c1)CC[C@@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587809666 GI Annotated Clean CCc1cc(OC)c(O)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587809868 GI Annotated Clean CCc1cc(OC)c(O)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587809870 GI Annotated Clean CCc1cc(OC)c(O)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587809872 GI Annotated Clean CCc1cc(OC)c(O)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587809874 GI Annotated Clean COc1cc(C[C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1O ZINC000587809977 GI Annotated Anodyne COc1cc(C[C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1O ZINC000587809980 GI Annotated Anodyne COc1cc(C[C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1O ZINC000587809983 GI Annotated Anodyne COc1cc(C[C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1O ZINC000587809986 GI Annotated Anodyne COC(=O)C[C@]1(C2CCCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810007 GI Annotated Anodyne COC(=O)C[C@]1(C2CCCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810009 GI Annotated Anodyne COC(=O)C[C@@]1(C2CCCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810013 GI Annotated Anodyne COC(=O)C[C@@]1(C2CCCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810015 GI Annotated Anodyne CC(=O)Oc1cccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587810119 GI Annotated Anodyne CC[C@@]1(C2(C(=O)OC)CCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810120 GI Annotated Anodyne CC(=O)Oc1cccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587810121 GI Annotated Anodyne CC[C@@]1(C2(C(=O)OC)CCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810124 GI Annotated Anodyne CC(=O)Oc1cccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587810125 GI Annotated Anodyne CC[C@]1(C2(C(=O)OC)CCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810127 GI Annotated Anodyne CC(=O)Oc1cccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587810129 GI Annotated Anodyne CC[C@]1(C2(C(=O)OC)CCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810131 GI Annotated Anodyne CC(=O)Oc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587810298 GI Annotated Anodyne CC(=O)Oc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587810299 GI Annotated Anodyne CC(=O)Oc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587810300 GI Annotated Anodyne CC(=O)Oc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587810301 GI Annotated Anodyne COc1cccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587810361 GI Annotated Clean COc1cccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587810362 GI Annotated Clean COc1cccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587810364 GI Annotated Clean COc1cccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587810366 GI Annotated Clean COc1cc(O)c2c(c1)CC[C@@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587810444 GI Annotated Clean COc1cc(O)c2c(c1)CC[C@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587810449 GI Annotated Clean COc1cc(O)c2c(c1)CC[C@@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587810453 GI Annotated Clean COc1cc(O)c2c(c1)CC[C@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587810457 GI Annotated Clean COc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(OC)c1 ZINC000587810522 GI Annotated Anodyne COc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c(OC)c1 ZINC000587810527 GI Annotated Anodyne COc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(OC)c1 ZINC000587810529 GI Annotated Anodyne COc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c(OC)c1 ZINC000587810532 GI Annotated Anodyne COc1cccc2c1CC[C@@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810764 GI Annotated Anodyne COc1cccc2c1CC[C@@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810766 GI Annotated Anodyne COc1cccc2c1CC[C@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810768 GI Annotated Anodyne COc1cccc2c1CC[C@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587810771 GI Annotated Anodyne COc1ccc(O)c([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587811077 GI Annotated Clean COc1ccc(O)c([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587811079 GI Annotated Clean COc1ccc(O)c([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587811081 GI Annotated Clean COc1ccc(O)c([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587811082 GI Annotated Clean COC(=O)c1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)c1 ZINC000587811230 GI Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)c1 ZINC000587811231 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)c1 ZINC000587811232 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)c1 ZINC000587811233 GI Annotated Anodyne COC(=O)c1cc(C)cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587811270 GI Annotated Anodyne COC(=O)c1cc(C)cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587811271 GI Annotated Anodyne COC(=O)c1cc(C)cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587811272 GI Annotated Anodyne COC(=O)c1cc(C)cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587811273 GI Annotated Anodyne COc1ccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(OC)c1 ZINC000587811339 GI Annotated Anodyne COc1ccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(OC)c1 ZINC000587811340 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(OC)c1 ZINC000587811341 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(OC)c1 ZINC000587811342 GI Annotated Anodyne COc1ccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1OC ZINC000587811387 GI Annotated Anodyne COc1ccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1OC ZINC000587811388 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1OC ZINC000587811389 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1OC ZINC000587811390 GI Annotated Anodyne COc1ccc2c(c1)C[C@@]1(C2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587811613 GI Annotated Anodyne COc1ccc2c(c1)C[C@@]1(C2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587811614 GI Annotated Anodyne COc1ccc2c(c1)C[C@]1(C2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587811615 GI Annotated Anodyne COc1ccc2c(c1)C[C@]1(C2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587811616 GI Annotated Anodyne COc1cccc([C@H](C=O)[C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587811842 GI Annotated Mild COc1cccc([C@H](C=O)[C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587811845 GI Annotated Mild COc1cccc([C@H](C=O)[C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587811847 GI Annotated Mild COc1cccc([C@H](C=O)[C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587811849 GI Annotated Mild COC(=O)c1ccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587811950 GI Annotated Anodyne COC(=O)c1ccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587811953 GI Annotated Anodyne COC(=O)c1ccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587811955 GI Annotated Anodyne COC(=O)c1ccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587811957 GI Annotated Anodyne COc1ccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587812010 GI Annotated Clean COc1ccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587812012 GI Annotated Clean COc1ccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587812013 GI Annotated Clean COc1ccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587812015 GI Annotated Clean CC(=O)C[C@@]1(c2ccccc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587812180 GI Annotated Anodyne CC(=O)C[C@@]1(c2ccccc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587812181 GI Annotated Anodyne CC(=O)C[C@]1(c2ccccc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587812182 GI Annotated Anodyne CC(=O)C[C@]1(c2ccccc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587812183 GI Annotated Anodyne CC[C@]1([C@@H](C(=O)OC)C(C)C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587812359 GI Annotated Anodyne CC[C@]1([C@@H](C(=O)OC)C(C)C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587812361 GI Annotated Anodyne CC[C@]1([C@H](C(=O)OC)C(C)C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587812363 GI Annotated Anodyne CC[C@]1([C@H](C(=O)OC)C(C)C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587812365 GI Annotated Anodyne COC(=O)c1cc(C)cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587812422 GI Annotated Anodyne COC(=O)c1cc(C)cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587812423 GI Annotated Anodyne COC(=O)c1cc(C)cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587812424 GI Annotated Anodyne COC(=O)c1cc(C)cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587812426 GI Annotated Anodyne COC(=O)c1cccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587812498 GI Annotated Anodyne COC(=O)c1cccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587812500 GI Annotated Anodyne COc1cc(OC)cc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587812544 GI Annotated Anodyne COc1cc(OC)cc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587812545 GI Annotated Anodyne COc1cc(OC)cc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587812546 GI Annotated Anodyne COC(=O)c1cccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587812547 GI Annotated Anodyne COc1cc(OC)cc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587812548 GI Annotated Anodyne COC(=O)c1cccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587812549 GI Annotated Anodyne Cc1cccc(C)c1[C@@]1(C=O)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587813134 GI Annotated Mild Cc1cccc(C)c1[C@]1(C=O)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587813135 GI Annotated Mild Cc1cccc(C)c1[C@@]1(C=O)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587813136 GI Annotated Mild Cc1cccc(C)c1[C@]1(C=O)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587813137 GI Annotated Mild CCC(=O)OC1=C(C)CC[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587813588 GI Annotated Anodyne CCC(=O)OC1=C(C)CC[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587813589 GI Annotated Anodyne CCC(=O)OC1=C(C)CC[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587813590 GI Annotated Anodyne CCC(=O)OC1=C(C)CC[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587813591 GI Annotated Anodyne CCC(=O)OC1=C(C)CC[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587813612 GI Annotated Anodyne CCC(=O)OC1=C(C)CC[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587813613 GI Annotated Anodyne CCC(=O)OC1=C(C)CC[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587813614 GI Annotated Anodyne CCC(=O)OC1=C(C)CC[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587813615 GI Annotated Anodyne Cc1cccc(C)c1[C@]1(C=O)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587813651 GI Annotated Mild Cc1cccc(C)c1[C@@]1(C=O)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587813653 GI Annotated Mild Cc1cccc(C)c1[C@]1(C=O)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587813654 GI Annotated Mild Cc1cccc(C)c1[C@@]1(C=O)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587813655 GI Annotated Mild CC(=O)Oc1cccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587813718 GI Annotated Anodyne CC(=O)Oc1cccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587813720 GI Annotated Anodyne CC(=O)Oc1cccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587813722 GI Annotated Anodyne CC(=O)Oc1cccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587813724 GI Annotated Anodyne CC(=O)C[C@@]1(c2ccccc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587814268 GI Annotated Anodyne CC(=O)C[C@@]1(c2ccccc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587814269 GI Annotated Anodyne CC(=O)C[C@]1(c2ccccc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587814270 GI Annotated Anodyne CC(=O)C[C@]1(c2ccccc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587814271 GI Annotated Anodyne Cc1cc(C)cc([C@@]2(C=O)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587815955 GI Annotated Mild Cc1cc(C)cc([C@]2(C=O)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587815956 GI Annotated Mild Cc1cc(C)cc([C@@]2(C=O)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587815957 GI Annotated Mild Cc1cc(C)cc([C@]2(C=O)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587815958 GI Annotated Mild Cc1cc(C)cc([C@@]2(C=O)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587816295 GI Annotated Mild Cc1cc(C)cc([C@]2(C=O)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587816296 GI Annotated Mild Cc1cc(C)cc([C@@]2(C=O)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587816297 GI Annotated Mild Cc1cc(C)cc([C@]2(C=O)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587816298 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)[C@]1(C)CC[C@H]2C1(C)C ZINC000587816959 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)[C@]1(C)CC[C@H]2C1(C)C ZINC000587816960 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)[C@@]1(C)CC[C@@H]2C1(C)C ZINC000587816961 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)[C@]1(C)CC[C@H]2C1(C)C ZINC000587816962 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)[C@@]1(C)CC[C@@H]2C1(C)C ZINC000587816963 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)[C@]1(C)CC[C@H]2C1(C)C ZINC000587816964 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)[C@@]1(C)CC[C@@H]2C1(C)C ZINC000587816965 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)[C@@]1(C)CC[C@@H]2C1(C)C ZINC000587816966 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@@]3(C)CC(=O)C[C@@]3(C)C2)N1 ZINC000587817109 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@@]3(C)CC(=O)C[C@@]3(C)C2)N1 ZINC000587817110 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@@]3(C)CC(=O)C[C@@]3(C)C2)N1 ZINC000587817111 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@@]3(C)CC(=O)C[C@@]3(C)C2)N1 ZINC000587817112 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)[C@]1(C)CC[C@H]2C1(C)C ZINC000587817551 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)[C@@]1(C)CC[C@@H]2C1(C)C ZINC000587817552 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)[C@]1(C)CC[C@H]2C1(C)C ZINC000587817553 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)[C@@]1(C)CC[C@@H]2C1(C)C ZINC000587817554 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)[C@]1(C)CC[C@H]2C1(C)C ZINC000587817555 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)[C@@]1(C)CC[C@@H]2C1(C)C ZINC000587817556 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)[C@]1(C)CC[C@H]2C1(C)C ZINC000587817557 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)[C@@]1(C)CC[C@@H]2C1(C)C ZINC000587817558 GI Annotated Anodyne Cc1cccc([C@H](C=O)[C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587817599 GI Annotated Mild Cc1cccc([C@H](C=O)[C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587817603 GI Annotated Mild Cc1cccc([C@H](C=O)[C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587817605 GI Annotated Mild Cc1cccc([C@H](C=O)[C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587817606 GI Annotated Mild CC(C)C1=CC=CC(=O)[C@@]2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587817762 GI Annotated Mild CC(C)C1=CC=CC(=O)[C@@]2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587817764 GI Annotated Mild CC(C)C1=CC=CC(=O)[C@]2(C1)N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587817765 GI Annotated Mild CC(C)C1=CC=CC(=O)[C@]2(C1)N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587817767 GI Annotated Mild CC1=C[C@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)C(C(C)C)=CC1=O ZINC000587817844 GI Annotated Mild CC1=C[C@]2(N[C@@H](C)Cc3cc(Br)c(F)cc32)C(C(C)C)=CC1=O ZINC000587817847 GI Annotated Mild CC1=C[C@@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)C(C(C)C)=CC1=O ZINC000587817849 GI Annotated Mild CC1=C[C@@]2(N[C@@H](C)Cc3cc(Br)c(F)cc32)C(C(C)C)=CC1=O ZINC000587817853 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)[C@@H]1CC[C@@]2(C)C1(C)C ZINC000587818111 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)[C@H]1CC[C@]2(C)C1(C)C ZINC000587818112 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)[C@@H]1CC[C@@]2(C)C1(C)C ZINC000587818113 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)[C@@H]1CC[C@@]2(C)C1(C)C ZINC000587818114 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)[C@H]1CC[C@]2(C)C1(C)C ZINC000587818300 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)[C@H]1CC[C@]2(C)C1(C)C ZINC000587818301 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)[C@@H]1CC[C@@]2(C)C1(C)C ZINC000587818302 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)[C@H]1CC[C@]2(C)C1(C)C ZINC000587818303 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)[C@@H]1CC[C@@]2(C)C1(C)C ZINC000587818344 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)[C@H]1CC[C@]2(C)C1(C)C ZINC000587818345 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)[C@@H]1CC[C@@]2(C)C1(C)C ZINC000587818346 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)[C@@H]1CC[C@@]2(C)C1(C)C ZINC000587818347 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)[C@H]1CC[C@]2(C)C1(C)C ZINC000587818348 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)[C@H]1CC[C@]2(C)C1(C)C ZINC000587818349 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)[C@@H]1CC[C@@]2(C)C1(C)C ZINC000587818350 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)[C@H]1CC[C@]2(C)C1(C)C ZINC000587818351 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C=C3CCC(=O)[C@@]3(C)CC2)N1 ZINC000587818642 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=C3CCC(=O)[C@@]3(C)CC2)N1 ZINC000587818643 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=C3CCC(=O)[C@@]3(C)CC2)N1 ZINC000587818644 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C=C3CCC(=O)[C@@]3(C)CC2)N1 ZINC000587818645 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC3=CC(=O)CC[C@@]32C)N1 ZINC000587818709 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC3=CC(=O)CC[C@@]32C)N1 ZINC000587818711 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC3=CC(=O)CC[C@@]32C)N1 ZINC000587818713 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC3=CC(=O)CC[C@@]32C)N1 ZINC000587818714 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C=CC(=O)C(C(C)(C)C)=C2)N1 ZINC000587819172 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C=CC(=O)C(C(C)(C)C)=C2)N1 ZINC000587819173 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=CC(=O)C(C(C)(C)C)=C2)N1 ZINC000587819174 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=CC(=O)C(C(C)(C)C)=C2)N1 ZINC000587819175 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@@]3(C)CC(=O)C[C@@]3(C)C2)N1 ZINC000587819218 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@@]3(C)CC(=O)C[C@@]3(C)C2)N1 ZINC000587819219 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@@]3(C)CC(=O)C[C@@]3(C)C2)N1 ZINC000587819220 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@@]3(C)CC(=O)C[C@@]3(C)C2)N1 ZINC000587819221 GI Annotated Anodyne CC1=C[C@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)C(C(C)C)=CC1=O ZINC000587819437 GI Annotated Mild CC1=C[C@]2(N[C@@H](C)Cc3ccc(F)c(Br)c32)C(C(C)C)=CC1=O ZINC000587819439 GI Annotated Mild CC1=C[C@@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)C(C(C)C)=CC1=O ZINC000587819442 GI Annotated Mild CC1=C[C@@]2(N[C@@H](C)Cc3ccc(F)c(Br)c32)C(C(C)C)=CC1=O ZINC000587819444 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587819576 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587819577 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587819578 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587819579 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587819580 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587819581 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587819582 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587819583 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C=C3CCC(=O)[C@@]3(C)CC2)N1 ZINC000587819872 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=C3CCC(=O)[C@@]3(C)CC2)N1 ZINC000587819874 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=C3CCC(=O)[C@@]3(C)CC2)N1 ZINC000587819876 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C=C3CCC(=O)[C@@]3(C)CC2)N1 ZINC000587819877 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC3=CC(=O)CC[C@@]32C)N1 ZINC000587819957 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC3=CC(=O)CC[C@@]32C)N1 ZINC000587819959 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC3=CC(=O)CC[C@@]32C)N1 ZINC000587819961 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC3=CC(=O)CC[C@@]32C)N1 ZINC000587819963 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3c(C(=O)O)cccc32)N1 ZINC000587820111 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3c(C(=O)O)cccc32)N1 ZINC000587820112 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3c(C(=O)O)cccc32)N1 ZINC000587820113 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3c(C(=O)O)cccc32)N1 ZINC000587820114 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@H]3C[C@@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587820343 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@H]3C[C@@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587820347 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@H]3C[C@@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587820350 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@H]3C[C@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587820351 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@H]3C[C@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587820354 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@H]3C[C@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587820358 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(/C=C/C(=O)O)cc2)N1 ZINC000587820397 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(/C=C/C(=O)O)cc2)N1 ZINC000587820410 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(/C=C/C(=O)O)cc2)N1 ZINC000587820414 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(/C=C/C(=O)O)cc2)N1 ZINC000587820417 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](/C=C/C(=O)O)(c2ccccc2)N1 ZINC000587820514 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](/C=C/C(=O)O)(c2ccccc2)N1 ZINC000587820519 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](/C=C/C(=O)O)(c2ccccc2)N1 ZINC000587820522 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](/C=C/C(=O)O)(c2ccccc2)N1 ZINC000587820524 GI Annotated Anodyne CC[C@@]1(c2ccc(O)cc2O)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587821114 GI Annotated Clean CC[C@]1(c2ccc(O)cc2O)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587821116 GI Annotated Clean CC[C@]1(c2ccc(O)cc2O)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587821117 GI Annotated Clean CC[C@@]1(c2ccc(O)cc2O)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587821118 GI Annotated Clean CC[C@@]1(c2ccc(O)cc2O)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587821272 GI Annotated Clean CC[C@]1(c2ccc(O)cc2O)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587821273 GI Annotated Clean CC[C@]1(c2ccc(O)cc2O)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587821274 GI Annotated Clean CC[C@@]1(c2ccc(O)cc2O)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587821275 GI Annotated Clean Cc1c(O)ccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587821354 GI Annotated Clean Cc1c(O)ccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587821355 GI Annotated Clean Cc1c(O)ccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587821356 GI Annotated Clean Cc1c(O)ccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587821357 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CCc2ccc(O)c(O)c2)N1 ZINC000587821536 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CCc2ccc(O)c(O)c2)N1 ZINC000587821538 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(CCc2ccc(O)c(O)c2)N1 ZINC000587821539 GI Annotated Clean C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(CCc2ccc(O)c(O)c2)N1 ZINC000587821540 GI Annotated Clean Cc1cccc([C@H](C=O)[C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587821633 GI Annotated Mild Cc1cccc([C@H](C=O)[C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587821635 GI Annotated Mild Cc1cccc([C@H](C=O)[C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587821637 GI Annotated Mild Cc1cccc([C@H](C=O)[C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587821639 GI Annotated Mild Cc1cc(C=O)cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587821832 GI Annotated Clean Cc1cc(C=O)cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587821837 GI Annotated Clean Cc1cc(C=O)cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587821839 GI Annotated Clean Cc1cc(C=O)cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587821841 GI Annotated Clean Cc1ccc([C@H](C=O)[C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587821881 GI Annotated Mild Cc1ccc([C@H](C=O)[C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587821882 GI Annotated Mild Cc1ccc([C@H](C=O)[C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587821884 GI Annotated Mild Cc1ccc([C@H](C=O)[C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587821885 GI Annotated Mild Cc1ccc([C@H](C=O)[C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587822084 GI Annotated Mild Cc1ccc([C@H](C=O)[C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587822085 GI Annotated Mild Cc1ccc([C@H](C=O)[C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587822086 GI Annotated Mild Cc1ccc([C@H](C=O)[C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587822087 GI Annotated Mild Cc1cc(O)c([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587822280 GI Annotated Clean Cc1cc(O)c([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587822282 GI Annotated Clean Cc1cc(O)c([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587822283 GI Annotated Clean Cc1cc(O)c([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(O)c1 ZINC000587822284 GI Annotated Clean CC1=CC(=O)C(C(C)C)=C[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587822406 GI Annotated Mild CC1=CC(=O)C(C(C)C)=C[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587822408 GI Annotated Mild CC1=CC(=O)C(C(C)C)=C[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587822409 GI Annotated Mild CC1=CC(=O)C(C(C)C)=C[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587822411 GI Annotated Mild CC1=CC(=O)C(C(C)C)=C[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587822483 GI Annotated Mild CC1=CC(=O)C(C(C)C)=C[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587822485 GI Annotated Mild CC1=CC(=O)C(C(C)C)=C[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587822486 GI Annotated Mild CC1=CC(=O)C(C(C)C)=C[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587822487 GI Annotated Mild Cc1cc(C=O)cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587822710 GI Annotated Clean Cc1cc(C=O)cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587822711 GI Annotated Clean Cc1cc(C=O)cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587822712 GI Annotated Clean Cc1cc(C=O)cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1O ZINC000587822713 GI Annotated Clean CC(C)C1=CC=C[C@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)C(=O)C1 ZINC000587822898 GI Annotated Anodyne CC(C)C1=CC=C[C@]2(N[C@@H](C)Cc3ccc(F)c(Br)c32)C(=O)C1 ZINC000587822899 GI Annotated Anodyne CC(C)C1=CC=C[C@@]2(N[C@H](C)Cc3ccc(F)c(Br)c32)C(=O)C1 ZINC000587822900 GI Annotated Anodyne CC(C)C1=CC=C[C@@]2(N[C@@H](C)Cc3ccc(F)c(Br)c32)C(=O)C1 ZINC000587822901 GI Annotated Anodyne CC(C)C1=CC=C[C@@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)C(=O)C1 ZINC000587822975 GI Annotated Anodyne CC(C)C1=CC=C[C@@]2(N[C@@H](C)Cc3cc(Br)c(F)cc32)C(=O)C1 ZINC000587822976 GI Annotated Anodyne CC(C)C1=CC=C[C@]2(N[C@H](C)Cc3cc(Br)c(F)cc32)C(=O)C1 ZINC000587822978 GI Annotated Anodyne CC(C)C1=CC=C[C@]2(N[C@@H](C)Cc3cc(Br)c(F)cc32)C(=O)C1 ZINC000587822980 GI Annotated Anodyne Cc1c(O)ccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587823150 GI Annotated Clean Cc1c(O)ccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587823152 GI Annotated Clean Cc1c(O)ccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587823210 GI Annotated Clean Cc1c(O)ccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1O ZINC000587823211 GI Annotated Clean Cc1cc(C=O)c(O)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587823546 GI Annotated Clean Cc1cc(C=O)c(O)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587823548 GI Annotated Clean Cc1cc(C=O)c(O)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587823549 GI Annotated Clean Cc1cc(C=O)c(O)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587823550 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CCc2ccc(O)c(O)c2)N1 ZINC000587823633 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CCc2ccc(O)c(O)c2)N1 ZINC000587823635 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(CCc2ccc(O)c(O)c2)N1 ZINC000587823637 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(CCc2ccc(O)c(O)c2)N1 ZINC000587823640 GI Annotated Clean CC(C)C1=CC=CC(=O)[C@]2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587823693 GI Annotated Mild CC(C)C1=CC=CC(=O)[C@]2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587823694 GI Annotated Mild CC(C)C1=CC=CC(=O)[C@@]2(C1)N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587823695 GI Annotated Mild CC(C)C1=CC=CC(=O)[C@@]2(C1)N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587823696 GI Annotated Mild Cc1cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc(C=O)c1O ZINC000587823709 GI Annotated Anodyne Cc1cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc(C=O)c1O ZINC000587823710 GI Annotated Anodyne Cc1cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc(C=O)c1O ZINC000587823711 GI Annotated Anodyne Cc1cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc(C=O)c1O ZINC000587823712 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587823717 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587823718 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587823719 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587823720 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587823721 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587823722 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587823723 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@@H]3C[C@@H](C3(C)C)[C@]2(C)O)N1 ZINC000587823724 GI Annotated Anodyne Cc1cc(C=O)c(O)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587823796 GI Annotated Clean Cc1cc(C=O)c(O)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587823798 GI Annotated Clean Cc1cc(C=O)c(O)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587823800 GI Annotated Clean Cc1cc(C=O)c(O)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587823802 GI Annotated Clean Cc1cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc(C=O)c1O ZINC000587823844 GI Annotated Anodyne Cc1cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc(C=O)c1O ZINC000587823845 GI Annotated Anodyne Cc1cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc(C=O)c1O ZINC000587823846 GI Annotated Anodyne Cc1cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc(C=O)c1O ZINC000587823847 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=CC(=O)C=C2C(C)(C)C)N1 ZINC000587823870 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=CC(=O)C=C2C(C)(C)C)N1 ZINC000587823872 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C=CC(=O)C=C2C(C)(C)C)N1 ZINC000587823873 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C=CC(=O)C=C2C(C)(C)C)N1 ZINC000587823875 GI Annotated Mild Cc1cc(O)c([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587823909 GI Annotated Clean Cc1cc(O)c([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587823910 GI Annotated Clean Cc1cc(O)c([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587823911 GI Annotated Clean Cc1cc(O)c([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(O)c1 ZINC000587823912 GI Annotated Clean C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C=CC(=O)C(C(C)(C)C)=C2)N1 ZINC000587824097 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C=CC(=O)C(C(C)(C)C)=C2)N1 ZINC000587824098 GI Annotated Mild C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=CC(=O)C(C(C)(C)C)=C2)N1 ZINC000587824099 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=CC(=O)C(C(C)(C)C)=C2)N1 ZINC000587824100 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C=CC(=O)C=C2C(C)(C)C)N1 ZINC000587824170 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C=CC(=O)C=C2C(C)(C)C)N1 ZINC000587824171 GI Annotated Mild C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=CC(=O)C=C2C(C)(C)C)N1 ZINC000587824172 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=CC(=O)C=C2C(C)(C)C)N1 ZINC000587824174 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@H]3C[C@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587824365 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@H]3C[C@@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587824366 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3cc(C(=O)O)ccc32)N1 ZINC000587824383 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3cc(C(=O)O)ccc32)N1 ZINC000587824384 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3cc(C(=O)O)ccc32)N1 ZINC000587824385 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3cc(C(=O)O)ccc32)N1 ZINC000587824386 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(C(C)(C)O)N1 ZINC000587824535 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)(C(C)(C)O)N1 ZINC000587824536 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(C(C)(C)O)N1 ZINC000587824537 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)(C(C)(C)O)N1 ZINC000587824538 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccccc2C(=O)O)N1 ZINC000587824723 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccccc2C(=O)O)N1 ZINC000587824724 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccccc2C(=O)O)N1 ZINC000587824725 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccccc2C(=O)O)N1 ZINC000587824726 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3c(C(=O)O)cccc32)N1 ZINC000587824937 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3c(C(=O)O)cccc32)N1 ZINC000587824938 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3c(C(=O)O)cccc32)N1 ZINC000587824939 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3c(C(=O)O)cccc32)N1 ZINC000587824940 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@H]3CC[C@@]2(C(=O)O)C3(C)C)N1 ZINC000587824945 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@H]3CC[C@@]2(C(=O)O)C3(C)C)N1 ZINC000587824946 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@H]3CC[C@@]2(C(=O)O)C3(C)C)N1 ZINC000587824947 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@H]3CC[C@@]2(C(=O)O)C3(C)C)N1 ZINC000587824948 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(C(C)(C)O)N1 ZINC000587824999 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)(C(C)(C)O)N1 ZINC000587825000 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(C(C)(C)O)N1 ZINC000587825001 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)(C(C)(C)O)N1 ZINC000587825002 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC[C@H](C(=O)O)C(C)(C)C2)N1 ZINC000587825003 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC[C@@H](C(=O)O)C(C)(C)C2)N1 ZINC000587825004 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC[C@@H](C(=O)O)C(C)(C)C2)N1 ZINC000587825005 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC[C@H](C(=O)O)C(C)(C)C2)N1 ZINC000587825006 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC[C@H](C(=O)O)C(C)(C)C2)N1 ZINC000587825188 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC[C@@H](C(=O)O)C(C)(C)C2)N1 ZINC000587825190 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC[C@@H](C(=O)O)C(C)(C)C2)N1 ZINC000587825191 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC[C@H](C(=O)O)C(C)(C)C2)N1 ZINC000587825193 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(C(=O)O)cc2)N1 ZINC000587825194 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(C(=O)O)cc2)N1 ZINC000587825196 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(C(=O)O)cc2)N1 ZINC000587825197 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(C(=O)O)cc2)N1 ZINC000587825199 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(/C=C/C(=O)O)cc2)N1 ZINC000587825252 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(/C=C/C(=O)O)cc2)N1 ZINC000587825253 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(/C=C/C(=O)O)cc2)N1 ZINC000587825254 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(/C=C/C(=O)O)cc2)N1 ZINC000587825255 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc(C(=O)O)c2)N1 ZINC000587825314 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc(C(=O)O)c2)N1 ZINC000587825315 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cccc(C(=O)O)c2)N1 ZINC000587825316 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cccc(C(=O)O)c2)N1 ZINC000587825317 GI Annotated Anodyne Cc1cc(C(=O)O)cc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587825388 GI Annotated Anodyne Cc1cc(C(=O)O)cc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587825389 GI Annotated Anodyne Cc1cc(C(=O)O)cc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587825390 GI Annotated Anodyne Cc1cc(C(=O)O)cc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587825391 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCc2ccccc2)(C(=O)O)N1 ZINC000587825430 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCc2ccccc2)(C(=O)O)N1 ZINC000587825431 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCc2ccccc2)(C(=O)O)N1 ZINC000587825432 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCc2ccccc2)(C(=O)O)N1 ZINC000587825433 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@H]3CC[C@]2(C(=O)O)C3(C)C)N1 ZINC000587825464 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@H]3CC[C@]2(C(=O)O)C3(C)C)N1 ZINC000587825465 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C[C@H]3CC[C@]2(C(=O)O)C3(C)C)N1 ZINC000587825466 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C[C@H]3CC[C@]2(C(=O)O)C3(C)C)N1 ZINC000587825467 GI Annotated Anodyne Cc1cc(C(=O)O)cc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587825677 GI Annotated Anodyne Cc1cc(C(=O)O)cc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587825678 GI Annotated Anodyne Cc1cc(C(=O)O)cc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587825679 GI Annotated Anodyne Cc1cc(C(=O)O)cc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587825680 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(C)(C)[C@H]1CC[C@@]2(C(=O)O)C1 ZINC000587825681 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(C)(C)[C@H]1CC[C@@]2(C(=O)O)C1 ZINC000587825682 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(C)(C)[C@H]1CC[C@@]2(C(=O)O)C1 ZINC000587825683 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(C)(C)[C@H]1CC[C@@]2(C(=O)O)C1 ZINC000587825684 GI Annotated Anodyne CC[C@]1(c2ccc(C(=O)O)cc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587825719 GI Annotated Anodyne CC[C@]1(c2ccc(C(=O)O)cc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587825721 GI Annotated Anodyne CC[C@@]1(c2ccc(C(=O)O)cc2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587825722 GI Annotated Anodyne CC[C@@]1(c2ccc(C(=O)O)cc2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587825723 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)([C@@H]2C[C@H](CC(=O)O)C2(C)C)N1 ZINC000587825770 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)([C@@H]2C[C@H](CC(=O)O)C2(C)C)N1 ZINC000587825773 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)([C@@H]2C[C@H](CC(=O)O)C2(C)C)N1 ZINC000587825774 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)([C@@H]2C[C@H](CC(=O)O)C2(C)C)N1 ZINC000587825776 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)[C@H]1CC=C[C@H]2C[C@H](C(=O)O)C1 ZINC000587825822 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)[C@H]1CC=C[C@H]2C[C@@H](C(=O)O)C1 ZINC000587825837 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)[C@H]1CC=C[C@H]2C[C@@H](C(=O)O)C1 ZINC000587825841 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)[C@H]1CC=C[C@H]2C[C@H](C(=O)O)C1 ZINC000587825844 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C2(N1)[C@H]1CCC[C@H]2CC(C(=O)O)C1 ZINC000587825973 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(N1)[C@H]1CCC[C@H]2CC(C(=O)O)C1 ZINC000587825974 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3cc(C(=O)O)ccc32)N1 ZINC000587825983 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3cc(C(=O)O)ccc32)N1 ZINC000587825984 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3cc(C(=O)O)ccc32)N1 ZINC000587825985 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3cc(C(=O)O)ccc32)N1 ZINC000587825986 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3ccc(C(=O)O)cc32)N1 ZINC000587826018 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3ccc(C(=O)O)cc32)N1 ZINC000587826020 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3ccc(C(=O)O)cc32)N1 ZINC000587826022 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3ccc(C(=O)O)cc32)N1 ZINC000587826023 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCC[C@@H]2CCC(=O)O)N1 ZINC000587826094 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCC[C@@H]2CCC(=O)O)N1 ZINC000587826096 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCC[C@H]2CCC(=O)O)N1 ZINC000587826099 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCC[C@H]2CCC(=O)O)N1 ZINC000587826100 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)[C@@]1(C)CC[C@H]2C1(C)C ZINC000587826113 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)[C@@]1(C)CC[C@H]2C1(C)C ZINC000587826114 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)[C@@]1(C)CC[C@H]2C1(C)C ZINC000587826115 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)[C@@]1(C)CC[C@H]2C1(C)C ZINC000587826116 GI Annotated Anodyne Cc1ccc([C@]2([C@H](C)O)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587826267 GI Annotated Anodyne Cc1ccc([C@]2([C@H](C)O)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587826268 GI Annotated Anodyne Cc1ccc([C@]2([C@@H](C)O)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587826269 GI Annotated Anodyne Cc1ccc([C@]2([C@@H](C)O)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587826270 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccccc2C(=O)O)N1 ZINC000587826379 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccccc2C(=O)O)N1 ZINC000587826380 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccccc2C(=O)O)N1 ZINC000587826382 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccccc2C(=O)O)N1 ZINC000587826383 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587826432 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587826435 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587826439 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587826441 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(CCC(=O)O)c2)N1 ZINC000587826448 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(CCC(=O)O)c2)N1 ZINC000587826450 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(CCC(=O)O)c2)N1 ZINC000587826452 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(CCC(=O)O)c2)N1 ZINC000587826455 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](/C=C/C(=O)O)(c2ccccc2)N1 ZINC000587826491 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](/C=C/C(=O)O)(c2ccccc2)N1 ZINC000587826492 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](/C=C/C(=O)O)(c2ccccc2)N1 ZINC000587826493 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](/C=C/C(=O)O)(c2ccccc2)N1 ZINC000587826494 GI Annotated Anodyne CC(=O)C[C@]1(c2ccccc2O)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587826501 GI Annotated Clean CC(=O)C[C@]1(c2ccccc2O)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587826512 GI Annotated Clean CC(=O)C[C@@]1(c2ccccc2O)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587826513 GI Annotated Clean CC(=O)C[C@@]1(c2ccccc2O)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587826515 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@H]3CC[C@@]2(C(=O)O)C3(C)C)N1 ZINC000587826669 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@H]3CC[C@@]2(C(=O)O)C3(C)C)N1 ZINC000587826671 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@H]3CC[C@@]2(C(=O)O)C3(C)C)N1 ZINC000587826672 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@H]3CC[C@@]2(C(=O)O)C3(C)C)N1 ZINC000587826673 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)[C@H]1CC=C[C@H]2C[C@H](C(=O)O)C1 ZINC000587826747 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)[C@H]1CC=C[C@H]2C[C@@H](C(=O)O)C1 ZINC000587826749 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCC(=O)O)(c2ccccc2)N1 ZINC000587826750 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)[C@H]1CC=C[C@H]2C[C@@H](C(=O)O)C1 ZINC000587826751 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCC(=O)O)(c2ccccc2)N1 ZINC000587826752 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)[C@H]1CC=C[C@H]2C[C@H](C(=O)O)C1 ZINC000587826753 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCC(=O)O)(c2ccccc2)N1 ZINC000587826754 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCC(=O)O)(c2ccccc2)N1 ZINC000587826755 GI Annotated Anodyne CC[C@]1(c2ccc(C(=O)O)cc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587826789 GI Annotated Anodyne CC[C@]1(c2ccc(C(=O)O)cc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587826792 GI Annotated Anodyne CC[C@@]1(c2ccc(C(=O)O)cc2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587826794 GI Annotated Anodyne CC[C@@]1(c2ccc(C(=O)O)cc2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587826797 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3ccc(C(=O)O)cc32)N1 ZINC000587827103 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3ccc(C(=O)O)cc32)N1 ZINC000587827104 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3ccc(C(=O)O)cc32)N1 ZINC000587827106 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3ccc(C(=O)O)cc32)N1 ZINC000587827108 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(CCC(=O)O)c2)N1 ZINC000587827262 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(CCC(=O)O)c2)N1 ZINC000587827263 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(CCC(=O)O)c2)N1 ZINC000587827264 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(CCC(=O)O)c2)N1 ZINC000587827265 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCC(=O)O)(c2ccccc2)N1 ZINC000587827361 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCC(=O)O)(c2ccccc2)N1 ZINC000587827362 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCC(=O)O)(c2ccccc2)N1 ZINC000587827363 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCC(=O)O)(c2ccccc2)N1 ZINC000587827364 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@H]3CC[C@]2(C(=O)O)C3(C)C)N1 ZINC000587827605 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@H]3CC[C@]2(C(=O)O)C3(C)C)N1 ZINC000587827606 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@H]3CC[C@]2(C(=O)O)C3(C)C)N1 ZINC000587827607 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@H]3CC[C@]2(C(=O)O)C3(C)C)N1 ZINC000587827608 GI Annotated Anodyne COC(=O)c1cc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)o1 ZINC000587827812 GI Annotated Anodyne COC(=O)c1cc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)o1 ZINC000587827813 GI Annotated Anodyne COC(=O)c1cc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)o1 ZINC000587827814 GI Annotated Anodyne COC(=O)c1cc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)o1 ZINC000587827815 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCc2ccccc2)(C(=O)O)N1 ZINC000587827945 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCc2ccccc2)(C(=O)O)N1 ZINC000587827946 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCc2ccccc2)(C(=O)O)N1 ZINC000587827947 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCc2ccccc2)(C(=O)O)N1 ZINC000587827948 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)[C@@]1(C)CC[C@H]2C1(C)C ZINC000587827951 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)[C@@]1(C)CC[C@H]2C1(C)C ZINC000587827952 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)[C@@]1(C)CC[C@H]2C1(C)C ZINC000587827953 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)[C@@]1(C)CC[C@H]2C1(C)C ZINC000587827954 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(CC(=O)O)cc2)N1 ZINC000587828019 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(CC(=O)O)cc2)N1 ZINC000587828020 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(CC(=O)O)cc2)N1 ZINC000587828021 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(CC(=O)O)cc2)N1 ZINC000587828022 GI Annotated Anodyne Cc1ccc([C@]2([C@H](C)O)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587828148 GI Annotated Anodyne Cc1ccc([C@]2([C@H](C)O)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587828150 GI Annotated Anodyne Cc1ccc([C@]2([C@@H](C)O)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587828152 GI Annotated Anodyne Cc1ccc([C@]2([C@@H](C)O)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587828154 GI Annotated Anodyne C[C@H]1C(C)(C)[C@H](C(=O)O)CC[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587828156 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC[C@H](C(=O)O)C(C)(C)[C@H]2C)N1 ZINC000587828158 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC[C@@H](C(=O)O)C(C)(C)[C@H]2C)N1 ZINC000587828160 GI Annotated Anodyne C[C@H]1C(C)(C)[C@@H](C(=O)O)CC[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587828162 GI Annotated Anodyne COC(=O)c1cc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)o1 ZINC000587828206 GI Annotated Anodyne COC(=O)c1cc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)o1 ZINC000587828207 GI Annotated Anodyne COC(=O)c1cc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)o1 ZINC000587828208 GI Annotated Anodyne COC(=O)c1cc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)o1 ZINC000587828209 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccccc2/C=C/C(=O)O)N1 ZINC000587828263 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccccc2/C=C/C(=O)O)N1 ZINC000587828264 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccccc2/C=C/C(=O)O)N1 ZINC000587828265 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccccc2/C=C/C(=O)O)N1 ZINC000587828266 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(CC(=O)O)cc2)N1 ZINC000587828347 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(CC(=O)O)cc2)N1 ZINC000587828349 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(CC(=O)O)cc2)N1 ZINC000587828352 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(CC(=O)O)cc2)N1 ZINC000587828353 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC(=O)C[C@H](c3ccco3)C2)N1 ZINC000587828396 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC(=O)C[C@@H](c3ccco3)C2)N1 ZINC000587828403 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC(=O)C[C@@H](c3ccco3)C2)N1 ZINC000587828404 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC(=O)C[C@H](c3ccco3)C2)N1 ZINC000587828405 GI Annotated Anodyne C[C@H]1C(C)(C)[C@H](C(=O)O)CC[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587828452 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC[C@H](C(=O)O)C(C)(C)[C@H]2C)N1 ZINC000587828454 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC[C@@H](C(=O)O)C(C)(C)[C@H]2C)N1 ZINC000587828456 GI Annotated Anodyne C[C@H]1C(C)(C)[C@@H](C(=O)O)CC[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587828458 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(C)(C)[C@H]1CC[C@@]2(C(=O)O)C1 ZINC000587828620 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(C)(C)[C@H]1CC[C@@]2(C(=O)O)C1 ZINC000587828622 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(C)(C)[C@H]1CC[C@@]2(C(=O)O)C1 ZINC000587828625 GI Annotated Anodyne CCc1oc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1C(=O)OC ZINC000587828626 GI Annotated Anodyne CCc1oc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1C(=O)OC ZINC000587828627 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(C)(C)[C@H]1CC[C@@]2(C(=O)O)C1 ZINC000587828628 GI Annotated Anodyne CCc1oc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cc1C(=O)OC ZINC000587828629 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(N1)[C@H]1CCC[C@H]2CC(C(=O)O)C1 ZINC000587828630 GI Annotated Anodyne CCc1oc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1C(=O)OC ZINC000587828631 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(N1)[C@H]1CCC[C@H]2CC(C(=O)O)C1 ZINC000587828633 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CC2CCCCC2)(C(=O)O)N1 ZINC000587828681 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CC2CCCCC2)(C(=O)O)N1 ZINC000587828683 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CC2CCCCC2)(C(=O)O)N1 ZINC000587828685 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CC2CCCCC2)(C(=O)O)N1 ZINC000587828686 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(CCC3(CC2)CC(C(=O)O)C3)N1 ZINC000587828731 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(CCC3(CC2)CC(C(=O)O)C3)N1 ZINC000587828734 GI Annotated Anodyne Cc1ccc(C(=O)O)cc1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587828738 GI Annotated Anodyne Cc1ccc(C(=O)O)cc1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587828740 GI Annotated Anodyne Cc1ccc(C(=O)O)cc1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587828742 GI Annotated Anodyne Cc1ccc(C(=O)O)cc1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587828745 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)[C@H]1CC[C@@]2(C)C1(C)C ZINC000587828809 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)[C@H]1CC[C@@]2(C)C1(C)C ZINC000587828810 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)C(=O)[C@H]1CC[C@@]2(C)C1(C)C ZINC000587828811 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)C(=O)[C@H]1CC[C@@]2(C)C1(C)C ZINC000587828812 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)([C@H]2COc3ccccc3O2)N1 ZINC000587828918 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)([C@@H]2COc3ccccc3O2)N1 ZINC000587828919 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)([C@H]2COc3ccccc3O2)N1 ZINC000587828920 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)([C@@H]2COc3ccccc3O2)N1 ZINC000587828921 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@H]3C[C@@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587829057 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@H]3C[C@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587829058 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@H]3C[C@@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587829059 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@H]3C[C@@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587829061 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C[C@H]3C[C@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587829063 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@H]3C[C@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587829065 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@H]3C[C@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587829067 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C[C@H]3C[C@@H](C3(C)C)[C@@]2(C)O)N1 ZINC000587829069 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)[C@H]1CC[C@@]2(C)C1(C)C ZINC000587829153 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)[C@H]1CC[C@@]2(C)C1(C)C ZINC000587829155 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)C(=O)[C@H]1CC[C@@]2(C)C1(C)C ZINC000587829156 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)C(=O)[C@H]1CC[C@@]2(C)C1(C)C ZINC000587829158 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCC[C@@H]2CCC(=O)O)N1 ZINC000587829219 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCC[C@@H]2CCC(=O)O)N1 ZINC000587829220 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCC[C@H]2CCC(=O)O)N1 ZINC000587829221 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCC[C@H]2CCC(=O)O)N1 ZINC000587829222 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CC2CCCCC2)(C(=O)O)N1 ZINC000587829227 GI Annotated Anodyne CCC(=O)OC1=C(C)OC=C[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587829313 GI Annotated Anodyne CCC(=O)OC1=C(C)OC=C[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587829317 GI Annotated Anodyne CCC(=O)OC1=C(C)OC=C[C@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587829319 GI Annotated Anodyne CCC(=O)OC1=C(C)OC=C[C@@]12N[C@@H](C)Cc1cc(Br)c(F)cc12 ZINC000587829322 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc(C(=O)O)c2)N1 ZINC000587829409 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc(C(=O)O)c2)N1 ZINC000587829412 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cccc(C(=O)O)c2)N1 ZINC000587829415 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cccc(C(=O)O)c2)N1 ZINC000587829417 GI Annotated Anodyne CCC(=O)OC1=C(C)OC=C[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587829428 GI Annotated Anodyne CCC(=O)OC1=C(C)OC=C[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587829431 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CC2CCCCC2)(C(=O)O)N1 ZINC000587829579 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CC2CCCCC2)(C(=O)O)N1 ZINC000587829580 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CC2CCCCC2)(C(=O)O)N1 ZINC000587829581 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccccc2/C=C/C(=O)O)N1 ZINC000587829612 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccccc2/C=C/C(=O)O)N1 ZINC000587829613 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccccc2/C=C/C(=O)O)N1 ZINC000587829614 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccccc2/C=C/C(=O)O)N1 ZINC000587829616 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=C3CCC(=O)[C@]3(C)CC2)N1 ZINC000587829631 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C=C3CCC(=O)[C@]3(C)CC2)N1 ZINC000587829632 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(CCC(=O)O)cc2)N1 ZINC000587829691 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(CCC(=O)O)cc2)N1 ZINC000587829692 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(CCC(=O)O)cc2)N1 ZINC000587829693 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(CCC(=O)O)cc2)N1 ZINC000587829694 GI Annotated Anodyne CCC(=O)OC1=C(C)OC=C[C@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587829745 GI Annotated Anodyne CCC(=O)OC1=C(C)OC=C[C@@]12N[C@@H](C)Cc1ccc(F)c(Br)c12 ZINC000587829746 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587829835 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587829837 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587829840 GI Annotated Anodyne Cc1cc(C(=O)O)ccc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587829842 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(CCC3(CC2)CC(C(=O)O)C3)N1 ZINC000587829862 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C2(CCC3(CC2)CC(C(=O)O)C3)N1 ZINC000587829866 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCC3=CC(=O)CC[C@]32C)N1 ZINC000587830119 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCC3=CC(=O)CC[C@]32C)N1 ZINC000587830121 GI Annotated Mild Cc1ccc2c(c1O)[C@]1(CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587830166 GI Annotated Clean Cc1ccc2c(c1O)[C@]1(CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587830168 GI Annotated Clean Cc1ccc2c(c1O)[C@@]1(CC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587830170 GI Annotated Clean Cc1ccc2c(c1O)[C@@]1(CC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587830172 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)c2ccccc2O)N1 ZINC000587830220 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)c2ccccc2O)N1 ZINC000587830224 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)c2ccccc2O)N1 ZINC000587830225 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)c2ccccc2O)N1 ZINC000587830227 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3ccc(O)cc3C2)N1 ZINC000587830483 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3ccc(O)cc3C2)N1 ZINC000587830484 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3ccc(O)cc3C2)N1 ZINC000587830485 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3ccc(O)cc3C2)N1 ZINC000587830486 GI Annotated Anodyne Cc1ccc2c(c1O)[C@]1(CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587830635 GI Annotated Clean Cc1ccc2c(c1O)[C@]1(CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587830636 GI Annotated Clean Cc1ccc2c(c1O)[C@@]1(CC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587830638 GI Annotated Clean Cc1ccc2c(c1O)[C@@]1(CC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587830640 GI Annotated Clean CCc1oc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1C(=O)OC ZINC000587830819 GI Annotated Anodyne CCc1oc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1C(=O)OC ZINC000587830820 GI Annotated Anodyne CCc1oc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cc1C(=O)OC ZINC000587830822 GI Annotated Anodyne CCc1oc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1C(=O)OC ZINC000587830824 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC(=O)C[C@H](c3ccco3)C2)N1 ZINC000587831019 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC(=O)C[C@@H](c3ccco3)C2)N1 ZINC000587831020 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC(=O)C[C@@H](c3ccco3)C2)N1 ZINC000587831021 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC(=O)C[C@H](c3ccco3)C2)N1 ZINC000587831022 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)([C@@H]2C[C@H](C(=O)O)C2(C)C)N1 ZINC000587831223 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)([C@@H]2C[C@H](C(=O)O)C2(C)C)N1 ZINC000587831225 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)([C@@H]2C[C@H](C(=O)O)C2(C)C)N1 ZINC000587831228 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)([C@@H]2C[C@H](C(=O)O)C2(C)C)N1 ZINC000587831229 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=C3CCC(=O)[C@]3(C)CC2)N1 ZINC000587831270 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C=C3CCC(=O)[C@]3(C)CC2)N1 ZINC000587831273 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCC3=CC(=O)CC[C@]32C)N1 ZINC000587831700 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCC3=CC(=O)CC[C@]32C)N1 ZINC000587831701 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3c(c2)OCO3)N1 ZINC000587831824 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3c(c2)OCO3)N1 ZINC000587831826 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3c(c2)OCO3)N1 ZINC000587831831 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3c(c2)OCO3)N1 ZINC000587831837 GI Annotated Anodyne Cc1cccc2c1OCC[C@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587831969 GI Annotated Anodyne Cc1cccc2c1OCC[C@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587831975 GI Annotated Anodyne Cc1cccc2c1OCC[C@@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587831978 GI Annotated Anodyne Cc1cccc2c1OCC[C@@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587831980 GI Annotated Anodyne COc1ccc2c(c1)OCC[C@@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587832278 GI Annotated Anodyne COc1ccc2c(c1)OCC[C@@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587832291 GI Annotated Anodyne COc1ccc2c(c1)OCC[C@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587832293 GI Annotated Anodyne COc1ccc2c(c1)OCC[C@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587832295 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](C2=Cc3cc(O)ccc3OC2)N1 ZINC000587832319 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](C2=Cc3cc(O)ccc3OC2)N1 ZINC000587832321 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](C2=Cc3cc(O)ccc3OC2)N1 ZINC000587832323 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](C2=Cc3cc(O)ccc3OC2)N1 ZINC000587832325 GI Annotated Anodyne Cc1ccc2c(c1)OC[C@]1(CO2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587832430 GI Annotated Anodyne Cc1ccc2c(c1)OC[C@]1(CO2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587832436 GI Annotated Anodyne Cc1ccc2c(c1)OC[C@@]1(CO2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587832438 GI Annotated Anodyne Cc1ccc2c(c1)OC[C@@]1(CO2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587832441 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)([C@@H]2C[C@H](C(=O)O)C2(C)C)N1 ZINC000587832552 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)([C@@H]2C[C@H](C(=O)O)C2(C)C)N1 ZINC000587832554 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)([C@@H]2C[C@H](C(=O)O)C2(C)C)N1 ZINC000587832555 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)([C@@H]2C[C@H](C(=O)O)C2(C)C)N1 ZINC000587832557 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)([C@@H]2C[C@H](CC(=O)O)C2(C)C)N1 ZINC000587832588 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)([C@@H]2C[C@H](CC(=O)O)C2(C)C)N1 ZINC000587832589 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)([C@@H]2C[C@H](CC(=O)O)C2(C)C)N1 ZINC000587832590 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)([C@@H]2C[C@H](CC(=O)O)C2(C)C)N1 ZINC000587832591 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(C=CC3(CCOCC3)CC2)N1 ZINC000587832709 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=CC3(CCOCC3)CC2)N1 ZINC000587832710 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(C=CC3(CCOCC3)CC2)N1 ZINC000587832711 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(C=CC3(CCOCC3)CC2)N1 ZINC000587832712 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)c1ccccc1OC[C@@H]2C ZINC000587832735 GI Annotated Anodyne C[C@@H]1COc2ccccc2[C@@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587832737 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)c1ccccc1OC[C@@H]2C ZINC000587832740 GI Annotated Anodyne C[C@@H]1COc2ccccc2[C@]12N[C@H](C)Cc1ccc(F)c(Br)c12 ZINC000587832741 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3oc(CO)cc3c2)N1 ZINC000587832810 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3oc(CO)cc3c2)N1 ZINC000587832812 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3oc(CO)cc3c2)N1 ZINC000587832814 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3oc(CO)cc3c2)N1 ZINC000587832816 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3c(c2)OCCO3)N1 ZINC000587833041 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3c(c2)OCCO3)N1 ZINC000587833042 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3c(c2)OCCO3)N1 ZINC000587833043 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3c(c2)OCCO3)N1 ZINC000587833044 GI Annotated Anodyne COc1ccc2c(c1)OCC[C@@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587833160 GI Annotated Anodyne COc1ccc2c(c1)OCC[C@@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587833164 GI Annotated Anodyne COc1ccc2c(c1)OCC[C@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587833166 GI Annotated Anodyne COc1ccc2c(c1)OCC[C@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587833169 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3c(c2)OCCCO3)N1 ZINC000587833307 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3c(c2)OCCCO3)N1 ZINC000587833308 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3c(c2)OCCCO3)N1 ZINC000587833309 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3c(c2)OCCCO3)N1 ZINC000587833310 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC[C@@H](O)c3ccccc32)N1 ZINC000587833357 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC[C@H](O)c3ccccc32)N1 ZINC000587833360 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC[C@H](O)c3ccccc32)N1 ZINC000587833362 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CC[C@@H](O)c3ccccc32)N1 ZINC000587833366 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3c(c2)OCO3)N1 ZINC000587833391 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3c(c2)OCO3)N1 ZINC000587833393 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3c(c2)OCO3)N1 ZINC000587833396 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3c(c2)OCO3)N1 ZINC000587833398 GI Annotated Anodyne Cc1ccc(O)c2c1CC[C@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587833634 GI Annotated Clean Cc1ccc(O)c2c1CC[C@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587833636 GI Annotated Clean Cc1ccc(O)c2c1CC[C@@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587833638 GI Annotated Clean Cc1ccc(O)c2c1CC[C@@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587833640 GI Annotated Clean C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)([C@H]2COc3ccccc3O2)N1 ZINC000587833681 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)([C@@H]2COc3ccccc3O2)N1 ZINC000587833683 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)([C@@H]2COc3ccccc3O2)N1 ZINC000587833685 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)([C@H]2COc3ccccc3O2)N1 ZINC000587833687 GI Annotated Anodyne Cc1cc2c(cc1[C@H]1N[C@@H](C)Cc3ccc(F)c(Br)c31)OCCO2 ZINC000587833754 GI Annotated Anodyne Cc1cc2c(cc1[C@H]1N[C@H](C)Cc3ccc(F)c(Br)c31)OCCO2 ZINC000587833757 GI Annotated Anodyne Cc1cc2c(cc1[C@@H]1N[C@@H](C)Cc3ccc(F)c(Br)c31)OCCO2 ZINC000587833759 GI Annotated Anodyne Cc1cc2c(cc1[C@@H]1N[C@H](C)Cc3ccc(F)c(Br)c31)OCCO2 ZINC000587833762 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3oc(CO)cc3c2)N1 ZINC000587833855 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3oc(CO)cc3c2)N1 ZINC000587833856 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3oc(CO)cc3c2)N1 ZINC000587833857 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3oc(CO)cc3c2)N1 ZINC000587833859 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(C=CC3(CCOCC3)CC2)N1 ZINC000587833899 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=CC3(CCOCC3)CC2)N1 ZINC000587833900 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(C=CC3(CCOCC3)CC2)N1 ZINC000587833901 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(C=CC3(CCOCC3)CC2)N1 ZINC000587833902 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3c(c2)OCCCO3)N1 ZINC000587833927 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3c(c2)OCCCO3)N1 ZINC000587833928 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3c(c2)OCCCO3)N1 ZINC000587833929 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3c(c2)OCCCO3)N1 ZINC000587833930 GI Annotated Anodyne Cc1cc2c(cc1[C@H]1N[C@@H](C)Cc3cc(Br)c(F)cc31)OCCO2 ZINC000587833997 GI Annotated Anodyne Cc1cc2c(cc1[C@H]1N[C@H](C)Cc3cc(Br)c(F)cc31)OCCO2 ZINC000587833998 GI Annotated Anodyne Cc1cc2c(cc1[C@@H]1N[C@@H](C)Cc3cc(Br)c(F)cc31)OCCO2 ZINC000587833999 GI Annotated Anodyne Cc1cc2c(cc1[C@@H]1N[C@H](C)Cc3cc(Br)c(F)cc31)OCCO2 ZINC000587834001 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3ccc(O)cc32)N1 ZINC000587834117 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3ccc(O)cc32)N1 ZINC000587834118 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3ccc(O)cc32)N1 ZINC000587834120 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3ccc(O)cc32)N1 ZINC000587834121 GI Annotated Anodyne Cc1cccc2c1OCC[C@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587834223 GI Annotated Anodyne Cc1cccc2c1OCC[C@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587834224 GI Annotated Anodyne Cc1cccc2c1OCC[C@@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587834225 GI Annotated Anodyne Cc1cccc2c1OCC[C@@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587834226 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3ccc4c(c32)CCO4)N1 ZINC000587834243 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3ccc4c(c32)CCO4)N1 ZINC000587834244 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3ccc4c(c32)CCO4)N1 ZINC000587834245 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3ccc4c(c32)CCO4)N1 ZINC000587834246 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3cc(O)ccc3C2)N1 ZINC000587834306 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3cc(O)ccc3C2)N1 ZINC000587834308 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3cc(O)ccc3C2)N1 ZINC000587834309 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3cc(O)ccc3C2)N1 ZINC000587834312 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3cc(O)ccc32)N1 ZINC000587834419 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3cc(O)ccc32)N1 ZINC000587834420 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3cc(O)ccc32)N1 ZINC000587834421 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3cc(O)ccc32)N1 ZINC000587834422 GI Annotated Anodyne CC(=O)C[C@]1(c2ccccc2O)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587834574 GI Annotated Clean CC(=O)C[C@]1(c2ccccc2O)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587834576 GI Annotated Clean CC(=O)C[C@@]1(c2ccccc2O)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587834578 GI Annotated Clean CC(=O)C[C@@]1(c2ccccc2O)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587834580 GI Annotated Clean Cc1ccc2c(c1)[C@]1(CCO2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587834599 GI Annotated Anodyne Cc1ccc2c(c1)[C@]1(CCO2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587834602 GI Annotated Anodyne Cc1ccc2c(c1)[C@@]1(CCO2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587834604 GI Annotated Anodyne Cc1ccc2c(c1)[C@@]1(CCO2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587834606 GI Annotated Anodyne Cc1ccc(O)c2c1CC[C@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587834662 GI Annotated Clean Cc1ccc(O)c2c1CC[C@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587834665 GI Annotated Clean Cc1ccc(O)c2c1CC[C@@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587834668 GI Annotated Clean Cc1ccc(O)c2c1CC[C@@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587834671 GI Annotated Clean C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3ccc(O)cc32)N1 ZINC000587834684 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3ccc(O)cc32)N1 ZINC000587834685 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3ccc(O)cc32)N1 ZINC000587834686 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3ccc(O)cc32)N1 ZINC000587834687 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc3c2OCCCO3)N1 ZINC000587834827 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc3c2OCCCO3)N1 ZINC000587834829 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc3c2OCCCO3)N1 ZINC000587834831 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc3c2OCCCO3)N1 ZINC000587834832 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3cc(O)ccc3C2)N1 ZINC000587834911 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3cc(O)ccc3C2)N1 ZINC000587834912 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3cc(O)ccc3C2)N1 ZINC000587834913 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3cc(O)ccc3C2)N1 ZINC000587834914 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)c2ccccc2O)N1 ZINC000587834949 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)c2ccccc2O)N1 ZINC000587834951 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)c2ccccc2O)N1 ZINC000587834953 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)c2ccccc2O)N1 ZINC000587834955 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc(C[C@@H](C)O)c2)N1 ZINC000587835100 GI Annotated Anodyne C[C@@H](O)Cc1cccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587835101 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc(C[C@@H](C)O)c2)N1 ZINC000587835102 GI Annotated Anodyne C[C@@H](O)Cc1cccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587835103 GI Annotated Anodyne C[C@H](O)Cc1cccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587835104 GI Annotated Anodyne C[C@H](O)Cc1cccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587835105 GI Annotated Anodyne C[C@H](O)Cc1cccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587835106 GI Annotated Anodyne C[C@H](O)Cc1cccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587835107 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3cc(O)ccc32)N1 ZINC000587835151 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3cc(O)ccc32)N1 ZINC000587835153 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3cc(O)ccc32)N1 ZINC000587835155 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3cc(O)ccc32)N1 ZINC000587835157 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H]([C@@H]2COc3ccccc3C2)N1 ZINC000587835158 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H]([C@H]2COc3ccccc3C2)N1 ZINC000587835160 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H]([C@H]2COc3ccccc3C2)N1 ZINC000587835161 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H]([C@@H]2COc3ccccc3C2)N1 ZINC000587835163 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc3c2OCCCO3)N1 ZINC000587835231 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc3c2OCCCO3)N1 ZINC000587835233 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc3c2OCCCO3)N1 ZINC000587835236 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc3c2OCCCO3)N1 ZINC000587835237 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3c(O)cccc32)N1 ZINC000587835242 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCCc3c(O)cccc32)N1 ZINC000587835245 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3c(O)cccc32)N1 ZINC000587835247 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCCc3c(O)cccc32)N1 ZINC000587835249 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC[C@@H](O)c3ccccc32)N1 ZINC000587835433 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC[C@H](O)c3ccccc32)N1 ZINC000587835434 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CC[C@@H](O)c3ccccc32)N1 ZINC000587835435 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC[C@H](O)c3ccccc32)N1 ZINC000587835436 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc(C[C@@H](C)O)c2)N1 ZINC000587835465 GI Annotated Anodyne C[C@@H](O)Cc1cccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587835466 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc(C[C@@H](C)O)c2)N1 ZINC000587835467 GI Annotated Anodyne C[C@@H](O)Cc1cccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587835468 GI Annotated Anodyne C[C@H](O)Cc1cccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587835469 GI Annotated Anodyne C[C@H](O)Cc1cccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587835470 GI Annotated Anodyne C[C@H](O)Cc1cccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587835471 GI Annotated Anodyne C[C@H](O)Cc1cccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587835472 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3c(O)cccc32)N1 ZINC000587835717 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCCc3c(O)cccc32)N1 ZINC000587835718 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3c(O)cccc32)N1 ZINC000587835719 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCCc3c(O)cccc32)N1 ZINC000587835720 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3ccccc3OC2)N1 ZINC000587835867 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3ccccc3OC2)N1 ZINC000587835868 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3ccccc3OC2)N1 ZINC000587835869 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3ccccc3OC2)N1 ZINC000587835870 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(C3(C)COC3)cc2)N1 ZINC000587835877 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc(C3(C)COC3)cc2)N1 ZINC000587835878 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(C3(C)COC3)cc2)N1 ZINC000587835879 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc(C3(C)COC3)cc2)N1 ZINC000587835880 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3ccc(O)cc3C2)N1 ZINC000587836099 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3ccc(O)cc3C2)N1 ZINC000587836102 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3ccc(O)cc3C2)N1 ZINC000587836105 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3ccc(O)cc3C2)N1 ZINC000587836107 GI Annotated Anodyne COc1cccc2c1OCC[C@@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587836335 GI Annotated Anodyne COc1cccc2c1OCC[C@@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587836336 GI Annotated Anodyne COc1cccc2c1OCC[C@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587836337 GI Annotated Anodyne COc1cccc2c1OCC[C@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587836338 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)c1ccccc1OC[C@@H]2C ZINC000587836373 GI Annotated Anodyne C[C@@H]1COc2ccccc2[C@@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587836374 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)c1ccccc1OC[C@@H]2C ZINC000587836375 GI Annotated Anodyne C[C@@H]1COc2ccccc2[C@]12N[C@H](C)Cc1cc(Br)c(F)cc12 ZINC000587836376 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3ccccc3OC2)N1 ZINC000587836417 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3ccccc3OC2)N1 ZINC000587836418 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3ccccc3OC2)N1 ZINC000587836419 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3ccccc3OC2)N1 ZINC000587836420 GI Annotated Anodyne COc1cccc2c1OCC[C@@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836451 GI Annotated Anodyne COc1cccc2c1OCC[C@@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836452 GI Annotated Anodyne COc1cccc2c1OCC[C@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836453 GI Annotated Anodyne COc1cccc2c1OCC[C@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836454 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836523 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836525 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836527 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836529 GI Annotated Anodyne Cc1ccc2c(c1)[C@@]1(CCO2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836543 GI Annotated Anodyne Cc1ccc2c(c1)[C@@]1(CCO2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836545 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3cc4c(cc32)OCO4)N1 ZINC000587836579 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3cc4c(cc32)OCO4)N1 ZINC000587836580 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CCc3cc4c(cc32)OCO4)N1 ZINC000587836581 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(CCc3cc4c(cc32)OCO4)N1 ZINC000587836582 GI Annotated Anodyne Cc1ccc2c(c1)[C@]1(CCO2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836625 GI Annotated Anodyne Cc1ccc2c(c1)[C@]1(CCO2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836626 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3c(c2)OCCO3)N1 ZINC000587836691 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3c(c2)OCCO3)N1 ZINC000587836692 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3c(c2)OCCO3)N1 ZINC000587836693 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3c(c2)OCCO3)N1 ZINC000587836694 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3c(c2)CCO3)N1 ZINC000587836699 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc3c(c2)CCO3)N1 ZINC000587836700 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3c(c2)CCO3)N1 ZINC000587836701 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc3c(c2)CCO3)N1 ZINC000587836702 GI Annotated Anodyne Cc1ccc2c(c1)OC[C@]1(CO2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836703 GI Annotated Anodyne Cc1ccc2c(c1)OC[C@]1(CO2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836704 GI Annotated Anodyne Cc1ccc2c(c1)OC[C@@]1(CO2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836705 GI Annotated Anodyne Cc1ccc2c(c1)OC[C@@]1(CO2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587836706 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)([C@@H]2CCOC2)N1 ZINC000587836707 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)([C@H]2CCOC2)N1 ZINC000587836708 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ccccc2)([C@@H]2CCOC2)N1 ZINC000587836709 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ccccc2)([C@H]2CCOC2)N1 ZINC000587836710 GI Annotated Anodyne Cc1cc2c(cc1[C@@H]1N[C@H](C)Cc3cc(Br)c(F)cc31)OCO2 ZINC000587836857 GI Annotated Anodyne Cc1cc2c(cc1[C@H]1N[C@H](C)Cc3cc(Br)c(F)cc31)OCO2 ZINC000587836858 GI Annotated Anodyne Cc1cc2c(cc1[C@H]1N[C@@H](C)Cc3cc(Br)c(F)cc31)OCO2 ZINC000587836859 GI Annotated Anodyne Cc1cc2c(cc1[C@@H]1N[C@@H](C)Cc3cc(Br)c(F)cc31)OCO2 ZINC000587836860 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](C2=Cc3cc(O)ccc3OC2)N1 ZINC000587836901 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](C2=Cc3cc(O)ccc3OC2)N1 ZINC000587836902 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](C2=Cc3cc(O)ccc3OC2)N1 ZINC000587836903 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](C2=Cc3cc(O)ccc3OC2)N1 ZINC000587836904 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(C3(C)COC3)cc2)N1 ZINC000587836905 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc(C3(C)COC3)cc2)N1 ZINC000587836906 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(C3(C)COC3)cc2)N1 ZINC000587836907 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc(C3(C)COC3)cc2)N1 ZINC000587836908 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3ccc4c(c32)CCO4)N1 ZINC000587836909 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3ccc4c(c32)CCO4)N1 ZINC000587836910 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3ccc4c(c32)CCO4)N1 ZINC000587836911 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3ccc4c(c32)CCO4)N1 ZINC000587836912 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587837045 GI Annotated Anodyne COc1ccc2c(c1)[C@@]1(CCO2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587837046 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587837047 GI Annotated Anodyne COc1ccc2c(c1)[C@]1(CCO2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587837048 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H]([C@@H]2COc3ccccc3C2)N1 ZINC000587837053 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H]([C@H]2COc3ccccc3C2)N1 ZINC000587837054 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H]([C@H]2COc3ccccc3C2)N1 ZINC000587837055 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H]([C@@H]2COc3ccccc3C2)N1 ZINC000587837056 GI Annotated Anodyne Cc1cc2c(cc1[C@@H]1N[C@H](C)Cc3ccc(F)c(Br)c31)OCO2 ZINC000587837077 GI Annotated Anodyne Cc1cc2c(cc1[C@H]1N[C@H](C)Cc3ccc(F)c(Br)c31)OCO2 ZINC000587837078 GI Annotated Anodyne Cc1cc2c(cc1[C@H]1N[C@@H](C)Cc3ccc(F)c(Br)c31)OCO2 ZINC000587837079 GI Annotated Anodyne Cc1cc2c(cc1[C@@H]1N[C@@H](C)Cc3ccc(F)c(Br)c31)OCO2 ZINC000587837080 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)([C@@H]2CCOC2)N1 ZINC000587837135 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)([C@H]2CCOC2)N1 ZINC000587837137 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ccccc2)([C@@H]2CCOC2)N1 ZINC000587837138 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ccccc2)([C@H]2CCOC2)N1 ZINC000587837139 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3c(c2)CCO3)N1 ZINC000587837141 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc3c(c2)CCO3)N1 ZINC000587837142 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3c(c2)CCO3)N1 ZINC000587837143 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc3c(c2)CCO3)N1 ZINC000587837145 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](CC2CCC3(CC2)OCCO3)N1 ZINC000587837565 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](CC2CCC3(CC2)OCCO3)N1 ZINC000587837566 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](CC2CCC3(CC2)OCCO3)N1 ZINC000587837567 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](CC2CCC3(CC2)OCCO3)N1 ZINC000587837568 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3oc(=O)ccc3c2)N1 ZINC000587837573 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3oc(=O)ccc3c2)N1 ZINC000587837574 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3oc(=O)ccc3c2)N1 ZINC000587837575 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3oc(=O)ccc3c2)N1 ZINC000587837576 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](CC2CCC3(CC2)OCCO3)N1 ZINC000587837619 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](CC2CCC3(CC2)OCCO3)N1 ZINC000587837620 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](CC2CCC3(CC2)OCCO3)N1 ZINC000587837621 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](CC2CCC3(CC2)OCCO3)N1 ZINC000587837622 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc([S@@](C)=O)cc2)N1 ZINC000587837887 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc([S@](C)=O)cc2)N1 ZINC000587837895 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc([S@](C)=O)cc2)N1 ZINC000587837898 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc([S@@](C)=O)cc2)N1 ZINC000587837901 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H]([C@H]2COC3(CCCCC3)O2)N1 ZINC000587838439 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H]([C@H]2COC3(CCCCC3)O2)N1 ZINC000587838440 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H]([C@H]2COC3(CCCCC3)O2)N1 ZINC000587838441 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H]([C@H]2COC3(CCCCC3)O2)N1 ZINC000587838442 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3cc4c(cc32)OCO4)N1 ZINC000587838779 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3cc4c(cc32)OCO4)N1 ZINC000587838780 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(CCc3cc4c(cc32)OCO4)N1 ZINC000587838781 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(CCc3cc4c(cc32)OCO4)N1 ZINC000587838782 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2coc3ccccc3c2=O)N1 ZINC000587839208 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2coc3ccccc3c2=O)N1 ZINC000587839209 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2coc3ccccc3c2=O)N1 ZINC000587839210 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2coc3ccccc3c2=O)N1 ZINC000587839211 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)[C@H]1CCO[C@H]1C21CCCC1 ZINC000587839289 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@]2(N1)[C@H]1CCO[C@H]1C21CCCC1 ZINC000587839291 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)[C@H]1CCO[C@H]1C21CCCC1 ZINC000587839293 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@]2(N1)[C@H]1CCO[C@H]1C21CCCC1 ZINC000587839295 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H]([C@H]2COC3(CCCCC3)O2)N1 ZINC000587839316 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H]([C@H]2COC3(CCCCC3)O2)N1 ZINC000587839323 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H]([C@H]2COC3(CCCCC3)O2)N1 ZINC000587839325 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H]([C@H]2COC3(CCCCC3)O2)N1 ZINC000587839328 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)[C@H]1CCO[C@H]1C21CCCC1 ZINC000587839875 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@]2(N1)[C@H]1CCO[C@H]1C21CCCC1 ZINC000587839876 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)[C@H]1CCO[C@H]1C21CCCC1 ZINC000587839877 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@]2(N1)[C@H]1CCO[C@H]1C21CCCC1 ZINC000587839878 GI Annotated Anodyne COc1ccc2c(c1)OC=C[C@@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587840078 GI Annotated Anodyne COc1ccc2c(c1)OC=C[C@@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587840079 GI Annotated Anodyne COc1ccc2c(c1)OC=C[C@]21N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587840080 GI Annotated Anodyne COc1ccc2c(c1)OC=C[C@]21N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587840081 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](C[C@H]2CCCCC23OCCO3)N1 ZINC000587840214 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](C[C@@H]2CCCCC23OCCO3)N1 ZINC000587840215 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](C[C@H]2CCCCC23OCCO3)N1 ZINC000587840216 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](C[C@@H]2CCCCC23OCCO3)N1 ZINC000587840217 GI Annotated Anodyne COc1ccc2c(c1)OC=C[C@@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587840306 GI Annotated Anodyne COc1ccc2c(c1)OC=C[C@@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587840307 GI Annotated Anodyne COc1ccc2c(c1)OC=C[C@]21N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587840308 GI Annotated Anodyne COc1ccc2c(c1)OC=C[C@]21N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587840309 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](C[C@@H]2CCCCC23OCCO3)N1 ZINC000587840490 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](C[C@@H]2CCCCC23OCCO3)N1 ZINC000587840491 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](C[C@H]2CCCCC23OCCO3)N1 ZINC000587840492 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](C[C@H]2CCCCC23OCCO3)N1 ZINC000587840493 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3oc(=O)ccc3c2)N1 ZINC000587840610 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3oc(=O)ccc3c2)N1 ZINC000587840611 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3oc(=O)ccc3c2)N1 ZINC000587840612 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3oc(=O)ccc3c2)N1 ZINC000587840613 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc([S@@](C)=O)cc2)N1 ZINC000587841098 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc([S@](C)=O)cc2)N1 ZINC000587841099 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc([S@](C)=O)cc2)N1 ZINC000587841100 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc([S@@](C)=O)cc2)N1 ZINC000587841101 GI Annotated Anodyne CCSc1ncc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587842004 GI Annotated Anodyne CCSc1ncc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587842007 GI Annotated Anodyne CCSc1ncc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587842009 GI Annotated Anodyne CCSc1ncc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)cn1 ZINC000587842011 GI Annotated Anodyne CCSc1ncc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)n1C ZINC000587842368 GI Annotated Anodyne CCSc1ncc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)n1C ZINC000587842380 GI Annotated Anodyne CCSc1ncc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)n1C ZINC000587842382 GI Annotated Anodyne CCSc1ncc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)n1C ZINC000587842384 GI Annotated Anodyne Cc1nc(C)c([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(S)n1 ZINC000587842866 GI Annotated Anodyne Cc1nc(C)c([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(S)n1 ZINC000587842867 GI Annotated Anodyne Cc1nc(C)c([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(S)n1 ZINC000587842868 GI Annotated Anodyne Cc1nc(C)c([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(S)n1 ZINC000587842869 GI Annotated Anodyne CC(=O)Nc1ccsc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587843193 GI Annotated Anodyne CC(=O)SCC[C@]1(CCl)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587843195 GI Annotated Reactive CC(=O)SCC[C@@]1(CCl)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587843196 GI Annotated Reactive CC(=O)SCC[C@]1(CCl)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587843197 GI Annotated Reactive CC(=O)Nc1ccsc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587843198 GI Annotated Anodyne CC(=O)SCC[C@@]1(CCl)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587843199 GI Annotated Reactive CC(=O)Nc1ccsc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587843200 GI Annotated Anodyne CC(=O)Nc1ccsc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587843202 GI Annotated Anodyne COC(=O)c1sccc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587843685 GI Annotated Anodyne COC(=O)c1sccc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587843687 GI Annotated Anodyne COC(=O)c1sccc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587843689 GI Annotated Anodyne COC(=O)c1sccc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587843690 GI Annotated Anodyne CCOC(=O)c1ccsc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587844086 GI Annotated Anodyne CCOC(=O)c1ccsc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587844087 GI Annotated Anodyne CCOC(=O)c1ccsc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587844088 GI Annotated Anodyne CCOC(=O)c1ccsc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587844089 GI Annotated Anodyne CSc1ccc([C@@]2(C=O)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587844119 GI Annotated Mild CSc1ccc([C@@]2(C=O)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587844122 GI Annotated Mild CSc1ccc([C@]2(C=O)N[C@@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587844124 GI Annotated Mild CSc1ccc([C@]2(C=O)N[C@H](C)Cc3ccc(F)c(Br)c32)cc1 ZINC000587844126 GI Annotated Mild C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2coc3ccccc3c2=O)N1 ZINC000587844304 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2coc3ccccc3c2=O)N1 ZINC000587844305 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2coc3ccccc3c2=O)N1 ZINC000587844306 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2coc3ccccc3c2=O)N1 ZINC000587844307 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccsc2C(=O)O)N1 ZINC000587844366 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccsc2C(=O)O)N1 ZINC000587844367 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccsc2C(=O)O)N1 ZINC000587844368 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccsc2C(=O)O)N1 ZINC000587844369 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(C(=O)O)s2)N1 ZINC000587844482 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccc(C(=O)O)s2)N1 ZINC000587844483 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(C(=O)O)s2)N1 ZINC000587844484 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccc(C(=O)O)s2)N1 ZINC000587844485 GI Annotated Anodyne CC(=O)SCC[C@]1(CCl)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587844577 GI Annotated Reactive CC(=O)SCC[C@@]1(CCl)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587844579 GI Annotated Reactive CC(=O)SCC[C@]1(CCl)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587844581 GI Annotated Reactive CC(=O)SCC[C@@]1(CCl)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587844582 GI Annotated Reactive COC(=O)c1csc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587844854 GI Annotated Anodyne COC(=O)c1csc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587844855 GI Annotated Anodyne COC(=O)c1csc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587844856 GI Annotated Anodyne COC(=O)c1csc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587844857 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCC(=O)O)(c2cccs2)N1 ZINC000587844862 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCC(=O)O)(c2cccs2)N1 ZINC000587844863 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCC(=O)O)(c2cccs2)N1 ZINC000587844864 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCC(=O)O)(c2cccs2)N1 ZINC000587844865 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(CN(C)C)cs2)N1 ZINC000587844925 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(CN(C)C)cs2)N1 ZINC000587844926 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(CN(C)C)cs2)N1 ZINC000587844927 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(CN(C)C)cs2)N1 ZINC000587844928 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2csc(C(=O)O)c2)N1 ZINC000587844955 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2csc(C(=O)O)c2)N1 ZINC000587844957 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2csc(C(=O)O)c2)N1 ZINC000587844959 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2csc(C(=O)O)c2)N1 ZINC000587844960 GI Annotated Anodyne CCSc1ncc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587845106 GI Annotated Anodyne CCSc1ncc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587845107 GI Annotated Anodyne CCSc1ncc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587845108 GI Annotated Anodyne CCSc1ncc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)cn1 ZINC000587845109 GI Annotated Anodyne CC(=O)Nc1ccsc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587845383 GI Annotated Anodyne CC(=O)Nc1ccsc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587845385 GI Annotated Anodyne CC(=O)Nc1ccsc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587845387 GI Annotated Anodyne CC(=O)Nc1ccsc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587845389 GI Annotated Anodyne CSc1nc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1C#N ZINC000587845572 GI Annotated Mild CSc1nc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1C#N ZINC000587845573 GI Annotated Mild CSc1nc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)ccc1C#N ZINC000587845574 GI Annotated Mild CSc1nc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)ccc1C#N ZINC000587845575 GI Annotated Mild COC(=O)c1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587845678 GI Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587845680 GI Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587845682 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587845683 GI Annotated Anodyne Cc1nc(C)c([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(S)n1 ZINC000587845720 GI Annotated Anodyne Cc1nc(C)c([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(S)n1 ZINC000587845722 GI Annotated Anodyne Cc1nc(C)c([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(S)n1 ZINC000587845723 GI Annotated Anodyne Cc1nc(C)c([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(S)n1 ZINC000587845725 GI Annotated Anodyne Cc1cc(C(=O)O)sc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587845755 GI Annotated Anodyne Cc1cc(C(=O)O)sc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587845756 GI Annotated Anodyne Cc1cc(C(=O)O)sc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587845757 GI Annotated Anodyne Cc1cc(C(=O)O)sc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587845758 GI Annotated Anodyne COC(=O)c1csc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587846062 GI Annotated Anodyne COC(=O)c1csc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587846084 GI Annotated Anodyne COC(=O)c1csc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587846085 GI Annotated Anodyne COC(=O)c1csc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c1 ZINC000587846087 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCN(C)C)(c2cccs2)N1 ZINC000587846101 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCN(C)C)(c2cccs2)N1 ZINC000587846106 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCN(C)C)(c2cccs2)N1 ZINC000587846108 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCN(C)C)(c2cccs2)N1 ZINC000587846109 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc(C(=O)O)cs2)N1 ZINC000587846145 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc(C(=O)O)cs2)N1 ZINC000587846146 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc(C(=O)O)cs2)N1 ZINC000587846147 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc(C(=O)O)cs2)N1 ZINC000587846148 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccsc2C(=O)O)N1 ZINC000587846222 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ccsc2C(=O)O)N1 ZINC000587846223 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccsc2C(=O)O)N1 ZINC000587846224 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ccsc2C(=O)O)N1 ZINC000587846225 GI Annotated Anodyne CSc1ncc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587846240 GI Annotated Anodyne CSc1ncc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587846241 GI Annotated Anodyne CSc1ncc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587846242 GI Annotated Anodyne CSc1ncc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c(C)n1 ZINC000587846243 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc(C(=O)O)cs2)N1 ZINC000587846503 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc(C(=O)O)cs2)N1 ZINC000587846504 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc(C(=O)O)cs2)N1 ZINC000587846505 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc(C(=O)O)cs2)N1 ZINC000587846506 GI Annotated Anodyne COC(=O)c1sccc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587846599 GI Annotated Anodyne COC(=O)c1sccc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587846600 GI Annotated Anodyne COC(=O)c1sccc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587846601 GI Annotated Anodyne COC(=O)c1sccc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587846602 GI Annotated Anodyne Cc1cc(C(=O)O)sc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587846657 GI Annotated Anodyne Cc1cc(C(=O)O)sc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587846658 GI Annotated Anodyne Cc1cc(C(=O)O)sc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587846659 GI Annotated Anodyne Cc1cc(C(=O)O)sc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587846660 GI Annotated Anodyne COC(=O)c1ccc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587846812 GI Annotated Anodyne COC(=O)c1ccc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587846813 GI Annotated Anodyne COC(=O)c1ccc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587846814 GI Annotated Anodyne COC(=O)c1ccc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587846815 GI Annotated Anodyne CCOC(=O)c1ccsc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587846956 GI Annotated Anodyne CCOC(=O)c1ccsc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587846957 GI Annotated Anodyne CCOC(=O)c1ccsc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587846958 GI Annotated Anodyne CCOC(=O)c1ccsc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587846960 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(-n3ccnc3)cs2)N1 ZINC000587847200 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(-n3ccnc3)cs2)N1 ZINC000587847203 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cc(-n3ccnc3)cs2)N1 ZINC000587847205 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cc(-n3ccnc3)cs2)N1 ZINC000587847208 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc(CC(=O)O)cs2)N1 ZINC000587847337 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2cc(CC(=O)O)cs2)N1 ZINC000587847338 GI Annotated Anodyne COC(=O)c1ccsc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587847351 GI Annotated Anodyne COC(=O)c1ccsc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587847352 GI Annotated Anodyne COC(=O)c1ccsc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587847353 GI Annotated Anodyne COC(=O)c1ccsc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587847354 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc(CC(=O)O)cs2)N1 ZINC000587847439 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2cc(CC(=O)O)cs2)N1 ZINC000587847440 GI Annotated Anodyne CSc1nc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1C#N ZINC000587847514 GI Annotated Mild CSc1nc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1C#N ZINC000587847515 GI Annotated Mild CSc1nc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)ccc1C#N ZINC000587847517 GI Annotated Mild CSc1nc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)ccc1C#N ZINC000587847518 GI Annotated Mild COC(=O)c1ccc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587847539 GI Annotated Anodyne COC(=O)c1ccc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587847542 GI Annotated Anodyne COC(=O)c1ccc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587847544 GI Annotated Anodyne COC(=O)c1ccc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587847545 GI Annotated Anodyne CSc1ccc([C@@]2(C=O)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587847688 GI Annotated Mild CSc1ccc([C@@]2(C=O)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587847690 GI Annotated Mild CSc1ccc([C@]2(C=O)N[C@@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587847691 GI Annotated Mild CSc1ccc([C@]2(C=O)N[C@H](C)Cc3cc(Br)c(F)cc32)cc1 ZINC000587847692 GI Annotated Mild C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2csc(C(=O)O)c2)N1 ZINC000587847914 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2csc(C(=O)O)c2)N1 ZINC000587847915 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2csc(C(=O)O)c2)N1 ZINC000587847916 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2csc(C(=O)O)c2)N1 ZINC000587847917 GI Annotated Anodyne CCSc1ncc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)n1C ZINC000587848040 GI Annotated Anodyne CCSc1ncc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)n1C ZINC000587848042 GI Annotated Anodyne CCSc1ncc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)n1C ZINC000587848044 GI Annotated Anodyne CCSc1ncc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)n1C ZINC000587848046 GI Annotated Anodyne COC(=O)c1ccsc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587848073 GI Annotated Anodyne COC(=O)c1ccsc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587848074 GI Annotated Anodyne COC(=O)c1ccsc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587848075 GI Annotated Anodyne COC(=O)c1ccsc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587848077 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc(CC(=O)O)cs2)N1 ZINC000587848298 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2cc(CC(=O)O)cs2)N1 ZINC000587848299 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc(CC(=O)O)cs2)N1 ZINC000587848301 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2cc(CC(=O)O)cs2)N1 ZINC000587848302 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(C(=O)O)s2)N1 ZINC000587848443 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ccc(C(=O)O)s2)N1 ZINC000587848444 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(C(=O)O)s2)N1 ZINC000587848592 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ccc(C(=O)O)s2)N1 ZINC000587848593 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(CN(C)C)cs2)N1 ZINC000587848618 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(CN(C)C)cs2)N1 ZINC000587848619 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(CN(C)C)cs2)N1 ZINC000587848620 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(CN(C)C)cs2)N1 ZINC000587848621 GI Annotated Anodyne CSc1ncc([C@@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587848744 GI Annotated Anodyne CSc1ncc([C@@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587848745 GI Annotated Anodyne CSc1ncc([C@]2(C)N[C@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587848746 GI Annotated Anodyne CSc1ncc([C@]2(C)N[C@@H](C)Cc3ccc(F)c(Br)c32)c(C)n1 ZINC000587848747 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCC(=O)O)(c2cccs2)N1 ZINC000587848898 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCC(=O)O)(c2cccs2)N1 ZINC000587848899 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCC(=O)O)(c2cccs2)N1 ZINC000587848900 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCC(=O)O)(c2cccs2)N1 ZINC000587848901 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2scc3c2OCCO3)N1 ZINC000587849532 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2scc3c2OCCO3)N1 ZINC000587849533 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2scc3c2OCCO3)N1 ZINC000587849534 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2scc3c2OCCO3)N1 ZINC000587849535 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(-n3ccnc3)cs2)N1 ZINC000587849690 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(-n3ccnc3)cs2)N1 ZINC000587849691 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cc(-n3ccnc3)cs2)N1 ZINC000587849792 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cc(-n3ccnc3)cs2)N1 ZINC000587849793 GI Annotated Anodyne COC(=O)c1csc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587850134 GI Annotated Anodyne COC(=O)c1csc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587850135 GI Annotated Anodyne COC(=O)c1csc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587850136 GI Annotated Anodyne COC(=O)c1csc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587850137 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587850190 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587850191 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587850245 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587850247 GI Annotated Anodyne COC(=O)c1csc([C@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587850335 GI Annotated Anodyne COC(=O)c1csc([C@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587850337 GI Annotated Anodyne COC(=O)c1csc([C@@]2(C)N[C@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587850338 GI Annotated Anodyne COC(=O)c1csc([C@@]2(C)N[C@@H](C)Cc3cc(Br)c(F)cc32)c1 ZINC000587850340 GI Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587850377 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587850378 GI Annotated Anodyne COC(=O)c1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587850379 GI Annotated Anodyne COC(=O)c1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587850381 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587850512 GI Annotated Anodyne CC(=O)Nc1ccc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587850513 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587850514 GI Annotated Anodyne CC(=O)Nc1ccc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587850515 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCN(C)C)(c2cccs2)N1 ZINC000587850580 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCN(C)C)(c2cccs2)N1 ZINC000587850581 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCN(C)C)(c2cccs2)N1 ZINC000587850582 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCN(C)C)(c2cccs2)N1 ZINC000587850583 GI Annotated Anodyne COc1nc(Cl)c([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587850762 GI Annotated Anodyne COc1nc(Cl)c([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587850763 GI Annotated Anodyne COc1nc(Cl)c([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587850764 GI Annotated Anodyne COc1nc(Cl)c([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587850765 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](c2ncc[nH]2)(c2cccs2)N1 ZINC000587850782 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](c2ncc[nH]2)(c2cccs2)N1 ZINC000587850783 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](c2ncc[nH]2)(c2cccs2)N1 ZINC000587850784 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](c2ncc[nH]2)(c2cccs2)N1 ZINC000587850785 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ncc(Cl)s2)N1 ZINC000587851182 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2ncc(Cl)s2)N1 ZINC000587851189 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ncc(Cl)s2)N1 ZINC000587851190 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2ncc(Cl)s2)N1 ZINC000587851192 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2scc3c2OCCO3)N1 ZINC000587851268 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2scc3c2OCCO3)N1 ZINC000587851269 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2scc3c2OCCO3)N1 ZINC000587851270 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2scc3c2OCCO3)N1 ZINC000587851271 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2scc3c2OCCO3)N1 ZINC000587851722 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2scc3c2OCCO3)N1 ZINC000587851723 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2scc3c2OCCO3)N1 ZINC000587851724 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2scc3c2OCCO3)N1 ZINC000587851725 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc(N3CCCC3)s2)N1 ZINC000587852117 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc(N3CCCC3)s2)N1 ZINC000587852120 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cnc(N3CCCC3)s2)N1 ZINC000587852121 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cnc(N3CCCC3)s2)N1 ZINC000587852122 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ncc(Cl)s2)N1 ZINC000587852522 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2ncc(Cl)s2)N1 ZINC000587852523 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ncc(Cl)s2)N1 ZINC000587852524 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2ncc(Cl)s2)N1 ZINC000587852525 GI Annotated Anodyne CCOCc1ncc([C@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587852566 GI Annotated Anodyne CCOCc1ncc([C@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587852567 GI Annotated Anodyne CCOCc1ncc([C@@H]2N[C@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587852568 GI Annotated Anodyne CCOCc1ncc([C@@H]2N[C@@H](C)Cc3cc(Br)c(F)cc32)s1 ZINC000587852569 GI Annotated Anodyne COc1nc(Cl)c([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587852628 GI Annotated Anodyne COc1nc(Cl)c([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587852629 GI Annotated Anodyne COc1nc(Cl)c([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587852630 GI Annotated Anodyne COc1nc(Cl)c([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587852631 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2cscn2)N1 ZINC000587852730 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2cscn2)N1 ZINC000587852731 GI Annotated Reactive C[C@H]1Cc2cc(Br)c(F)cc2[C@@](CCl)(c2cscn2)N1 ZINC000587852732 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@](CCl)(c2cscn2)N1 ZINC000587852733 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](c2ncc[nH]2)(c2cccs2)N1 ZINC000587852846 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](c2ncc[nH]2)(c2cccs2)N1 ZINC000587852847 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](c2ncc[nH]2)(c2cccs2)N1 ZINC000587852848 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](c2ncc[nH]2)(c2cccs2)N1 ZINC000587852849 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)c2nccs2)N1 ZINC000587852924 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(CC(=O)c2nccs2)N1 ZINC000587852925 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)c2nccs2)N1 ZINC000587852926 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(CC(=O)c2nccs2)N1 ZINC000587852927 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2cscn2)N1 ZINC000587853045 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2cscn2)N1 ZINC000587853046 GI Annotated Reactive C[C@H]1Cc2ccc(F)c(Br)c2[C@](CCl)(c2cscn2)N1 ZINC000587853048 GI Annotated Reactive C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](CCl)(c2cscn2)N1 ZINC000587853050 GI Annotated Reactive C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2sc(O)nc2Cl)N1 ZINC000587853123 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2sc(O)nc2Cl)N1 ZINC000587853128 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2sc(O)nc2Cl)N1 ZINC000587853130 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2sc(O)nc2Cl)N1 ZINC000587853131 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccn2-c2nccs2)N1 ZINC000587853201 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccn2-c2nccs2)N1 ZINC000587853202 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccn2-c2nccs2)N1 ZINC000587853203 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccn2-c2nccs2)N1 ZINC000587853204 GI Annotated Anodyne Cc1nc2sccn2c1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587853581 GI Annotated Anodyne Cc1nc2sccn2c1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587853588 GI Annotated Anodyne Cc1nc2sccn2c1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587853589 GI Annotated Anodyne Cc1nc2sccn2c1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587853591 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2sc(O)nc2Cl)N1 ZINC000587853827 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2sc(O)nc2Cl)N1 ZINC000587853829 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2sc(O)nc2Cl)N1 ZINC000587853831 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2sc(O)nc2Cl)N1 ZINC000587853833 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1n[nH]cc1Cl ZINC000587853993 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1nc(OC)ncc1F ZINC000587854004 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)Cn1cc(Cl)cn1 ZINC000587854010 GI Annotated Anodyne CCOCc1ncc([C@@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587854112 GI Annotated Anodyne CCOCc1ncc([C@@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587854114 GI Annotated Anodyne CCOCc1ncc([C@H]2N[C@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587854115 GI Annotated Anodyne CCOCc1ncc([C@H]2N[C@@H](C)Cc3ccc(F)c(Br)c32)s1 ZINC000587854117 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2C2(CCN(c3nccs3)CC2)N1 ZINC000587854214 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2C2(CCN(c3nccs3)CC2)N1 ZINC000587854215 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2C2(CCN(c3nccs3)CC2)N1 ZINC000587854221 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2C2(CCN(c3nccs3)CC2)N1 ZINC000587854223 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccn2-c2nccs2)N1 ZINC000587854255 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccn2-c2nccs2)N1 ZINC000587854258 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2scc3c2OCCO3)N1 ZINC000587854362 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2scc3c2OCCO3)N1 ZINC000587854363 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2scc3c2OCCO3)N1 ZINC000587854364 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2scc3c2OCCO3)N1 ZINC000587854365 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1ccncc1F ZINC000587854373 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1ncnc(Cl)c1N ZINC000587854409 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc3nsnc23)N1 ZINC000587854480 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccc3nsnc23)N1 ZINC000587854482 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc3nsnc23)N1 ZINC000587854483 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccc3nsnc23)N1 ZINC000587854484 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3snnc3c2)N1 ZINC000587854495 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3snnc3c2)N1 ZINC000587854496 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3snnc3c2)N1 ZINC000587854498 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3snnc3c2)N1 ZINC000587854500 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2cccn2-c2nccs2)N1 ZINC000587854560 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2cccn2-c2nccs2)N1 ZINC000587854563 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](/C=C/c2cccs2)(C(=O)O)N1 ZINC000587854825 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](/C=C/c2cccs2)(C(=O)O)N1 ZINC000587854827 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](/C=C/c2cccs2)(C(=O)O)N1 ZINC000587854831 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](/C=C/c2cccs2)(C(=O)O)N1 ZINC000587854832 GI Annotated Anodyne Cc1nc(N(C)C)sc1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587854904 GI Annotated Anodyne Cc1nc(N(C)C)sc1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587854911 GI Annotated Anodyne Cc1nc(N(C)C)sc1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587854913 GI Annotated Anodyne Cc1nc(N(C)C)sc1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587854916 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1nnc(Cl)cc1N ZINC000587855137 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1ccc(F)cn1 ZINC000587855155 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1cnc(Cl)cn1 ZINC000587855183 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1cc(Cl)[nH]c(=N)n1 ZINC000587855184 GI Annotated Anodyne Cc1nc2sccn2c1[C@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587855483 GI Annotated Anodyne Cc1nc2sccn2c1[C@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587855505 GI Annotated Anodyne Cc1nc2sccn2c1[C@@]1(C)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587855506 GI Annotated Anodyne Cc1nc2sccn2c1[C@@]1(C)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587855509 GI Annotated Anodyne Cc1nc(N(C)C)sc1[C@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587855584 GI Annotated Anodyne Cc1nc(N(C)C)sc1[C@@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587855593 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1nncc(N)c1Cl ZINC000587855594 GI Annotated Anodyne Cc1nc(N(C)C)sc1[C@H]1N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587855595 GI Annotated Anodyne Cc1nc(N(C)C)sc1[C@@H]1N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587855596 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)NCC(F)(F)F ZINC000587855646 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc(N3CCCC3)s2)N1 ZINC000587855726 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc(N3CCCC3)s2)N1 ZINC000587855727 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cnc(N3CCCC3)s2)N1 ZINC000587855728 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cnc(N3CCCC3)s2)N1 ZINC000587855729 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)c2nccs2)N1 ZINC000587855747 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(CC(=O)c2nccs2)N1 ZINC000587855748 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)c2nccs2)N1 ZINC000587855749 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(CC(=O)c2nccs2)N1 ZINC000587855750 GI Annotated Anodyne Cc1nc2c(s1)[C@]1(CCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587855891 GI Annotated Anodyne Cc1nc2c(s1)[C@]1(CCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587855895 GI Annotated Anodyne Cc1nc2c(s1)[C@@]1(CCC2)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587855897 GI Annotated Anodyne Cc1nc2c(s1)[C@@]1(CCC2)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587855900 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC[C@@H]3SCCS[C@H]32)N1 ZINC000587855907 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC[C@H]3SCCS[C@@H]32)N1 ZINC000587855912 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC[C@H]3SCCS[C@H]32)N1 ZINC000587855913 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@]2(CC[C@@H]3SCCS[C@@H]32)N1 ZINC000587855915 GI Annotated Anodyne Cc1nc2sccn2c1[C@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587856611 GI Annotated Anodyne Cc1nc2sccn2c1[C@@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587856612 GI Annotated Anodyne Cc1nc2sccn2c1[C@H]1N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587856613 GI Annotated Anodyne Cc1nc2sccn2c1[C@@H]1N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587856614 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](/C=C/c2cccs2)(C(=O)O)N1 ZINC000587856620 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](/C=C/c2cccs2)(C(=O)O)N1 ZINC000587856621 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](/C=C/c2cccs2)(C(=O)O)N1 ZINC000587856622 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](/C=C/c2cccs2)(C(=O)O)N1 ZINC000587856623 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1cnnc(O)c1Cl ZINC000587857435 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1c(Cl)cnn1C ZINC000587857458 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3nsnc3c2)N1 ZINC000587857650 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@H](c2ccc3nsnc3c2)N1 ZINC000587857651 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3nsnc3c2)N1 ZINC000587857653 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@H](c2ccc3nsnc3c2)N1 ZINC000587857654 GI Annotated Anodyne Cc1nc2c(s1)[C@]1(CCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587857753 GI Annotated Anodyne Cc1nc2c(s1)[C@]1(CCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587857755 GI Annotated Anodyne Cc1nc2c(s1)[C@@]1(CCC2)N[C@H](C)Cc2cc(Br)c(F)cc21 ZINC000587857756 GI Annotated Anodyne Cc1nc2c(s1)[C@@]1(CCC2)N[C@@H](C)Cc2cc(Br)c(F)cc21 ZINC000587857757 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC[C@@H]3SCCS[C@H]32)N1 ZINC000587857759 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC[C@H]3SCCS[C@@H]32)N1 ZINC000587857760 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC[C@H]3SCCS[C@H]32)N1 ZINC000587857761 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@]2(CC[C@@H]3SCCS[C@@H]32)N1 ZINC000587857762 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1ccc(O)c(O)c1 ZINC000587857847 GI Annotated Clean CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1cnc(C)nc1C ZINC000587857853 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)COc1cc(C)on1 ZINC000587857865 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2nc3c(s2)CCC3)N1 ZINC000587857926 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@](C)(c2nc3c(s2)CCC3)N1 ZINC000587857930 GI Annotated Anodyne C[C@@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2nc3c(s2)CCC3)N1 ZINC000587857932 GI Annotated Anodyne C[C@H]1Cc2ccc(F)c(Br)c2[C@@](C)(c2nc3c(s2)CCC3)N1 ZINC000587857934 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2nc3c(s2)CCC3)N1 ZINC000587857969 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@](C)(c2nc3c(s2)CCC3)N1 ZINC000587857970 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2nc3c(s2)CCC3)N1 ZINC000587857971 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@](C)(c2nc3c(s2)CCC3)N1 ZINC000587857972 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1cnc(C)cn1 ZINC000587858006 GI Annotated Anodyne Cc1nc2sccn2c1[C@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587858027 GI Annotated Anodyne Cc1nc2sccn2c1[C@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587858029 GI Annotated Anodyne Cc1nc2sccn2c1[C@@]1(C)N[C@H](C)Cc2ccc(F)c(Br)c21 ZINC000587858031 GI Annotated Anodyne Cc1nc2sccn2c1[C@@]1(C)N[C@@H](C)Cc2ccc(F)c(Br)c21 ZINC000587858032 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3snnc3c2)N1 ZINC000587858169 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3snnc3c2)N1 ZINC000587858171 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3snnc3c2)N1 ZINC000587858172 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3snnc3c2)N1 ZINC000587858174 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1cnc(C)nc1 ZINC000587858327 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)[C@@H](C)N1CCCC1 ZINC000587858824 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)[C@H](C)N1CCCC1 ZINC000587858828 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)Cc1c(C)n[nH]c1C ZINC000587858840 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3nsnc3c2)N1 ZINC000587858856 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2ccc3nsnc3c2)N1 ZINC000587858857 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3nsnc3c2)N1 ZINC000587858858 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2ccc3nsnc3c2)N1 ZINC000587858859 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)C1CCN(C)CC1 ZINC000587858880 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1ccc(O)nc1 ZINC000587858891 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)Cc1cc(C)[nH]n1 ZINC000587858902 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1cc(OC)ccn1 ZINC000587858917 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1ncccc1C(=O)O ZINC000587859121 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1ccnc(OC)c1 ZINC000587859234 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=S)N[C@@H](C)COC ZINC000587859500 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=S)N[C@H](C)COC ZINC000587859501 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)C(=O)NC(CC)CC ZINC000587859534 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1cccc(OC)n1 ZINC000587859546 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)CC1(C)OCCO1 ZINC000587859552 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1ccn(CC)n1 ZINC000587859598 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc3nsnc23)N1 ZINC000587859648 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc3nsnc23)N1 ZINC000587859649 GI Annotated Anodyne C[C@@H]1Cc2cc(Br)c(F)cc2[C@H](c2cccc3nsnc23)N1 ZINC000587859650 GI Annotated Anodyne C[C@H]1Cc2cc(Br)c(F)cc2[C@@H](c2cccc3nsnc23)N1 ZINC000587859651 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1cc(C)nn1CC ZINC000587859686 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)Cn1cc(C)cn1 ZINC000587859782 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)CC1CCNCC1 ZINC000587859983 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=S)NCCSC ZINC000587860009 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)N=c1cc[nH]cc1 ZINC000587860018 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)Cn1nc(C)cc1C ZINC000587860029 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1ccnc(N(C)C)n1 ZINC000587860079 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=S)NCCCOC ZINC000587860255 GI Annotated Anodyne CCOc1cc(-n2nc(-c3cc(Cl)ccc3Cl)cc2OCC)ncn1 ZINC000587860304 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1cc(C(=O)O)ccn1 ZINC000587860380 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1c(C)n[nH]c1C ZINC000587860387 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1cnn(CC)c1 ZINC000587860399 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)Cn1nccc1C ZINC000587860414 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1cn(CC)nc1C ZINC000587860415 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1nc(C)c(C)c(O)n1 ZINC000587860478 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)Cn1ccc(C)n1 ZINC000587860528 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1cc([N+](=O)[O-])c[nH]1 ZINC000587860529 GI Annotated Bother CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1nc(O)cc(CC)n1 ZINC000587860544 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)[C@@H](C)n1cccn1 ZINC000587860572 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)[C@H](C)n1cccn1 ZINC000587860573 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)CCn1ccc(C)n1 ZINC000587860585 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1nc(C)cc(OC)n1 ZINC000587860594 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1ccnn1CC ZINC000587860606 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1ccc(Cl)cn1 ZINC000587860644 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1ccncc1Cl ZINC000587860662 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)CNc1ccccc1F ZINC000587860672 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ccnc(C(F)(F)F)n1 ZINC000587860719 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ccc(C(F)(F)F)nn1 ZINC000587860884 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ncc(Br)cn1 ZINC000587860962 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1snnc1C ZINC000587860987 GI Annotated Anodyne COc1cccc(C(=O)n2nc(-c3ccccc3C(F)(F)F)cc2OC)c1F ZINC000587861014 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=N)c1cc(Cl)ccn1 ZINC000587861060 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)Cn1cc(Cl)c(C)n1 ZINC000587861078 GI Annotated Anodyne CCn1cc(Cl)c(C(=O)n2nc(-c3ccccc3C(F)(F)F)cc2OC)n1 ZINC000587861097 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)c1sc(=N)[nH]c1C ZINC000587861130 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)Cc1csc(=N)[nH]1 ZINC000587861151 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1ccnc(Cl)c1 ZINC000587861221 GI Annotated Anodyne COCc1nc(Cl)cc(-n2nc(-c3ccccc3C(F)(F)F)cc2OC)n1 ZINC000587861227 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)CNc1ccc(F)cc1 ZINC000587861228 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cc(Cl)ccn1 ZINC000587861271 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)CCn1cc(Cl)cn1 ZINC000587861276 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)[C@H](C)n1cc(Cl)cn1 ZINC000587861288 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)[C@@H](C)n1cc(Cl)cn1 ZINC000587861289 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1C(=O)N1CCSCC1 ZINC000587861419 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ccc(Cl)c(CO)n1 ZINC000587861475 GI Annotated Anodyne COC(=O)c1ccc(F)c(-n2nc(-c3ccccc3C(F)(F)F)cc2OC)c1 ZINC000587861542 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cc(Cl)cn1C ZINC000587861658 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cc(C2CC2)on1 ZINC000587861682 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1ccc(Cl)nc1 ZINC000587861695 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)CCc1cccnc1 ZINC000587861715 GI Annotated Anodyne CCOc1cc(-c2cc(Cl)ccc2Cl)nn1-c1nnc(COC)s1 ZINC000587861903 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1cc(C#N)cc(Cl)n1 ZINC000587861968 GI Annotated Mild COc1cc(-c2ccccc2C(F)(F)F)nn1-c1nnc(C(F)(F)F)s1 ZINC000587862014 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=N)c1ccnc(Cl)c1 ZINC000587862027 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1ccc(C)c(N)c1 ZINC000587862323 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cc(C)ccc1N ZINC000587862362 GI Annotated Anodyne CCOC(C)(OCC)C(=O)n1nc(-c2ccccc2C(F)(F)F)cc1OC ZINC000587862378 GI Annotated Anodyne COc1ccc(C(=O)n2nc(-c3ccccc3C(F)(F)F)cc2OC)cc1 ZINC000587862396 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)CCn1nc(C)cc1C ZINC000587862449 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1ccc2c(c1)CCO2 ZINC000587862450 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ncc([N+](=O)[O-])cc1C ZINC000587862472 GI Annotated Bother COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)Cn1nc(C)c(C)c1C ZINC000587862582 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ccc2c(=O)[nH]ccc2c1 ZINC000587862609 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cccc(N(C)C)c1 ZINC000587862630 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)Cc1c(C)noc1C ZINC000587862662 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1ccc2nccnc2c1 ZINC000587862715 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1ccc(N(C)C)cc1 ZINC000587862731 GI Annotated Anodyne COc1ccc(-n2nc(-c3ccccc3C(F)(F)F)cc2OC)c([N+](=O)[O-])c1 ZINC000587862781 GI Annotated Bother COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ncc(C)cc1[N+](=O)[O-] ZINC000587862782 GI Annotated Bother COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1ccccc1[N+](=O)[O-] ZINC000587862808 GI Annotated Bother COC(=O)c1ccc(-n2nc(-c3ccccc3C(F)(F)F)cc2OC)cc1 ZINC000587862930 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ccc(C#N)cc1[N+](=O)[O-] ZINC000587862948 GI Annotated Mild COc1cc(-c2ccccc2C(F)(F)F)nn1-c1nc(-c2cccnc2)no1 ZINC000587862959 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1nnc(C)n1-c1ccccc1 ZINC000587862977 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1nncc(-c2ccccc2)n1 ZINC000587862985 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ccc(Cn2cncn2)cc1 ZINC000587863034 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cccnc1SC ZINC000587863098 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1nc(O)c2ccccc2n1 ZINC000587863100 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1nc(-c2ccncc2)no1 ZINC000587863198 GI Annotated Anodyne COc1cc(C(=O)O)ccc1-n1nc(-c2ccccc2C(F)(F)F)cc1OC ZINC000587863204 GI Annotated Anodyne CCN(CC)c1ccnc(-n2nc(-c3ccccc3C(F)(F)F)cc2OC)n1 ZINC000587863214 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ccc2c(c1)OCCO2 ZINC000587863227 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1nc(O)cc(C(C)C)n1 ZINC000587863240 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)[C@@H]1Cc2ccccc2O1 ZINC000587863256 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)[C@H]1Cc2ccccc2O1 ZINC000587863257 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)CCN1CCCCC1 ZINC000587863340 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)CSc1ccccn1 ZINC000587863341 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1ccc(-n2cnnc2)cc1 ZINC000587863391 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C1CN(C(=O)OC(C)(C)C)C1 ZINC000587863435 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=S)NCc1ccco1 ZINC000587863467 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1-c1cc(C)nc(SC)n1 ZINC000587863723 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)Cc1csc(C)n1 ZINC000587863767 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1sc(C)nc1C ZINC000587863812 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1cccc(C)n1 ZINC000587863816 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)Cc1ccccn1 ZINC000587863849 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1ccncc1F ZINC000587863851 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1ccc(N)cc1 ZINC000587863859 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1ccnc(OC)c1 ZINC000587863892 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)Cc1c(C)noc1C ZINC000587863916 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)CCc1c(C)n[nH]c1C ZINC000587864006 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)NCC(F)(F)F ZINC000587864099 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1cc(OC)ccn1 ZINC000587864123 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1n[nH]cc1Cl ZINC000587864166 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1cc(O)ccc1O ZINC000587864192 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1ccc(O)cc1 ZINC000587864292 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1ccc2n[nH]cc2c1 ZINC000587864355 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)c1cc(C(C)(C)C)n[nH]1 ZINC000587864368 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)CCN1CCCCCC1 ZINC000587864378 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1c(Cl)cnn1C ZINC000587864380 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)Cc1ccncc1 ZINC000587864456 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1ccc(C)nc1 ZINC000587864485 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)NCCc1cccs1 ZINC000587864545 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1ccc(O)c(O)c1 ZINC000587864603 GI Annotated Clean CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1cccc(OC)n1 ZINC000587864607 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=O)Cc1nc(C)cs1 ZINC000587864685 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=S)NCC(F)(F)F ZINC000587864745 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)Cn1cc(Cl)cn1 ZINC000587864797 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=S)Nc1ccccn1 ZINC000587864935 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1ccc(Cl)c(CO)n1 ZINC000587865009 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1oc(C)nc1C ZINC000587865069 GI Annotated Anodyne COc1cc(-c2ccccc2C(F)(F)F)nn1C(=S)Nc1cccnc1 ZINC000587865153 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1ccc(F)cn1 ZINC000587865205 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)CCN(CC)CC ZINC000587865265 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1cnnc(O)c1Cl ZINC000587865280 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1cnc(Cl)cn1 ZINC000587865391 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1ccncc1[N+](=O)[O-] ZINC000587865498 GI Annotated Bother CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)CCn1ccc(C)n1 ZINC000587865542 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1cc(C)n(CC)n1 ZINC000587865602 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1nc(C)c(CC)c(O)n1 ZINC000587865736 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1nc(O)cc(CC)n1 ZINC000587865747 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)NCc1ccco1 ZINC000587865778 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1ccc([N+](=O)[O-])cn1 ZINC000587865800 GI Annotated Bother CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)[C@@H](C)n1ccc(C)n1 ZINC000587865817 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)[C@H](C)n1ccc(C)n1 ZINC000587865818 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1nc(C)cc(OC)n1 ZINC000587865897 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=S)NC(=O)C(C)(C)C ZINC000587866004 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)[C@@H](C)n1cc(C)cn1 ZINC000587866012 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)[C@H](C)n1cc(C)cn1 ZINC000587866013 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)CN1CCCCC1 ZINC000587866016 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1nc(C)c(C)c(O)n1 ZINC000587866121 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1cc(C)nn1CC ZINC000587866130 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)Cc1cccn1C ZINC000587866154 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1ncccc1[N+](=O)[O-] ZINC000587866156 GI Annotated Bother CCOc1cc(-n2nc(-c3ccc(C(F)(F)F)cc3)cc2OCC)ncn1 ZINC000587866159 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1cc(SC)ncn1 ZINC000587866236 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)CCn1cc(C)cn1 ZINC000587866246 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=S)NCCSC ZINC000587866304 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccnc(Br)c1 ZINC000587866330 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1scnc1C ZINC000587866410 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cc(Br)ccn1 ZINC000587866550 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ncccc1Br ZINC000587866577 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1ccnc2c1cnn2C ZINC000587866585 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccc(O)c(Cl)c1 ZINC000587866596 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccc(Br)cn1 ZINC000587866616 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cc(C(=O)O)ccc1Cl ZINC000587866664 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1cc(C2CC2)[nH]n1 ZINC000587866782 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)CCN1CCCCC1 ZINC000587866785 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1-c1ccnc(SC)n1 ZINC000587866896 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=S)NCc1ccco1 ZINC000587866912 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=S)N[C@H](C)C1CC1 ZINC000587867015 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=S)N[C@@H](C)C1CC1 ZINC000587867017 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccc(C#N)c(Cl)c1 ZINC000587867049 GI Annotated Mild CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)CCN1CCCC1 ZINC000587867065 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)[C@@H](C)n1nccc1C ZINC000587867117 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)[C@H](C)n1nccc1C ZINC000587867119 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)c1csc(C)n1 ZINC000587867131 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)[C@@H](C)n1cccn1 ZINC000587867170 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=O)[C@H](C)n1cccn1 ZINC000587867171 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccc2ccccc2n1 ZINC000587867193 GI Annotated Anodyne CCOc1cc(-c2ccc(C(F)(F)F)cc2)nn1C(=S)NCC1CCC1 ZINC000587867210 GI Annotated Anodyne CCc1ccc(C(=O)n2nc(-c3ccc(C(F)(F)F)nc3)cc2OC)cc1 ZINC000587867268 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@@H](C)Oc1ccccc1 ZINC000587867413 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@H](C)Oc1ccccc1 ZINC000587867415 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1nc2cc(F)c(F)cc2[nH]1 ZINC000587867429 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cccc(Br)n1 ZINC000587867448 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)CCNc1ccccc1 ZINC000587867505 GI Annotated Anodyne CCOc1ccccc1C(=O)n1nc(-c2ccc(C(F)(F)F)nc2)cc1OC ZINC000587867508 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)CCOc1ccccc1 ZINC000587867524 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ncnc2ccc(F)cc12 ZINC000587867538 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccc2ncccc2c1 ZINC000587867546 GI Annotated Anodyne CCOc1ccc(C(=O)n2nc(-c3ccc(C(F)(F)F)nc3)cc2OC)cc1 ZINC000587867568 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)Cc1ccccc1C ZINC000587867583 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccc(Cl)cc1O ZINC000587867585 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccc(Cl)cc1 ZINC000587867624 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cccc(C)c1C ZINC000587867647 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)CCc1ccccc1 ZINC000587867648 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccc(C)c(C)c1 ZINC000587867650 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cccc(F)c1[N+](=O)[O-] ZINC000587867751 GI Annotated Bother COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccc2cccc(O)c2n1 ZINC000587867781 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cc2ccccc2o1 ZINC000587867811 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)CNc1ccc(C)cc1 ZINC000587867839 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1nccnc1C1CCC1 ZINC000587867865 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cc(C)cc(C)c1 ZINC000587867914 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)COc1ccccc1C ZINC000587867919 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cccc2ncccc12 ZINC000587867933 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccnc2ccccc12 ZINC000587867941 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=N)c1cc(F)ccc1F ZINC000587867988 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccc(C(F)(F)F)cn1 ZINC000587867996 GI Annotated Anodyne COc1c(F)cc(F)cc1-n1nc(-c2ccc(C(F)(F)F)nc2)cc1OC ZINC000587868031 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)COc1ccc(C)cc1 ZINC000587868109 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cncc2ccccc12 ZINC000587868115 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=N)c1ccc2ccccc2n1 ZINC000587868139 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccc2c(c1)CCC2 ZINC000587868147 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cccc2cccnc12 ZINC000587868149 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)CNc1ccccc1C ZINC000587868215 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1nccc(-c2ccco2)n1 ZINC000587868236 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@H]1CCO[C@@H]1C(C)(C)C ZINC000587868242 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1nc(C(F)(F)F)cs1 ZINC000587868314 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)COc1cccc(C)c1 ZINC000587868342 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cccc(C(F)(F)F)n1 ZINC000587868348 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)Cc1ccc(F)cc1F ZINC000587868349 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)Nc1c(F)cccc1F ZINC000587868350 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1c(F)cccc1Cl ZINC000587868377 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)Nc1ccccc1C ZINC000587868391 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cc(Cl)ccc1O ZINC000587868413 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1oc(CC(C)C)nc1C#N ZINC000587868467 GI Annotated Mild COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1nnc(Cl)c(C)c1C ZINC000587868514 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=S)Nc1cccc(F)c1 ZINC000587868632 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cc(C(F)(F)F)ccn1 ZINC000587868763 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccc(Cl)cc1F ZINC000587868774 GI Annotated Anodyne COc1ccc(Cn2nc(-c3ccc(C(F)(F)F)nc3)cc2OC)cc1OC ZINC000587868791 GI Annotated Anodyne COC(=O)c1ccc(C)c(-n2nc(-c3ccc(C(F)(F)F)nc3)cc2OC)c1 ZINC000587868813 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cc(F)c(C#N)cc1F ZINC000587868823 GI Annotated Mild COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1cccc([N+](=O)[O-])c1C ZINC000587868838 GI Annotated Bother COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1oc(C(C)(C)C)nc1C#N ZINC000587868841 GI Annotated Mild COc1cc(-c2ccc(C(F)(F)F)nc2)nn1CCCCc1ccccn1 ZINC000587868888 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)Nc1cc(F)cc(F)c1 ZINC000587868900 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@H]1C[C@@H]1c1ccccc1 ZINC000587868901 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@H]1C[C@H]1c1ccccc1 ZINC000587868903 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@@H]1C[C@@H]1c1ccccc1 ZINC000587868904 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)[C@@H]1C[C@H]1c1ccccc1 ZINC000587868905 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1nc(C)nc(Cl)c1C ZINC000587868942 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ccc(-c2ccccc2)nn1 ZINC000587868956 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=S)Nc1ccccc1F ZINC000587869024 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ncccc1C(F)(F)F ZINC000587869030 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1nc2ccc(Cl)cc2[nH]1 ZINC000587869041 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=N)c1cc(F)cc(F)c1 ZINC000587869048 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1nc(C)c(C)nc1Cl ZINC000587869059 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ncnc2c(C)csc12 ZINC000587869217 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1csc(C)c1C ZINC000587869230 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccc(Cl)s1 ZINC000587869296 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1c[nH]c2ccccc12 ZINC000587869405 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cc2ccccc2[nH]1 ZINC000587869418 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1snc(SC)c1C#N ZINC000587869445 GI Annotated Mild CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1ccc(Br)o1 ZINC000587869498 GI Annotated Anodyne CCCCCCNC(=S)n1nc(-c2ccc(C(F)(F)F)nc2)cc1OC ZINC000587869627 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1-c1ncnc2scc(C)c12 ZINC000587869642 GI Annotated Anodyne CCc1cc(C(=O)n2nc(-c3ccc(C(F)(F)F)nc3)cc2OC)cs1 ZINC000587869647 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=S)Nc1ccccc1 ZINC000587869650 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cccc2cc[nH]c12 ZINC000587869678 GI Annotated Anodyne CCc1ccc(C(=O)n2nc(-c3ccc(C(F)(F)F)nc3)cc2OC)s1 ZINC000587869760 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=S)N[C@H]1CCCC[C@@H]1C ZINC000587869809 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=S)N[C@@H]1CCCC[C@H]1C ZINC000587869810 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=S)N[C@@H]1CCCC[C@@H]1C ZINC000587869811 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=S)N[C@H]1CCCC[C@H]1C ZINC000587869812 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1Cc1cncc(Br)c1 ZINC000587869848 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cc(Br)co1 ZINC000587869923 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1ncc(Br)nc1Cl ZINC000587869946 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccc(SC)cc1 ZINC000587869972 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cc(Cl)cs1 ZINC000587869982 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cc2c(s1)CCC2 ZINC000587869984 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1sccc1Cl ZINC000587870108 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](C)Oc1cccc(OC)c1 ZINC000587870169 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](C)Oc1cccc(OC)c1 ZINC000587870170 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](C)Oc1ccc(C#N)cc1 ZINC000587870173 GI Annotated Mild CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](C)Oc1ccc(C#N)cc1 ZINC000587870175 GI Annotated Mild COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1ccccc1SC ZINC000587870179 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cncn1-c1ccc(F)cc1 ZINC000587870198 GI Annotated Anodyne COc1cc(-c2ccc(C(F)(F)F)nc2)nn1C(=O)c1cccc2[nH]ccc12 ZINC000587870222 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)CCc1ccc2c(c1)OCO2 ZINC000587870224 GI Annotated Anodyne CCOc1ccc(NCC(=O)n2nc(-c3cccc(F)c3)cc2OCC)cc1 ZINC000587870285 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](C)Oc1ccc(C(C)=O)cc1 ZINC000587870325 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](C)Oc1ccc(C(C)=O)cc1 ZINC000587870328 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](C)Oc1ccc(OC)cc1 ZINC000587870376 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](C)Oc1ccc(OC)cc1 ZINC000587870377 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](C)Oc1ccccc1OC ZINC000587870390 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](C)Oc1ccccc1OC ZINC000587870391 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1ccc(-c2cnco2)cc1 ZINC000587870435 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)COc1ccc2c(c1)CCC2 ZINC000587870438 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1ccc(NC(=O)C(C)C)cc1 ZINC000587870441 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)CCCNC(=O)OC(C)(C)C ZINC000587870543 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cc(C(F)(F)F)nn1CC ZINC000587870576 GI Annotated Anodyne CCOc1ccccc1OCC(=O)n1nc(-c2cccc(F)c2)cc1OCC ZINC000587870644 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1nc(-c2ccc(C)cc2)no1 ZINC000587870655 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=S)Nc1ccc(OC)c(F)c1 ZINC000587870677 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](C)n1nc(C(F)F)cc1C ZINC000587870776 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](C)n1nc(C(F)F)cc1C ZINC000587870777 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)C(F)(F)Oc1ccccc1 ZINC000587870782 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1cnn(C(C)(C)C)c(=O)c1Cl ZINC000587870804 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cc(-c2ccc(F)cc2)[nH]n1 ZINC000587870807 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cc(C(F)(F)F)n(CC)n1 ZINC000587870869 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cnccc1C(F)(F)F ZINC000587870871 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](C)n1ccc(C(F)(F)F)n1 ZINC000587870881 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](C)n1ccc(C(F)(F)F)n1 ZINC000587870886 GI Annotated Anodyne CCOC(=O)c1cnc(Cl)cc1-n1nc(-c2cccc(F)c2)cc1OCC ZINC000587870929 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)CNc1ccc(F)cc1F ZINC000587870988 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](C)Oc1ccc(F)cc1F ZINC000587870992 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](C)Oc1ccc(F)cc1F ZINC000587870993 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1ccc(NC(=O)CC)cc1 ZINC000587871005 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1c(F)cc(C(=O)N(C)C)cc1F ZINC000587871039 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)COc1ccc(C)cc1OC ZINC000587871081 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)COc1ccc([N+](=O)[O-])c(C)c1 ZINC000587871120 GI Annotated Bother CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cn2cc(Cl)ccc2n1 ZINC000587871142 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)COc1ccc(C)c([N+](=O)[O-])c1 ZINC000587871165 GI Annotated Bother CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](C)n1nc(C)c(Cl)c1C ZINC000587871236 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](C)n1nc(C)c(Cl)c1C ZINC000587871237 GI Annotated Anodyne CCCn1cc(Cl)c(C(=O)n2nc(-c3cccc(F)c3)cc2OCC)n1 ZINC000587871248 GI Annotated Anodyne CCOC(=O)c1ccc(-n2nc(-c3cccc(F)c3)cc2OCC)c([N+](=O)[O-])c1 ZINC000587871267 GI Annotated Bother CCOc1cc(-c2cccc(F)c2)nn1C(=O)COc1ccc(F)cc1F ZINC000587871337 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cc(-c2ccc(O)cc2)on1 ZINC000587871384 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)COc1cc(F)ccc1F ZINC000587871401 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1ccc(OC(F)F)cc1 ZINC000587871459 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1ncccc1-c1nc(C2CC2)no1 ZINC000587871466 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1nc(O)cc(-c2ccccc2)n1 ZINC000587871488 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)CCn1nc(C)c(Cl)c1C ZINC000587871528 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](C)n1cc(Cl)c(C)n1 ZINC000587871547 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](C)n1cc(Cl)c(C)n1 ZINC000587871548 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](CC)n1cc(Cl)cn1 ZINC000587871549 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](CC)n1cc(Cl)cn1 ZINC000587871550 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)Cn1c(C)nc2ccccc21 ZINC000587871584 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@@H](C)Oc1ccccc1[N+](=O)[O-] ZINC000587871594 GI Annotated Bother CCOc1cc(-c2cccc(F)c2)nn1C(=O)[C@H](C)Oc1ccccc1[N+](=O)[O-] ZINC000587871595 GI Annotated Bother CCOc1cc(-c2cccc(F)c2)nn1C(=O)CN1CCCc2ccccc21 ZINC000587871621 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)Cn1c(CC)nc2ccccc21 ZINC000587871630 GI Annotated Anodyne CCCc1noc(-c2cccnc2-n2nc(-c3cccc(F)c3)cc2OCC)n1 ZINC000587871635 GI Annotated Anodyne O=C(c1cn2cc(Br)ccc2n1)n1nc2cc1oc1ccc(F)cc21 ZINC000587871751 GI Annotated Anodyne O=C(COc1ccc(Br)cc1)n1nc2cc1oc1ccc(F)cc21 ZINC000587871761 GI Annotated Anodyne O=C(c1cc(Br)ccc1O)n1nc2cc1oc1ccc(F)cc21 ZINC000587871779 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=S)Nc1ccc2c(c1)OCO2 ZINC000587871832 GI Annotated Anodyne O=C(COc1ccccc1Br)n1nc2cc1oc1ccc(F)cc21 ZINC000587871851 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=S)Nc1ccccc1[N+](=O)[O-] ZINC000587871874 GI Annotated Bother CCOc1cc(-c2cccc(F)c2)nn1C(=O)CSc1nc2ccccc2[nH]1 ZINC000587871896 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)C12C[C@H]3C[C@@H](CC(O)(C3)C1)C2 ZINC000587871932 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cc(-c2ccccc2)on1 ZINC000587871981 GI Annotated Anodyne CC[C@H](C(=O)n1nc2cc1oc1ccc(F)cc21)n1cc(Br)cn1 ZINC000587872046 GI Annotated Anodyne CC[C@@H](C(=O)n1nc2cc1oc1ccc(F)cc21)n1cc(Br)cn1 ZINC000587872047 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1nc2cc3c(cc2s1)OCCO3 ZINC000587872147 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=S)NCc1ccc(OC)cc1 ZINC000587872164 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1nc2cc3c(cc2s1)OCO3 ZINC000587872189 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1ccc(CN(CC)CC)o1 ZINC000587872313 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1ccc(C(=O)OC(C)(C)C)cn1 ZINC000587872321 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)COc1ccc(C)cc1[N+](=O)[O-] ZINC000587872332 GI Annotated Bother CCOc1cc(-c2cccc(F)c2)nn1C(=O)Nc1ccc(OC)cc1OC ZINC000587872348 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1nncc(-c2ccc(CC)cc2)n1 ZINC000587872360 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cc(-c2ccc(C)cc2)[nH]n1 ZINC000587872362 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1nccc(-c2cn(CC)nc2C)n1 ZINC000587872398 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1nc2ccccc2c(=O)n1C1CC1 ZINC000587872421 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=S)Nc1cccc(NC(C)=O)c1 ZINC000587872468 GI Annotated Anodyne O=C(COc1cccc(Br)c1)n1nc2cc1oc1ccc(F)cc21 ZINC000587872484 GI Annotated Anodyne CCNc1ccc(C(=O)n2nc(-c3cccc(F)c3)cc2OCC)cc1[N+](=O)[O-] ZINC000587872528 GI Annotated Bother CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cc(-c2cccs2)on1 ZINC000587872549 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cc(-c2cccs2)[nH]n1 ZINC000587872792 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=S)NCCc1cccs1 ZINC000587872798 GI Annotated Anodyne COc1ccc(C(=O)n2nc3cc2oc2ccc(F)cc32)cc1Br ZINC000587872897 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=S)Nc1ccc(N(C)C)cc1 ZINC000587872902 GI Annotated Anodyne N=c1[nH]c(C(=O)n2nc3cc2oc2ccc(F)cc32)c(-c2cccc(F)c2)s1 ZINC000587872998 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1-c1nnc2c(n1)[nH]c1c(C)cccc12 ZINC000587873190 GI Annotated Anodyne Cc1nn([C@H](C)C(=O)n2nc3cc2oc2ccc(F)cc32)cc1Br ZINC000587873218 GI Annotated Anodyne Cc1nn([C@@H](C)C(=O)n2nc3cc2oc2ccc(F)cc32)cc1Br ZINC000587873222 GI Annotated Anodyne CCOc1cc(-c2cccc(F)c2)nn1C(=O)c1cc(-c2ccccc2)[nH]n1 ZINC000587873236 GI Annotated Anodyne COc1ccc(Br)c(C(=O)n2nc3cc2oc2ccc(F)cc32)c1 ZINC000587873326 GI Annotated Anodyne Cn1nc(C(F)(F)F)c(Cl)c1C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587873429 GI Annotated Anodyne Cc1c(C(=O)n2nc3cc2oc2ccc(F)cc32)nnn1-c1ccc(Cl)cc1 ZINC000587873518 GI Annotated Anodyne Cc1c(C(=O)n2nc3cc2oc2ccc(F)cc32)cnn1-c1ccccc1F ZINC000587873598 GI Annotated Anodyne O=S(=O)(c1ccc(-n2nc3cc2oc2ccc(F)cc32)cc1)C(F)(F)F ZINC000587873635 GI Annotated Anodyne Cc1nn(C)cc1-c1cc(C(F)F)nc(-n2nc3cc2oc2ccc(F)cc32)n1 ZINC000587873654 GI Annotated Anodyne Cn1nc(C(=O)n2nc3cc2oc2ccc(F)cc32)c(Cl)c1C(F)(F)F ZINC000587873701 GI Annotated Anodyne COc1cc(C(=O)n2nc3cc2oc2ccc(F)cc32)ccc1OC(F)F ZINC000587873727 GI Annotated Anodyne O=C(c1nc(-c2ccc(Cl)cc2)no1)n1nc2cc1oc1ccc(F)cc21 ZINC000587873731 GI Annotated Anodyne O=c1c(Cl)c(-n2nc3cc2oc2ccc(F)cc32)cnn1Cc1ccccc1 ZINC000587873744 GI Annotated Anodyne O=C(Nc1cccc(C(F)(F)F)c1)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587873765 GI Annotated Anodyne N=c1[nH]c(C(=O)n2nc3cc2oc2ccc(F)cc32)c(-c2ccc(F)cc2)s1 ZINC000587873801 GI Annotated Anodyne Cc1c(C(=O)n2nc3cc2oc2ccc(F)cc32)cnn1-c1ccc(F)cc1 ZINC000587873813 GI Annotated Anodyne O=C(Cn1nc(C(F)(F)F)cc1C1CC1)n1nc2cc1oc1ccc(F)cc21 ZINC000587873854 GI Annotated Anodyne O=C(c1cn2cc(C(F)(F)F)ccc2n1)n1nc2cc1oc1ccc(F)cc21 ZINC000587873890 GI Annotated Anodyne Cc1cc(C(F)(F)F)nn1CCC(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587874037 GI Annotated Anodyne CCCOC(=O)c1ccc(OCC(=O)n2nc3cc2oc2ccc(F)cc32)cc1 ZINC000587874138 GI Annotated Anodyne CCOc1ccc(NC(=O)CCC(=O)n2nc3cc2oc2ccc(F)cc32)cc1 ZINC000587874208 GI Annotated Anodyne Cc1cc(C(F)(F)F)nn1C[C@@H](C)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587874264 GI Annotated Anodyne Cc1cc(C(F)(F)F)nn1C[C@H](C)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587874267 GI Annotated Anodyne Cc1cc(C(F)(F)F)nn1[C@H](C)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587874327 GI Annotated Anodyne Cc1cc(C(F)(F)F)nn1[C@@H](C)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587874328 GI Annotated Anodyne O=C(Cn1nc(C(F)F)cc1C(F)F)n1nc2cc1oc1ccc(F)cc21 ZINC000587874351 GI Annotated Anodyne O=C(c1ccc(Cn2cc(Cl)cn2)o1)n1nc2cc1oc1ccc(F)cc21 ZINC000587874355 GI Annotated Anodyne COc1ccc2c(c1)CCc1cnc(-n3nc4cc3oc3ccc(F)cc43)nc1-2 ZINC000587874589 GI Annotated Anodyne COc1ccc(-c2cc(C(=O)n3nc4cc3oc3ccc(F)cc43)no2)cc1 ZINC000587874720 GI Annotated Anodyne Cc1cc(C)n(Cc2cccc(C(=O)n3nc4cc3oc3ccc(F)cc43)c2)n1 ZINC000587874769 GI Annotated Anodyne CC(C)(C)OC(=O)N1CCC(C(=O)n2nc3cc2oc2ccc(F)cc32)CC1 ZINC000587874783 GI Annotated Anodyne Cc1cc(CC#CCNC(=O)Cc2ccc(Cl)cc2Cl)ccc1[N+](=O)[O-] ZINC000587874798 GI Annotated Mild Cc1cc(C)n(Cc2ccc(C(=O)n3nc4cc3oc3ccc(F)cc43)cc2)n1 ZINC000587874915 GI Annotated Anodyne CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587874990 GI Annotated Anodyne COCc1cccc(CC#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587875007 GI Annotated Mild Cc1cc(-n2nc3cc2oc2ccc(F)cc32)c(Cl)cc1S(C)(=O)=O ZINC000587875293 GI Annotated Anodyne Cc1cc(O[C@H](C)C(=O)n2nc3cc2oc2ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000587875483 GI Annotated Bother Cc1cc(O[C@@H](C)C(=O)n2nc3cc2oc2ccc(F)cc32)ccc1[N+](=O)[O-] ZINC000587875487 GI Annotated Bother CC(C)(C)OC(=O)N1CCC[C@@H](C(=O)n2nc3cc2oc2ccc(F)cc32)C1 ZINC000587875720 GI Annotated Anodyne CC(C)(C)OC(=O)N1CCC[C@H](C(=O)n2nc3cc2oc2ccc(F)cc32)C1 ZINC000587875721 GI Annotated Anodyne Cc1nn(C)c2nc(C3CC3)cc(C(=O)n3nc4cc3oc3ccc(F)cc43)c12 ZINC000587875742 GI Annotated Anodyne C[C@H](N=c1[nH]c2ccccc2s1)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587875824 GI Annotated Anodyne C[C@@H](N=c1[nH]c2ccccc2s1)C(=O)n1nc2cc1oc1ccc(F)cc21 ZINC000587875826 GI Annotated Anodyne CCCn1nc(C)c2c(C(=O)n3nc4cc3oc3ccc(F)cc43)cc(C)nc21 ZINC000587875854 GI Annotated Anodyne Cc1ccc(O[C@H](C)C(=O)n2nc3cc2oc2ccc(F)cc32)c([N+](=O)[O-])c1 ZINC000587875916 GI Annotated Bother Cc1ccc(O[C@@H](C)C(=O)n2nc3cc2oc2ccc(F)cc32)c([N+](=O)[O-])c1 ZINC000587875917 GI Annotated Bother COc1ccc(-c2cc(C(=O)n3nc4cc3oc3ccc(F)cc43)n[nH]2)cc1 ZINC000587875927 GI Annotated Anodyne Cc1noc2nc(C3CC3)cc(C(=O)n3nc4cc3oc3ccc(F)cc43)c12 ZINC000587876013 GI Annotated Anodyne CCOC(=O)c1ccc(NC(=S)n2nc3cc2oc2ccc(F)cc32)cc1 ZINC000587876069 GI Annotated Anodyne CCOc1ccc(-c2cc(C(=O)n3nc4cc3oc3ccc(F)cc43)n[nH]2)cc1 ZINC000587876393 GI Annotated Anodyne COc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c(O)c1Cl ZINC000587876529 GI Annotated Mild Cc1cc(C)n(Cc2ccc(C(=O)n3nc4cc3oc3ccc(F)cc43)o2)n1 ZINC000587876718 GI Annotated Anodyne COc1ccccc1-c1cc(C(=O)n2nc3cc2oc2ccc(F)cc32)n[nH]1 ZINC000587876726 GI Annotated Anodyne CN(CCCNC(=S)n1nc2cc1oc1ccc(F)cc21)c1ccccc1 ZINC000587876861 GI Annotated Anodyne Cc1ccccc1OCn1ccc(C(=O)n2nc3cc2oc2ccc(F)cc32)n1 ZINC000587876883 GI Annotated Anodyne Cn1c(SCC(=O)n2nc3cc2oc2ccc(F)cc32)nc2ccccc21 ZINC000587876997 GI Annotated Anodyne Cc1cc([N+](=O)[O-])cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1C ZINC000587877243 GI Annotated Mild O=Cc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1Cl ZINC000587877438 GI Annotated Mild N#Cc1c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cccc1NC1CC1 ZINC000587877492 GI Annotated Mild Cc1ccc(C(=O)O)c(C)c1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587877701 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc([N+](=O)[O-])c1Cl ZINC000587877740 GI Annotated Mild Cc1c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cccc1CCC#N ZINC000587877900 GI Annotated Mild Cc1cc(C)c([N+](=O)[O-])cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587877929 GI Annotated Mild CCNc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1C#N ZINC000587877984 GI Annotated Mild COc1cc(C)c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c(OC)c1 ZINC000587878127 GI Annotated Mild CCOc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c(OC)c1 ZINC000587878877 GI Annotated Mild N#CCc1ccc(Cl)c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587878905 GI Annotated Mild Cc1c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)ccc2c(C=O)c[nH]c12 ZINC000587879172 GI Annotated Mild C=CCOCc1ccccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587879201 GI Annotated Mild N#CC1(c2ccccc2C#CCNC(=O)Cc2ccc(Cl)cc2Cl)CC1 ZINC000587879226 GI Annotated Mild C[C@@H](O)c1ccc(Cl)c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587879288 GI Annotated Mild C[C@H](O)c1ccc(Cl)c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587879289 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cc([N+](=O)[O-])ccc1Cl ZINC000587879307 GI Annotated Mild O=Cc1cccc(Cl)c1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587879739 GI Annotated Mild CCCOc1ccc(N)cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587879909 GI Annotated Mild O=Cc1nc2ccccc2cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587879976 GI Annotated Mild CC[C@@H](C)c1ncncc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587880061 GI Annotated Mild CC[C@H](C)c1ncncc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587880062 GI Annotated Mild CCCNc1ccc(N)cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587880073 GI Annotated Mild CCc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc(C)c1N ZINC000587880092 GI Annotated Mild CC(C)CCc1ncncc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587880187 GI Annotated Mild Cc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)ccc1C(=O)Cl ZINC000587880527 GI Annotated Reactive CCCCCc1ncncc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587880579 GI Annotated Mild Cc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc(C)c1N=C=O ZINC000587880678 GI Annotated Reactive O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cncnc1C1CCCC1 ZINC000587880697 GI Annotated Mild Cc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)ccc1N(C)C ZINC000587880784 GI Annotated Mild CC(C)Oc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1N ZINC000587880803 GI Annotated Mild CC(C)Nc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1N ZINC000587880832 GI Annotated Mild CCc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)ccc1N=C=O ZINC000587880927 GI Annotated Reactive CCOc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1OC ZINC000587881075 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc([C@@H]2CCCN2)c1 ZINC000587881847 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc([C@H]2CCCN2)c1 ZINC000587881848 GI Annotated Mild NC1(c2cccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)c2)CCC1 ZINC000587881978 GI Annotated Mild N#CC1(c2cccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)c2)CC1 ZINC000587882010 GI Annotated Mild CC(=O)/C=C/c1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587882078 GI Annotated Mild CC(=O)/C=C\c1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587882079 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc(OCC2CC2)c1 ZINC000587882090 GI Annotated Mild N#CC(C#N)=Cc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587882239 GI Annotated Reactive CCOc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)ccc1OC ZINC000587882487 GI Annotated Mild COc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1CCl ZINC000587882950 GI Annotated Reactive C[C@@H](N=O)c1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)ccc1O ZINC000587882954 GI Annotated Mild C[C@H](N=O)c1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)ccc1O ZINC000587882955 GI Annotated Mild CC(C)Oc1cc(O)cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587882994 GI Annotated Mild [N-]=[N+]=Nc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)ccc1O ZINC000587883052 GI Annotated Mild CC(C)Oc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)ccc1O ZINC000587883082 GI Annotated Mild CC[C@H](O)c1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587883139 GI Annotated Mild CC[C@@H](O)c1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587883140 GI Annotated Mild N#CC1(c2ccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cc2)CC1 ZINC000587883293 GI Annotated Mild NC1(c2ccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cc2)CCC1 ZINC000587883694 GI Annotated Mild CC1(C)COc2ccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cc21 ZINC000587884154 GI Annotated Mild CC(C)NCc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1 ZINC000587884547 GI Annotated Mild CC1(C)CNc2cc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)ccc21 ZINC000587884712 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc2c(c1)CCCCO2 ZINC000587884829 GI Annotated Mild CC1(C)NCc2cc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)ccc21 ZINC000587884910 GI Annotated Mild COc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc2[nH]ccc12 ZINC000587885041 GI Annotated Mild N#CCCC(=O)c1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1 ZINC000587885159 GI Annotated Mild C[C@@H]1Cc2ccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cc2C1=O ZINC000587885173 GI Annotated Mild C[C@H]1Cc2ccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cc2C1=O ZINC000587885175 GI Annotated Mild CC(C)(O)Cc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1 ZINC000587885363 GI Annotated Mild CCCOc1ncc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1C ZINC000587885484 GI Annotated Mild COc1cc2cc[nH]c2cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587885608 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc2c(C3CC3)n[nH]c2c1 ZINC000587885946 GI Annotated Mild Cc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc2ccc(O)nc12 ZINC000587886087 GI Annotated Mild N#Cc1cc2ncccc2cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587886127 GI Annotated Mild CC(C)Oc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1 ZINC000587886237 GI Annotated Mild COc1cc2ccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cc2cn1 ZINC000587886389 GI Annotated Mild CCc1nc2cc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)ccc2o1 ZINC000587886502 GI Annotated Mild Cc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc2cc(O)[nH]c12 ZINC000587886538 GI Annotated Mild Cn1c(C=O)cc2ccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cc21 ZINC000587886554 GI Annotated Mild COc1ccc2cc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)ccc2n1 ZINC000587886611 GI Annotated Mild O=Cc1cc2cc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)ccc2o1 ZINC000587886660 GI Annotated Mild Cc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc2c(C=O)c[nH]c12 ZINC000587886701 GI Annotated Mild Cc1cc2c(cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl)NCCC2 ZINC000587886738 GI Annotated Mild CC(=O)c1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc2cc[nH]c12 ZINC000587886780 GI Annotated Mild N#Cc1cnc2ccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cc2c1 ZINC000587886915 GI Annotated Mild CC(C)(C)Oc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cn1 ZINC000587887462 GI Annotated Mild N#CC1(c2ccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cn2)CCC1 ZINC000587887577 GI Annotated Mild CC1(C)CNc2c(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cccc21 ZINC000587887829 GI Annotated Mild COc1cccc2cc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cnc12 ZINC000587887907 GI Annotated Mild CCc1cc2cc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cnc2[nH]1 ZINC000587887966 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cnc2c(Cl)c[nH]c2c1 ZINC000587887969 GI Annotated Mild O=Cc1ccc2cc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cnc2c1 ZINC000587887971 GI Annotated Mild N#Cc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c2cc[nH]c2c1 ZINC000587888017 GI Annotated Mild C[C@@H]1Cc2c(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cccc2C1=O ZINC000587888069 GI Annotated Mild C[C@H]1Cc2c(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cccc2C1=O ZINC000587888072 GI Annotated Mild O=Cc1ccc2cccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)c2n1 ZINC000587888126 GI Annotated Mild COc1ccc2cccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)c2n1 ZINC000587888466 GI Annotated Mild CC1(C)Cc2cccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)c2O1 ZINC000587888575 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc2c1CCCCN2 ZINC000587888721 GI Annotated Mild N#Cc1[nH]c2ccccc2c1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587888842 GI Annotated Mild N#Cc1cc2ccccc2nc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587889304 GI Annotated Mild COc1ccc2ncc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)cc2c1 ZINC000587889370 GI Annotated Mild COc1cccc2ccc(C#CCNC(=O)Cc3ccc(Cl)cc3Cl)nc12 ZINC000587889446 GI Annotated Mild CCCCOc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)n1 ZINC000587889850 GI Annotated Mild CC[C@H](C)Oc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)nc1 ZINC000587889861 GI Annotated Mild CC[C@@H](C)Oc1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)nc1 ZINC000587889863 GI Annotated Mild CC(C)(C)Oc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)n1 ZINC000587890225 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc(-c2ccccn2)n1 ZINC000587890305 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#CC1=C[C@@H](C2CCCCC2)ON1 ZINC000587891203 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#CC1=C[C@H](C2CCCCC2)ON1 ZINC000587891204 GI Annotated Mild N#CC(F)(F)c1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1 ZINC000587891335 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#CCc1ccc(OC(F)F)cc1 ZINC000587891568 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc2c1OC(F)(F)O2 ZINC000587891593 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(OC(F)F)cc1 ZINC000587891610 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(OCCF)cc1 ZINC000587892139 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc(OCCF)c1 ZINC000587892177 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cncc(CCCCF)c1 ZINC000587892212 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc(OCCCF)c1 ZINC000587892461 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc(OCCCF)cc1 ZINC000587892610 GI Annotated Mild N#C/C=C/c1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1F ZINC000587894141 GI Annotated Reactive N#C/C=C\c1ccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cc1F ZINC000587894142 GI Annotated Reactive O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc(N=C=S)c1 ZINC000587895065 GI Annotated Reactive O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc2nc(S)oc2c1 ZINC000587895199 GI Annotated Mild COc1ccc(S)cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587895966 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cc(F)c2[nH]ccc2c1 ZINC000587896021 GI Annotated Mild CSc1ccc(C#N)cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587896149 GI Annotated Mild CCc1sc(C(=O)O)cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587896337 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1oc2cccc(F)c2c1O ZINC000587896346 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cc(F)c2[nH]c(O)cc2c1 ZINC000587896434 GI Annotated Mild N#CSc1ccccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587896468 GI Annotated Reactive COc1ccc(S)c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587896544 GI Annotated Mild CC(=S)Nc1ccccc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587896546 GI Annotated Mild CSc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)ccc1C=O ZINC000587896711 GI Annotated Mild Cc1sc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c(C(=O)O)c1C ZINC000587896829 GI Annotated Mild CCc1sc(C=O)cc1C#CCNC(=O)Cc1ccc(Cl)cc1Cl ZINC000587896991 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc2oc(S)nc2c1 ZINC000587897006 GI Annotated Mild N#CCSc1cccc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)c1 ZINC000587897037 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccccc1N=C=S ZINC000587897141 GI Annotated Reactive CC(=O)c1cc(C)c(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)s1 ZINC000587897153 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc([C@@H]2CCCN2)s1 ZINC000587897480 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc([C@H]2CCCN2)s1 ZINC000587897481 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1c[nH]nc1-c1cccs1 ZINC000587897608 GI Annotated Mild CCOCc1cc(C#CCNC(=O)Cc2ccc(Cl)cc2Cl)cs1 ZINC000587897624 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc([C@@H](O)C2CC2)s1 ZINC000587897758 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc([C@H](O)C2CC2)s1 ZINC000587897759 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cc(CNC2CC2)cs1 ZINC000587897816 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1ccc2scnc2c1 ZINC000587897995 GI Annotated Mild COC(=O)c1cc(Br)cc(CC#Cc2cc(Cl)ccc2OC)c1 ZINC000587898023 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc2c(cc1CBr)OCO2 ZINC000587898317 GI Annotated Reactive O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1csc2ccnc(O)c12 ZINC000587898675 GI Annotated Mild COC(=O)c1cc(CBr)ccc1C#Cc1cc(Cl)ccc1OC ZINC000587898770 GI Annotated Reactive COC(=O)c1cc(Br)ccc1CC#Cc1cc(Cl)ccc1OC ZINC000587898823 GI Annotated Mild COc1ccc(Cl)cc1C#CCc1cc2c(cc1Br)OCO2 ZINC000587898838 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cscc1C(=O)Cl ZINC000587898873 GI Annotated Reactive COc1ccc(Cl)cc1C#Cc1cc(CBr)cc2c1OCO2 ZINC000587898957 GI Annotated Reactive COC(=O)c1ccc(Br)c(CC#Cc2cc(Cl)ccc2OC)c1 ZINC000587898978 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc2c1NCCS2 ZINC000587898988 GI Annotated Mild COc1ccc(Cl)cc1C#CCc1cc(Br)c2c(c1)OCO2 ZINC000587898991 GI Annotated Mild COC(=O)c1ccc(Br)cc1CC#Cc1cc(Cl)ccc1OC ZINC000587899054 GI Annotated Mild O=C(Cc1ccc(Cl)cc1Cl)NCC#Cc1cccc2scnc12 ZINC000587899236 GI Annotated Mild CCOc1cc(/C=C(/C)[N+](=O)[O-])cc(C#Cc2cc(Cl)ccc2OC)c1O ZINC000587899329 GI Annotated Mild CCOc1cc(/C=C(\C)[N+](=O)[O-])cc(C#Cc2cc(Cl)ccc2OC)c1O ZINC000587899330 GI Annotated Mild COCCc1cc(C#Cc2cc(Cl)ccc2OC)cc(Br)c1N ZINC000587899356 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)c(N)c(C)c1[N+](=O)[O-] ZINC000587899388 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)c([N+](=O)[O-])c(C)c1N ZINC000587899462 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)cc(C=O)c1OC ZINC000587899493 GI Annotated Mild COCCc1cc(Br)cc(C#Cc2cc(Cl)ccc2OC)c1N ZINC000587899495 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C(C)=O)cc(Br)c1O ZINC000587899550 GI Annotated Mild COc1cc([N+](=O)[O-])c(C#Cc2cc(Cl)ccc2OC)cc1Br ZINC000587899631 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc([N+](=O)[O-])cc(Br)c1N ZINC000587899673 GI Annotated Mild CNCc1cccc(C#Cc2cc(Cl)ccc2OC)c1OC[C@@H]1CCCO1 ZINC000587899783 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)cc(CN=O)c1O ZINC000587899792 GI Annotated Mild CNCc1cccc(C#Cc2cc(Cl)ccc2OC)c1OC[C@H]1CCCO1 ZINC000587899796 GI Annotated Mild COC(=O)Cc1cc(C#Cc2cc(Cl)ccc2OC)c(Cl)cc1[N+](=O)[O-] ZINC000587899812 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc([N+](=O)[O-])cc(Br)c1OC ZINC000587899813 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(OC)c(OC)cc1C(OC)OC ZINC000587899869 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1c(OC)c([N+](=O)[O-])cc(Cl)c1[N+](=O)[O-] ZINC000587899964 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)cc(C(C)=O)c1N ZINC000587900263 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)c(N)c([N+](=O)[O-])c1 ZINC000587900423 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)c(OC)c(C=O)c1 ZINC000587900442 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C)c([N+](=O)[O-])c(Br)c1N ZINC000587900478 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C)c(N)c(Br)c1[N+](=O)[O-] ZINC000587900492 GI Annotated Mild COc1ccc(Cl)cc1C#CCc1cc(=O)oc2cc(OC)c(OC)cc12 ZINC000587900507 GI Annotated Mild COc1cc(C#Cc2cc(Cl)ccc2OC)c(Br)c([N+](=O)[O-])c1 ZINC000587900601 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1c(Br)cc(OC)c(O)c1C=O ZINC000587900646 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1c(N)c(C)cc(Br)c1[N+](=O)[O-] ZINC000587900784 GI Annotated Mild COc1ccc(Cl)cc1C#CCc1nn(C(=O)OC(C)(C)C)c2ncccc12 ZINC000587900792 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1c(N)c(Br)cc(C)c1[N+](=O)[O-] ZINC000587900840 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C=O)c(O)c(Br)c1OC ZINC000587900842 GI Annotated Mild COc1cc(Br)c(C#Cc2cc(Cl)ccc2OC)c([N+](=O)[O-])c1 ZINC000587900955 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1c(O)c(C=O)cc(Br)c1OC ZINC000587901160 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)cc(C(C)=O)c1O ZINC000587901185 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1-c1nn(CCC#N)cc1C=O ZINC000587901410 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1Cc1noc([C@@H]2CCCN2)n1 ZINC000587901433 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1Cc1noc([C@H]2CCCN2)n1 ZINC000587901434 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(O)c(-c2nc3ccccn3c2N)c1 ZINC000587902030 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(OC2CCN(C)CC2)c(OC)c1 ZINC000587902290 GI Annotated Mild COC(=O)c1c(C#Cc2cc(Cl)ccc2OC)ccn1C(=O)OC(C)(C)C ZINC000587902364 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1-c1nnc(CNC2CC2)o1 ZINC000587902632 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1c(C)nn(-c2ccc(C(=O)O)cc2)c1C ZINC000587902988 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1c(C)nn(-c2ccc([N+](=O)[O-])cc2)c1C ZINC000587903069 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc(OCc2ccccc2)nc1N(C)C ZINC000587903123 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc(N(C)C)nc1OCc1ccccc1 ZINC000587903204 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1-c1noc([C@H]2CCCN2)n1 ZINC000587903333 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1-c1noc([C@@H]2CCCN2)n1 ZINC000587903334 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cncnc1Oc1ccc2c(c1)OCO2 ZINC000587903723 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C(=O)N2CCCCC2)cc([N+](=O)[O-])c1 ZINC000587904715 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cccc(-n2ncc3c2CCCC3=O)c1 ZINC000587905426 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cccc(-c2nn(CCC#N)cc2C=O)c1 ZINC000587905562 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(-c2noc([C@H]3CCCN3)n2)cc1 ZINC000587906377 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(-c2noc([C@@H]3CCCN3)n2)cc1 ZINC000587906378 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(-c2nc3c(o2)CCN(C)C3)cc1 ZINC000587906703 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(-c2nn(CCC#N)cc2C=O)cc1 ZINC000587906708 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(-c2nc3ncccn3c2C=O)cc1 ZINC000587906828 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(-c2nn(CCC#N)cc2C#N)cc1 ZINC000587906830 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc2c(cc1Br)OCCO2 ZINC000587907242 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(Oc2c([N+](=O)[O-])ncn2C)cc1 ZINC000587907302 GI Annotated Mild COC(=O)c1cc(C#Cc2cc(Cl)ccc2OC)cc2c1cnn2C(C)C ZINC000587907391 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(CCl)c2occ(C=O)c(=O)c2c1 ZINC000587907918 GI Annotated Reactive COC(=O)c1cc(C#Cc2cc(Cl)ccc2OC)cc2nc(CCl)oc12 ZINC000587907951 GI Annotated Reactive COc1ccc(Cl)cc1C#Cc1cnc(NC(=O)OC(C)(C)C)cc1C=O ZINC000587908539 GI Annotated Mild CC[C@H]1CCCN(c2ncc(C#Cc3cc(Cl)ccc3OC)cc2CO)C1 ZINC000587908814 GI Annotated Mild CC[C@@H]1CCCN(c2ncc(C#Cc3cc(Cl)ccc3OC)cc2CO)C1 ZINC000587908815 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc2occ(-c3nnc(C)o3)c(=O)c2c1 ZINC000587909082 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc(OCCOC(C)(C)C)c(OC)c1 ZINC000587909221 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc2c(c1)[C@H]1C=CC[C@H]1[C@@H](C(=O)O)N2 ZINC000587909343 GI Annotated Mild CCOC(=O)c1c[nH]c2cc(C)c(C#Cc3cc(Cl)ccc3OC)cc2c1=O ZINC000587909469 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc(NCc2ccco2)c([N+](=O)[O-])c1 ZINC000587909527 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc2c(cnn2C(=O)OC(C)(C)C)c1 ZINC000587909974 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)c2c(c1)C(=O)CCO2 ZINC000587910044 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)cc2c1OCCC2=O ZINC000587910071 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1c[nH]c(C(=O)N2CCc3ccccc3C2)c1 ZINC000587910210 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc2c(Br)[nH]c(=N)cc2c1 ZINC000587910439 GI Annotated Mild CCOC(=O)c1nc(C#Cc2cc(Cl)ccc2OC)ccc1Br ZINC000587910712 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ncc(CN=O)cc1NC(=O)C(C)(C)C ZINC000587910760 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc([C@H](C)NC(=O)OC(C)(C)C)[nH]1 ZINC000587910927 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1c(NN)[nH]c2ccc(Br)cc12 ZINC000587910946 GI Annotated Mild CCOC(=O)c1cc2c(C#Cc3cc(Cl)ccc3OC)c(OC)ccc2[nH]1 ZINC000587911045 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc2[nH]c(NN)c(Br)c2c1 ZINC000587911171 GI Annotated Mild CCOC(=O)c1cc(C#Cc2cc(Cl)ccc2OC)c2c(c1)nc(C)n2C ZINC000587911238 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1c(OC[C@@H](N)N=O)ccc2ccccc12 ZINC000587911335 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1c(OC[C@H](N)N=O)ccc2ccccc12 ZINC000587911336 GI Annotated Mild CCn1c(C)nc2cc(C(=O)OC)cc(C#Cc3cc(Cl)ccc3OC)c21 ZINC000587911382 GI Annotated Mild CCn1c(CC#N)nc2c(Cl)ncc(C#Cc3cc(Cl)ccc3OC)c21 ZINC000587911486 GI Annotated Mild CCCn1nnc2cc(C(=O)OCC)cc(C#Cc3cc(Cl)ccc3OC)c21 ZINC000587911703 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Cl)cc2c(O)cc(C(=O)O)nc12 ZINC000587911718 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)c2ncnc(O)c2c1 ZINC000587911843 GI Annotated Mild COc1ccc(Cn2c(C#Cc3cc(Cl)ccc3OC)ccc2C=O)cc1 ZINC000587911880 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)cc2c(O)ncnc12 ZINC000587911940 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cn2c(Br)cnc2cc1C ZINC000587911970 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc2c(Br)cc(C)cn12 ZINC000587911992 GI Annotated Mild CCOC(=O)c1nc2ccc(Cl)cn2c1C#Cc1cc(Cl)ccc1OC ZINC000587912017 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C=O)cn(Cc2ccc(C)cc2)c1=O ZINC000587912033 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cn2c(Cl)cnc2c(Br)n1 ZINC000587912147 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C)cn2c(Br)cnc12 ZINC000587912164 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Cl)nn2c(Br)cnc12 ZINC000587912172 GI Annotated Mild CCOC(=O)c1cc(C#Cc2cc(Cl)ccc2OC)oc1Br ZINC000587912238 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C#N)cn2c(Br)cnc12 ZINC000587912476 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc2c(Br)cc(Cl)nn12 ZINC000587912479 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc2c(Br)cc(C#N)cn12 ZINC000587912537 GI Annotated Mild CCOC(=O)c1cc(Br)oc1C#Cc1cc(Cl)ccc1OC ZINC000587912588 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc2cc(C)c(Br)cn12 ZINC000587912737 GI Annotated Mild CCOC(=O)c1cn2cc(Cl)cc(C#Cc3cc(Cl)ccc3OC)c2n1 ZINC000587912783 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1nc(Br)cn2c(Cl)cnc12 ZINC000587912921 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1nn(C)c2ccc(Br)cc12 ZINC000587912930 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ncc(C(=O)O)c2oc(C(C)(C)C)nc12 ZINC000587913065 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1nn(C(=O)OC(C)(C)C)c2ncccc12 ZINC000587913586 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc2c(c1)c(Br)nn2C ZINC000587913623 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(OC(F)(F)F)cc([N+](=O)[O-])c1O ZINC000587914367 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(OC(F)(F)F)c(N)c([N+](=O)[O-])c1 ZINC000587914401 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1nc(Br)[nH]c1C(F)(F)F ZINC000587914478 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(OC(F)(F)F)cc([N+](=O)[O-])c1N ZINC000587914530 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(N)c([N+](=O)[O-])cc1OC(F)(F)F ZINC000587914757 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(F)cc1[C@@H](N)COC(F)(F)F ZINC000587914860 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(F)cc1[C@H](N)COC(F)(F)F ZINC000587914866 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1c(Br)ncnc1C(F)(F)F ZINC000587915016 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(OC(F)F)c(OC)cc1CC#N ZINC000587915459 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cn(Cc2c(F)cccc2Cl)[nH]c1=N ZINC000587915476 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(OC(F)(F)F)c([N+](=O)[O-])cc1N ZINC000587915646 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ncnc(C(F)(F)F)c1Br ZINC000587915652 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(CC#N)cc(OC)c1OC(F)F ZINC000587915811 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)c(N)c(C#N)c1F ZINC000587915895 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(Br)c(F)c(C#N)c1N ZINC000587915947 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C)c(NC(C)=O)c([N+](=O)[O-])c1F ZINC000587915951 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1c(F)c(Br)cc2[nH]c(=N)oc12 ZINC000587916443 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(-n2c(C)nnc2Cl)c(F)c1 ZINC000587916471 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1nccc(CNC(=O)OC(C)(C)C)c1F ZINC000587916706 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc2[nH]c(=N)oc2c(Br)c1F ZINC000587916832 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cnn(-c2ccc(/C=C/C(=O)O)cc2F)c1 ZINC000587916928 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cnn(-c2ccc(/C=C\C(=O)O)cc2F)c1 ZINC000587916930 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(I)cc1O ZINC000587917160 GI Annotated Mild COc1ccc(C#Cc2cc(Cl)ccc2OC)c(I)c1 ZINC000587917308 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(I)cc1OC ZINC000587917316 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(I)ccc1C#N ZINC000587917378 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(I)ccc1C=O ZINC000587917400 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(I)cc1C=O ZINC000587917534 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C)c(N)c(I)c1 ZINC000587917618 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(C=O)cc1I ZINC000587917643 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(I)cc1C#N ZINC000587917698 GI Annotated Mild COc1ccc(I)c(C#Cc2cc(Cl)ccc2OC)c1 ZINC000587917700 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(I)cc(C)c1O ZINC000587918068 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1sc(S(=O)(=O)Cl)cc1Cl ZINC000587918101 GI Annotated Unstable COc1ccc(Cl)cc1C#Cc1cc(Cl)sc1S(=O)(=O)Cl ZINC000587918443 GI Annotated Unstable COc1ccc(Cl)cc1C#Cc1cncc2cccc(S(=O)(=O)Cl)c12 ZINC000587918462 GI Annotated Unstable COc1ccc(Cl)cc1C#Cc1cc(S(=O)(=O)Cl)sc1Cl ZINC000587918565 GI Annotated Unstable COC(=O)c1cc(Br)c(C#Cc2cc(Cl)ccc2OC)s1 ZINC000587918646 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc2nc(S)n(CC(C)C)c(=O)c2c1 ZINC000587918667 GI Annotated Mild COC(=O)c1sc(C#Cc2cc(Cl)ccc2OC)cc1Br ZINC000587918673 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(O[C@H](C)c2nnc(S)n2C)cc1 ZINC000587918694 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(O[C@@H](C)c2nnc(S)n2C)cc1 ZINC000587918695 GI Annotated Mild COC(=O)c1scc(C#Cc2cc(Cl)ccc2OC)c1Br ZINC000587918726 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1c(C=O)sc(C=O)c1Br ZINC000587918764 GI Annotated Mild COC(=O)c1cc(C#Cc2cc(Cl)ccc2OC)c(Br)s1 ZINC000587918906 GI Annotated Mild COC(=O)c1sc(Br)cc1C#Cc1cc(Cl)ccc1OC ZINC000587918912 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(C(=O)NCCSC)n(C(C)C)c1 ZINC000587918932 GI Annotated Mild CCNc1sc(C#Cc2cc(Cl)ccc2OC)c([N+](=O)[O-])c1[N+](=O)[O-] ZINC000587919007 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cc(CC(N)=O)sc1-c1ccc(N)cc1 ZINC000587919050 GI Annotated Mild C=CCn1c(S)nnc1-c1cccc(C#Cc2cc(Cl)ccc2OC)c1 ZINC000587919111 GI Annotated Mild CCCn1c(S)nc2ccc(C#Cc3cc(Cl)ccc3OC)cc2c1=O ZINC000587919163 GI Annotated Mild CCn1c(S)nnc1-c1cc(C#Cc2cc(Cl)ccc2OC)cs1 ZINC000587919194 GI Annotated Mild C=CCn1c(S)nnc1-c1ccc(C#Cc2cc(Cl)ccc2OC)cc1 ZINC000587919298 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(Br)cc1NC(N)=S ZINC000587919808 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(C=C(C#N)C#N)c2nsnc12 ZINC000587920102 GI Annotated Reactive CCN(Cc1ccc(C#Cc2cc(Cl)ccc2OC)s1)C(=O)CCl ZINC000587920255 GI Annotated Reactive COc1ccc(Cl)cc1C#Cc1ccccc1C(=O)N1CCSC1=S ZINC000587920367 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(/C=C2/SC(=S)N(C)C2=O)o1 ZINC000587920459 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(/C=C2\SC(=S)N(C)C2=O)o1 ZINC000587920462 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc2[nH]c(=NCCCN(C)C)sc2c1 ZINC000587920559 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccccc1N=c1[nH]c(C(=O)O)cs1 ZINC000587920609 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1sc(NC(=O)OC(C)(C)C)nc1C#N ZINC000587920627 GI Annotated Mild COCCN=c1[nH]c(-c2cccc(C#Cc3cc(Cl)ccc3OC)c2)cs1 ZINC000587920651 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1sc(Br)c2c1OCCO2 ZINC000587920779 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(Cl)c(-c2n[nH]c(=N)s2)c1 ZINC000587920998 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1cnc2[nH]c(-c3scnc3C)nc2c1 ZINC000587921196 GI Annotated Mild COc1ccc(Cl)cc1C#Cc1ccc(C2=C(C=O)SC3=NCCN32)cc1 ZINC000587921371 GI Annotated Reactive COc1ccc(Cl)cc1C#Cc1ccc2nc(N3CCOCC3)sc2c1 ZINC000587921447 GI Annotated Mild Cc1cc(-c2csc(CCN3CCOC3=O)n2)c(C)n1-c1ccccc1F ZINC000587921837 GI Annotated Clean CCN(c1ccc(-c2csc(-c3c(C)cncc3C)n2)cc1)S(C)(=O)=O ZINC000587922273 GI Annotated Anodyne CCN(c1ccc(-c2csc(-c3ccc(Cl)nc3)n2)cc1)S(C)(=O)=O ZINC000587922314 GI Annotated Anodyne CCc1cc(-c2nc(-c3ccc(N(CC)S(C)(=O)=O)cc3)cs2)ccn1 ZINC000587922515 GI Annotated Anodyne C=C1NNC(=O)C(c2nc(-c3cc(C)n(-c4ccccc4F)c3C)cs2)=C1C ZINC000587922543 GI Annotated Clean CCN(c1ccc(-c2csc(/C=C(\N)c3ccccc3)n2)cc1)S(C)(=O)=O ZINC000587922595 GI Annotated Anodyne CCN(c1ccc(-c2csc(/C=C(/N)c3ccccc3)n2)cc1)S(C)(=O)=O ZINC000587922596 GI Annotated Anodyne CCN(c1ccc(-c2csc(-c3ccc4nc[nH]c4c3)n2)cc1)S(C)(=O)=O ZINC000587922952 GI Annotated Anodyne Cc1ccc(-c2nc(-c3ccc(N(C)S(C)(=O)=O)cc3)cs2)cc1F ZINC000587923547 GI Annotated Anodyne CCCc1cc(-c2nc(-c3ccc(N(C)S(C)(=O)=O)cc3)cs2)ccn1 ZINC000587923612 GI Annotated Anodyne CN(c1ccc(-c2csc(-c3ccc(N)cc3Cl)n2)cc1)S(C)(=O)=O ZINC000587923621 GI Annotated Anodyne CS(=O)(=O)Nc1ccc(-c2csc(COc3ccc(F)cc3F)n2)cc1 ZINC000587923710 GI Annotated Anodyne CN(c1ccc(-c2csc(-c3c[nH]c4ccccc34)n2)cc1)S(C)(=O)=O ZINC000587923713 GI Annotated Anodyne CN(c1ccc(-c2csc(-c3ccnc4ccccc34)n2)cc1)S(C)(=O)=O ZINC000587923739 GI Annotated Anodyne Cc1ccc(NCCc2nc(-c3ccc(NS(C)(=O)=O)cc3)cs2)cc1 ZINC000587923760 GI Annotated Anodyne CN(c1ccc(-c2csc(-c3cccc4cccnc34)n2)cc1)S(C)(=O)=O ZINC000587923770 GI Annotated Anodyne CN(c1ccc(-c2csc(-c3cccc4cnccc34)n2)cc1)S(C)(=O)=O ZINC000587923784 GI Annotated Anodyne CN(c1ccc(-c2csc(-c3ccc(F)cc3F)n2)cc1)S(C)(=O)=O ZINC000587923788 GI Annotated Anodyne CN(c1ccc(-c2csc(Cc3ccccc3Cl)n2)cc1)S(C)(=O)=O ZINC000587923796 GI Annotated Anodyne CN(c1ccc(-c2csc(Cc3ccc(Cl)cc3)n2)cc1)S(C)(=O)=O ZINC000587923987 GI Annotated Anodyne Cc1ccc(C)c(Cc2nc(-c3ccc(N(C)S(C)(=O)=O)cc3)cs2)c1 ZINC000587923993 GI Annotated Anodyne CS(=O)(=O)Nc1ccc(-c2csc(-c3cccc4cccnc34)n2)cc1 ZINC000587924155 GI Annotated Anodyne CS(=O)(=O)Nc1ccc(-c2csc(-c3ccnc4ccccc34)n2)cc1 ZINC000587924240 GI Annotated Anodyne CS(=O)(=O)Nc1ccc(-c2csc(/C(C#N)=C\c3cccs3)n2)cc1 ZINC000587924367 GI Annotated Reactive CS(=O)(=O)Nc1ccc(-c2csc(/C(C#N)=C/c3cccs3)n2)cc1 ZINC000587924368 GI Annotated Reactive CSc1ccc(-c2csc(CCN3C(=O)c4ccccc4C3=O)n2)cc1 ZINC000587924595 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(-c3ccc(C)cc3OC)nc2c1 ZINC000587924708 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(-c3ccc(C)cc3OC)nc2c1 ZINC000587924725 GI Annotated Anodyne COc1ccc(OC)c(-c2nc3ccc(Br)c(F)c3[nH]2)c1OC ZINC000587924933 GI Annotated Anodyne COc1ccc(OC)c(-c2nc3cc(Br)c(F)cc3[nH]2)c1OC ZINC000587924947 GI Annotated Anodyne COc1ccc(C[C@H](C)c2nc3c(Br)ccnc3[nH]2)cc1OC ZINC000587925101 GI Annotated Anodyne COc1ccc(C[C@@H](C)c2nc3c(Br)ccnc3[nH]2)cc1OC ZINC000587925102 GI Annotated Anodyne COc1ccc(C[C@H](C)c2nc3ccc(Br)nc3[nH]2)cc1OC ZINC000587925198 GI Annotated Anodyne COc1ccc(C[C@@H](C)c2nc3ccc(Br)nc3[nH]2)cc1OC ZINC000587925202 GI Annotated Anodyne COc1ccc(CCCc2nc3cc(-n4cccn4)c(F)cc3[nH]2)cc1OC ZINC000587925345 GI Annotated Anodyne COc1ccc(OC)c(-c2nc3ccc(F)c(Br)c3[nH]2)c1OC ZINC000587925442 GI Annotated Anodyne CC[C@H](c1ccc(OC)c(OC)c1)c1nc2cncc(Br)c2[nH]1 ZINC000587925522 GI Annotated Anodyne CC[C@@H](c1ccc(OC)c(OC)c1)c1nc2cncc(Br)c2[nH]1 ZINC000587925525 GI Annotated Anodyne COc1ccc(C[C@H](C)c2nc3ccc(Br)c(O)c3[nH]2)cc1OC ZINC000587925641 GI Annotated Anodyne COc1ccc(C[C@@H](C)c2nc3ccc(Br)c(O)c3[nH]2)cc1OC ZINC000587925644 GI Annotated Anodyne COc1ccc(C[C@H](C)c2nc3cncc(Br)c3[nH]2)cc1OC ZINC000587925681 GI Annotated Anodyne COc1ccc(C[C@@H](C)c2nc3cncc(Br)c3[nH]2)cc1OC ZINC000587925684 GI Annotated Anodyne COc1cc(C)ccc1-c1nc2c(I)cnc(Cl)c2[nH]1 ZINC000587925775 GI Annotated Anodyne COc1cc(C2(c3nc4[nH]c(Cl)nc(C(F)(F)F)c-4n3)CC2)ccc1C ZINC000587925915 GI Annotated Anodyne COc1ccc(-c2ccc(-c3nc4cc5cn[nH]c5cc4[nH]3)c(O)c2)cc1OC ZINC000587925973 GI Annotated Anodyne CC[C@@H](c1ccc(OC)c(OC)c1)c1nc2ccc(OCCN(C)C)cc2[nH]1 ZINC000587925986 GI Annotated Anodyne CC[C@H](c1ccc(OC)c(OC)c1)c1nc2ccc(OCCN(C)C)cc2[nH]1 ZINC000587925987 GI Annotated Anodyne CC[C@H](c1ccc(OC)c(OC)c1)c1nc2cc(Br)ncc2[nH]1 ZINC000587926020 GI Annotated Anodyne CC[C@@H](c1ccc(OC)c(OC)c1)c1nc2cc(Br)ncc2[nH]1 ZINC000587926021 GI Annotated Anodyne COc1ccc(OC)c(-c2nc3cc(Br)cc(F)c3[nH]2)c1OC ZINC000587926029 GI Annotated Anodyne CC(C)(C)Oc1cc(Cc2ccccc2)c(O)n1-c1cc(O)cc(C(=O)O)c1 ZINC000587926030 GI Annotated Anodyne O=C(O)c1cc(O)cc(-n2c(O)cc(-c3ccc(Cl)cc3Cl)c2O)c1 ZINC000587926032 GI Annotated Anodyne O=C(O)c1cc(O)cc(-n2c(O)cc(-c3c(Cl)cccc3Cl)c2O)c1 ZINC000587926074 GI Annotated Anodyne O=C(O)CCc1ccc(-c2ccc(Cl)cc2)n1-c1cc(O)cc(C(=O)O)c1 ZINC000587926338 GI Annotated Clean COc1ccc(OC)c(-c2nc3cc(Br)c(F)c(F)c3[nH]2)c1OC ZINC000587926342 GI Annotated Anodyne C=C(C)C(=O)OCCOc1ccc(O)n1-c1ccc(O)c(-c2ccccc2)c1 ZINC000587926344 GI Annotated Mild COc1ccc(CCCc2nc3c(F)cnc(Br)c3[nH]2)cc1OC ZINC000587926356 GI Annotated Anodyne COc1ccc(OC)c(-c2nc3cc(F)cc(Br)c3[nH]2)c1OC ZINC000587926361 GI Annotated Anodyne COc1cc(C)ccc1-c1nc2c(Br)cnc(Br)c2[nH]1 ZINC000587926406 GI Annotated Anodyne COc1ccc(C[C@@H](C)c2nc3c(F)cnc(Br)c3[nH]2)cc1OC ZINC000587926656 GI Annotated Anodyne COc1ccc(C[C@H](C)c2nc3c(F)cnc(Br)c3[nH]2)cc1OC ZINC000587926658 GI Annotated Anodyne COc1ccc(OC)c(-c2nc3ccc(-c4ccc(N)c(N)c4)cc3[nH]2)c1OC ZINC000587926851 GI Annotated Anodyne COc1ccc(Cc2nc3cc(Br)c(F)c(F)c3[nH]2)cc1OC ZINC000587926944 GI Annotated Anodyne COc1c(Cc2cccc3ccccc23)cc(O)n1-c1cc(O)cc(C(=O)O)c1 ZINC000587926952 GI Annotated Anodyne COc1ccc(CCCc2nc3c(C)c(Br)cnc3[nH]2)cc1OC ZINC000587927026 GI Annotated Anodyne COc1ccc(-c2ccc(-c3nc4ccc(CCO)cc4[nH]3)c(O)c2)cc1OC ZINC000587927092 GI Annotated Anodyne COc1ccc(-c2ccc(-c3nc4cc5c(cc4[nH]3)OCO5)c(O)c2)cc1OC ZINC000587927216 GI Annotated Anodyne COc1ccc(C[C@H](C)c2nc3ccnc(Br)c3[nH]2)cc1OC ZINC000587927361 GI Annotated Anodyne COc1ccc(C[C@@H](C)c2nc3ccnc(Br)c3[nH]2)cc1OC ZINC000587927362 GI Annotated Anodyne CC[C@@H](c1ccc(OC)c(OC)c1)c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587927379 GI Annotated Anodyne CC[C@H](c1ccc(OC)c(OC)c1)c1nc2cc(-n3cccn3)c(F)cc2[nH]1 ZINC000587927380 GI Annotated Anodyne COc1ccc(CCCc2nc3cc([N+](=O)[O-])c(Cl)cc3[nH]2)cc1OC ZINC000587927399 GI Annotated Bother COc1ccc(C[C@H](C)c2nc3c(C)c(Br)cnc3[nH]2)cc1OC ZINC000587927423 GI Annotated Anodyne COc1ccc(C[C@@H](C)c2nc3c(C)c(Br)cnc3[nH]2)cc1OC ZINC000587927425 GI Annotated Anodyne C=C(C)C(=O)OCCOc1ccc(O)n1-c1cccc(-c2cccc(OC)c2)c1 ZINC000587927454 GI Annotated Mild COc1ccc(OC)c(-c2nc3cc4nc5ccccc5nc4cc3[nH]2)c1OC ZINC000587927455 GI Annotated Bother COc1ccc(CCCc2nc3ccc(Br)c(O)c3[nH]2)cc1OC ZINC000587927478 GI Annotated Anodyne COc1ccc(C[C@@H](C)c2nc3cc(-n4cccn4)c(F)cc3[nH]2)cc1OC ZINC000587927481 GI Annotated Anodyne COc1ccc(C[C@H](C)c2nc3cc(-n4cccn4)c(F)cc3[nH]2)cc1OC ZINC000587927482 GI Annotated Anodyne COc1cc(C2(c3nc4c(F)cnc(Br)c4[nH]3)CC2)ccc1C ZINC000587927561 GI Annotated Anodyne COc1ccc(C[C@H](C)c2nc3cc(Br)c(C)nc3[nH]2)cc1OC ZINC000587927680 GI Annotated Anodyne COc1ccc(C[C@@H](C)c2nc3cc(Br)c(C)nc3[nH]2)cc1OC ZINC000587927681 GI Annotated Anodyne COc1ccc(C[C@H](C)c2nc3cc([N+](=O)[O-])c(Cl)cc3[nH]2)cc1OC ZINC000587927756 GI Annotated Bother COc1ccc(C[C@@H](C)c2nc3cc([N+](=O)[O-])c(Cl)cc3[nH]2)cc1OC ZINC000587927761 GI Annotated Bother COc1ccc(CCCc2nc3cc(Br)c(C)nc3[nH]2)cc1OC ZINC000587927838 GI Annotated Anodyne COc1ccc(C[C@H](C)c2nc3cc(Br)ncc3[nH]2)cc1OC ZINC000587927959 GI Annotated Anodyne COc1ccc(C[C@@H](C)c2nc3cc(Br)ncc3[nH]2)cc1OC ZINC000587927960 GI Annotated Anodyne CC[C@@H](c1ccc(OC)c(OC)c1)c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587928079 GI Annotated Anodyne CC[C@H](c1ccc(OC)c(OC)c1)c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587928080 GI Annotated Anodyne COc1ccc(-c2ccc(-c3nc4cnc(Cl)[nH]c-4n3)c(O)c2)cc1OC ZINC000587928105 GI Annotated Anodyne COc1ccc(OC)c(-c2nc3c4cccnc4c4ncccc4c3[nH]2)c1OC ZINC000587928221 GI Annotated Bother COc1ccc(CCCc2nc3c(F)cnc(Br)c3[nH]2)c(OC)c1 ZINC000587928272 GI Annotated Anodyne COc1ccc(CCCc2nc3cc([N+](=O)[O-])c(Cl)cc3[nH]2)c(OC)c1 ZINC000587928309 GI Annotated Bother COc1ccc(/C=C/Cc2nc3cc(-n4cccn4)c(F)cc3[nH]2)c(OC)c1 ZINC000587928421 GI Annotated Anodyne COc1ccc(/C=C\Cc2nc3cc(-n4cccn4)c(F)cc3[nH]2)c(OC)c1 ZINC000587928422 GI Annotated Anodyne COc1ccc(-c2ccc(-c3nc4c([N+](=O)[O-])cncc4[nH]3)cc2)cc1OC ZINC000587928489 GI Annotated Bother COC(=O)c1cc(Cl)c2[nH]c(CCCc3ccc(OC)cc3OC)nc2c1 ZINC000587928767 GI Annotated Anodyne COc1ccc(-c2ccc(-c3nc4ncc([N+](=O)[O-])cc4[nH]3)cc2)cc1OC ZINC000587928797 GI Annotated Bother COc1ccc(CCCc2nc3c(C)c(Br)cnc3[nH]2)c(OC)c1 ZINC000587928812 GI Annotated Anodyne COc1ccc(-c2cccc(-c3nc4c(O)nc(S)nc4[nH]3)c2C)c(OC)c1 ZINC000587928976 GI Annotated Anodyne COc1ccc(CCCc2nc3ccc(Br)c(O)c3[nH]2)c(OC)c1 ZINC000587929065 GI Annotated Anodyne COc1ccc(CCCc2nc3cc(-n4cccn4)c(F)cc3[nH]2)c(OC)c1 ZINC000587929148 GI Annotated Anodyne COc1ccccc1CC(=O)c1nc2c(Cl)cc(Br)cc2[nH]1 ZINC000587929161 GI Annotated Anodyne COc1ccccc1CC(=O)c1nc2c(F)c(F)c(Br)cc2[nH]1 ZINC000587929169 GI Annotated Anodyne COc1ccccc1CC(=O)c1nc2c(Br)cc(Cl)cc2[nH]1 ZINC000587929428 GI Annotated Anodyne COc1ccc(CCCc2nc3cc(Br)c(C)nc3[nH]2)c(OC)c1 ZINC000587929610 GI Annotated Anodyne COc1cccc([C@@H](C)Cc2nc3cc(Br)cc(C(=O)O)c3[nH]2)c1 ZINC000587929635 GI Annotated Anodyne COc1ccc(-c2cccc(-c3nc4[nH]c(=N)[nH]c(Cl)c-4n3)c2C)c(OC)c1 ZINC000587929638 GI Annotated Anodyne COc1cccc([C@H](C)Cc2nc3cc(Br)cc(C(=O)O)c3[nH]2)c1 ZINC000587929641 GI Annotated Anodyne COc1ccccc1CC(=O)c1nc2cnc(C(F)(F)C(F)(F)F)cc2[nH]1 ZINC000587929838 GI Annotated Anodyne COc1cccc(Cc2nc3c(Br)cnc(Br)c3[nH]2)c1 ZINC000587930014 GI Annotated Anodyne COc1cccc([C@H](C)Cc2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)c1 ZINC000587930145 GI Annotated Anodyne COc1cccc([C@@H](C)Cc2nc3ccc(S(=O)(=O)C(F)(F)F)cc3[nH]2)c1 ZINC000587930151 GI Annotated Anodyne COc1cc(O)cc(-c2cccc(-c3nc4cnc(C(F)(F)F)[nH]c-4n3)c2)c1 ZINC000587930452 GI Annotated Anodyne COc1cccc(CCc2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)c1 ZINC000587931048 GI Annotated Bother COc1ccccc1[C@@]1(C)C[C@@H]1c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587931064 GI Annotated Anodyne COc1ccccc1[C@]1(C)C[C@H]1c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587931077 GI Annotated Anodyne COc1ccccc1[C@@]1(C)C[C@H]1c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587931080 GI Annotated Anodyne COc1ccccc1[C@]1(C)C[C@@H]1c1nc2c(F)cnc(Br)c2[nH]1 ZINC000587931083 GI Annotated Anodyne COc1cc(O)cc(-c2cccc(-c3nc4nc(Br)c[nH]c-4n3)c2)c1 ZINC000587932087 GI Annotated Anodyne COc1cc(O)cc(-c2cccc(-c3nc4cc(F)cc(C(=O)O)c4[nH]3)c2)c1 ZINC000587932181 GI Annotated Anodyne COc1cccc(CCc2nc3ccc4c(c3[nH]2)C(=O)c2ccccc2C4=O)c1 ZINC000587932410 GI Annotated Clean COc1cccc(CCc2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)c1 ZINC000587932472 GI Annotated Bother COc1cccc(-c2cc(O)cc(-c3nc4nc(Br)c[nH]c-4n3)c2)c1 ZINC000587932543 GI Annotated Anodyne COc1ccccc1[C@]1(C)C[C@@H]1c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587932846 GI Annotated Anodyne COc1ccccc1[C@]1(C)C[C@H]1c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587932850 GI Annotated Anodyne COc1ccccc1[C@@]1(C)C[C@@H]1c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587932852 GI Annotated Anodyne COc1ccccc1[C@@]1(C)C[C@H]1c1nc2[nH]c(Cl)nc(C(F)(F)F)c-2n1 ZINC000587932854 GI Annotated Anodyne CCOC(=O)c1cc(Br)c2[nH]c(Cc3cccc(OC)c3)nc2c1 ZINC000587932890 GI Annotated Anodyne COc1cccc(C2(c3nc4ccc(OCCN(C)C)cc4[nH]3)CCCC2)c1 ZINC000587933111 GI Annotated Anodyne COC(=O)c1ccc2nc(C3(c4cccc(OC)c4)CCCC3)[nH]c2c1OC ZINC000587933134 GI Annotated Anodyne COc1cc(O)cc(-c2cccc(-c3nc4cc5c(cc4[nH]3)NC(=O)CC5)c2)c1 ZINC000587933242 GI Annotated Anodyne COc1cccc(C2(c3nc4ccc(CN5CCOCC5)cc4[nH]3)CCCC2)c1 ZINC000587933584 GI Annotated Anodyne COc1ccc([C@H](c2ccccc2)c2nc3nc(Br)c[nH]c-3n2)cc1 ZINC000587933601 GI Annotated Anodyne COc1ccc([C@@H](c2ccccc2)c2nc3nc(Br)c[nH]c-3n2)cc1 ZINC000587933602 GI Annotated Anodyne COc1cccc(-c2cc(O)cc(-c3nc4cnc(C(F)(F)F)[nH]c-4n3)c2)c1 ZINC000587933647 GI Annotated Anodyne COc1cccc(-c2cc(O)cc(-c3nc4cc5c(cc4[nH]3)NC(=O)CC5)c2)c1 ZINC000587933875 GI Annotated Anodyne COc1cccc(C2(c3nc4cc([N+](=O)[O-])c([N+](=O)[O-])cc4[nH]3)CCCC2)c1 ZINC000587933879 GI Annotated Bother COC(=O)c1cc2[nH]c(C3(c4cccc(OC)c4)CCCC3)nc2cc1OC ZINC000587933892 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(CC3=CCCc4cc(OC)ccc43)[nH]c2c1 ZINC000587933948 GI Annotated Anodyne COc1c(Cc2ccccc2)cc(O)n1-c1cccc(C2=NC(C)(C)CO2)c1 ZINC000587934083 GI Annotated Anodyne CCOc1ccc(OCC)n1-c1c(Br)cccc1-c1cnn(C)c1 ZINC000587934167 GI Annotated Anodyne COc1ccc([C@@H](O)[C@@H](C)c2nc3c(Cl)c(Br)cnc3[nH]2)cc1 ZINC000587934366 GI Annotated Anodyne COc1ccc([C@H](O)[C@H](C)c2nc3c(Cl)c(Br)cnc3[nH]2)cc1 ZINC000587934367 GI Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3c(Cl)c(Br)cnc3[nH]2)cc1 ZINC000587934368 GI Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3c(Cl)c(Br)cnc3[nH]2)cc1 ZINC000587934369 GI Annotated Anodyne COc1ccc([C@@H](O)[C@@H](C)c2nc3cc(F)cc(Br)c3[nH]2)cc1 ZINC000587934398 GI Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3cc(F)cc(Br)c3[nH]2)cc1 ZINC000587934399 GI Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3cc(F)cc(Br)c3[nH]2)cc1 ZINC000587934400 GI Annotated Anodyne COc1ccc([C@H](O)[C@H](C)c2nc3cc(F)cc(Br)c3[nH]2)cc1 ZINC000587934401 GI Annotated Anodyne COC(=O)c1ccc2nc(C3(c4ccc(OC)cc4)CC4(CCC4)C3)[nH]c2n1 ZINC000587934464 GI Annotated Anodyne COC(=O)c1ccnc2[nH]c(C3(c4ccc(OC)cc4)CC4(CCC4)C3)nc12 ZINC000587934487 GI Annotated Anodyne COc1ccccc1-c1cc(O)n(-c2cccc(C3=NC(C)(C)CO3)c2)c1O ZINC000587934547 GI Annotated Anodyne COc1ccc([C@@H](O)[C@@H](C)c2nc3c(Br)cnc(Cl)c3[nH]2)cc1 ZINC000587934709 GI Annotated Anodyne COc1ccc([C@H](O)[C@H](C)c2nc3c(Br)cnc(Cl)c3[nH]2)cc1 ZINC000587934710 GI Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3c(Br)cnc(Cl)c3[nH]2)cc1 ZINC000587934711 GI Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3c(Br)cnc(Cl)c3[nH]2)cc1 ZINC000587934712 GI Annotated Anodyne COc1ccc([C@@H](O)[C@@H](C)c2nc3ccc(Br)c(F)c3[nH]2)cc1 ZINC000587934765 GI Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3ccc(Br)c(F)c3[nH]2)cc1 ZINC000587934766 GI Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3ccc(Br)c(F)c3[nH]2)cc1 ZINC000587934767 GI Annotated Anodyne COc1ccc([C@H](O)[C@H](C)c2nc3ccc(Br)c(F)c3[nH]2)cc1 ZINC000587934768 GI Annotated Anodyne COc1ccc2c(c1)C[C@H](c1nc3cc(C#N)cc(Br)c3[nH]1)CC2 ZINC000587934816 GI Annotated Mild COc1ccc2c(c1)C[C@@H](c1nc3cc(C#N)cc(Br)c3[nH]1)CC2 ZINC000587934817 GI Annotated Mild COc1ccc(C2(c3nc4ccc(S(=O)(=O)O)cc4[nH]3)CC3(CCC3)C2)cc1 ZINC000587934827 GI Annotated Anodyne COC(=O)c1cc2nc(C3(c4ccc(OC)cc4)CC4(CCC4)C3)[nH]c2cn1 ZINC000587934963 GI Annotated Anodyne CCCNc1cc(OCC)c(Br)cc1-n1c(OC)ccc1OC ZINC000587935030 GI Annotated Anodyne COc1ccc2c(c1)CCC=C2Cc1nc2c(F)cnc(Br)c2[nH]1 ZINC000587935346 GI Annotated Anodyne CCOc1cc(C(C)=O)c(OCC)n1-c1cccc(Br)c1[N+](=O)[O-] ZINC000587935677 GI Annotated Bother COc1cccc(-c2cc(O)n(-c3cccc(C4=NC(C)(C)CO4)c3)c2O)c1 ZINC000587935682 GI Annotated Anodyne COc1ccc2c(c1)CCC=C2Cc1nc2ccc(OCCN(C)C)cc2[nH]1 ZINC000587935969 GI Annotated Anodyne CCCNc1cc(OCC)c(Br)cc1-n1c(O)cc(C)c1OC ZINC000587935983 GI Annotated Anodyne CCCNc1cc(OCC)c(Br)cc1-n1c(OC)cc(C)c1O ZINC000587936015 GI Annotated Anodyne Cc1cc2c(n1-c1ccc(N3CCN(C)CC3)c(Br)c1)CCCC2 ZINC000587936020 GI Annotated Clean COc1ccc(-c2cccc(-c3nc4nc(Br)c[nH]c-4n3)c2)cc1 ZINC000587936089 GI Annotated Anodyne Cc1ccc(C(C)C)n1-c1ccc(N2CCN(C)CC2)c(Br)c1 ZINC000587936100 GI Annotated Clean COc1ccc2cc([C@@H](C)c3nc4nc(Br)c[nH]c-4n3)ccc2c1 ZINC000587936131 GI Annotated Anodyne O=[N+]([O-])c1c(Br)cccc1-n1c(O)cc(Cc2ccccc2)c1O ZINC000587936146 GI Annotated Bother O=[N+]([O-])c1c(Br)cccc1-n1c(O)cc(-c2ccccc2)c1O ZINC000587936189 GI Annotated Bother COc1ccc([C@@H](O)[C@@H](C)c2nc3cc(Br)c(F)cc3[nH]2)cc1 ZINC000587936320 GI Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3cc(Br)c(F)cc3[nH]2)cc1 ZINC000587936322 GI Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3cc(Br)c(F)cc3[nH]2)cc1 ZINC000587936326 GI Annotated Anodyne COc1ccc([C@H](O)[C@H](C)c2nc3cc(Br)c(F)cc3[nH]2)cc1 ZINC000587936329 GI Annotated Anodyne O=[N+]([O-])c1c(Br)cccc1-n1c(O)cc(-c2ccc(F)cc2)c1O ZINC000587936374 GI Annotated Bother COc1ccc([C@@H](O)[C@@H](C)c2nc3ccc(F)c(Br)c3[nH]2)cc1 ZINC000587936435 GI Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3ccc(F)c(Br)c3[nH]2)cc1 ZINC000587936437 GI Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3ccc(F)c(Br)c3[nH]2)cc1 ZINC000587936440 GI Annotated Anodyne COc1ccc([C@H](O)[C@H](C)c2nc3ccc(F)c(Br)c3[nH]2)cc1 ZINC000587936441 GI Annotated Anodyne C=CCOc1ccc(OCC=C)n1-c1cccc(Br)c1[N+](=O)[O-] ZINC000587936484 GI Annotated Mild CCCCc1ccc(-n2c(OC)cc(C(=O)OC)c2OC)c(Br)c1 ZINC000587936592 GI Annotated Anodyne COc1ccc(C2(c3nc4cc5c(cc4[nH]3)OCC(=O)N5)CC3(CCC3)C2)cc1 ZINC000587936617 GI Annotated Anodyne COc1ccc([C@H](c2ccccc2)c2nc3c(S)nc(S)nc3[nH]2)cc1 ZINC000587936754 GI Annotated Anodyne COc1ccc([C@@H](c2ccccc2)c2nc3c(S)nc(S)nc3[nH]2)cc1 ZINC000587936755 GI Annotated Anodyne COc1ccc(C2(c3nc4c(S)nc(S)nc4[nH]3)CC3(CCC3)C2)cc1 ZINC000587936830 GI Annotated Anodyne COc1ccc(-c2cc(O)n(-c3cccc(C4=NC(C)(C)CO4)c3)c2O)cc1 ZINC000587936921 GI Annotated Anodyne CCCNc1cc(OCC)c(Br)cc1-n1c(O)c(C)c(C)c1O ZINC000587936956 GI Annotated Anodyne C=C(C(=O)O)c1cc(O)n(-c2ccc(CCCC)cc2Br)c1O ZINC000587936963 GI Annotated Anodyne COC(=O)c1cc(-n2c(OC)cc(C)c2OC)c(Cl)cc1Br ZINC000587937011 GI Annotated Anodyne C=CCOc1ccc(OCC=C)n1-c1cccc(-c2cccc(C(=O)O)n2)c1 ZINC000587937037 GI Annotated Mild COc1ccc([C@H](O)[C@@H](C)c2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)cc1 ZINC000587937173 GI Annotated Mild COc1ccc([C@@H](O)[C@H](C)c2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)cc1 ZINC000587937174 GI Annotated Mild COc1ccc([C@H](O)[C@H](C)c2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)cc1 ZINC000587937175 GI Annotated Mild COc1ccc([C@@H](O)[C@@H](C)c2nc3cc(C#N)c(C(F)(F)F)cc3[nH]2)cc1 ZINC000587937176 GI Annotated Mild COc1ccc([C@H](O)[C@H](C)c2nc3cc(C)cc(Br)c3[nH]2)cc1 ZINC000587937201 GI Annotated Anodyne COc1ccc([C@@H](O)[C@@H](C)c2nc3cc(C)cc(Br)c3[nH]2)cc1 ZINC000587937202 GI Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3cc(C)cc(Br)c3[nH]2)cc1 ZINC000587937203 GI Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3cc(C)cc(Br)c3[nH]2)cc1 ZINC000587937204 GI Annotated Anodyne CCc1ccc(CC)n1-c1ccc(N2CCN(C)CC2)c(Br)c1 ZINC000587937247 GI Annotated Clean COc1ccc([C@@H](O)[C@@H](C)c2nc3cc(Br)cc(F)c3[nH]2)cc1 ZINC000587937606 GI Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3cc(Br)cc(F)c3[nH]2)cc1 ZINC000587937607 GI Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3cc(Br)cc(F)c3[nH]2)cc1 ZINC000587937608 GI Annotated Anodyne COc1ccc([C@H](O)[C@H](C)c2nc3cc(Br)cc(F)c3[nH]2)cc1 ZINC000587937609 GI Annotated Anodyne O=[N+]([O-])c1c(Br)cccc1-n1c(O)cc(-c2ccccc2F)c1O ZINC000587937646 GI Annotated Bother O=[N+]([O-])c1c(Br)cccc1-n1c(O)ccc1OCc1ccccc1 ZINC000587937671 GI Annotated Bother COc1ccc([C@@H](O)[C@@H](C)c2nc3cc(Br)c(F)c(F)c3[nH]2)cc1 ZINC000587937890 GI Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3cc(Br)c(F)c(F)c3[nH]2)cc1 ZINC000587937891 GI Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3cc(Br)c(F)c(F)c3[nH]2)cc1 ZINC000587937892 GI Annotated Anodyne COc1ccc([C@H](O)[C@H](C)c2nc3cc(Br)c(F)c(F)c3[nH]2)cc1 ZINC000587937893 GI Annotated Anodyne O=[N+]([O-])c1c(Br)cccc1-n1c(O)cc(-c2cccc(F)c2)c1O ZINC000587937899 GI Annotated Bother COc1ccc([C@H](O)[C@H](C)c2nc3cc(C)c(Br)cc3[nH]2)cc1 ZINC000587938044 GI Annotated Anodyne COc1ccc([C@@H](O)[C@@H](C)c2nc3cc(C)c(Br)cc3[nH]2)cc1 ZINC000587938101 GI Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3cc(C)c(Br)cc3[nH]2)cc1 ZINC000587938102 GI Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3cc(C)c(Br)cc3[nH]2)cc1 ZINC000587938103 GI Annotated Anodyne COc1ccc(C2(c3nc4nc(Br)c[nH]c-4n3)CC3(CCC3)C2)cc1 ZINC000587938132 GI Annotated Anodyne COc1ccc([C@@H](O)[C@@H](C)c2nc3ccc(-c4ccc(N)c(N)c4)cc3[nH]2)cc1 ZINC000587938177 GI Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3ccc(-c4ccc(N)c(N)c4)cc3[nH]2)cc1 ZINC000587938178 GI Annotated Anodyne COc1ccc([C@H](O)[C@H](C)c2nc3ccc(-c4ccc(N)c(N)c4)cc3[nH]2)cc1 ZINC000587938179 GI Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3ccc(-c4ccc(N)c(N)c4)cc3[nH]2)cc1 ZINC000587938181 GI Annotated Anodyne O=C(O)c1cccc(-c2cccc(-n3c(O)cc(-c4cccc(F)c4)c3O)c2)n1 ZINC000587938222 GI Annotated Anodyne COc1ccc([C@H](O)[C@H](C)c2nc3ccc(Br)c(C)c3[nH]2)cc1 ZINC000587938324 GI Annotated Anodyne COc1ccc([C@@H](O)[C@@H](C)c2nc3ccc(Br)c(C)c3[nH]2)cc1 ZINC000587938325 GI Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3ccc(Br)c(C)c3[nH]2)cc1 ZINC000587938326 GI Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3ccc(Br)c(C)c3[nH]2)cc1 ZINC000587938327 GI Annotated Anodyne COc1ccc([C@@H](c2ccccc2)c2nc3cc4c(cc3[nH]2)OCC(=O)N4)cc1 ZINC000587938382 GI Annotated Anodyne COc1ccc([C@H](c2ccccc2)c2nc3cc4c(cc3[nH]2)OCC(=O)N4)cc1 ZINC000587938383 GI Annotated Anodyne CC1(C)COC(c2cccc(-n3c(O)cc(-c4ccc([N+](=O)[O-])cc4)c3O)c2)=N1 ZINC000587938410 GI Annotated Bother O=C(O)c1cccc(-c2cccc(-n3c(O)cc(-c4ccc(F)cc4)c3O)c2)n1 ZINC000587938411 GI Annotated Anodyne CCOc1cc(C(C)=O)c(OCC)n1-c1cccc(-c2cccc(C(=O)O)n2)c1 ZINC000587938417 GI Annotated Anodyne O=C(O)c1cccc(-c2cccc(-n3c(O)cc(-c4ccccc4F)c3O)c2)n1 ZINC000587938452 GI Annotated Anodyne O=C(O)c1cccc(-c2cccc(-n3c(O)cc(Cc4ccccc4)c3O)c2)n1 ZINC000587938461 GI Annotated Anodyne COc1ccc2c(c1)C[C@H](c1nc3[nH]c(Cl)nc(C(F)(F)F)c-3n1)CC2 ZINC000587938489 GI Annotated Anodyne COc1ccc2c(c1)C[C@@H](c1nc3[nH]c(Cl)nc(C(F)(F)F)c-3n1)CC2 ZINC000587938490 GI Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3cc(C#N)cc(Br)c3[nH]2)cc1 ZINC000587938555 GI Annotated Mild COc1ccc([C@@H](O)[C@H](C)c2nc3cc(C#N)cc(Br)c3[nH]2)cc1 ZINC000587938556 GI Annotated Mild COc1ccc([C@H](O)[C@H](C)c2nc3cc(C#N)cc(Br)c3[nH]2)cc1 ZINC000587938557 GI Annotated Mild COc1ccc([C@@H](O)[C@@H](C)c2nc3cc(C#N)cc(Br)c3[nH]2)cc1 ZINC000587938558 GI Annotated Mild COc1ccc([C@H](O)[C@H](C)c2nc3cc(Br)cc(C)c3[nH]2)cc1 ZINC000587938650 GI Annotated Anodyne COc1ccc([C@@H](O)[C@@H](C)c2nc3cc(Br)cc(C)c3[nH]2)cc1 ZINC000587938651 GI Annotated Anodyne COc1ccc([C@@H](O)[C@H](C)c2nc3cc(Br)cc(C)c3[nH]2)cc1 ZINC000587938652 GI Annotated Anodyne COc1ccc([C@H](O)[C@@H](C)c2nc3cc(Br)cc(C)c3[nH]2)cc1 ZINC000587938653 GI Annotated Anodyne CC(C)c1cc(OC(C)(C)C)n(-c2cc(C(=O)O)ncc2Br)c1O ZINC000587938782 GI Annotated Anodyne Nc1ccc(-c2cc(O)n(-c3cnc4cc(Br)ccc4c3)c2O)cc1 ZINC000587938810 GI Annotated Anodyne CCOC(=O)c1cc(C)n(C[C@H](c2cccc(Br)c2)N(C)C)c1C ZINC000587938979 GI Annotated Anodyne CCOC(=O)c1cc(C)n(C[C@@H](c2cccc(Br)c2)N(C)C)c1C ZINC000587938980 GI Annotated Anodyne CCOc1cc(C=O)c(OCC)n1-c1cnc2cc(Br)ccc2c1 ZINC000587939201 GI Annotated Anodyne Oc1cc(-c2ccccc2F)c(O)n1NCc1ccccc1Br ZINC000587939314 GI Annotated Anodyne Cc1ncc(-n2c(O)cc(-c3cccc(Cl)c3)c2O)nc1Br ZINC000587939321 GI Annotated Anodyne COc1c(Cc2ccccc2)cc(O)n1NCc1ccccc1Br ZINC000587939442 GI Annotated Anodyne CCOc1cc(-n2c(O)cc(-c3cccc(F)c3)c2O)c(Cl)cc1C(=O)O ZINC000587939520 GI Annotated Anodyne O=C(O)CCc1ccc(-c2cccs2)n1-c1ccnc(Br)c1 ZINC000587939603 GI Annotated Anodyne CC(C)(C)Oc1ccc(O)n1-c1cc(Br)cnc1Br ZINC000587939610 GI Annotated Anodyne COc1cc(C(C)=O)c(OC)n1-c1cnc2cc(Br)ccc2c1 ZINC000587939755 GI Annotated Anodyne CCOc1cc(-n2c(O)cc(-c3ccccc3F)c2O)c(Cl)cc1C(=O)O ZINC000587939822 GI Annotated Anodyne C=CCOc1c(-c2ccccc2)cc(O)n1-c1cnc(C)c(Br)n1 ZINC000587939902 GI Annotated Mild COc1ccccc1-c1cc(O)n(NCc2ccccc2Br)c1O ZINC000587940005 GI Annotated Anodyne Oc1cc(-c2ccccc2)c(O)n1-c1cc2cnccc2c(Br)n1 ZINC000587940019 GI Annotated Anodyne Oc1cc(Cc2ccccc2)c(O)n1-c1cc2cnccc2c(Br)n1 ZINC000587940025 GI Annotated Anodyne CC(C)c1ccc(-c2cc(O)n(-c3c[nH]cc(Br)c3=O)c2O)cc1 ZINC000587940076 GI Annotated Anodyne CCOc1ccc(OCC)n1C[C@@H](c1cccc(Br)c1)N(C)C ZINC000587940175 GI Annotated Anodyne CCOc1ccc(OCC)n1C[C@H](c1cccc(Br)c1)N(C)C ZINC000587940176 GI Annotated Anodyne CCOc1cc(-n2c(O)cc(Cc3ccccc3)c2O)c(Cl)cc1C(=O)O ZINC000587940401 GI Annotated Anodyne CCOc1ccc(OCC)n1-c1cc(Br)cnc1Br ZINC000587940409 GI Annotated Anodyne CN(C)[C@@H](Cn1c(O)cc(-c2ccco2)c1O)c1cccc(Br)c1 ZINC000587940439 GI Annotated Anodyne CN(C)[C@H](Cn1c(O)cc(-c2ccco2)c1O)c1cccc(Br)c1 ZINC000587940441 GI Annotated Anodyne Oc1cc(-c2ccc(F)cc2)c(O)n1NCc1ccccc1Br ZINC000587940482 GI Annotated Anodyne COc1cccc(-c2cc(O)n(NCc3ccccc3Br)c2O)c1 ZINC000587940519 GI Annotated Anodyne COc1ccc(OC(C)(C)C)n1-c1cc2cnccc2c(Br)n1 ZINC000587940652 GI Annotated Anodyne Cc1ncc(-n2c(O)cc(-c3ccc(Cl)cc3)c2O)nc1Br ZINC000587940705 GI Annotated Anodyne Cc1ncc(-n2c(O)cc(-c3ccccc3Cl)c2O)nc1Br ZINC000587940720 GI Annotated Anodyne Oc1ccc(OCc2ccccc2)n1-c1cc2cnccc2c(Br)n1 ZINC000587940866 GI Annotated Anodyne C=CCOc1ccc(OCC=C)n1-c1cc(OCC)c(C(=O)O)cc1Cl ZINC000587940872 GI Annotated Mild COc1ccc(-c2cc(O)n(NCc3ccccc3Br)c2O)cc1 ZINC000587941050 GI Annotated Anodyne Cc1ncc(-n2c(CCC(=O)O)ccc2-c2cccs2)nc1Br ZINC000587941124 GI Annotated Anodyne Oc1ccc(OCCc2ccccc2)n1NCc1ccccc1Br ZINC000587941192 GI Annotated Anodyne Oc1cc(-c2cccc(F)c2)c(O)n1NCc1ccccc1Br ZINC000587941294 GI Annotated Anodyne O=C(O)CCc1ccc(-c2ccc(Cl)cc2)n1-c1ccnc(CCl)n1 ZINC000587941400 GI Annotated Reactive Cc1ncc(-n2c(O)ccc2OCCCc2ccccc2)nc1Br ZINC000587941402 GI Annotated Anodyne COc1c(Cc2cccc3ccccc23)cc(O)n1-c1ccnc(CCl)n1 ZINC000587941513 GI Annotated Reactive CN(C)[C@@H](Cn1c(O)ccc1OC(C)(C)C)c1cccc(Br)c1 ZINC000587941686 GI Annotated Anodyne CN(C)[C@H](Cn1c(O)ccc1OC(C)(C)C)c1cccc(Br)c1 ZINC000587941688 GI Annotated Anodyne CCOc1cc(-n2c(O)cc(-c3ccc(F)cc3)c2O)c(Cl)cc1C(=O)O ZINC000587941992 GI Annotated Anodyne CC(=O)SCc1cc(O)n(-c2cc(Cl)cc(Br)c2)c1O ZINC000587942050 GI Annotated Anodyne CCOc1cc(-n2c(OCC)cc(C(C)=O)c2OCC)c(Cl)cc1C(=O)O ZINC000587942075 GI Annotated Anodyne Cc1cc(OC(C)(C)C)n(-c2cc3cnccc3c(Br)n2)c1O ZINC000587942271 GI Annotated Anodyne C=CCOc1ccc(OCC=C)n1-c1cc2cnccc2c(Br)n1 ZINC000587942308 GI Annotated Mild Cc1cc(OCCn2c(O)cc(CCC(=O)O)c2O)c(C(C)C)cc1Cl ZINC000587942830 GI Annotated Anodyne COC(=O)c1cc(OC)n(-c2cc(OC(C)C)c(Cl)cc2Cl)c1OC ZINC000587942837 GI Annotated Anodyne Cc1c(F)c(Br)cc([N+](=O)[O-])c1-n1c(O)ccc1OC(C)(C)C ZINC000587942888 GI Annotated Bother C=C(C(=O)O)c1cc(O)n(CCOc2cc(C)c(Cl)cc2C(C)C)c1O ZINC000587943092 GI Annotated Anodyne COC(=O)c1cc(OC)n(CCOc2cc(C)c(Cl)cc2C(C)C)c1OC ZINC000587943293 GI Annotated Anodyne COc1cc(C)c(OC)n1-c1ccc(F)c(C(=O)OCc2ccccc2)c1F ZINC000587943419 GI Annotated Anodyne COC(=O)Cc1cc(OC)n(-c2ccc(-c3cccc(F)c3)c(F)c2)c1OC ZINC000587943431 GI Annotated Anodyne CCOc1ccc(OCC)n1-c1c([N+](=O)[O-])cc(Br)c(F)c1C ZINC000587943446 GI Annotated Bother CCOC(=O)c1cc(C)n(-c2c([N+](=O)[O-])cc(Br)c(F)c2C)c1C ZINC000587943549 GI Annotated Clean COc1cc(C#N)c(OC)n1-c1ccc(F)c(C(=O)OCc2ccccc2)c1F ZINC000587943912 GI Annotated Mild Cc1c(F)c(Br)cc([N+](=O)[O-])c1-n1c(O)cc(-c2ccco2)c1O ZINC000587944055 GI Annotated Bother O=N[C@H](COc1cc(F)cc(F)c1)n1c(O)cc(-c2cccc(F)c2)c1O ZINC000587944121 GI Annotated Anodyne O=N[C@@H](COc1cc(F)cc(F)c1)n1c(O)cc(-c2cccc(F)c2)c1O ZINC000587944122 GI Annotated Anodyne CCOc1cc(CC(C)=O)c(OCC)n1[C@@H](COc1cc(F)cc(F)c1)N=O ZINC000587944181 GI Annotated Anodyne CCOc1cc(CC(C)=O)c(OCC)n1[C@H](COc1cc(F)cc(F)c1)N=O ZINC000587944182 GI Annotated Anodyne O=C(O)CCc1ccc(-c2ccccc2)n1-c1nc(N2CCCCC2)ncc1F ZINC000587944183 GI Annotated Anodyne O=N[C@@H](COc1cc(F)cc(F)c1)n1c(O)ccc1OCCc1ccccc1 ZINC000587944192 GI Annotated Anodyne O=N[C@H](COc1cc(F)cc(F)c1)n1c(O)ccc1OCCc1ccccc1 ZINC000587944193 GI Annotated Anodyne Nc1ccc(-c2cc(O)n(-c3cc(F)c(Br)cc3F)c2O)cc1 ZINC000587944198 GI Annotated Anodyne CCOc1cc(C(C)=O)c(OCC)n1-c1cc(C)n(Cc2ccccc2F)n1 ZINC000587944211 GI Annotated Anodyne COc1cccc(-c2cc(O)n(-c3cc(C)n(Cc4ccccc4F)n3)c2O)c1 ZINC000587944216 GI Annotated Anodyne Cc1cc(-n2c(O)cc(-c3cccc(F)c3)c2O)nn1Cc1ccccc1F ZINC000587944241 GI Annotated Anodyne Oc1cc(-c2cccc(F)c2)c(O)n1-c1cnc(Cc2ccc(F)cc2)nc1 ZINC000587944351 GI Annotated Anodyne CCOc1cc(CC(C)=O)c(OCC)n1-c1cc(C)n(Cc2ccccc2F)n1 ZINC000587944396 GI Annotated Anodyne C=CCOc1c(-c2ccccc2)cc(O)n1-c1nc(N2CCCCC2)ncc1F ZINC000587944434 GI Annotated Mild Oc1ccc(OCCc2ccccc2)n1-c1cnc(Cc2ccc(F)cc2)nc1 ZINC000587944470 GI Annotated Anodyne Cc1cc(-n2c(O)cc(-c3ccc(F)cc3)c2O)nn1Cc1ccccc1F ZINC000587944702 GI Annotated Anodyne CCOc1ccc(OCC)n1-c1nn(COc2ccccc2F)cc1Cl ZINC000587944724 GI Annotated Anodyne C=C(C(=O)O)c1cc(O)n(-c2ccc(Oc3ccc4c(c3)CCC4)c(F)c2)c1O ZINC000587944784 GI Annotated Anodyne COc1ccccc1-c1cc(O)n(-c2cc(C)n(Cc3ccccc3F)n2)c1O ZINC000587944797 GI Annotated Anodyne Cc1cc(-n2c(O)cc(-c3ccccc3F)c2O)nn1Cc1ccccc1F ZINC000587944846 GI Annotated Anodyne COC(=O)c1cc(OC)n(-c2ccc(Oc3ccc(F)cc3)c(F)c2)c1OC ZINC000587944859 GI Annotated Anodyne Oc1ccc(OCc2ccccc2)n1-c1cnc(Cc2ccc(F)cc2)nc1 ZINC000587945087 GI Annotated Anodyne COc1cc(C)c(OC)n1Cc1nc2ccccc2n1Cc1cccc(F)c1 ZINC000587945095 GI Annotated Anodyne COc1ccc(-c2cc(O)n([C@@H](COc3cc(F)cc(F)c3)N=O)c2O)cc1 ZINC000587945325 GI Annotated Anodyne COc1ccc(-c2cc(O)n([C@H](COc3cc(F)cc(F)c3)N=O)c2O)cc1 ZINC000587945329 GI Annotated Anodyne Cc1cc(-n2c(O)cc(Cc3ccccc3)c2O)nn1Cc1ccccc1F ZINC000587945390 GI Annotated Anodyne COc1c(Cc2ccccc2)cc(O)n1-c1cnc(Cc2ccc(F)cc2)nc1 ZINC000587945417 GI Annotated Anodyne COc1cc(C)c(OC)n1-c1nc(-c2ccc(F)cc2NC(C)=O)cs1 ZINC000587945574 GI Annotated Anodyne O=C(O)CCc1ccc(-c2cccs2)n1-c1n[nH]c(-c2ccccc2F)n1 ZINC000587945575 GI Annotated Anodyne COc1cc(-c2ccccc2)c(OC)n1-c1nc(N2CCCCC2)ncc1F ZINC000587945589 GI Annotated Anodyne CCOc1cc(C(C)=O)c(OCC)n1[C@@H](COc1cc(F)cc(F)c1)N=O ZINC000587945592 GI Annotated Anodyne CCOc1cc(C(C)=O)c(OCC)n1[C@H](COc1cc(F)cc(F)c1)N=O ZINC000587945594 GI Annotated Anodyne COc1cccc(-c2cc(O)n([C@@H](COc3cc(F)cc(F)c3)N=O)c2O)c1 ZINC000587945703 GI Annotated Anodyne COc1cccc(-c2cc(O)n([C@H](COc3cc(F)cc(F)c3)N=O)c2O)c1 ZINC000587945704 GI Annotated Anodyne O=N[C@H](COc1cc(F)cc(F)c1)n1c(O)cc(-c2ccccc2F)c1O ZINC000587945720 GI Annotated Anodyne O=N[C@@H](COc1cc(F)cc(F)c1)n1c(O)cc(-c2ccccc2F)c1O ZINC000587945721 GI Annotated Anodyne O=C(O)CCc1cc(O)n(-c2ccc(Oc3ccc4c(c3)CCC4)c(F)c2)c1O ZINC000587945746 GI Annotated Anodyne O=N[C@H](COc1cc(F)cc(F)c1)n1c(O)cc(-c2ccc(F)cc2)c1O ZINC000587945775 GI Annotated Anodyne O=N[C@@H](COc1cc(F)cc(F)c1)n1c(O)cc(-c2ccc(F)cc2)c1O ZINC000587945776 GI Annotated Anodyne Cc1ccc(-c2ccc(CCC(=O)O)n2-c2n[nH]c(-c3ccccc3F)n2)s1 ZINC000587945809 GI Annotated Anodyne COC(=O)c1cc(OC)n(CC[C@@H](c2ccc(F)cc2)c2ccco2)c1OC ZINC000587945933 GI Annotated Anodyne COC(=O)c1cc(OC)n(CC[C@H](c2ccc(F)cc2)c2ccco2)c1OC ZINC000587945934 GI Annotated Anodyne COc1ccc(-c2cc(O)n(-c3cnc(Cc4ccc(F)cc4)nc3)c2O)cc1 ZINC000587945961 GI Annotated Anodyne COc1ccc2c(c1)C[C@@H](c1nc3c(F)cnc(Br)c3[nH]1)CC2 ZINC000587946014 GI Annotated Anodyne COc1ccc2c(c1)C[C@H](c1nc3c(F)cnc(Br)c3[nH]1)CC2 ZINC000587946015 GI Annotated Anodyne COc1ccccc1-c1cc(O)n(-c2cnc(Cc3ccc(F)cc3)nc2)c1O ZINC000587946030 GI Annotated Anodyne Oc1ccc(OCCCc2ccccc2)n1-c1nc(N2CCCCC2)ncc1F ZINC000587946132 GI Annotated Anodyne C=CCOc1c(-c2ccccc2)cc(O)n1-c1n[nH]c(-c2ccccc2F)n1 ZINC000587946183 GI Annotated Mild Oc1cc(-c2ccccc2Cl)c(O)n1-c1nc(N2CCCCC2)ncc1F ZINC000587946194 GI Annotated Anodyne CCOc1ccc(OCC)n1-c1nc(-c2ccc(F)cc2NC(C)=O)cs1 ZINC000587946219 GI Annotated Anodyne CC(C)c1cc(OC(C)(C)C)n(-c2nc(N3CCCCC3)ncc2F)c1O ZINC000587946254 GI Annotated Anodyne Oc1cc(-c2ccc(Cl)cc2)c(O)n1-c1nc(N2CCCCC2)ncc1F ZINC000587946260 GI Annotated Anodyne CCOC(=O)c1cc(C)n(-c2nn(COc3ccccc3F)cc2Cl)c1C ZINC000587946301 GI Annotated Anodyne COc1c(Cc2ccccc2)cc(O)n1-c1cc(C)n(Cc2ccccc2F)n1 ZINC000587946305 GI Annotated Anodyne Cc1cc(-n2c(O)ccc2OCCc2ccccc2)nn1Cc1ccccc1F ZINC000587946395 GI Annotated Anodyne COc1ccc(-c2cc(O)n(-c3cc(C)n(Cc4ccccc4F)n3)c2O)cc1 ZINC000587946409 GI Annotated Anodyne Oc1cc(-c2ccc(F)cc2)c(O)n1-c1cnc(Cc2ccc(F)cc2)nc1 ZINC000587946450 GI Annotated Anodyne Oc1cc(-c2ccccc2F)c(O)n1-c1cnc(Cc2ccc(F)cc2)nc1 ZINC000587946502 GI Annotated Anodyne COc1c(Cc2ccccc2)cc(O)n1[C@H](COc1cc(F)cc(F)c1)N=O ZINC000587946576 GI Annotated Anodyne COc1c(Cc2ccccc2)cc(O)n1[C@@H](COc1cc(F)cc(F)c1)N=O ZINC000587946581 GI Annotated Anodyne COc1cccc(-c2cc(O)n(-c3cnc(Cc4ccc(F)cc4)nc3)c2O)c1 ZINC000587946597 GI Annotated Anodyne CC(C)(C)Oc1ccc(O)n1-c1nn(COc2ccccc2F)cc1Cl ZINC000587946664 GI Annotated Anodyne COc1ccccc1-c1cc(O)n([C@@H](COc2cc(F)cc(F)c2)N=O)c1O ZINC000587946684 GI Annotated Anodyne COc1ccccc1-c1cc(O)n([C@H](COc2cc(F)cc(F)c2)N=O)c1O ZINC000587946686 GI Annotated Anodyne Cc1ccccc1-c1cc(O)n(-c2cnc(Cc3ccc(F)cc3)nc2)c1O ZINC000587946726 GI Annotated Anodyne O=C(O)CCc1ccc(-c2ccccc2)n1-c1n[nH]c(-c2ccccc2F)n1 ZINC000587946750 GI Annotated Anodyne Cc1cc2c(n1-c1nc(S)ncc1C(=O)Nc1cccc(F)c1)CCCC2 ZINC000587946785 GI Annotated Anodyne Oc1cc(-c2ccco2)c(O)n1-c1nn(COc2ccccc2F)cc1Cl ZINC000587946821 GI Annotated Anodyne Oc1ccc(OCCCc2ccccc2)n1-c1n[nH]c(-c2ccccc2F)n1 ZINC000587946874 GI Annotated Anodyne Cc1ccc(-c2cc(O)n(-c3cnc(Cc4ccc(F)cc4)nc3)c2O)cc1 ZINC000587947114 GI Annotated Anodyne CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)c1ccccc1-c1nc2cnnc(O)c2[nH]1 ZINC000587948462 GI Annotated Anodyne Brc1c[nH]c2nc(Cc3ccccc3Oc3ccccc3)nc-2n1 ZINC000587948659 GI Annotated Anodyne CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)c1ccccc1-c1nc2c(O)ncnc2[nH]1 ZINC000587948911 GI Annotated Anodyne CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)c1ccccc1-c1nc2c[nH]c(=N)[nH]c-2n1 ZINC000587949292 GI Annotated Anodyne CC(C)[C@@H]1CC[C@@H](C)C[C@H]1OC(=O)c1ccccc1-c1nc2c(N)ncnc2[nH]1 ZINC000587949305 GI Annotated Anodyne O=S(=O)(O)c1ccc2nc(Cc3ccccc3Oc3ccccc3)[nH]c2c1 ZINC000587949580 GI Annotated Anodyne NS(=O)(=O)c1ccc2nc(/C=C/c3ccccc3Oc3ccccc3)[nH]c2c1 ZINC000587949581 GI Annotated Anodyne NS(=O)(=O)c1ccc2nc(/C=C\c3ccccc3Oc3ccccc3)[nH]c2c1 ZINC000587949582 GI Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4cc(C(F)(F)F)cnc4[nH]1)(C3)C2 ZINC000587949765 GI Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4c(Cl)cnc(Cl)c4[nH]1)(C3)C2 ZINC000587949796 GI Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4c(Cl)c(Cl)cnc4[nH]1)(C3)C2 ZINC000587949865 GI Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4cc(-n5cccn5)c(F)cc4[nH]1)(C3)C2 ZINC000587949874 GI Annotated Anodyne CO[C@@H](C)COC1CCC(c2nc3ccc(Br)c(O)c3[nH]2)CC1 ZINC000587950223 GI Annotated Anodyne CO[C@H](C)COC1CCC(c2nc3ccc(Br)c(O)c3[nH]2)CC1 ZINC000587950225 GI Annotated Anodyne CC[C@H](O[C@H]1CCC[C@H](C)C1)c1nc2ccc(C3=C(C)CC(=O)NN3)cc2[nH]1 ZINC000587950336 GI Annotated Anodyne CC[C@H](O[C@H]1CCC[C@@H](C)C1)c1nc2ccc(C3=C(C)CC(=O)NN3)cc2[nH]1 ZINC000587950337 GI Annotated Anodyne CC[C@H](O[C@@H]1CCC[C@H](C)C1)c1nc2ccc(C3=C(C)CC(=O)NN3)cc2[nH]1 ZINC000587950338 GI Annotated Anodyne CC[C@H](O[C@@H]1CCC[C@@H](C)C1)c1nc2ccc(C3=C(C)CC(=O)NN3)cc2[nH]1 ZINC000587950339 GI Annotated Anodyne FC(F)(F)c1nc(Cl)[nH]c2nc(COC34CC5CC(CC(C5)C3)C4)nc1-2 ZINC000587950371 GI Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4cc([N+](=O)[O-])c(Cl)cc4[nH]1)(C3)C2 ZINC000587950494 GI Annotated Bother NS(=O)(=O)c1cccc2nc(/C=C/c3ccccc3Oc3ccccc3)[nH]c12 ZINC000587950527 GI Annotated Anodyne NS(=O)(=O)c1cccc2nc(/C=C\c3ccccc3Oc3ccccc3)[nH]c12 ZINC000587950529 GI Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4ccc(Br)cc4[nH]1)(C3)C2 ZINC000587950591 GI Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4cc(C(F)(F)F)ncc4[nH]1)(C3)C2 ZINC000587950866 GI Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4c(F)c(F)c(F)c(F)c4[nH]1)(C3)C2 ZINC000587950940 GI Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4cc(Cl)c(Cl)nc4[nH]1)(C3)C2 ZINC000587950988 GI Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4cc(Cl)nc(Cl)c4[nH]1)(C3)C2 ZINC000587951026 GI Annotated Anodyne CC(=O)OC12C[C@H]3C[C@@H](C1)CC(c1nc4cccc(Br)c4[nH]1)(C3)C2 ZINC000587951314 GI Annotated Anodyne Fc1cnc(Br)c2[nH]c(COC34CC5CC(CC(C5)C3)C4)nc12 ZINC000587951517 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc(-c3ccc(OC4CCC4)cc3)nc-2[nH]1 ZINC000587951791 GI Annotated Anodyne CO[C@@H](C)COC1CCC(c2nc3c(C)c(Br)cnc3[nH]2)CC1 ZINC000587951830 GI Annotated Anodyne CO[C@H](C)COC1CCC(c2nc3c(C)c(Br)cnc3[nH]2)CC1 ZINC000587951832 GI Annotated Anodyne CO[C@@H](C)COC1CCC(c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)CC1 ZINC000587951841 GI Annotated Anodyne CO[C@H](C)COC1CCC(c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)CC1 ZINC000587951844 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(C3CCC(OC[C@H](C)OC)CC3)nc2c1 ZINC000587952223 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(C3CCC(OC[C@@H](C)OC)CC3)nc2c1 ZINC000587952224 GI Annotated Anodyne CO[C@H](C)COC1CCC(c2nc3ccc(-c4ccc(N)c(N)c4)cc3[nH]2)CC1 ZINC000587952602 GI Annotated Anodyne CO[C@@H](C)COC1CCC(c2nc3ccc(-c4ccc(N)c(N)c4)cc3[nH]2)CC1 ZINC000587952603 GI Annotated Anodyne C[C@H](Oc1ccc2ccccc2c1)c1nc2ccc(S(=O)(=O)N(C)C)cc2[nH]1 ZINC000587952872 GI Annotated Anodyne C[C@H](Oc1ccc2ccccc2c1)c1nc2cccc(S(=O)(=O)N(C)C)c2[nH]1 ZINC000587952935 GI Annotated Anodyne CO[C@H](C)COC1CCC(c2nc3cc(C#N)cc(Br)c3[nH]2)CC1 ZINC000587953056 GI Annotated Mild CO[C@@H](C)COC1CCC(c2nc3cc(C#N)cc(Br)c3[nH]2)CC1 ZINC000587953057 GI Annotated Mild CO[C@@H](C)COC1CCC(c2nc3cc(Br)c(C)nc3[nH]2)CC1 ZINC000587953093 GI Annotated Anodyne CO[C@H](C)COC1CCC(c2nc3cc(Br)c(C)nc3[nH]2)CC1 ZINC000587953094 GI Annotated Anodyne Brc1ccc(Br)c2[nH]c(C#Cc3ccccc3)nc12 ZINC000587953255 GI Annotated Mild Brc1cc2nc(C#Cc3ccccc3)[nH]c2cc1Br ZINC000587954022 GI Annotated Mild CC(C)(CC(=O)O)Cc1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587954836 GI Annotated Anodyne CC(C)COc1cc2nc(CC(C)(C)CC(=O)O)[nH]c2cc1Br ZINC000587954838 GI Annotated Anodyne CC(C)(CC(=O)O)Cc1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587954861 GI Annotated Anodyne CC(C)(CC(=O)O)Cc1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000587955213 GI Annotated Anodyne CCc1ccc(C(=O)CCc2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)cc1 ZINC000587955505 GI Annotated Anodyne O=S(=O)(O)c1ccc2nc([C@H](Cc3ccccc3)c3ccccc3)[nH]c2c1 ZINC000587955533 GI Annotated Anodyne O=S(=O)(O)c1ccc2nc([C@@H](Cc3ccccc3)c3ccccc3)[nH]c2c1 ZINC000587955534 GI Annotated Anodyne CC(C)(CC(=O)O)Cc1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587955538 GI Annotated Anodyne CC(C)(CC(=O)O)Cc1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000587955547 GI Annotated Anodyne C=CC(C)(C)c1nc2ccc(S(=O)(=O)Nc3ccc(Cl)cc3)cc2[nH]1 ZINC000587955561 GI Annotated Mild CC(C)(CC(=O)O)Cc1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000587955773 GI Annotated Anodyne CC(C)(CC(=O)O)Cc1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587955791 GI Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc(CC(C)(C)CC(=O)O)[nH]c3c2)cc1 ZINC000587955830 GI Annotated Anodyne Cc1ccccc1C(C)(C)c1nc2cc(I)cnc2[nH]1 ZINC000587955916 GI Annotated Anodyne CC(C)(CC(=O)O)Cc1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587956106 GI Annotated Anodyne COC(=O)c1cc2nc(CC(C)(C)CC(=O)O)[nH]c2c(F)c1Nc1ccccc1 ZINC000587956151 GI Annotated Anodyne Brc1c[nH]c2nc([C@@H](Cc3ccccc3)c3ccccc3)nc-2n1 ZINC000587956243 GI Annotated Anodyne Brc1c[nH]c2nc([C@H](Cc3ccccc3)c3ccccc3)nc-2n1 ZINC000587956244 GI Annotated Anodyne CC(C)(CC(=O)O)Cc1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587956359 GI Annotated Anodyne CC#CCCCCCCCc1nc2cc(I)cnc2[nH]1 ZINC000587956939 GI Annotated Mild O=C(O)CCCCCCCCCCCCc1nc2ccc(-n3cnnn3)cc2[nH]1 ZINC000587957107 GI Annotated Anodyne CC#CCCCCCCCc1nc2ccc(S(=O)(=O)N(CC)CC)cc2[nH]1 ZINC000587957263 GI Annotated Mild CCc1ccc(C(=O)CCc2nc3c(F)cnc(Br)c3[nH]2)cc1 ZINC000587957371 GI Annotated Anodyne N=c1[nH]c2nc(CCCCCCCCCCCCC(=O)O)nc-2c(Cl)[nH]1 ZINC000587957373 GI Annotated Anodyne O=C(O)CCCCCCCCCCCCc1nc2c(O)nc(S)nc2[nH]1 ZINC000587957729 GI Annotated Anodyne N#Cc1nc2nc(CCCCCCCCCCCCC(=O)O)[nH]c2nc1C#N ZINC000587957792 GI Annotated Mild Cc1ccc(C)c(Cc2nc3c(I)cnc(Cl)c3[nH]2)c1 ZINC000587958478 GI Annotated Anodyne CC[C@@]1(Cc2nc3cc(Br)cnc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587959108 GI Annotated Anodyne CC[C@]1(Cc2nc3cc(Br)cnc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587959109 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(C[C@@H]3C[C@H]3c3ccccc3)nc2c1 ZINC000587959471 GI Annotated Anodyne CC[C@@]1(Cc2nc3ccc(OCCN(C)C)cc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587959536 GI Annotated Anodyne CC[C@]1(Cc2nc3ccc(OCCN(C)C)cc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587959538 GI Annotated Anodyne C[C@H](CCC(=O)O)Cc1nc2cc(Br)cc(C(F)(F)F)c2[nH]1 ZINC000587959852 GI Annotated Anodyne O=S(=O)(c1ccc2nc(C[C@@H]3C[C@H]3c3ccccc3)[nH]c2c1)C(F)(F)F ZINC000587959865 GI Annotated Anodyne CC[C@@]1(Cc2nc3c(Br)ccnc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587960044 GI Annotated Anodyne CC[C@]1(Cc2nc3c(Br)ccnc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587960047 GI Annotated Anodyne C[C@H](CCc1nc2c(Br)ccc(Br)c2[nH]1)CC(=O)O ZINC000587960090 GI Annotated Anodyne CC[C@]1(Cc2nc3ccc(C(=O)N(C)C)cc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587960300 GI Annotated Anodyne CC[C@@]1(Cc2nc3ccc(C(=O)N(C)C)cc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587960301 GI Annotated Anodyne O=C(O)Cc1ccc(Cc2nc3cc(OC(F)(F)F)c(Cl)cc3[nH]2)cc1 ZINC000587960365 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(C[C@]3(CC)CC(=O)c4ccccc4C3)[nH]c2c1 ZINC000587960584 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(C[C@@]3(CC)CC(=O)c4ccccc4C3)[nH]c2c1 ZINC000587960588 GI Annotated Anodyne C[C@H](CCC(=O)O)Cc1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587960599 GI Annotated Anodyne C[C@H](CCC(=O)O)Cc1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587960637 GI Annotated Anodyne CC[C@]1(Cc2nc3cc(OC)c(C(=O)OC)cc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587960678 GI Annotated Anodyne C[C@H](CCc1nc2cc(Br)c(Br)cc2[nH]1)CC(=O)O ZINC000587960679 GI Annotated Anodyne CC[C@@]1(Cc2nc3cc(OC)c(C(=O)OC)cc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587960681 GI Annotated Anodyne CC(C)COc1cc2nc(C[C@H](C)CCC(=O)O)[nH]c2cc1Br ZINC000587960715 GI Annotated Anodyne C[C@H]1C(=O)CC[C@@H]1Cc1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000587960778 GI Annotated Anodyne C[C@@H]1C(=O)CC[C@@H]1Cc1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000587960779 GI Annotated Anodyne C[C@H]1C(=O)CC[C@H]1Cc1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000587960780 GI Annotated Anodyne C[C@@H]1C(=O)CC[C@H]1Cc1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000587960781 GI Annotated Anodyne O=C(O)Cc1ccc(Cc2nc3cc(Br)cc(Cl)c3[nH]2)cc1 ZINC000587960860 GI Annotated Anodyne CC[C@@]1(Cc2nc3cncc(Br)c3[nH]2)CC(=O)c2ccccc2C1 ZINC000587960969 GI Annotated Anodyne CC[C@]1(Cc2nc3cncc(Br)c3[nH]2)CC(=O)c2ccccc2C1 ZINC000587960971 GI Annotated Anodyne CC[C@@]1(Cc2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587960987 GI Annotated Bother CC[C@]1(Cc2nc3cc([N+](=O)[O-])c([N+](=O)[O-])cc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587960992 GI Annotated Bother CCCCNS(=O)(=O)c1ccc2nc(CC3CCC(C)(C)CC3)[nH]c2c1 ZINC000587961252 GI Annotated Anodyne C[C@H]1C(=O)CC[C@@H]1Cc1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587961392 GI Annotated Anodyne C[C@@H]1C(=O)CC[C@@H]1Cc1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587961396 GI Annotated Anodyne C[C@H]1C(=O)CC[C@H]1Cc1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587961397 GI Annotated Anodyne C[C@@H]1C(=O)CC[C@H]1Cc1nc2cc(Br)c(Br)cc2[nH]1 ZINC000587961398 GI Annotated Anodyne O=C(O)Cc1ccc(Cc2nc3cc(Cl)cc(Br)c3[nH]2)cc1 ZINC000587961472 GI Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc(CC3CCC(C)(C)CC3)[nH]c2c1 ZINC000587961489 GI Annotated Anodyne CC[C@@]1(Cc2nc3ccc(Br)nc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587961577 GI Annotated Anodyne CC[C@]1(Cc2nc3ccc(Br)nc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587961580 GI Annotated Anodyne CC[C@@]1(Cc2nc3cc(Br)ncc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587961718 GI Annotated Anodyne CC[C@]1(Cc2nc3cc(Br)ncc3[nH]2)CC(=O)c2ccccc2C1 ZINC000587961719 GI Annotated Anodyne C[C@H](CCc1nc2cc(Br)cc(C(F)(F)F)c2[nH]1)CC(=O)O ZINC000587961768 GI Annotated Anodyne C[C@H](CCc1nc2cc(C(F)(F)F)c(Br)cc2[nH]1)CC(=O)O ZINC000587961786 GI Annotated Anodyne C[C@H](CCC(=O)O)Cc1nc2cc(C(F)(F)F)c(Br)cc2[nH]1 ZINC000587961812 GI Annotated Anodyne CC(C)COc1cc2nc(CC[C@@H](C)CC(=O)O)[nH]c2cc1Br ZINC000587961872 GI Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc(C[C@H](C)CCC(=O)O)[nH]c3c2)cc1 ZINC000587962128 GI Annotated Anodyne CC[C@]1(Cc2nc3cc4c(cc3[nH]2)OCCCO4)CC(=O)c2ccccc2C1 ZINC000587962138 GI Annotated Anodyne CC[C@@]1(Cc2nc3cc4c(cc3[nH]2)OCCCO4)CC(=O)c2ccccc2C1 ZINC000587962150 GI Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc(CC[C@@H](C)CC(=O)O)[nH]c3c2)cc1 ZINC000587962221 GI Annotated Anodyne CC[C@@]1(Cc2nc3ccnc(Br)c3[nH]2)CC(=O)c2ccccc2C1 ZINC000587962224 GI Annotated Anodyne CC[C@]1(Cc2nc3ccnc(Br)c3[nH]2)CC(=O)c2ccccc2C1 ZINC000587962226 GI Annotated Anodyne COC(=O)c1cc2nc(CC[C@@H](C)CC(=O)O)[nH]c2c(F)c1Nc1ccccc1 ZINC000587962298 GI Annotated Anodyne C[C@H](CCc1nc2ccc(Br)c(C(F)(F)F)c2[nH]1)CC(=O)O ZINC000587962344 GI Annotated Anodyne C[C@H](CCc1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1)CC(=O)O ZINC000587962620 GI Annotated Anodyne CC[C@]1(Cc2nc3ccc(C(=O)OC)c(OC)c3[nH]2)CC(=O)c2ccccc2C1 ZINC000587962663 GI Annotated Anodyne CC[C@@]1(Cc2nc3ccc(C(=O)OC)c(OC)c3[nH]2)CC(=O)c2ccccc2C1 ZINC000587962665 GI Annotated Anodyne CN(C)S(=O)(=O)c1cccc2nc(Cc3ccccc3-c3ccccc3)[nH]c12 ZINC000587962672 GI Annotated Anodyne C[C@H]1C(=O)CC[C@@H]1Cc1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000587962882 GI Annotated Anodyne C[C@@H]1C(=O)CC[C@@H]1Cc1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000587962884 GI Annotated Anodyne C[C@H]1C(=O)CC[C@H]1Cc1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000587962885 GI Annotated Anodyne C[C@@H]1C(=O)CC[C@H]1Cc1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000587962887 GI Annotated Anodyne C[C@H](CCc1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1)CC(=O)O ZINC000587963007 GI Annotated Anodyne C[C@H](CCC(=O)O)Cc1nc2ccc(Br)c(C(F)(F)F)c2[nH]1 ZINC000587963264 GI Annotated Anodyne C[C@H](CCC(=O)O)Cc1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1 ZINC000587963288 GI Annotated Anodyne C[C@H](CCc1nc2cc(C(F)(F)F)cc(Br)c2[nH]1)CC(=O)O ZINC000587963313 GI Annotated Anodyne C[C@H](CCc1nc2cc(OC(F)(F)F)cc(Br)c2[nH]1)CC(=O)O ZINC000587963394 GI Annotated Anodyne C[C@H](CCC(=O)O)Cc1nc2cc(Br)cc(OC(F)(F)F)c2[nH]1 ZINC000587963420 GI Annotated Anodyne COC(=O)c1cc2nc(C[C@H](C)CCC(=O)O)[nH]c2c(F)c1Nc1ccccc1 ZINC000587963432 GI Annotated Anodyne C[C@H](CCC(=O)O)Cc1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000587963452 GI Annotated Anodyne C[C@H](CCC(=O)O)Cc1nc2cc(C(F)(F)F)cc(Br)c2[nH]1 ZINC000587963470 GI Annotated Anodyne C[C@H]1C(=O)CC[C@@H]1Cc1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587963614 GI Annotated Anodyne C[C@@H]1C(=O)CC[C@@H]1Cc1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587963615 GI Annotated Anodyne C[C@H]1C(=O)CC[C@H]1Cc1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587963616 GI Annotated Anodyne C[C@@H]1C(=O)CC[C@H]1Cc1nc2c(Br)ccc(Br)c2[nH]1 ZINC000587963617 GI Annotated Anodyne C[C@H]1C(=O)CC[C@@H]1Cc1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000587963692 GI Annotated Anodyne C[C@@H]1C(=O)CC[C@@H]1Cc1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000587963693 GI Annotated Anodyne C[C@H]1C(=O)CC[C@H]1Cc1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000587963694 GI Annotated Anodyne C[C@@H]1C(=O)CC[C@H]1Cc1nc2cc(OC(F)(F)F)c(Br)cc2[nH]1 ZINC000587963695 GI Annotated Anodyne COC(=O)c1cc2nc(C[C@H]3CCC(=O)[C@@H]3C)[nH]c2c(F)c1Nc1ccccc1 ZINC000587963832 GI Annotated Anodyne COC(=O)c1cc2nc(C[C@@H]3CCC(=O)[C@@H]3C)[nH]c2c(F)c1Nc1ccccc1 ZINC000587963833 GI Annotated Anodyne COC(=O)c1cc2nc(C[C@H]3CCC(=O)[C@H]3C)[nH]c2c(F)c1Nc1ccccc1 ZINC000587963834 GI Annotated Anodyne COC(=O)c1cc2nc(C[C@@H]3CCC(=O)[C@H]3C)[nH]c2c(F)c1Nc1ccccc1 ZINC000587963835 GI Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc(C[C@H]4CCC(=O)[C@H]4C)[nH]c3c2)cc1 ZINC000587964023 GI Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc(C[C@@H]4CCC(=O)[C@@H]4C)[nH]c3c2)cc1 ZINC000587964024 GI Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc(C[C@H]4CCC(=O)[C@@H]4C)[nH]c3c2)cc1 ZINC000587964025 GI Annotated Anodyne COC(=O)c1ccc(Oc2ccc3nc(C[C@@H]4CCC(=O)[C@H]4C)[nH]c3c2)cc1 ZINC000587964026 GI Annotated Anodyne Cc1ccc(C(=O)/C=C\c2nc3cccc(I)c3[nH]2)cc1 ZINC000587965154 GI Annotated Mild Cc1ccc(C(=O)/C=C/c2nc3cccc(I)c3[nH]2)cc1 ZINC000587965158 GI Annotated Mild CC(C)CCOc1cc2[nH]c(/C=C/C=C/C(=O)O)nc2cc1Br ZINC000587965555 GI Annotated Anodyne CC(C)CCOc1cc2[nH]c(/C=C/C=C\C(=O)O)nc2cc1Br ZINC000587965556 GI Annotated Anodyne Cc1ccc(C(=O)/C=C/c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)cc1 ZINC000587965569 GI Annotated Mild Cc1ccc(C(=O)/C=C\c2nc3ccc(Br)c([N+](=O)[O-])c3[nH]2)cc1 ZINC000587965570 GI Annotated Mild Cc1ccc(C(=O)/C=C/c2nc3ccc(I)cc3[nH]2)cc1 ZINC000587965577 GI Annotated Mild Cc1ccc(C(=O)/C=C\c2nc3ccc(I)cc3[nH]2)cc1 ZINC000587965578 GI Annotated Mild Cc1ccc(C(=O)/C=C\c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)cc1 ZINC000587965666 GI Annotated Mild Cc1ccc(C(=O)/C=C/c2nc3cc(Br)cc([N+](=O)[O-])c3[nH]2)cc1 ZINC000587965668 GI Annotated Mild CCCCNS(=O)(=O)c1ccc2nc(C=C3C4CC5CC(C4)CC3C5)[nH]c2c1 ZINC000587967067 GI Annotated Anodyne Oc1nc(NCc2ccccc2)c2nc(C=C3C4CC5CC(C4)CC3C5)nc-2[nH]1 ZINC000587967250 GI Annotated Anodyne COc1ccc(NS(=O)(=O)c2ccc3nc([C@@H]4C[C@H]5C=C[C@@H]4C5)[nH]c3c2)cc1 ZINC000587967360 GI Annotated Anodyne COC(=O)c1cc(Br)c2[nH]c(/C=C/C(=O)c3ccc(C)cc3)nc2c1 ZINC000587967446 GI Annotated Mild COC(=O)c1cc(Br)c2[nH]c(/C=C\C(=O)c3ccc(C)cc3)nc2c1 ZINC000587967451 GI Annotated Mild Ic1cnc2[nH]c(C=C3C4CC5CC(C4)CC3C5)nc2c1 ZINC000587967970 GI Annotated Anodyne CCN(CC)S(=O)(=O)c1ccc2nc(C=C3C4CC5CC(C4)CC3C5)[nH]c2c1 ZINC000587967993 GI Annotated Anodyne O=C1[C@H]2C[C@H]3C[C@@H]1C[C@@](c1nc4c(Br)cnc(Cl)c4[nH]1)(C3)C2 ZINC000587968975 GI Annotated Anodyne O=C1[C@H]2C[C@H]3C[C@@H]1C[C@@](c1nc4c(Cl)c(Br)cnc4[nH]1)(C3)C2 ZINC000587969618 GI Annotated Anodyne O=C1[C@H]2C[C@H]3C[C@@H]1C[C@@](c1nc4cc(Br)c(F)c(F)c4[nH]1)(C3)C2 ZINC000587969700 GI Annotated Anodyne COc1ccc(NS(=O)(=O)c2ccc3nc([C@@H]4CC=CC[C@H]4C)[nH]c3c2)cc1 ZINC000587969851 GI Annotated Anodyne O=C1CCC(c2ccccc2)(c2nc3ccc(Br)c(O)c3[nH]2)CC1 ZINC000587969941 GI Annotated Anodyne O=C1[C@H]2C[C@H]3C[C@@H]1C[C@@](c1nc4cc(C(F)(F)C(F)(F)F)ncc4[nH]1)(C3)C2 ZINC000587970093 GI Annotated Anodyne O=C1CCC(c2ccccc2)(c2nc3[nH]c(Cl)nc(C(F)(F)F)c-3n2)CC1 ZINC000587970216 GI Annotated Anodyne Cc1c(Br)cnc2[nH]c(C3(c4ccccc4)CCC(=O)CC3)nc12 ZINC000587970286 GI Annotated Anodyne CCOC(=O)Cc1ccc2nc(C3(c4ccccc4)CCC(=O)CC3)[nH]c2c1 ZINC000587970317 GI Annotated Anodyne Cc1nc2[nH]c(C3(c4ccccc4)CCC(=O)CC3)nc2cc1Br ZINC000587970896 GI Annotated Anodyne COC(=O)c1cc(Cl)c2[nH]c(C3(c4ccccc4)CCC(=O)CC3)nc2c1 ZINC000587971020 GI Annotated Anodyne O=C1CCC(c2ccccc2)(c2nc3c(F)cnc(Br)c3[nH]2)CC1 ZINC000587971109 GI Annotated Anodyne COCc1c(F)c(F)c(COC(=O)[C@@H]2[C@@H](/C=C(/C)C#N)C2(C)C)c(F)c1F ZINC000059042856 GI Annotated Reactive in-vitro O=C(c1ccc(-c2ccc3c(c2)CCN(CCN2CCCC2)C3=O)cc1)C1CC1 ZINC000059112270 GI Annotated Anodyne O=C1c2ccc(-c3ccc(C(F)(F)F)cc3)cc2CCN1CCN1CCCC1 ZINC000059113586 GI Annotated Anodyne Cc1c(COc2cccc(OCC3CCOCC3)c2)[nH]c2ccccc2c1=O ZINC000059127726 GI Annotated Anodyne CC1(C)C=Cc2c(cc3c(oc(=O)c4c5cc6c(cc5oc34)OCO6)c2O)O1 ZINC000059204747 GI Annotated Bother CC1(C)CCc2c(cc3c(oc(=O)c4c5cc6c(cc5oc34)OCO6)c2O)O1 ZINC000059204756 GI Annotated Bother COC(=O)c1oc2cccc(Cl)c2c1NC(=O)CCSc1ccccn1 ZINC000059255775 GI Annotated Anodyne C[C@@H]1CCCN1[C@@H]1CCN(c2ccc(NC(=O)C3CC3)c(C(F)(F)F)c2)C1 ZINC000059261980 GI Annotated Anodyne C[C@H]1CCCN1[C@@H]1CCN(c2ccc(NC(=O)C3CC3)c(C(F)(F)F)c2)C1 ZINC000059261983 GI Annotated Anodyne O=C(c1ccc(Cl)cc1Cl)N1CCN(c2ccccc2Cl)C(=O)C1 ZINC000059278837 GI Annotated Anodyne CCOC(=O)C1(C[C@@H]2CCCCO2)CCN(Cc2nc(C(C)C)cs2)CC1 ZINC000059322776 GI Annotated Anodyne CCOC(=O)C1(C[C@H]2CCCCO2)CCN(Cc2nc(C(C)C)cs2)CC1 ZINC000059322777 GI Annotated Anodyne CC(C)=CC[C@@](C)(OC(=O)CC(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000059586755 GI Annotated Mild in-vitro biogenic CCOc1ccc2c(c1OCC)-c1c(O)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3 ZINC000059586801 GI Annotated Bother in-vitro biogenic CCOc1cc2c(cc1O)C[C@H]1c3c(cc(OC)c(OCC)c3-2)CC[N+]1(C)C ZINC000059587176 GI Annotated Bother in-vitro biogenic CC(C)=CC[C@@](C)(OC(=O)C=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000059587299 GI Annotated Mild in-vitro biogenic CC(=O)O[C@@H]1C[C@@H](C)[C@]2(CC[C@@]3(COC(=O)C3)O2)[C@@]2(C)CCCC(C)(C)[C@H]12 ZINC000059587882 GI Annotated Anodyne in-vitro biogenic CCOc1ccc2c(c1O)-c1c(OCC)c(OC)cc3c1[C@H](C2)[N+](C)(C)CC3 ZINC000059587941 GI Annotated Bother in-vitro biogenic CC[C@@H](C)C(=O)O[C@](C)(CC=C(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000059588274 GI Annotated Mild in-vitro biogenic CC/C=C(\C)Cc1c(O)ccc([C@H]2COc3cc(O)cc(O)c3C2=O)c1OCC ZINC000059588993 GI Annotated Anodyne in-vitro biogenic COc1cc2c(c3oc(=O)c(-c4ccc5c(c4)OCO5)c(O)c13)C=CC(C)(C)O2 ZINC000059778212 GI Annotated Anodyne CCOC(=O)[C@H]1CCCN([C@@H](c2ccccn2)c2c(C)[nH]c3ccccc23)C1 ZINC000059827094 GI Annotated Anodyne COc1cc([C@H]2SCC(=O)N2c2cccc(Cl)c2)cc(OC)c1OC ZINC000006003732 GI Annotated Anodyne COc1cc([C@H]2SCC(=O)N2c2ccccc2Cl)cc(OC)c1OC ZINC000006003738 GI Annotated Anodyne CN1C(=O)[C@](C)(Cc2ccc(F)cc2)N(C(=O)OC(C)(C)C)[C@@H]1C(C)(C)C ZINC000006004265 GI Annotated Anodyne N#Cc1ccc([C@H]2NN=C[C@]23C(=O)c2ccccc2O[C@@H]3c2ccccc2)cc1 ZINC000006004893 GI Annotated Mild N#Cc1ccc([C@H]2NN=C[C@]23C(=O)c2ccccc2O[C@H]3c2ccccc2)cc1 ZINC000006004895 GI Annotated Mild N#Cc1ccc([C@H]2NN=C[C@@]23C(=O)c2ccccc2O[C@H]3c2ccccc2)cc1 ZINC000006004896 GI Annotated Mild C/C=C(/C)C(=O)O[C@H]1C[C@@H](C)[C@H]2CC(=O)C(C)=C2C[C@@H]1C(C)(C)OC(C)=O ZINC000006006486 GI Annotated Mild O=c1c2c3c(sc2nc2n1N=C(c1ccc(Cl)cc1)CS2)CCCC3 ZINC000006006823 GI Annotated Anodyne COc1cc(NS(C)(=O)=O)ccc1Nc1cc(C)nc2ccc3[nH]ccc3c12 ZINC000006009957 GI Annotated Anodyne CCO[C@@H]1OC(=O)c2cc3ccc4c(c3c(-c3ccc5c(c3)OCO5)c21)OCO4 ZINC000006018153 GI Annotated Anodyne COc1cccc2c(-c3ccc4c(c3O)[C@@H](C)N[C@H](C)C4)c(CO)cc(OC)c12 ZINC000006031635 GI Annotated Clean C=CC[C@H](N=C(SC)SC)C(=O)N1C(=O)N(C)[C@@H](C)[C@H]1c1ccccc1 ZINC000006040263 GI Annotated Mild CCOC(=O)CC[C@]1(C(=O)O[C@@H]2C[C@H](C)CC[C@H]2C(C)C)CCCCC1=O ZINC000006040309 GI Annotated Anodyne CCOC(=O)CC[C@@]1(C(=O)O[C@@H]2C[C@H](C)CC[C@H]2C(C)C)CCCCC1=O ZINC000006040310 GI Annotated Anodyne O=C1/C(=C2\SCC(=O)N2c2ccccc2)SC(=S)N1c1ccccc1 ZINC000006041607 GI Annotated Clean CSc1ccccc1NC(=O)CSc1nnc(C)n1-c1ccc(C)cc1 ZINC000006056718 GI Annotated Anodyne Cc1cc(O)cc(O)c1C(=O)O[C@@H]1C[C@]2(C)[C@H]3CC(C)(C)C[C@H]3C=C(C=O)[C@H]12 ZINC000006069946 GI Annotated Reactive in-man CCOC(=O)CCN1C(=O)/C(=C\c2ccc(Cl)cc2Cl)SC1=S ZINC000006076255 GI Annotated Clean CC(C)n1c(O)c(/N=N\C(=O)Cn2ccc(C(F)(F)F)n2)c2ccccc21 ZINC000006171676 GI Annotated Clean CCOC(=O)[C@H]1C(=O)C=C(c2ccccc2)C[C@H]1c1ccc(OC)c(OC)c1 ZINC000006206441 GI Annotated Mild CCOC(=O)[C@H]1C(=O)C=C(c2ccccc2)C[C@@H]1c1ccc(OC)c(OC)c1 ZINC000006206463 GI Annotated Mild CCOC(=O)[C@@H]1C(=O)C=C(c2ccccc2)C[C@H]1c1ccc(OC)c(OC)c1 ZINC000006206549 GI Annotated Mild CCOC(=O)[C@@H]1C(=O)C=C(c2ccccc2)C[C@@H]1c1ccc(OC)c(OC)c1 ZINC000006206571 GI Annotated Mild CCc1cc2c(cc1CCCC(=O)O)C[C@]1(Cc3ccc(C(=O)O)cc3C1)C2 ZINC000006371688 GI Annotated Anodyne CCCNc1[nH]c(C(=O)c2ccccc2)c(N)c1C(=S)Nc1ccccc1 ZINC000006380544 GI Annotated Anodyne CCN1c2ncc(COc3ccccc3)cc2C(=O)N(C)c2ccc(Cl)nc21 ZINC000006385141 GI Annotated Anodyne CCN1c2ncc(NCc3ccccc3)cc2C(=O)N(C)c2ccc(Cl)nc21 ZINC000006385151 GI Annotated Anodyne COC(=O)c1c2c(cc3c1C[C@]1(Cc4cc5c(c(C=O)c4C1)CCC5)C3)CCC2 ZINC000006385160 GI Annotated Anodyne COC(=O)c1ccc2c(c1)C[C@@]1(C2)Cc2cc3c(c(C(=O)OC)c2C1)CCCC3 ZINC000006385212 GI Annotated Anodyne CCONC(=N)c1ccc(-c2ccc(-c3ccc(C(=N)NOCC)cc3)o2)cc1 ZINC000006385478 GI Annotated Anodyne CCOC(=O)c1sc2cc(-c3ccc(Br)cc3)oc(=O)c2c1N ZINC000006403611 GI Annotated Anodyne CC[C@H](C)CNCCCNCCCCCCCNCCCNC[C@H](C)CC ZINC000006411730 GI Annotated Anodyne CC[C@H](C)/C=C(C)\C=C\C1=CC2=C(Cl)C(=O)[C@@](C)(OC(C)=O)C(=O)C2=CO1 ZINC000006412253 GI Annotated Mild CCc1c(Sc2cc(C)cc(C)c2)n(C/C=C/c2ccco2)c(=O)[nH]c1=O ZINC000006424910 GI Annotated Anodyne C[C@]12C=CC(=O)C=C1CC[C@@H]1[C@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)C[C@H]3O[C@@]312 ZINC000006482656 GI Annotated Anodyne C[C@]12C=CC(=O)C=C1CC[C@@H]1[C@@H]2CC[C@]2(C)[C@@H](c3ccc(=O)oc3)C[C@H]3O[C@@]312 ZINC000006482805 GI Annotated Anodyne COc1c(Cl)ccc2c1[C@@](C#Cc1ccccc1)(C(F)(F)F)NC(=O)N2 ZINC000006483447 GI Annotated Mild COc1cc2c(cc1OCc1ccccc1)NC(=S)[C@@H]1CCCN1C2=S ZINC000006483796 GI Annotated Anodyne COc1cccc([C@@H]2SC(=N)Nc3c2c(C)nn3C(=O)Cc2ccccc2)c1 ZINC000006483910 GI Annotated Anodyne Cc1nn(C(=O)c2ccc(Cl)cc2)c2c1[C@H](c1ccc(O)cc1)SC(=N)N2 ZINC000006483930 GI Annotated Anodyne Cc1nn(C(=O)c2ccc(Cl)cc2)c2c1[C@H](c1ccccc1O)SC(=N)N2 ZINC000006483933 GI Annotated Anodyne Cc1nn(C(=O)c2ccncc2)c2c1[C@H](c1ccc(Cl)cc1)SC(=N)N2 ZINC000006483965 GI Annotated Anodyne COc1ccc(C2=C3SC=c4ccccc4=C3ON=C2c2ccccc2)cc1 ZINC000006484237 GI Annotated Anodyne COc1ccc(C2=NOC3=c4ccccc4=CSC3=C2c2ccccc2)cc1 ZINC000006484262 GI Annotated Anodyne Cc1ccc([C@@H]2SC(=N)Nc3c2c(C)nn3C(=O)c2ccccc2O)cc1 ZINC000006487843 GI Annotated Anodyne COc1nc2c(c(=O)n1C)N=C(c1ccc(Cl)cc1)C[C@@H](c1ccccc1)N2 ZINC000006494313 GI Annotated Anodyne CC(=N)[C@@H](C#N)C(=O)CSc1nnc(SCc2ccc(Cl)cc2)s1 ZINC000006498499 GI Annotated Mild COc1ccc([C@H]2CC(=O)[C@H]3C(=Nc4ncnn4[C@@H]3c3ccccc3C)C2)cc1 ZINC000006498675 GI Annotated Anodyne COc1ccc([C@@H]2CC(=O)[C@@H]3C(=Nc4ncnn4[C@@H]3c3ccccc3C)C2)cc1 ZINC000006498677 GI Annotated Anodyne C#C[C@@H]1C[C@@H]2[C@@H]3CCC4=C[C@@H](OC(C)=O)CC[C@@H]4[C@@H]3CC[C@]2(C)[C@H]1OC(C)=O ZINC000061389402 GI Annotated Anodyne in-man C#C[C@@H]1C[C@@H]2[C@@H]3CCC4=C[C@@H](OC(C)=O)CC[C@H]4[C@@H]3CC[C@]2(C)[C@H]1OC(C)=O ZINC000061389404 GI Annotated Anodyne in-man C#C[C@@H]1C[C@@H]2[C@@H]3CCC4=C[C@@H](OC(C)=O)CC[C@@H]4[C@H]3CC[C@]2(C)[C@H]1OC(C)=O ZINC000061389407 GI Annotated Anodyne in-man C#C[C@@H]1C[C@@H]2[C@@H]3CCC4=C[C@@H](OC(C)=O)CC[C@H]4[C@H]3CC[C@]2(C)[C@H]1OC(C)=O ZINC000061389409 GI Annotated Anodyne in-man COc1ccc(-c2nn(-c3ccccc3)cc2/C=N\Nc2ccccn2)cc1OC ZINC000061887789 GI Annotated Mild N[C@@H](Cc1ccc(F)cc1)c1csc(Nc2nccc(C(F)(F)F)n2)n1 ZINC000061895502 GI Annotated Anodyne N[C@H](Cc1ccc(F)cc1)c1csc(Nc2nccc(C(F)(F)F)n2)n1 ZINC000061895503 GI Annotated Anodyne CCc1nc2c(OCc3ccc(F)cc3)cccn2c1N(C)C(=O)c1ccco1 ZINC000061895621 GI Annotated Anodyne N[C@@H](COCc1ccccc1)c1csc(Nc2nncc3ccccc23)n1 ZINC000061895767 GI Annotated Anodyne N[C@H](COCc1ccccc1)c1csc(Nc2nncc3ccccc23)n1 ZINC000061895768 GI Annotated Anodyne CCCCN(C)C(=O)c1sc(=O)n(Cc2ccc(Cl)c(Cl)c2)c1C ZINC000061895902 GI Annotated Anodyne CC(C)=CCn1c2ccc(NC(=O)Nc3ccc(N(C)C)cc3)cc2c(=O)n1C ZINC000061895906 GI Annotated Anodyne CCCCN(C=O)c1c(CC)nc2c(OCC(=O)c3ccc(F)cc3)cccn12 ZINC000061895919 GI Annotated Anodyne O=C(Nc1ccc2c(c1)OCO2)[C@H]1Cc2c(-c3ccc(Cl)cc3)ccnc2O1 ZINC000061895945 GI Annotated Anodyne O=C(Nc1ccc2c(c1)OCO2)[C@@H]1Cc2c(-c3ccc(Cl)cc3)ccnc2O1 ZINC000061895946 GI Annotated Anodyne COc1ccc(OC)c(NC(=O)c2cc(-c3ccc(F)cc3OC(C)C)[nH]n2)c1 ZINC000061896114 GI Annotated Anodyne Cc1ccccc1Cn1c(C)c(C(=O)NCc2cccc(Cl)c2)sc1=O ZINC000061896402 GI Annotated Anodyne CC(=O)Nc1cc(-c2cccc(CO)c2)cn2c(-c3ccc(F)cc3)cnc12 ZINC000061896805 GI Annotated Anodyne Cc1ccccc1-c1cc2nc(Oc3ccc4c(c3)OCO4)n(C)c(=O)c2s1 ZINC000061897170 GI Annotated Anodyne COc1ccc(-c2csc([C@@](C)(NC(C)=O)c3ccc(OC)cc3)n2)cc1 ZINC000061897691 GI Annotated Anodyne COc1ccc(-c2csc([C@](C)(NC(C)=O)c3ccc(OC)cc3)n2)cc1 ZINC000061897692 GI Annotated Anodyne COc1ccc(C(C)=O)cc1C[C@@]1(C)C(=O)Nc2ccc(OC(F)(F)F)cc21 ZINC000061897855 GI Annotated Anodyne COc1ccc(C(C)=O)cc1C[C@]1(C)C(=O)Nc2ccc(OC(F)(F)F)cc21 ZINC000061897857 GI Annotated Anodyne C[C@]1(C(=O)N2CCCCC2)CCN1C(=O)c1ccccc1CCc1ccccc1 ZINC000061898222 GI Annotated Anodyne C[C@@]1(C(=O)N2CCCCC2)CCN1C(=O)c1ccccc1CCc1ccccc1 ZINC000061898223 GI Annotated Anodyne CCc1nc2c(OCc3cccc(OC)c3)cccn2c1N(C)C(=O)C(C)C ZINC000061898469 GI Annotated Anodyne CCCCN(C=O)c1c(CC)nc2c(OCCOc3ccc(F)cc3)cccn12 ZINC000061902467 GI Annotated Anodyne CC(C)[C@H](N)c1csc(Nc2ccc(C(=O)N(C)Cc3ccccc3)cn2)n1 ZINC000061902581 GI Annotated Anodyne CC(C)[C@@H](N)c1csc(Nc2ccc(C(=O)N(C)Cc3ccccc3)cn2)n1 ZINC000061902583 GI Annotated Anodyne COc1ccc(C[C@H](N)c2csc(Nc3nncc4ccccc34)n2)cc1 ZINC000061902591 GI Annotated Anodyne COc1ccc(C[C@@H](N)c2csc(Nc3nncc4ccccc34)n2)cc1 ZINC000061902592 GI Annotated Anodyne C=C(C)Cn1c2ccc(NC(=O)CCc3cccc(Cl)c3)cc2c(=O)n1C ZINC000061902890 GI Annotated Mild COc1ccc(-c2csc([C@](C)(O)c3ccc(F)c(F)c3)n2)cc1OC ZINC000061902900 GI Annotated Anodyne COc1ccc(-c2csc([C@@](C)(O)c3ccc(F)c(F)c3)n2)cc1OC ZINC000061902901 GI Annotated Anodyne CCOC(=O)[C@]1(C)CCCCCN1C(=O)c1ccc(OC)c(C(F)(F)F)c1 ZINC000061902920 GI Annotated Anodyne CCOC(=O)[C@@]1(C)CCCCCN1C(=O)c1ccc(OC)c(C(F)(F)F)c1 ZINC000061902921 GI Annotated Anodyne COc1cccc([C@H](NC(C)=O)c2nc(-c3ccc(F)cc3OC)cs2)c1 ZINC000061903044 GI Annotated Anodyne COc1cccc([C@@H](NC(C)=O)c2nc(-c3ccc(F)cc3OC)cs2)c1 ZINC000061903045 GI Annotated Anodyne CC(=O)Nc1ccc(-c2ccnc3c2C[C@@](C)(C(=O)Nc2ccccc2)O3)cc1 ZINC000061903047 GI Annotated Anodyne CC(=O)Nc1ccc(-c2ccnc3c2C[C@](C)(C(=O)Nc2ccccc2)O3)cc1 ZINC000061903048 GI Annotated Anodyne Nc1ccc(-c2cc(NC=O)c3ncc(-c4cccc(C(F)(F)F)c4)n3c2)cn1 ZINC000061903070 GI Annotated Anodyne COc1ccccc1CNc1nc(NCc2cnc(C)cn2)c2sccc2n1 ZINC000061903255 GI Annotated Anodyne CCOC(=O)N(C)c1c(CC)nc2c(OCc3ccc(F)c(F)c3)cccn12 ZINC000061903267 GI Annotated Anodyne COCCc1ccc(O[C@@]2(C)CCN(Cc3cccn3-c3nccs3)C2)cc1 ZINC000061903445 GI Annotated Anodyne COCCc1ccc(O[C@]2(C)CCN(Cc3cccn3-c3nccs3)C2)cc1 ZINC000061903446 GI Annotated Anodyne NC(=O)c1cccc(-c2coc3c(C(=O)NCCc4ccccc4)cccc23)c1 ZINC000061903467 GI Annotated Anodyne CCCCN(C=O)c1c(CC)nc2c(OCCOc3ccccc3)cccn12 ZINC000061903486 GI Annotated Anodyne COc1ccc(OC)c(NC(=O)[C@@]2(C)CCN2Cc2ccc(SC)cc2)c1 ZINC000061903532 GI Annotated Anodyne COc1ccc(OC)c(NC(=O)[C@]2(C)CCN2Cc2ccc(SC)cc2)c1 ZINC000061903533 GI Annotated Anodyne COCCCNc1ccn2nc(-c3ccc(OCc4ccccc4)cc3)cc2n1 ZINC000061903649 GI Annotated Anodyne C[C@]1(C(=O)NCc2ccc(F)c(F)c2)Cc2c(-c3ccccc3)ccnc2O1 ZINC000061903784 GI Annotated Anodyne C[C@@]1(C(=O)NCc2ccc(F)c(F)c2)Cc2c(-c3ccccc3)ccnc2O1 ZINC000061903785 GI Annotated Anodyne Cc1c(Br)cccc1NC(=O)[C@]1(C)CCN1CCc1ccccc1 ZINC000061903939 GI Annotated Anodyne Cc1c(Br)cccc1NC(=O)[C@@]1(C)CCN1CCc1ccccc1 ZINC000061903940 GI Annotated Anodyne COc1ccc(-c2cnc3c(NC=O)cc(-c4ccc(F)cc4)cn23)cc1OC ZINC000061903986 GI Annotated Anodyne COc1ccccc1CNc1nc2cc(-c3ccsc3)sc2c(=O)n1C ZINC000061904009 GI Annotated Anodyne C[C@]1(C(=O)Nc2cnc3ccccc3c2)CCN1C(=O)C/C=C/c1ccccc1 ZINC000061904234 GI Annotated Anodyne C[C@@]1(C(=O)Nc2cnc3ccccc3c2)CCN1C(=O)C/C=C/c1ccccc1 ZINC000061904235 GI Annotated Anodyne CCc1nc2c(OCCn3cccc3)cccn2c1N(C)C(=O)c1cccs1 ZINC000061904377 GI Annotated Anodyne COc1ccc([C@](C)(NC(C)=O)c2nc(-c3ccccc3OC)cs2)cc1 ZINC000061904483 GI Annotated Anodyne COc1ccc([C@@](C)(NC(C)=O)c2nc(-c3ccccc3OC)cs2)cc1 ZINC000061904484 GI Annotated Anodyne N[C@@H](CCc1ccccc1)c1csc(Nc2nccc(C(F)(F)F)n2)n1 ZINC000061904530 GI Annotated Anodyne N[C@H](CCc1ccccc1)c1csc(Nc2nccc(C(F)(F)F)n2)n1 ZINC000061904531 GI Annotated Anodyne CN(C)c1cccc(NC(=O)[C@@H]2Cc3c(-c4ccc(Cl)cc4)ccnc3O2)c1 ZINC000061904686 GI Annotated Anodyne CN(C)c1cccc(NC(=O)[C@H]2Cc3c(-c4ccc(Cl)cc4)ccnc3O2)c1 ZINC000061904687 GI Annotated Anodyne COCc1cccc(-c2csc([C@@H](NC(C)=O)c3ccc(F)c(F)c3)n2)c1 ZINC000061904925 GI Annotated Anodyne COCc1cccc(-c2csc([C@H](NC(C)=O)c3ccc(F)c(F)c3)n2)c1 ZINC000061904926 GI Annotated Anodyne CC(C)(C)c1ccc(C(=O)N2CC[C@]2(C)C(=O)Nc2cccc(C#N)c2)cc1 ZINC000061904940 GI Annotated Mild CC(C)(C)c1ccc(C(=O)N2CC[C@@]2(C)C(=O)Nc2cccc(C#N)c2)cc1 ZINC000061904941 GI Annotated Mild COc1ccc(OC)c([C@H](O)c2nc(-c3ccc(C(F)(F)F)cc3)c[nH]2)c1 ZINC000061905164 GI Annotated Anodyne COc1ccc(OC)c([C@@H](O)c2nc(-c3ccc(C(F)(F)F)cc3)c[nH]2)c1 ZINC000061905165 GI Annotated Anodyne COc1ccc([C@H](N)c2csc(Nc3ccc(C(F)(F)F)cn3)n2)cc1 ZINC000061905434 GI Annotated Anodyne COc1ccc([C@@H](N)c2csc(Nc3ccc(C(F)(F)F)cn3)n2)cc1 ZINC000061905435 GI Annotated Anodyne CCNC(=O)[C@]1(C)CCCN(Cc2ccc3ccccc3c2Br)C1 ZINC000061905484 GI Annotated Anodyne CCNC(=O)[C@@]1(C)CCCN(Cc2ccc3ccccc3c2Br)C1 ZINC000061905485 GI Annotated Anodyne COc1ccccc1CNc1nc(-c2ccccc2CO)c2sccc2n1 ZINC000061905804 GI Annotated Anodyne CC(=O)Nc1cc(-c2cccc(N)c2)cn2c(-c3ccc(C(C)=O)cc3)cnc12 ZINC000061906136 GI Annotated Anodyne COc1cccc(-c2cc(NC=O)c3ncc(-c4ccc(C(C)=O)cc4)n3c2)c1 ZINC000061906373 GI Annotated Anodyne CCCNC(=O)[C@]1(C)CCN(Cc2ccc3ccccc3c2Br)C1 ZINC000061906407 GI Annotated Anodyne CCCNC(=O)[C@@]1(C)CCN(Cc2ccc3ccccc3c2Br)C1 ZINC000061906408 GI Annotated Anodyne Cc1cc(C)cc(Cn2c(C)c(C(=O)N(C)Cc3ccc(F)cc3)sc2=O)c1 ZINC000061906503 GI Annotated Anodyne C[C@]1(C(=O)Nc2cccc3cccnc23)CCN1Cc1ccccc1OC(F)F ZINC000061906513 GI Annotated Anodyne C[C@@]1(C(=O)Nc2cccc3cccnc23)CCN1Cc1ccccc1OC(F)F ZINC000061906514 GI Annotated Anodyne CCc1nc2c(OCc3ccccc3)cccn2c1N(C)C(=O)c1ccco1 ZINC000061906523 GI Annotated Anodyne COc1cccc(-c2cnc3c(NC=O)cc(-c4ccc(N(C)C)cc4)cn23)c1 ZINC000061906609 GI Annotated Anodyne Cc1ccccc1-c1cc2nc(NCCOc3ccccc3)n(C)c(=O)c2s1 ZINC000061906734 GI Annotated Anodyne CC(=O)Nc1ccc(NC(=O)[C@]2(C)Cc3c(-c4ccccc4)ccnc3O2)cc1 ZINC000061907012 GI Annotated Anodyne CC(=O)Nc1ccc(NC(=O)[C@@]2(C)Cc3c(-c4ccccc4)ccnc3O2)cc1 ZINC000061907013 GI Annotated Anodyne CCc1nc2c(OCCOc3ccc(F)cc3)cccn2c1N(C)C(=O)C(C)C ZINC000061907048 GI Annotated Anodyne C#Cc1ccc(NC(=O)[C@@]2(C)CCN2C(=O)C2(c3ccccc3)CCCC2)cc1 ZINC000061907086 GI Annotated Mild C#Cc1ccc(NC(=O)[C@]2(C)CCN2C(=O)C2(c3ccccc3)CCCC2)cc1 ZINC000061907087 GI Annotated Mild Cc1ccc(-c2cc(NC=O)c3ncc(-c4cccc(C(=O)N(C)C)c4)n3c2)cc1 ZINC000061907136 GI Annotated Anodyne CCc1nc2c(OCc3ccc(F)c(F)c3)cccn2c1N(C)C(=O)C(C)C ZINC000061907261 GI Annotated Anodyne O=C(O)c1cccc(-c2csc([C@](O)(c3ccccc3)C(F)(F)F)n2)c1 ZINC000061907310 GI Annotated Anodyne O=C(O)c1cccc(-c2csc([C@@](O)(c3ccccc3)C(F)(F)F)n2)c1 ZINC000061907311 GI Annotated Anodyne CC(=O)Nc1cc(-c2cccc(CO)c2)cn2c(-c3ccc(C(C)=O)cc3)cnc12 ZINC000061907524 GI Annotated Anodyne CC(=O)N[C@@H](c1ccc(F)c(F)c1)c1nc(-c2ccc3c(c2)OCO3)cs1 ZINC000061907580 GI Annotated Anodyne CC(=O)N[C@H](c1ccc(F)c(F)c1)c1nc(-c2ccc3c(c2)OCO3)cs1 ZINC000061907581 GI Annotated Anodyne C[C@]1(C(=O)NCc2cccc(Cl)c2)Cc2c(-c3ccccc3)ccnc2O1 ZINC000061907651 GI Annotated Anodyne C[C@@]1(C(=O)NCc2cccc(Cl)c2)Cc2c(-c3ccccc3)ccnc2O1 ZINC000061907652 GI Annotated Anodyne COc1ccc(Nc2nc3cc(-c4ccsc4)sc3c(=O)n2C)cc1OC ZINC000061907844 GI Annotated Anodyne CCC(CC)C(=O)N(C)c1c(C)nc2c(OCCOc3ccccc3)cccn12 ZINC000061907846 GI Annotated Anodyne COc1ccccc1NC(=O)Nc1nc([C@H](N)CCc2ccccc2)cs1 ZINC000061907947 GI Annotated Anodyne COc1ccccc1NC(=O)Nc1nc([C@@H](N)CCc2ccccc2)cs1 ZINC000061907948 GI Annotated Anodyne CC(C)(C)c1ccc(C(=O)N2CC[C@]2(C)C(=O)Nc2ccc3[nH]cnc3c2)cc1 ZINC000061908283 GI Annotated Anodyne CC(C)(C)c1ccc(C(=O)N2CC[C@@]2(C)C(=O)Nc2ccc3[nH]cnc3c2)cc1 ZINC000061908284 GI Annotated Anodyne CCc1nc2c(OCC(=O)C(C)(C)C)cccn2c1N(C)C(=O)c1cccs1 ZINC000061908412 GI Annotated Anodyne C[C@]1(C(=O)NCc2ccc(C(F)(F)F)cc2)CCN1Cc1c(F)cccc1F ZINC000061908816 GI Annotated Anodyne C[C@@]1(C(=O)NCc2ccc(C(F)(F)F)cc2)CCN1Cc1c(F)cccc1F ZINC000061908817 GI Annotated Anodyne CC(=O)Nc1cc(-c2ccc(CO)cc2)cn2c(-c3ccc(F)cc3)cnc12 ZINC000061908822 GI Annotated Anodyne CC(C)(C)OC(=O)N1CCc2onc(-c3ccc(Br)cc3)c2C1=O ZINC000061920904 GI Annotated Anodyne CC1(C)CC(=O)C=C(c2ccc(COC(=O)c3cc(F)cc(F)c3)cc2)C1=O ZINC000061921089 GI Annotated Mild CCC[C@H]1NC(=O)c2cc3ccccc3cc2-n2c1nc1ccc(F)cc1c2=O ZINC000061921266 GI Annotated Anodyne CCC[C@@H]1NC(=O)c2cc3ccccc3cc2-n2c1nc1ccc(F)cc1c2=O ZINC000061921267 GI Annotated Anodyne CCC[C@H]1NC(=O)c2cc3ccccc3cc2-n2c1nc1cc(F)ccc1c2=O ZINC000061921268 GI Annotated Anodyne CCC[C@@H]1NC(=O)c2cc3ccccc3cc2-n2c1nc1cc(F)ccc1c2=O ZINC000061921269 GI Annotated Anodyne CCC[C@H]1NC(=O)c2cc3ccccc3cc2-n2c1nc1cc(C)ccc1c2=O ZINC000061921272 GI Annotated Anodyne CCC[C@@H]1NC(=O)c2cc3ccccc3cc2-n2c1nc1cc(C)ccc1c2=O ZINC000061921273 GI Annotated Anodyne CC[C@H]1NC(=O)c2cc3ccccc3cc2-n2c1nc1cc(C)cc(C)c1c2=O ZINC000061921291 GI Annotated Anodyne CC[C@@H]1NC(=O)c2cc3ccccc3cc2-n2c1nc1cc(C)cc(C)c1c2=O ZINC000061921292 GI Annotated Anodyne CC[C@H]1NC(=O)c2cc3ccccc3cc2-n2c1nc1cc(Cl)ccc1c2=O ZINC000061921301 GI Annotated Anodyne CC[C@@H]1NC(=O)c2cc3ccccc3cc2-n2c1nc1cc(Cl)ccc1c2=O ZINC000061921302 GI Annotated Anodyne CSc1ncnc2c1ncn2CCCN[C@H](C)c1cccc2ccccc12 ZINC000061922481 GI Annotated Anodyne CCCCN1CC(C)(C)[C@H](CC(=O)Nc2ccc(Br)cc2)C1=O ZINC000061923187 GI Annotated Anodyne CCCCN1C[C@H](Cc2ccccc2)[C@@H](CC(=O)Nc2ccc(OC)cc2)C1=O ZINC000061923243 GI Annotated Anodyne C[C@H]1CN(c2ccccc2)C(=O)[C@@H]1CC(=O)Nc1ccc(Br)cc1 ZINC000061923292 GI Annotated Anodyne CCc1cc(-c2cnnn2Cc2ccccc2)ccc1-c1cn(CC(C)C)nn1 ZINC000061923348 GI Annotated Anodyne Cc1ccc([C@H]2C[C@H](O)[C@@H](n3cc(C4CC4)nn3)CN2CC2CCCCC2)cc1 ZINC000061923672 GI Annotated Anodyne CCCCCCN1C[C@H](n2cc(C3CC3)nn2)[C@@H](O)C[C@@H]1c1ccc(C)cc1 ZINC000061923676 GI Annotated Anodyne Cc1ccc([C@H]2C[C@H](O)[C@@H](n3cc(C4CC4)nn3)CN2Cc2cccs2)cc1 ZINC000061923679 GI Annotated Anodyne O[C@H]1C[C@H](c2ccccc2)N(CC2CCCCC2)C[C@@H]1n1cc(C2CC2)nn1 ZINC000061923683 GI Annotated Anodyne Cc1ccc([C@H]2C[C@@H](O)[C@H](n3cc(C4CC4)nn3)CN2CC2CCCCC2)cc1 ZINC000061923793 GI Annotated Anodyne CCCCCCN1C[C@@H](n2cc(C3CC3)nn2)[C@H](O)C[C@@H]1c1ccc(C)cc1 ZINC000061923796 GI Annotated Anodyne Cc1ccc([C@H]2C[C@@H](O)[C@H](n3cc(C4CC4)nn3)CN2Cc2cccs2)cc1 ZINC000061923798 GI Annotated Anodyne O[C@@H]1C[C@H](c2ccccc2)N(CC2CCCCC2)C[C@H]1n1cc(C2CC2)nn1 ZINC000061923803 GI Annotated Anodyne Cc1ccc([C@H]2C[C@H](n3cc(C4CC4)nn3)[C@@H](O)CN2CC2CCCCC2)cc1 ZINC000061923847 GI Annotated Anodyne Cc1ccc([C@H]2C[C@H](n3cc(C4CC4)nn3)[C@@H](O)CN2Cc2cccs2)cc1 ZINC000061923856 GI Annotated Anodyne O[C@H]1CN(CC2CCCCC2)[C@@H](c2ccccc2)C[C@@H]1n1cc(C2CC2)nn1 ZINC000061923861 GI Annotated Anodyne Cc1ccc([C@H]2C[C@@H](n3cc(C4CC4)nn3)[C@H](O)CN2CC2CCCCC2)cc1 ZINC000061923958 GI Annotated Anodyne Cc1ccc([C@H]2C[C@@H](n3cc(C4CC4)nn3)[C@H](O)CN2Cc2cccs2)cc1 ZINC000061923966 GI Annotated Anodyne O[C@@H]1CN(CC2CCCCC2)[C@@H](c2ccccc2)C[C@H]1n1cc(C2CC2)nn1 ZINC000061923970 GI Annotated Anodyne CN[C@H]1C[C@H]2c3[nH]c4ccc(-c5cccc(C)c5)cc4c3CCN2C[C@H]1[C@H](C)O ZINC000061924223 GI Annotated Anodyne CC(=O)Nc1cc(-c2cccc(C(=O)N(C)C)c2)cn2c(-c3ccccc3)cnc12 ZINC000061925543 GI Annotated Anodyne COc1ccccc1-c1cnc([C@H](O)c2ccc(CN3CCCCC3)cc2)[nH]1 ZINC000061925801 GI Annotated Anodyne COc1ccccc1-c1cnc([C@@H](O)c2ccc(CN3CCCCC3)cc2)[nH]1 ZINC000061925802 GI Annotated Anodyne Cc1nc2cc(Oc3nc(NCCN(C)C)nc4ccsc34)ccc2s1 ZINC000061925962 GI Annotated Anodyne COc1ccc(-c2cc(NC=O)c3ncc(-c4cccc(C(C)=O)c4)n3c2)cc1 ZINC000061925970 GI Annotated Anodyne CCCNC(=O)[C@]1(C)CCN(Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000061926084 GI Annotated Anodyne CCCNC(=O)[C@@]1(C)CCN(Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000061926085 GI Annotated Anodyne C=Cc1ccc(Cn2c(C)c(C(=O)NCc3cccc(C)c3)sc2=O)cc1 ZINC000061926177 GI Annotated Anodyne CC(=O)N[C@@H](c1ccc(F)c(F)c1)c1nc(-c2cccc(C(=O)O)c2)cs1 ZINC000061926411 GI Annotated Anodyne CC(=O)N[C@H](c1ccc(F)c(F)c1)c1nc(-c2cccc(C(=O)O)c2)cs1 ZINC000061926412 GI Annotated Anodyne CCc1nc2c(OCc3ccc(F)c(F)c3)cccn2c1N(C)C(=O)C1CC1 ZINC000061926743 GI Annotated Anodyne O=C(Nc1cccc(OC(F)(F)F)c1)[C@@H]1Cc2c(-c3ccco3)ccnc2O1 ZINC000061927003 GI Annotated Anodyne O=C(Nc1cccc(OC(F)(F)F)c1)[C@H]1Cc2c(-c3ccco3)ccnc2O1 ZINC000061927004 GI Annotated Anodyne CCNC(=O)[C@]1(C)CCCN(Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000061927009 GI Annotated Anodyne CCNC(=O)[C@@]1(C)CCCN(Cc2csc(-c3ccc(Cl)cc3)n2)C1 ZINC000061927010 GI Annotated Anodyne COc1cc(Cl)ccc1O[C@@]1(C)CCN(Cc2cccc(OC)c2OC)C1 ZINC000061927074 GI Annotated Anodyne COc1cc(Cl)ccc1O[C@]1(C)CCN(Cc2cccc(OC)c2OC)C1 ZINC000061927075 GI Annotated Anodyne CCCCNC(=O)c1ccc2nc(CC)c(N(C)Cc3ccc(OC)cc3)n2c1 ZINC000061927120 GI Annotated Anodyne CSc1ccc(NC(=O)[C@@]2(C)CCN2C(=O)C2(c3ccccc3)CC2)cc1 ZINC000061927226 GI Annotated Anodyne CSc1ccc(NC(=O)[C@]2(C)CCN2C(=O)C2(c3ccccc3)CC2)cc1 ZINC000061927227 GI Annotated Anodyne CCCNC(=O)c1cc([C@@H]2CCCCN2C(=O)c2ccc(C(C)C)cc2)on1 ZINC000061927426 GI Annotated Anodyne CCCNC(=O)c1cc([C@H]2CCCCN2C(=O)c2ccc(C(C)C)cc2)on1 ZINC000061927429 GI Annotated Anodyne COc1ccc([C@](C)(NC(C)=O)c2nc(-c3cc(F)cc(F)c3)cs2)cc1 ZINC000061928491 GI Annotated Anodyne COc1ccc([C@@](C)(NC(C)=O)c2nc(-c3cc(F)cc(F)c3)cs2)cc1 ZINC000061928492 GI Annotated Anodyne C[C@]1(C(=O)Nc2cnc3ccccc3c2)CCN1Cc1ccccc1OC(F)F ZINC000061928970 GI Annotated Anodyne C[C@@]1(C(=O)Nc2cnc3ccccc3c2)CCN1Cc1ccccc1OC(F)F ZINC000061928972 GI Annotated Anodyne COc1ccc([C@](C)(NC(C)=O)c2nc(-c3cccc(C#N)c3)cs2)cc1 ZINC000061929121 GI Annotated Mild COc1ccc([C@@](C)(NC(C)=O)c2nc(-c3cccc(C#N)c3)cs2)cc1 ZINC000061929122 GI Annotated Mild Cc1ccccc1-c1cc2nc(NCCc3ccncc3)n(C)c(=O)c2s1 ZINC000061929167 GI Annotated Anodyne COc1ccc(OC)c([C@H](O)c2nc(-c3cccc(C(F)(F)F)c3)c[nH]2)c1 ZINC000061929703 GI Annotated Anodyne COc1ccc(OC)c([C@@H](O)c2nc(-c3cccc(C(F)(F)F)c3)c[nH]2)c1 ZINC000061929705 GI Annotated Anodyne C[C@]1(C(=O)Nc2cccc3c2CCCC3)CCN1C(=O)C1(c2ccccc2)CC1 ZINC000061929970 GI Annotated Anodyne C[C@@]1(C(=O)Nc2cccc3c2CCCC3)CCN1C(=O)C1(c2ccccc2)CC1 ZINC000061929973 GI Annotated Anodyne COc1ccccc1-c1cc(NC=O)c2ncc(-c3cccc(C(C)=O)c3)n2c1 ZINC000061930112 GI Annotated Anodyne CC(=O)c1cccc(NC(=O)[C@@H]2Cc3c(-c4cccc(F)c4)ccnc3O2)c1 ZINC000061930208 GI Annotated Anodyne CC(=O)c1cccc(NC(=O)[C@H]2Cc3c(-c4cccc(F)c4)ccnc3O2)c1 ZINC000061930209 GI Annotated Anodyne Cc1ccc(-c2cc3nc(NCCc4ccncc4)n(C)c(=O)c3s2)cc1 ZINC000061930553 GI Annotated Anodyne C[C@]1(C(=O)Nc2ccc3c(c2)OCCO3)CCN1Cc1ccc2ccccc2c1 ZINC000061930613 GI Annotated Anodyne C[C@@]1(C(=O)Nc2ccc3c(c2)OCCO3)CCN1Cc1ccc2ccccc2c1 ZINC000061930614 GI Annotated Anodyne O=C(NCC1CC1)[C@H]1Cc2c(-c3ccccc3Oc3ccccc3)ccnc2O1 ZINC000061930814 GI Annotated Anodyne O=C(NCC1CC1)[C@@H]1Cc2c(-c3ccccc3Oc3ccccc3)ccnc2O1 ZINC000061930816 GI Annotated Anodyne CC(=O)c1ccc(O[C@]2(C)CCN(Cc3cccn3-c3nccs3)C2)cc1 ZINC000061930942 GI Annotated Anodyne CC(=O)c1ccc(O[C@@]2(C)CCN(Cc3cccn3-c3nccs3)C2)cc1 ZINC000061930943 GI Annotated Anodyne COc1ccc(CN2Cc3cnnn3-c3ccccc3[C@@H]2c2ccccc2)cc1 ZINC000061943120 GI Annotated Anodyne COc1ccc(CN2Cc3cnnn3-c3ccccc3[C@H]2c2ccccc2)cc1 ZINC000061943122 GI Annotated Anodyne C[C@@H]1C(=NO)[C@H](C)[C@@H](c2ccc(N(C)C)cc2)N[C@@H]1c1ccc(N(C)C)cc1 ZINC000061944361 GI Annotated Mild C[C@@H]1C(=NO)[C@@H](C)[C@@H](c2ccc(N(C)C)cc2)N[C@@H]1c1ccc(N(C)C)cc1 ZINC000061944362 GI Annotated Mild CC(C)CN1Cc2ccccc2Oc2cc(Br)ccc2S1(=O)=O ZINC000061944697 GI Annotated Anodyne CC(C)[C@H]1COCCS(=O)(=O)N1Cc1ccccc1-c1cccc(Cl)c1 ZINC000061944773 GI Annotated Anodyne O=S(=O)(NCc1ccccc1)c1ccccc1NCc1ccc(Cl)cc1 ZINC000061944862 GI Annotated Anodyne CCc1ccc([C@H]2C(C(=O)O)=C[C@@H](CC)N2S(=O)(=O)c2ccc(C)cc2)cc1 ZINC000061947037 GI Annotated Anodyne Cn1cncc1C#Cc1c(-c2ccc(S(C)(=O)=O)cc2)sc2ccccc12 ZINC000061948034 GI Annotated Mild COc1ccccc1-c1sc2cc3c(cc2c1C#Cc1cncn1C)OCO3 ZINC000061948056 GI Annotated Mild COc1ccc(-c2sc3cc4c(cc3c2C#Cc2cncn2C)OCO4)cc1 ZINC000061948087 GI Annotated Mild CN(C)c1ccc(/C=C2\Oc3ccc(C#Cc4cccc(N)c4)cc3C2=O)cc1 ZINC000061948101 GI Annotated Mild CC[C@@H](CO)Oc1cc(NCc2ccc(C(=O)O)cc2)c2ncn(C(C)C)c2c1 ZINC000061948925 GI Annotated Anodyne CC[C@H](CO)Oc1cc(NCc2ccc(C(=O)O)cc2)c2ncn(C(C)C)c2c1 ZINC000061948927 GI Annotated Anodyne CC[C@@H](CO)Oc1cc(NCc2ccccc2OC)c2ncn(C(C)C)c2c1 ZINC000061948967 GI Annotated Anodyne CC[C@H](CO)Oc1cc(NCc2ccccc2OC)c2ncn(C(C)C)c2c1 ZINC000061948969 GI Annotated Anodyne CC[C@@H](CO)Oc1cc(NCc2cccc([N+](=O)[O-])c2)c2ncn(C(C)C)c2c1 ZINC000061948996 GI Annotated Bother CC[C@H](CO)Oc1cc(NCc2cccc([N+](=O)[O-])c2)c2ncn(C(C)C)c2c1 ZINC000061948998 GI Annotated Bother CC[C@@H](CO)Oc1cc(NC(=O)Cc2ccccc2F)c2ncn(C(C)C)c2c1 ZINC000061949007 GI Annotated Anodyne CC[C@H](CO)Oc1cc(NC(=O)Cc2ccccc2F)c2ncn(C(C)C)c2c1 ZINC000061949009 GI Annotated Anodyne CC[C@@H](CO)Oc1cc(NC(=O)c2ccc(OC)cc2)c2ncn(C(C)C)c2c1 ZINC000061949026 GI Annotated Anodyne CC[C@H](CO)Oc1cc(NC(=O)c2ccc(OC)cc2)c2ncn(C(C)C)c2c1 ZINC000061949028 GI Annotated Anodyne CC[C@@H](CO)Oc1cc(NC(=O)c2ccccc2C)c2ncn(C(C)C)c2c1 ZINC000061949046 GI Annotated Anodyne CC[C@H](CO)Oc1cc(NC(=O)c2ccccc2C)c2ncn(C(C)C)c2c1 ZINC000061949049 GI Annotated Anodyne CC[C@@H](CO)Oc1cc(NC(=O)c2ccccc2F)c2ncn(C(C)C)c2c1 ZINC000061949054 GI Annotated Anodyne CC[C@H](CO)Oc1cc(NC(=O)c2ccccc2F)c2ncn(C(C)C)c2c1 ZINC000061949056 GI Annotated Anodyne CC[C@@H](CO)Oc1cc(NC(=O)c2cccc(F)c2)c2ncn(C(C)C)c2c1 ZINC000061949058 GI Annotated Anodyne CC[C@H](CO)Oc1cc(NC(=O)c2cccc(F)c2)c2ncn(C(C)C)c2c1 ZINC000061949060 GI Annotated Anodyne Cc1ccc2c(c1)-n1c(nc3ccc(Cl)cc3c1=O)[C@H](CC(C)C)NC2=O ZINC000061949338 GI Annotated Anodyne Cc1ccc2c(c1)-n1c(nc3ccc(Cl)cc3c1=O)[C@@H](CC(C)C)NC2=O ZINC000061949340 GI Annotated Anodyne Cc1ccc2c(c1)-n1c(nc3cc(Cl)ccc3c1=O)[C@H](CC(C)C)NC2=O ZINC000061949341 GI Annotated Anodyne Cc1ccc2c(c1)-n1c(nc3cc(Cl)ccc3c1=O)[C@@H](CC(C)C)NC2=O ZINC000061949344 GI Annotated Anodyne CC(C)C[C@H]1NC(=O)c2cc(Cl)ccc2-n2c1nc1cc(F)ccc1c2=O ZINC000061949354 GI Annotated Anodyne CC(C)C[C@@H]1NC(=O)c2cc(Cl)ccc2-n2c1nc1cc(F)ccc1c2=O ZINC000061949355 GI Annotated Anodyne CC(C)C[C@H]1NC(=O)c2ccc(Cl)cc2-n2c1nc1cc(F)ccc1c2=O ZINC000061949369 GI Annotated Anodyne CC(C)C[C@@H]1NC(=O)c2ccc(Cl)cc2-n2c1nc1cc(F)ccc1c2=O ZINC000061949371 GI Annotated Anodyne Cc1ccc2c(=O)n3c(nc2c1)[C@@H](CC(C)C)NC(=O)c1ccc(Cl)cc1-3 ZINC000061949373 GI Annotated Anodyne Cc1ccc2c(=O)n3c(nc2c1)[C@H](CC(C)C)NC(=O)c1ccc(Cl)cc1-3 ZINC000061949375 GI Annotated Anodyne O=C1CC[C@@H]2C[C@]3(C[C@@H]4CCN1[C@@H]42)Nc1ccccc1N=C3NC1CCCCC1 ZINC000061958540 GI Annotated Anodyne O=C1CC[C@@H]2C[C@@]3(C[C@@H]4CCN1[C@@H]42)Nc1ccccc1N=C3NC1CCCCC1 ZINC000061958542 GI Annotated Anodyne O=C1c2ccccc2[C@@H]2C[C@@H](O)[C@H](Nc3ccccc3-c3ccccc3)CCN12 ZINC000061959041 GI Annotated Anodyne C[C@@]12CC[C@@H]3[C@]4(C)CCC[C@@](C)(C(=O)N5CCOCC5)[C@@H]4CC[C@]3(CC1=O)C2 ZINC000061959360 GI Annotated Anodyne C[C@@]12CC[C@H]3[C@]4(C)CCC[C@@](C)(C(=O)N5CCOCC5)[C@@H]4CC[C@]3(CC1=O)C2 ZINC000061959361 GI Annotated Anodyne C[C@@]12CC[C@@H]3[C@]4(C)CCC[C@@](C)(C(=O)N5CCOCC5)[C@H]4CC[C@]3(CC1=O)C2 ZINC000061959362 GI Annotated Anodyne C[C@@]12CC[C@H]3[C@]4(C)CCC[C@@](C)(C(=O)N5CCOCC5)[C@H]4CC[C@]3(CC1=O)C2 ZINC000061959363 GI Annotated Anodyne COc1cc2c(C#Cc3cccnc3)c(-c3ccsc3)oc(=O)c2cc1OC ZINC000061969012 GI Annotated Mild COc1ccc(-c2sc3ccc(N4CCOCC4)cc3c2C#CCCO)cc1 ZINC000061969040 GI Annotated Mild O=C(COc1cccc(Br)c1)N=Nc1c(O)[nH]c2ccc(F)cc12 ZINC000617960067 GI Annotated Clean Cc1ccc(S(=O)(=O)N=Nc2c(O)[nH]c3ccc(Br)cc23)cc1 ZINC000617960117 GI Annotated Clean CC(C)c1cc(C(=O)N=Nc2c(O)[nH]c3ccc(Br)cc23)n[nH]1 ZINC000617960123 GI Annotated Clean COc1ccc(OC)c(-c2cc(C(=O)N=Nc3c(O)[nH]c4ccccc34)n[nH]2)c1 ZINC000617960157 GI Annotated Clean O=C(N=Nc1c(O)[nH]c2ccccc12)C(=O)Nc1cc(Cl)ccc1Cl ZINC000617960329 GI Annotated Clean CCCCCO/C(O)=C1\C(C)=NC(=S)N[C@@H]1c1cc(OC)ccc1OC ZINC000617964395 GI Annotated Anodyne CCCCCO/C(O)=C1\C(C)=NC(=S)N[C@H]1c1cc(OC)ccc1OC ZINC000617964396 GI Annotated Anodyne CSc1nc(O)c2c(n1)N=C1CCCC(O)=C1[C@@H]2c1ccc(N(C)C)cc1 ZINC000618005061 GI Annotated Anodyne CSc1nc(O)c2c(n1)N=C1CCCC(O)=C1[C@H]2c1ccc(N(C)C)cc1 ZINC000618005066 GI Annotated Anodyne COc1cccc([C@@H]2/C(=C(\O)OC3CCCCC3)C(C)=Nc3ncnn32)c1OC ZINC000618005642 GI Annotated Anodyne COc1cccc([C@H]2/C(=C(\O)OC3CCCCC3)C(C)=Nc3ncnn32)c1OC ZINC000618005643 GI Annotated Anodyne CCc1ccc(-n2c(SCc3ccccc3F)nc3nncc-3c2O)cc1 ZINC000618007530 GI Annotated Anodyne CN(C)CCSSCCC(=O)NCC(c1ccccc1)c1ccccc1 ZINC000618007604 GI Annotated Reactive CSc1ccc(Cl)c(C(=O)NCCCSSCCN(C)C)c1 ZINC000618007766 GI Annotated Reactive Cc1ccc(-c2cnn(C(C)(C)C(=O)NCc3cc(F)ccc3F)c2)c(C)c1 ZINC000618008044 GI Annotated Anodyne COc1cccc(-c2cnn(C(C)(C)C(=O)Nc3ccccc3SC)c2)n1 ZINC000618008076 GI Annotated Anodyne COc1ccccc1CNC(=O)C(C)(C)n1cc(-c2ccc(C)cc2C)cn1 ZINC000618008078 GI Annotated Anodyne CC(C)c1cc(C(=O)NCCSSCCN(C)C)c(O)c(C(C)C)c1 ZINC000618008098 GI Annotated Reactive CN(C)CCSSCCNC(=O)C(C)(c1ccccc1)c1ccccc1 ZINC000618008464 GI Annotated Reactive C[C@H](Oc1ccc2ccccc2c1)C(=O)NCCCSSCCN(C)C ZINC000618009037 GI Annotated Reactive C[C@@H](Oc1ccc2ccccc2c1)C(=O)NCCCSSCCN(C)C ZINC000618009038 GI Annotated Reactive CN(C)CCNC1CCN(c2cccc(-c3cc4cc(F)ccc4[nH]3)c2)CC1 ZINC000618009293 GI Annotated Anodyne CN(C)CCSSCCNC(=O)C(C)(C)Oc1ccc2ccccc2c1 ZINC000618009542 GI Annotated Reactive CN1CCC(NC2CCN(c3cccc(-c4cc5ccccc5[nH]4)c3)CC2)CC1 ZINC000618010192 GI Annotated Anodyne c1cc(-c2cc3ccccc3[nH]2)cc(N2CCC(NCCc3cnc[nH]3)CC2)c1 ZINC000618010534 GI Annotated Anodyne COC(=O)CCNC1CCN(c2cccc(-c3cc4cc(F)ccc4[nH]3)c2)CC1 ZINC000618011781 GI Annotated Anodyne c1cc(-c2cc3ccccc3[nH]2)cc(N2CCC(NCCN3CCCC3)CC2)c1 ZINC000618012463 GI Annotated Anodyne C[C@H](c1ccc(Cl)cc1)N(C(=O)[C@@H]1CC[C@@H](c2ccccn2)NC1=O)C1CC1 ZINC000618013056 GI Annotated Anodyne C[C@H](c1ccc(Cl)cc1)N(C(=O)[C@H]1CC[C@@H](c2ccccn2)NC1=O)C1CC1 ZINC000618013068 GI Annotated Anodyne CC1(C)Oc2ccccc2[C@@H]2O[C@@H]3CCN(Cc4cccc(C(=O)O)c4)[C@@H]3C[C@H]21 ZINC000618016760 GI Annotated Anodyne CN1[C@H](Cc2ccccc2)[C@@H]2C[C@@]3(C)[C@H](CCCC[C@@H]13)N2C(=O)c1ccccn1 ZINC000618016951 GI Annotated Anodyne CN(C)CCSSCCCNC(=O)c1occc1-c1ccc(F)cc1 ZINC000618017604 GI Annotated Reactive C[C@@H]1CC[C@](C)(CNC(=O)CCCC(=O)O)C[C@H](c2ccccc2)C[C@@H](O)C1 ZINC000618018236 GI Annotated Anodyne COc1ccc(OC)c([C@H]2CCN(Cc3cnn(-c4ccccc4F)c3C)C2)c1 ZINC000062224408 GI Annotated Anodyne Cc1cccc(NC(=O)c2ccc(C(F)F)o2)c1N1CCC2(CC1)OCCO2 ZINC000062241961 GI Annotated Anodyne COc1cc2c(cc1OC)-c1[nH]c(=Nc3cc4ccccc4cn3)sc1C2 ZINC000621429231 GI Annotated Anodyne COc1ccc(-c2cc(C(=O)NC3Cc4ccccc4C3)c(C)o2)cc1OC ZINC000621429318 GI Annotated Anodyne COc1ccc(-c2cc(C(=O)N[C@H]3CCOc4ccccc43)co2)cc1OC ZINC000621430218 GI Annotated Anodyne COc1ccc(-c2cc(C(=O)N[C@@H]3CCOc4ccccc43)co2)cc1OC ZINC000621430219 GI Annotated Anodyne CN(C)c1cccc(OCc2cc(=O)n3c(-c4ccccc4)csc3n2)c1 ZINC000621431072 GI Annotated Anodyne COc1ccc(-c2cc(C(=O)N3CCN=C3Cc3ccccc3)co2)cc1OC ZINC000621431137 GI Annotated Anodyne C=C(C)C[C@H](OCc1ccc(OC)cc1)[C@H](O[Si](C)(C)C(C)(C)C)C(N)=O ZINC000621431321 GI Annotated Reactive O=C(c1cnn2c(C(F)F)cc(-c3ccccc3)nc12)n1cnc2ccccc21 ZINC000621431797 GI Annotated Anodyne CC(C)c1nccn1C(=O)c1cnn2c(C(F)F)cc(-c3ccccc3)nc12 ZINC000621431826 GI Annotated Anodyne O=C(Nc1ccccc1-c1nc[nH]n1)c1cc2ccccc2nc1N1CCCCC1 ZINC000621432706 GI Annotated Anodyne O=C(Nc1ccc(-c2ccco2)cc1)C1CCN(C(=O)CCc2ccco2)CC1 ZINC000621476343 GI Annotated Anodyne Cc1sc(NC(=O)NCCSSCCN(C)C)nc1-c1ccccc1 ZINC000621476453 GI Annotated Reactive O=C(C[C@@H]1CCC[C@]2(C1)OOC1(O2)C2CC3CC(C2)CC1C3)N1CCCCC1 ZINC000621477519 GI Annotated Reactive C=C[C@@]1(OC(=O)NCC)CCC[C@]2(C1)OOC1(O2)C2CC3CC(C2)CC1C3 ZINC000621477537 GI Annotated Reactive O=C(O[C@@H]1CCC[C@]2(C1)OOC1(O2)C2CC3CC(C2)CC1C3)N1CCCCC1 ZINC000621477745 GI Annotated Reactive CCOC(=O)c1cc2n(c1C)-c1ccccc1/C2=N/c1ccc([N+](=O)[O-])cc1 ZINC000621477763 GI Annotated Mild CC1(C)Cc2c(cnn2-c2ccc(Cn3cncn3)cc2)-c2[nH]c3ccccc3c21 ZINC000621478288 GI Annotated Anodyne CC1(C)Cc2cnn(-c3ccc(Cn4cncn4)cc3)c2-c2[nH]c3ccccc3c21 ZINC000621485936 GI Annotated Anodyne CNC(=O)/C=C/c1cnc(N)c2c(-c3cc(F)c4[nH]c(C)cc4c3)csc12 ZINC000063298080 GI Annotated Anodyne CN(C)c1ccc(CNC(=O)c2cc3c(-c4ccccc4)n[nH]c3s2)cc1 ZINC000063298460 GI Annotated Clean CNC(=O)/C=C/c1cnc(N)c2c(-c3ccc4sc(C)nc4c3)csc12 ZINC000063298485 GI Annotated Anodyne CC(C)c1nnc2ccc(-c3c(-c4ccc(F)cc4F)nc4n3CCC4)nn12 ZINC000063539257 GI Annotated Anodyne CC(C)c1nnc2ccc(-c3c(-c4ccc(F)cc4F)nc4occn34)nn12 ZINC000063539260 GI Annotated Anodyne Cn1ccc2c(-c3ccccc3F)nc(N(C(N)=O)c3c(F)cccc3F)nc21 ZINC000063539682 GI Annotated Anodyne CCCNC(=O)c1ccc(Nc2nc(CCC(F)(F)F)c3cc[nH]c3n2)cc1 ZINC000063540079 GI Annotated Anodyne Oc1ccccc1/C=N\Nc1nnc2c3ccccc3n(Cc3ccccc3)c2n1 ZINC000064245712 GI Annotated Mild CCOc1cc([N+](=O)[O-])cc(/C=N\c2cccc(NC(=O)c3ccco3)c2)c1O ZINC000064251788 GI Annotated Mild COc1cc(-c2ncn(C)c2-c2ccc3c(Cl)cn(C)c3c2)cc(N)c1OC ZINC000064286964 GI Annotated Clean N#C[C@]1(c2ccc(F)cc2)c2c(ccc(F)c2F)NC(=O)N1CC(F)(F)F ZINC000064373201 GI Annotated Mild COc1ccc(-c2csc3nnc(Cc4ccc(Cl)cc4)c(=O)n23)cc1 ZINC000064393126 GI Annotated Anodyne Cn1c(=O)c(Cc2ccc(F)cc2F)cc2cnnc(-c3ccc(F)cc3F)c21 ZINC000064409756 GI Annotated Anodyne Cn1c(=O)c(Cc2ccc(F)cc2)cc2cnnc(-c3ccc(F)cc3F)c21 ZINC000064426442 GI Annotated Anodyne Cn1c(=O)c(Nc2ccc(F)cc2)cc2cnnc(-c3ccc(F)cc3F)c21 ZINC000064426564 GI Annotated Anodyne CN(c1ccc(F)cc1)c1cc2cnnc(-c3ccc(F)cc3F)c2n(C)c1=O ZINC000064436280 GI Annotated Anodyne O=C(O)C[C@H]1CCN([C@H]2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 ZINC000064436534 GI Annotated Anodyne O=C(O)C[C@H]1CCN([C@@H]2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 ZINC000064436536 GI Annotated Anodyne Cc1ccc(OCc2ccccc2-c2nn(CN3CCOCC3)c(=S)o2)cc1 ZINC000064436626 GI Annotated Anodyne Cn1c(=O)c(Oc2ccc(F)cc2)cc2cnnc(-c3ccc(F)cc3F)c21 ZINC000064436759 GI Annotated Anodyne CC1=C(C(=O)Nc2ccc(C(F)(F)F)cc2)[C@H](c2ccco2)c2c[nH]nc2N1 ZINC000064436937 GI Annotated Anodyne CC1=C(C(=O)Nc2ccc(C(F)(F)F)cc2)[C@@H](c2ccco2)c2c[nH]nc2N1 ZINC000064436939 GI Annotated Anodyne Cc1cccc(OCc2ccccc2-c2nn(CN3CCOCC3)c(=S)o2)c1 ZINC000064446902 GI Annotated Anodyne COc1ccc([C@@H]2c3c(ccc4ccccc34)O[C@H]3N=C(S)NC(=N)[C@@H]32)cc1 ZINC000064446966 GI Annotated Anodyne COc1ccc([C@H]2c3c(ccc4ccccc34)O[C@H]3N=C(S)NC(=N)[C@H]23)cc1 ZINC000064446968 GI Annotated Anodyne COc1ccc([C@@H]2c3c(ccc4ccccc34)O[C@@H]3N=C(S)NC(=N)[C@@H]32)cc1 ZINC000064446969 GI Annotated Anodyne COc1ccc([C@H]2c3c(ccc4ccccc34)O[C@@H]3N=C(S)NC(=N)[C@@H]32)cc1 ZINC000064446971 GI Annotated Anodyne COc1c2occc2c(OC)c2c(/C=C(\C)N3CCCCC3)c(C#N)c(=N)oc12 ZINC000064447283 GI Annotated Mild COc1ccc(CO[C@H]2C[C@H]3[C@@H]([C@H]2C)[C@H]2OC[C@H](C)[C@@]24CC[C@]3(C)OO4)cc1 ZINC000064447306 GI Annotated Reactive CC(=O)Nc1ccc(/C=C2\C(=O)N(c3ccccc3)N=C2c2ccccc2)cc1 ZINC000064447397 GI Annotated Clean COc1c2occc2c(OC)c2c(/C=C(\C)N3CCCC3)c(C#N)c(=N)oc12 ZINC000064448012 GI Annotated Mild NNc1ncnc2c1cc(-c1ccc(Br)cc1)n2-c1ccccc1 ZINC000064448049 GI Annotated Anodyne Cc1ccccc1OCc1ccccc1-c1nn(CN2CCOCC2)c(=S)o1 ZINC000064448172 GI Annotated Anodyne O=C(O)c1ccc(/C=C2\C(=O)N(c3ccc(F)cc3)N=C2c2ccccc2)cc1 ZINC000064448412 GI Annotated Clean CCN1CC2=C(NC(=S)N[C@H]2c2ccc(C)cc2)/C(=C/c2ccc(C)cc2)C1 ZINC000064448649 GI Annotated Anodyne CCN1CC2=C(NC(=S)N[C@@H]2c2ccc(C)cc2)/C(=C/c2ccc(C)cc2)C1 ZINC000064448651 GI Annotated Anodyne COc1ccc([C@@H]2c3ccc4ccccc4c3O[C@H]3N=C(S)NC(=N)[C@@H]32)cc1 ZINC000064448795 GI Annotated Anodyne COc1ccc([C@H]2c3ccc4ccccc4c3O[C@H]3N=C(S)NC(=N)[C@H]23)cc1 ZINC000064448796 GI Annotated Anodyne COc1ccc([C@@H]2c3ccc4ccccc4c3O[C@@H]3N=C(S)NC(=N)[C@@H]32)cc1 ZINC000064448797 GI Annotated Anodyne COc1ccc([C@H]2c3ccc4ccccc4c3O[C@@H]3N=C(S)NC(=N)[C@@H]32)cc1 ZINC000064448799 GI Annotated Anodyne C[C@]1(C(=O)O)CCN([C@@H]2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 ZINC000064448979 GI Annotated Anodyne C[C@@]1(C(=O)O)CCN([C@@H]2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)C1 ZINC000064448981 GI Annotated Anodyne O=C(O)C1CCN([C@H]2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)CC1 ZINC000064454014 GI Annotated Anodyne O=C(O)C1CCN([C@@H]2CC[C@]3(Cc4ccccc4Cc4ccccc43)C2)CC1 ZINC000064454016 GI Annotated Anodyne Cc1ccc(/C=C2/N=C(c3ccccc3)N(C(=O)c3ccc(C)cc3)NC2=O)cc1 ZINC000064503443 GI Annotated Clean O=C1N=C(O)/C(=C(/C=C/c2c[nH]c3ccccc23)c2ccc(Cl)cc2)C(=O)N1 ZINC000064504160 GI Annotated Anodyne COC(=O)[C@]1(C)[C@@H](O)CC[C@]2(C)c3cc4c(cc3CC[C@H]21)[nH]c1ccccc14 ZINC000064511781 GI Annotated Anodyne CC(C)c1n[nH]c(Cl)c1-c1ccnc(Nc2ccc(C3CCNCC3)cn2)n1 ZINC000064512026 GI Annotated Anodyne c1ccc2c(-c3cn(C[C@@H]4Cc5c([nH]c6ccccc56)CN4)nn3)cccc2c1 ZINC000064526429 GI Annotated Anodyne C=CC(=O)N1CCc2c(sc3ncnc(N[C@H](CC)c4ccccc4)c23)C1 ZINC000064527143 GI Annotated Anodyne CC(C)(C)OC(=O)c1cc2c(cn1)[nH]c1ccc(I)cc12 ZINC000064527188 GI Annotated Anodyne Cc1ccc(CNCC2(F)CCN(C(=O)C34CCCC(CCC3)C4)CC2)nc1 ZINC000064527423 GI Annotated Anodyne Cc1ccc(CNCC2(F)CCN(C(=O)C34CC5CC(CC(C5)C3)C4)CC2)nc1 ZINC000064527579 GI Annotated Anodyne CC(C)N1CCC(Oc2ccc3c(c2)cc2n3C[C@@H](C)N(CC3CC3)C2=O)CC1 ZINC000064528139 GI Annotated Anodyne CN1CCN([C@@H]2Cc3ccccc3Sc3ccc(-c4ccnn4C)cc32)CC1 ZINC000064528182 GI Annotated Anodyne CN1CCN([C@H]2Cc3ccccc3Sc3ccc(-c4ccnn4C)cc32)CC1 ZINC000064528183 GI Annotated Anodyne CC(C)N1CCN(C(=O)c2ccc3scc(CN4CCCCC4)c3c2)CC1 ZINC000064528299 GI Annotated Anodyne CCOc1ccc([C@@]2(c3ccc(O)cc3)C(=O)Nc3c2ccc(F)c3F)cc1 ZINC000064528396 GI Annotated Anodyne CCOc1ccc([C@]2(c3ccc(O)cc3)C(=O)Nc3c2ccc(F)c3F)cc1 ZINC000064528397 GI Annotated Anodyne C[C@@]1(C[C@](C)(O)CCCCCCCCCc2ccc(O)cc2)OC(=O)C[C@@H]1O ZINC000064528406 GI Annotated Anodyne COc1cccc(Nc2nc(-c3cccc4onc(C)c34)nc3c2cnn3C)c1 ZINC000064539582 GI Annotated Anodyne CCCOc1ccc(-c2nn3c(C)cc(C)nc3c2CC(=O)N(CC)CC)cc1 ZINC000064540451 GI Annotated Anodyne Cc1ccc(CNCC2(F)CCN(C(=O)c3cc4ccccc4s3)CC2)nc1 ZINC000064548498 GI Annotated Anodyne CN1CCN([C@@H]2Cc3ccccc3Sc3ccc(-c4cncnc4)cc32)CC1 ZINC000064548619 GI Annotated Anodyne CN1CCN([C@H]2Cc3ccccc3Sc3ccc(-c4cncnc4)cc32)CC1 ZINC000064548620 GI Annotated Anodyne Cc1ccc(CNCC2(F)CCN(C(=O)c3ccc4ccccc4c3)CC2)nc1 ZINC000064549296 GI Annotated Anodyne CC(=O)NC1=C(C#N)[C@H](c2ccccc2)C2=C(C[C@H](c3ccccc3)CC2=O)O1 ZINC000064549309 GI Annotated Reactive CC(=O)NC1=C(C#N)[C@@H](c2ccccc2)C2=C(C[C@H](c3ccccc3)CC2=O)O1 ZINC000064549310 GI Annotated Reactive CC(=O)NC1=C(C#N)[C@H](c2ccccc2)C2=C(C[C@@H](c3ccccc3)CC2=O)O1 ZINC000064549311 GI Annotated Reactive CC(=O)NC1=C(C#N)[C@@H](c2ccccc2)C2=C(C[C@@H](c3ccccc3)CC2=O)O1 ZINC000064549312 GI Annotated Reactive O=C(c1ccccc1N1Cn2c(ccc2-c2ccccc2)C1=O)N1CCCCC1 ZINC000064549458 GI Annotated Anodyne Cc1ccc(CNCC2(F)CCN(C(=O)c3csc4ccccc34)CC2)nc1 ZINC000064549510 GI Annotated Anodyne O=C(COCc1ccncc1)N1CCC(F)(c2ccc(Cl)cc2Cl)CC1 ZINC000064549630 GI Annotated Anodyne C[C@H](Nc1nc2cc[nH]c(=O)c2cc1-c1nc(-c2ccccc2)no1)C(C)(C)C ZINC000064549972 GI Annotated Anodyne C[C@@H](Nc1nc2cc[nH]c(=O)c2cc1-c1nc(-c2ccccc2)no1)C(C)(C)C ZINC000064549973 GI Annotated Anodyne Cc1ccc(SCc2nc3c(Cn4ccnc4C)c(O)ccc3n2C)cc1 ZINC000064559182 GI Annotated Clean O=C1OC[C@@H](COC(=O)c2ccccc2)C=C1c1ccc(Cl)c(Cl)c1 ZINC000064559312 GI Annotated Anodyne O=C1OC[C@H](COC(=O)c2ccccc2)C=C1c1ccc(Cl)c(Cl)c1 ZINC000064559313 GI Annotated Anodyne CN1CCc2c(c3ccc(-n4ccc(-c5ccc(F)cc5)cc4=O)cc3n2C)C1 ZINC000064560154 GI Annotated Anodyne Cn1c2c(c3ccc(-n4ccc(-c5ccc(Cl)cc5)cc4=O)cc31)CNCC2 ZINC000064560155 GI Annotated Anodyne COc1ccc(SCc2nc3c(Cn4ccnc4C)c(O)ccc3n2C)cc1 ZINC000064560741 GI Annotated Clean COc1cccc(SCc2nc3c(Cn4ccnc4C)c(O)ccc3n2C)c1 ZINC000064560770 GI Annotated Clean S=c1[nH]nc(Cc2nc(-c3ccccc3)no2)n1CCCc1ccccc1 ZINC000064744385 GI Annotated Anodyne N#C[C@]12Cc3cc4c(cc3-c3cccc(c31)CCN2C(=O)c1ccccc1)OCO4 ZINC000006514614 GI Annotated Mild N#C[C@@]12Cc3ccc4c(c3-c3cccc(c31)CCN2C(=O)c1ccccc1)OCO4 ZINC000006514615 GI Annotated Mild Cc1c(Sc2ccccc2)n(C/C=C/c2cc3ccccc3o2)c(=O)[nH]c1=O ZINC000006520169 GI Annotated Anodyne Cc1nccc2c1[nH]c1cc(OC(=O)[C@]34CC[C@](C)(C(=O)O3)C4(C)C)ccc12 ZINC000006520693 GI Annotated Anodyne Cc1nccc2c1[nH]c1cc(OC(=O)[C@@]34CC[C@@](C)(C(=O)O3)C4(C)C)ccc12 ZINC000006520695 GI Annotated Anodyne Cc1cc(C)cc(Sc2c(C(C)C)c(=O)[nH]c(=O)n2OCc2ccccc2)c1 ZINC000006521940 GI Annotated Anodyne Cc1cc(Cl)cc2c1S(=O)(=O)N=C(C(=O)c1ccc(Cl)cc1)S2 ZINC000006521994 GI Annotated Anodyne Cc1ccc(/C=C2\CN(C)C[C@@H]3C2=NC(=S)N[C@@H]3c2ccc(C)cc2)cc1 ZINC000006522398 GI Annotated Anodyne Cc1ccc(CN2c3ccccc3C(OCc3ccccc3)=NS2(=O)=O)cc1 ZINC000006522505 GI Annotated Anodyne Cn1c(N/N=C/c2ccc(Cl)cc2)nc(-c2ccc(Cl)cc2)c(C#N)c1=O ZINC000006523612 GI Annotated Mild CC1(C)CC(=O)C(/C=N/CC2CCN(C(=O)Nc3ccccc3)CC2)=C(O)C1 ZINC000006530842 GI Annotated Mild O=C1Nc2ccc(Cl)cc2[C@@](C#CC2CC2)(C(F)(F)F)[C@H]1OCC1CC1 ZINC000006567424 GI Annotated Mild Fc1cc(C2=C[C@H](c3ccc4c(c3)OCO4)NC(=S)N2)c(Cl)cc1Cl ZINC000006567548 GI Annotated Anodyne C[C@H]1C(=NO)[C@H](C)[C@H](c2ccc(N(C)C)cc2)N[C@@H]1c1ccc(N(C)C)cc1 ZINC000006576675 GI Annotated Mild C[C@@H]1C(=NO)[C@H](C)[C@H](c2ccc(N(C)C)cc2)N[C@H]1c1ccc(N(C)C)cc1 ZINC000006576676 GI Annotated Mild C[C@H]1C(=NO)[C@H](C)[C@H](c2ccc(N(C)C)cc2)N[C@H]1c1ccc(N(C)C)cc1 ZINC000006576677 GI Annotated Mild O[C@@]12CCCC[C@@H]1[C@@H](c1ccc3c(c1)OCO3)N(Cc1ccc(F)cc1)CC2 ZINC000006576846 GI Annotated Anodyne O[C@@]12CCCC[C@H]1[C@@H](c1ccc3c(c1)OCO3)N(Cc1ccc(F)cc1)CC2 ZINC000006576848 GI Annotated Anodyne O=[N+]([O-])c1ccc(C2=NOC3=c4ccccc4=CSC3=C2c2ccccc2)cc1 ZINC000006579044 GI Annotated Bother O=c1nc2c(ncn2Cc2ccccc2)c(-c2cccs2)n1Cc1ccccc1 ZINC000006581055 GI Annotated Anodyne O=C(c1ccn(S(=O)(=O)c2ccccc2)c1)c1ccc(Cl)cc1Cl ZINC000006581609 GI Annotated Anodyne COc1ccc(C(=O)O[C@@H]2C[C@@H]3[C@H](C=C2C)C(C)(C)CCC[C@]3(C)O)cc1O ZINC000006624450 GI Annotated Anodyne Oc1c(-c2nnc(Cc3ccc(F)cc3)o2)nc(-c2ccoc2)c2cccnc12 ZINC000006717761 GI Annotated Anodyne Cc1cccc(NC(=O)[C@@H]2c3ccccc3C(=O)N(C)[C@@H]2c2cccs2)n1 ZINC000006722051 GI Annotated Anodyne Cc1cccc(NC(=O)[C@H]2c3ccccc3C(=O)N(C)[C@@H]2c2cccs2)n1 ZINC000006722054 GI Annotated Anodyne Cc1cccc(NC(=O)[C@@H]2c3ccccc3C(=O)N(C)[C@H]2c2cccs2)n1 ZINC000006722057 GI Annotated Anodyne Cc1cccc(NC(=O)[C@H]2c3ccccc3C(=O)N(C)[C@H]2c2cccs2)n1 ZINC000006722059 GI Annotated Anodyne CO/C(O)=C1/C(C)=Nc2nc(SC)nc(O)c2[C@H]1c1ccc(Cl)cc1 ZINC000006723868 GI Annotated Anodyne CO/C(O)=C1/C(C)=Nc2nc(SC)nc(O)c2[C@@H]1c1ccc(Cl)cc1 ZINC000006723870 GI Annotated Anodyne CN1C(=O)c2ccccc2[C@@H](C(=O)Nc2ccccc2F)[C@H]1c1cccs1 ZINC000006725203 GI Annotated Anodyne CN1C(=O)c2ccccc2[C@@H](C(=O)Nc2ccccc2F)[C@@H]1c1cccs1 ZINC000006725204 GI Annotated Anodyne CN1C(=O)c2ccccc2[C@H](C(=O)Nc2ccccc2F)[C@H]1c1cccs1 ZINC000006725205 GI Annotated Anodyne CN1C(=O)c2ccccc2[C@H](C(=O)Nc2ccccc2F)[C@@H]1c1cccs1 ZINC000006725206 GI Annotated Anodyne COc1ccc(-c2nnc(C3CCN(C(=O)c4c(F)cccc4F)CC3)o2)cc1 ZINC000006737483 GI Annotated Anodyne Cc1ccsc1CCNC(=O)CCc1nc2cccnc2n1-c1ccccc1 ZINC000006737646 GI Annotated Anodyne COc1ccc(N2C(=O)CS[C@H]2c2ccc3cccc(O)c3n2)cc1Cl ZINC000006738777 GI Annotated Anodyne COc1ccc(N2C(=O)CS[C@@H]2c2ccc3cccc(O)c3n2)cc1Cl ZINC000006738778 GI Annotated Anodyne CC1=C(C(=O)Nc2ccc(Cc3ccncc3)cc2)C2(CCCCC2)OC1=O ZINC000006746385 GI Annotated Anodyne Cc1ccnc(NC(=O)Nc2sc3nc4n(c(=O)c3c2C)CC[C@H](C)CC4)c1 ZINC000006750156 GI Annotated Anodyne Cc1ccnc(NC(=O)Nc2sc3nc4n(c(=O)c3c2C)CC[C@@H](C)CC4)c1 ZINC000006750157 GI Annotated Anodyne O=C(CCC(=O)n1ncc2ccc(Cl)cc21)N[C@H]1CCCc2ccccc21 ZINC000006768492 GI Annotated Anodyne O=C(CCC(=O)n1ncc2ccc(Cl)cc21)N[C@@H]1CCCc2ccccc21 ZINC000006768493 GI Annotated Anodyne CC1=C(C(=O)Nc2ccccc2Br)C2(CCC(C)CC2)OC1=O ZINC000006772308 GI Annotated Anodyne CC1=C(C(=O)Nc2ccc(Br)cc2F)C2(CCCCC2)OC1=O ZINC000006772353 GI Annotated Anodyne CN1C(=O)c2ccccc2Sc2ccc(NC(=O)NCc3ccco3)cc21 ZINC000006795960 GI Annotated Anodyne Cc1cccc(C)c1NC(=O)CN1C(=O)c2ccccc2Sc2ncccc21 ZINC000006796988 GI Annotated Anodyne Cc1cc(C)cc(NC(=O)CN2C(=O)c3ccccc3Sc3ncccc32)c1 ZINC000006797025 GI Annotated Anodyne CC(C)CCNC(=O)CCCN1C(=O)c2ccccc2Sc2ncccc21 ZINC000006797081 GI Annotated Anodyne CC[C@@H](C(=O)N1CCC(C)CC1)n1nc(C)c2sc3ccccc3c2c1=O ZINC000006799216 GI Annotated Anodyne CC[C@H](C(=O)N1CCC(C)CC1)n1nc(C)c2sc3ccccc3c2c1=O ZINC000006799217 GI Annotated Anodyne COc1ccc(Br)cc1CNC(=O)c1cc2sc(C)cc2n1C ZINC000006804734 GI Annotated Anodyne Cc1nc2cc(-c3ccccc3)nn2c(C)c1CC(=O)N[C@@H](C)c1cccs1 ZINC000006809006 GI Annotated Anodyne Cc1nc2cc(-c3ccccc3)nn2c(C)c1CC(=O)N[C@H](C)c1cccs1 ZINC000006809007 GI Annotated Anodyne COc1ccc(C)cc1/N=C(\O)C1(S(=O)(=O)c2ccc(Cl)cc2)CC1 ZINC000006818886 GI Annotated Anodyne CCCCN(C)C(=O)[C@@H]1c2ccccc2C(=O)N(C)[C@@H]1c1c[nH]c2ccccc12 ZINC000006819376 GI Annotated Anodyne CCCCN(C)C(=O)[C@H]1c2ccccc2C(=O)N(C)[C@@H]1c1c[nH]c2ccccc12 ZINC000006819377 GI Annotated Anodyne CCCCN(C)C(=O)[C@@H]1c2ccccc2C(=O)N(C)[C@H]1c1c[nH]c2ccccc12 ZINC000006819378 GI Annotated Anodyne CCCCN(C)C(=O)[C@H]1c2ccccc2C(=O)N(C)[C@H]1c1c[nH]c2ccccc12 ZINC000006819379 GI Annotated Anodyne COC(=O)c1cc2sc(C)cc2n1CC(=O)Nc1ccc(C)cc1Cl ZINC000006820591 GI Annotated Anodyne Cc1ccc2c(c1)N(CC(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C)C(=O)c1cccnc1O2 ZINC000006878061 GI Annotated Anodyne Cc1ccc2c(c1)N(CC(=O)N[C@H]1CCC[C@H](C)[C@@H]1C)C(=O)c1cccnc1O2 ZINC000006878062 GI Annotated Anodyne Cc1ccc2c(c1)N(CC(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C)C(=O)c1cccnc1O2 ZINC000006878063 GI Annotated Anodyne Cc1ccc2c(c1)N(CC(=O)N[C@H]1CCC[C@@H](C)[C@@H]1C)C(=O)c1cccnc1O2 ZINC000006878064 GI Annotated Anodyne O=C(CN1C(=O)c2cccnc2Oc2ccc(Cl)cc21)Nc1ccccc1F ZINC000006878107 GI Annotated Anodyne Cc1ccc(NC(=O)CN2C(=O)c3cccnc3Oc3ccc(Cl)cc32)cc1 ZINC000006878139 GI Annotated Anodyne CCc1nnc(SCC(=O)N(C)C2CCCCC2)c2cc3sccc3n12 ZINC000006893874 GI Annotated Anodyne CC[C@H](Sc1nncn2c1cc1oc(C)cc12)C(=O)NCc1ccc(C)cc1 ZINC000006894065 GI Annotated Anodyne CC[C@@H](Sc1nncn2c1cc1oc(C)cc12)C(=O)NCc1ccc(C)cc1 ZINC000006894066 GI Annotated Anodyne CC[C@H](Sc1nnc(C)n2c1cc1occc12)C(=O)Nc1ccccc1F ZINC000006894119 GI Annotated Anodyne CC[C@@H](Sc1nnc(C)n2c1cc1occc12)C(=O)Nc1ccccc1F ZINC000006894120 GI Annotated Anodyne O=C(NCc1cccs1)c1ccc(C[S@](=O)Cc2ccccc2Cl)o1 ZINC000006895856 GI Annotated Anodyne O=C(NCc1cccs1)c1ccc(C[S@@](=O)Cc2ccccc2Cl)o1 ZINC000006895857 GI Annotated Anodyne CCN(c1ccccc1)S(=O)(=O)c1ccc(F)c(/C(O)=N/CCC(C)C)c1 ZINC000006919285 GI Annotated Mild CCOC(=O)c1cc(C)n(CC2CCC(C(=O)N3CCC[C@H](C)C3)CC2)c1C ZINC000006942001 GI Annotated Anodyne CCOC(=O)c1cc(C)n(CC2CCC(C(=O)N3CCC[C@@H](C)C3)CC2)c1C ZINC000006942008 GI Annotated Anodyne CCN(CC)c1ncnc2sc(C(=O)Nc3c(F)cccc3F)c(C)c12 ZINC000006948065 GI Annotated Anodyne CCOc1ccc2c(c1)SC1=N[C@@](c3ccccc3)(C(F)(F)F)NC(=O)N12 ZINC000006962279 GI Annotated Anodyne CCOc1ccc2c(c1)SC1=N[C@](c3ccccc3)(C(F)(F)F)NC(=O)N12 ZINC000006962280 GI Annotated Anodyne O=C(CSc1nnc2c(n1)[nH]c1ccccc12)c1cccc(Br)c1 ZINC000006992821 GI Annotated Anodyne Cc1nc(C)c(-c2ccc3c(c2)CCCN3C(=O)c2ccc(O)cc2O)s1 ZINC000653606719 GI Annotated Anodyne C[C@@H]1CCc2cc(-c3nccn3C)ccc2N1C(=O)c1cc(Cl)c(O)cc1O ZINC000653633827 GI Annotated Anodyne C[C@H]1CCc2cc(-c3nccn3C)ccc2N1C(=O)c1cc(Cl)c(O)cc1O ZINC000653633828 GI Annotated Anodyne Cc1ncc(C)c(-c2ccc3c(c2)CC[C@H](C)N3C(=O)c2ccc(O)cc2O)n1 ZINC000653634441 GI Annotated Anodyne C[C@H]1CCc2cc(-c3ncccc3C#N)ccc2N1C(=O)c1ccc(O)cc1O ZINC000653662274 GI Annotated Mild C[C@@H]1CCc2cc(-c3ncccc3C#N)ccc2N1C(=O)c1ccc(O)cc1O ZINC000653662275 GI Annotated Mild Cc1nn2c(=O)cc(-c3ccc4n[nH]cc4c3)[nH]c2c1-c1ccc(Cl)cc1 ZINC000653664900 GI Annotated Anodyne Fc1ccc(CC2CCN(c3nc4ccncc4nc3NC3CC3)CC2)c(F)c1 ZINC000653665383 GI Annotated Anodyne Cc1cc(-c2ccc3c(c2)CC[C@H](C)N3C(=O)c2ccc(O)cc2O)cnc1N ZINC000653668779 GI Annotated Anodyne Cn1ccnc1-c1ccc(N(Cc2ccccc2)C(=O)c2ccc(O)cc2O)cc1 ZINC000653668887 GI Annotated Anodyne Clc1ccc(OC2CCN(c3nc4cnccc4nc3NC3CC3)CC2)cc1 ZINC000653670666 GI Annotated Anodyne CCc1nccnc1-c1ccc2c(c1)CC[C@H](C)N2C(=O)c1ccc(O)cc1O ZINC000653671206 GI Annotated Anodyne Cc1cnc(C)c(-c2ccc3c(c2)CC[C@H](C)N3C(=O)c2ccc(O)cc2O)n1 ZINC000653671244 GI Annotated Anodyne C[C@H](C(=O)Nc1cnc2cnc(-c3cccc([N+](=O)[O-])c3)cn12)c1ccccc1 ZINC000653671301 GI Annotated Bother C[C@@H](C(=O)Nc1cnc2cnc(-c3cccc([N+](=O)[O-])c3)cn12)c1ccccc1 ZINC000653671302 GI Annotated Bother Cc1cc(N)cnc1-c1ccc2c(c1)CC[C@H](C)N2C(=O)c1ccc(O)cc1O ZINC000653675523 GI Annotated Anodyne O=C(c1cc(Cl)c(O)cc1O)N1c2ccccc2CC[C@@H]1c1cccnc1 ZINC000653678777 GI Annotated Anodyne COc1ccc(-c2c(C)nn3c(=O)cc(-c4ccc5ncccc5c4)[nH]c23)cc1 ZINC000653682142 GI Annotated Anodyne Cc1cnc(-c2cnn3c(=O)cc(-c4ccc(Cl)c(Cl)c4)[nH]c23)s1 ZINC000653684243 GI Annotated Anodyne CCc1nn2cc(-c3nc4ccc(OCc5ccncc5)cc4o3)nc2s1 ZINC000653684784 GI Annotated Anodyne Cc1nc(N)ccc1-c1ccc2c(c1)CC[C@H](C)N2C(=O)c1ccc(O)cc1O ZINC000653685694 GI Annotated Anodyne COc1ccc(-c2cc(NC(=O)N=c3cc[nH]cc3)cc(C(F)(F)F)c2)cn1 ZINC000653687967 GI Annotated Anodyne O=c1c2oc3nc(C(F)(F)F)ccc3c2ncn1/N=C/c1ccc(Cl)cc1 ZINC000653690486 GI Annotated Mild N#CCCCc1nc2nc(C(=O)c3ccccc3)c(-c3ccccc3)c-2c(O)[nH]1 ZINC000653691228 GI Annotated Mild Cc1ccc2c(c1)C(=O)N(c1ccc(NC(=O)c3occc3C)c(F)c1)C2=O ZINC000653696869 GI Annotated Anodyne Cc1ccoc1C(=O)Nc1ccc(N2C(=O)c3ccc(Cl)cc3C2=O)cc1F ZINC000653696902 GI Annotated Anodyne COC(=O)c1ccc(Cn2c(C)nc3c([N+](=O)[O-])c(Cl)c(Cl)cc32)cc1 ZINC000653699450 GI Annotated Bother O=C(/C=C/C=C/c1ccccc1)NCCN=c1c2c([nH]c3ccccc13)CCCC2 ZINC000653707770 GI Annotated Anodyne CCCCOc1ccc2nnnc(Nc3cccc(OC(F)(F)F)c3)c2n1 ZINC000653708741 GI Annotated Anodyne Cc1cn(-c2ccc3c(c2)NC(=O)c2ccc(Cc4ccccc4)nc2N3)cn1 ZINC000653709001 GI Annotated Anodyne CC1(C)OCc2c(Nc3n[nH]c4c(Cl)cc(F)cc34)nc(-c3cn[nH]c3)nc21 ZINC000653710219 GI Annotated Anodyne CC1(C)OCc2c(Nc3n[nH]c4c(Cl)c(F)ccc34)nc(-c3cn[nH]c3)nc21 ZINC000653710227 GI Annotated Anodyne CCOC(=O)c1sc(NCc2cnc[nH]2)c(C#N)c1-c1ccc(Cl)cc1 ZINC000653713020 GI Annotated Mild O=C(Cc1ccc2c(c1)Cc1ccccc1-2)Nc1ccc(-c2cnccn2)cn1 ZINC000653714189 GI Annotated Anodyne CC(=O)N1N=C(c2ccc(N(C)C)cc2)O[C@@H]1c1ccc(Cl)c(Cl)c1 ZINC000653716303 GI Annotated Anodyne CC(=O)N1N=C(c2ccc(N(C)C)cc2)O[C@H]1c1ccc(Cl)c(Cl)c1 ZINC000653716304 GI Annotated Anodyne Cc1cc(C)c(CNC(=O)c2ccc3cnn(C4CCCC4)c3c2C)c(O)n1 ZINC000653716371 GI Annotated Anodyne CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C/c1cn(C[C@H]2CO2)c2ccccc12 ZINC000653717431 GI Annotated Clean CC1=NN(c2ccc(Cl)cc2)C(=O)/C1=C/c1cn(C[C@@H]2CO2)c2ccccc12 ZINC000653717432 GI Annotated Clean CCNS(=O)(=O)c1ccc(NC2CCCCC2)c(NCc2ccccc2)c1 ZINC000653717541 GI Annotated Anodyne COc1ccc(CNc2c(-c3cc([N+](=O)[O-])ccc3O)nc3ccccn23)cc1 ZINC000653717583 GI Annotated Bother O=C(NNc1ccccc1)c1nc(Nc2ccccc2)nc(Nc2ccccc2)n1 ZINC000653720269 GI Annotated Reactive Cc1noc(C)c1-c1cnc2c(c1)nc(NC1CCOCC1)n2CC1CCCC1 ZINC000653720294 GI Annotated Anodyne C[C@@H](CN1C(=O)c2ccccc2[C@@H]1C(=O)NCC(F)F)c1ccc(Cl)cc1 ZINC000653724617 GI Annotated Anodyne C[C@H](CN1C(=O)c2ccccc2[C@@H]1C(=O)NCC(F)F)c1ccc(Cl)cc1 ZINC000653724618 GI Annotated Anodyne C[C@@H](CN1C(=O)c2ccccc2[C@H]1C(=O)NCC(F)F)c1ccc(Cl)cc1 ZINC000653724619 GI Annotated Anodyne C[C@H](CN1C(=O)c2ccccc2[C@H]1C(=O)NCC(F)F)c1ccc(Cl)cc1 ZINC000653724620 GI Annotated Anodyne O=C(O)c1cc(S(=O)(=O)Nc2ccc3ccccc3c2)c2ccccc2c1O ZINC000653724744 GI Annotated Anodyne CNC[C@@H](Cc1ccccc1)N1CCN(CC2CCC(C)CC2)[C@H](C(C)C)C1 ZINC000653725395 GI Annotated Anodyne CN1CC[C@H](CCCC#Cc2ccccc2Cc2ccccc2)[C@@H](C(=O)O)C1 ZINC000653735547 GI Annotated Mild COC(=O)c1ccnc2cc(OCc3ccc(Cl)c(OCC4CC4)c3)[nH]c12 ZINC000653735943 GI Annotated Anodyne CNC(=O)c1ccnc2cc(OCc3ccc(Cl)c(OC(F)(F)F)c3)[nH]c12 ZINC000653736049 GI Annotated Anodyne O=C(O)c1ccnc2cc(OCc3ccc(Cl)c(OC(F)(F)F)c3)[nH]c12 ZINC000653736197 GI Annotated Anodyne Cc1ccc(C(=O)NNc2c(Br)cccc2Br)cc1 ZINC000653737376 GI Annotated Reactive COC[C@H](C)CN1[C@H](C)Cc2cc(O)ccc2[C@H]1c1ccc(/C=C/C(=O)O)cc1 ZINC000653737674 GI Annotated Anodyne O=C(OCc1cn(-c2cccc(C(F)(F)F)c2)nn1)c1cc2ccccc2[nH]1 ZINC000653738868 GI Annotated Anodyne C[C@H](CF)CN1[C@H](C)Cc2cc(O)ccc2[C@H]1c1ccc(/C=C/C(=O)O)cc1 ZINC000653739070 GI Annotated Anodyne Cc1cc(F)ccc1C1CCN(C[C@@H]2Cc3c(Cl)ccc(O)c3CN2)CC1 ZINC000653739243 GI Annotated Clean Cc1cc(F)ccc1C1CCN(C[C@H]2Cc3c(Cl)ccc(O)c3CN2)CC1 ZINC000653739244 GI Annotated Clean COC(=O)[C@]1(C)[C@@H](O)CC[C@]2(C)c3cc4c(cc3C(=O)C[C@H]21)[nH]c1ccccc14 ZINC000653745173 GI Annotated Anodyne O=C(CC(CC(=O)c1ccccc1O)c1ccc(O)cc1O)c1ccccc1O ZINC000653753979 GI Annotated Anodyne CCOc1cc(OC)cc2oc(-c3cn4nc(Br)sc4n3)cc12 ZINC000653754916 GI Annotated Anodyne CN(C)C(=O)c1ccc(-c2cnc3cnc(-c4ccc5c(ccn5C)c4)cn23)cc1 ZINC000653758400 GI Annotated Anodyne CN(C)CCCC/N=C/c1c(-c2nc(O)c3ccccc3n2)[nH]c2ccccc12 ZINC000653758720 GI Annotated Mild CCCCC[C@]12C[C@@]1(C(=O)OCC)C(=O)Nc1ccc(Br)cc12 ZINC000653759938 GI Annotated Anodyne CSc1nn2cc(-c3nc4ccc(OCc5ccncc5)cc4o3)nc2s1 ZINC000653762206 GI Annotated Anodyne CSc1nn2cc(-c3nc4ccc(OCc5cccnc5)cc4o3)nc2s1 ZINC000653762259 GI Annotated Anodyne COc1cc(-c2nn(C)nc2-c2cc3ccccc3s2)cc(OC)c1OC ZINC000653764366 GI Annotated Anodyne CSc1nn2cc(-c3nc4c(OCc5cccnc5)cccc4o3)nc2s1 ZINC000653764991 GI Annotated Anodyne CCOC(=O)CCCOc1cccc2cc(-c3cn4nc(CC)sc4n3)oc12 ZINC000653765004 GI Annotated Anodyne Cc1nc(N[C@@H]2CCCc3ccccc32)cc(-c2ccc(C(N)=O)c(F)c2)n1 ZINC000653765614 GI Annotated Anodyne COc1ccc(C[C@H](O)c2ccc3c(c2OC)C=CC(C)(C)O3)c(F)c1OC ZINC000653765624 GI Annotated Anodyne COc1ccc(C[C@@H](O)c2ccc3c(c2OC)C=CC(C)(C)O3)c(F)c1OC ZINC000653765625 GI Annotated Anodyne COc1ccc(C(C)(C)[C@@H](O)c2ccc3c(c2OC)C=CC(C)(C)O3)nc1OC ZINC000653766950 GI Annotated Anodyne COc1ccc(C(C)(C)[C@H](O)c2ccc3c(c2OC)C=CC(C)(C)O3)nc1OC ZINC000653766951 GI Annotated Anodyne COc1ccc([C@@H](C)[C@@H](O)c2ccc3c(c2OC)C=CC(C)(C)O3)nc1OC ZINC000653767412 GI Annotated Anodyne COc1ccc([C@H](C)[C@H](O)c2ccc3c(c2OC)C=CC(C)(C)O3)nc1OC ZINC000653767413 GI Annotated Anodyne COc1ccc([C@H](C)[C@@H](O)c2ccc3c(c2OC)C=CC(C)(C)O3)nc1OC ZINC000653767414 GI Annotated Anodyne COc1ccc([C@@H](C)[C@H](O)c2ccc3c(c2OC)C=CC(C)(C)O3)nc1OC ZINC000653767415 GI Annotated Anodyne CSc1nn2cc(-c3nc4c(OCc5ccccn5)cccc4o3)nc2s1 ZINC000653767467 GI Annotated Anodyne O=[N+]([O-])c1c[nH]nc1-c1nc(-c2ccc(Oc3ccc(F)c(F)c3)cc2)no1 ZINC000653768392 GI Annotated Bother COc1ccc([C@H](C)C(=O)c2ccc3c(c2OC)C=CC(C)(C)O3)nc1OC ZINC000653768948 GI Annotated Anodyne COc1ccc(C(C)(C)C(=O)c2ccc3c(c2OC)C=CC(C)(C)O3)nc1OC ZINC000653768963 GI Annotated Anodyne CSc1nn2cc(-c3nc4c(OCc5ccncc5)cccc4o3)nc2s1 ZINC000653769217 GI Annotated Anodyne Cc1nc(N[C@@H]2CCOc3ccccc32)cc(-c2ccc3c(c2)N(C)CCO3)n1 ZINC000653769239 GI Annotated Anodyne COc1ccc(CC(=O)c2ccc3c(c2OC)C=CC(C)(C)O3)c(F)c1OC ZINC000653771305 GI Annotated Anodyne COc1ccc([C@@H](C)C(=O)c2ccc3c(c2OC)C=CC(C)(C)O3)nc1OC ZINC000653773226 GI Annotated Anodyne Cc1cc(S(=O)(=O)N2CC(F)(F)C[C@@H]2c2ccc(F)cc2)cc(C)c1F ZINC000653775506 GI Annotated Anodyne O=C(Nc1cccc(O)c1)c1cc2cc(Cl)cc(Br)c2oc1=O ZINC000653780432 GI Annotated Anodyne C=CC(=C)CC[C@@]1(C)[C@@H]2C[C@@H](O)C=C3[C@@H](OC)O[C@@H](OC(C)=O)[C@]32CC[C@H]1C ZINC000653780777 GI Annotated Mild Cc1ccc(OC(=O)N(Nc2ccccc2)S(=O)(=O)c2ccccc2)cc1 ZINC000653781611 GI Annotated Reactive CCCc1cccc2c(-c3cnc(-c4cnc(C(=O)O)c(OC)c4)s3)n[nH]c12 ZINC000653782560 GI Annotated Anodyne CCCc1cccc2c(-c3cnc(-c4ccc(CC(=O)O)nc4)s3)n[nH]c12 ZINC000653782574 GI Annotated Anodyne CCCc1cccc2c(-c3cnc(-c4ccc(C(=O)OC)nc4)s3)n[nH]c12 ZINC000653784950 GI Annotated Anodyne CCCc1cccc2c(-c3cnc(-c4cnc(C(=O)O)c(O)c4)s3)n[nH]c12 ZINC000653785027 GI Annotated Anodyne CC(=O)c1cc(-c2nc3ccccc3s2)c2cc(N3CCOCC3)ccn12 ZINC000653786060 GI Annotated Anodyne O=C(O)c1ccc(-c2ncc(-c3n[nH]c4c(CC5CC5)cccc34)s2)cn1 ZINC000653787439 GI Annotated Anodyne CC[C@H](C)Cn1c(-c2c(F)cccc2F)c(Cl)nc(-n2ccnc2)c1=O ZINC000653790075 GI Annotated Anodyne CCCc1cccc2c(-c3cnc(-c4ccc(C(=O)O)c(O)n4)s3)n[nH]c12 ZINC000653790209 GI Annotated Anodyne COc1cc([C@H]2COc3cc4c(c(OC)c3C2)C=CC(C)(C)O4)c(O)cc1O ZINC000653790520 GI Annotated Anodyne COc1cc([C@@H]2COc3cc4c(c(OC)c3C2)C=CC(C)(C)O4)c(O)cc1O ZINC000653790521 GI Annotated Anodyne CC(C)c1nc(-c2nnc(C3CCN(CC4CCC4)CC3)o2)c2ccccn12 ZINC000653790931 GI Annotated Anodyne CCCCCC/C(C)=N/N=C1\SCC(=O)N1Cc1ccc([N+](=O)[O-])cc1 ZINC000653792883 GI Annotated Mild Cc1ccc2cc(C)n(-c3nc4c(c(NCc5ccccc5)n3)CNCC4)c2c1 ZINC000653793692 GI Annotated Anodyne Cc1ccc2c(c1)cc(C)n2-c1nc2c(c(NCc3ccccc3)n1)CNCC2 ZINC000653793710 GI Annotated Anodyne O=C(NCCCCc1ccccc1)n1c(=O)oc2cc(C(F)(F)F)ccc21 ZINC000653794061 GI Annotated Anodyne COc1cc2c(cc1C(=O)N1CCCCC1)CC[C@H]1C(C)(C)[C@@H](O)CC[C@]21C ZINC000653795272 GI Annotated Anodyne CCc1ccc(-c2nc3ccccn3c2NCc2ccc(NC(=N)N)cc2)cc1 ZINC000653796447 GI Annotated Anodyne COc1cccc2c(OCc3ccccc3)nc(-n3c(N)nc4ccccc43)nc12 ZINC000653797873 GI Annotated Anodyne COc1cccc2c(CCc3ccccc3)nc(-n3c(N)nc4ccccc43)nc12 ZINC000653797950 GI Annotated Anodyne CC(C)n1cc(C(=O)C(=O)Nc2ccc(C(F)(F)F)nc2)c2ccccc21 ZINC000653799594 GI Annotated Anodyne CN1CCC=C(c2ccc(CN(C)C/C=C/c3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC000653801371 GI Annotated Bother COc1cccc2c(Cc3ccccc3)nc(-n3c(N)nc4ccccc43)nc12 ZINC000653801660 GI Annotated Anodyne CCCc1cccc2c(-c3cnc(-c4cnc(C(=O)OC)c(O)c4)s3)n[nH]c12 ZINC000653802172 GI Annotated Anodyne CCCc1c(O)ccc2c(-c3cnc(-c4cnc(C(=O)O)cc4C)s3)n[nH]c12 ZINC000653804920 GI Annotated Anodyne Cc1ccc(S(=O)(=O)N(Nc2ccccc2)C(=O)Oc2ccccc2)cc1 ZINC000653805746 GI Annotated Reactive CC(C)C1=CC[C@H](CS(=O)(=O)c2nc3ccccc3o2)[C@@]12C=CC(=O)CC2 ZINC000653805854 GI Annotated Mild CCOCC(=O)N1c2ccccc2CCc2ccc(NC(=O)OC(C)C)cc21 ZINC000653808746 GI Annotated Anodyne O=c1ccc2c3c(cc[n+]2Cc2ccc(C(F)(F)F)cc2)c2ccccc2n13 ZINC000653808766 GI Annotated Bother N=C(S)n1nc(-c2ccc([N+](=O)[O-])cc2)c(Cc2cccc(Cl)c2)c1O ZINC000653809988 GI Annotated Bother COCCCc1nc2nc(C(=O)c3ccccc3)c(-c3ccccc3)c-2c(O)[nH]1 ZINC000653810874 GI Annotated Anodyne CCOCCc1nc2nc(C(=O)c3ccccc3)c(-c3ccccc3)c-2c(O)[nH]1 ZINC000653810966 GI Annotated Anodyne CCc1nc2ccccc2nc1SCC(=O)NC(=O)Nc1cccc(F)c1C ZINC000653816506 GI Annotated Anodyne CCCn1c(=O)ccc2c(-c3cnc(-c4ccc(C(C)C)nc4)s3)[nH]nc21 ZINC000653819583 GI Annotated Clean CCCCCCCC[C@H]1OCc2c[n+](C)c(C)c(OC(=O)N(C)C)c2CO1 ZINC000653821675 GI Annotated Mild CCCCCCCC[C@@H]1OCc2c[n+](C)c(C)c(OC(=O)N(C)C)c2CO1 ZINC000653821676 GI Annotated Mild CC1(C)Oc2cc3oc(=O)ccc3cc2C[C@@H]1OC(=O)/C=C/c1cccc(F)c1 ZINC000653822635 GI Annotated Anodyne Cc1nc2ccccc2nc1SCC(=O)NC(=O)Nc1ccccc1Cl ZINC000653831376 GI Annotated Anodyne C[C@H]1Sc2nnc(-c3cc(-c4ccc(F)cc4)[nH]n3)n2N=C1c1ccccc1 ZINC000653834951 GI Annotated Anodyne C[C@@H]1Sc2nnc(-c3cc(-c4ccc(F)cc4)[nH]n3)n2N=C1c1ccccc1 ZINC000653834952 GI Annotated Anodyne CCCCN(C)C(=O)c1cc2c(C(=O)OC(C)(C)C)ncn2c2ccccc12 ZINC000653834985 GI Annotated Anodyne COc1ccc(N(C)c2nc(NCC3CCOCC3)c3ccccc3n2)cc1 ZINC000653837636 GI Annotated Anodyne COc1ccc(OC)c(-c2cc(-c3ccc(C(=O)NCC4CC4)s3)on2)c1 ZINC000653838503 GI Annotated Anodyne COc1ccc(OC)c(-c2cc(-c3ccc(C(=O)N4CCCC4)s3)on2)c1 ZINC000653838529 GI Annotated Anodyne O=C1c2ccccc2C(=O)c2c(O)c([C@H](O)C/C=C/c3ccccc3)cc(O)c21 ZINC000653846289 GI Annotated Clean O=C1c2ccccc2C(=O)c2c(O)c([C@@H](O)C/C=C/c3ccccc3)cc(O)c21 ZINC000653846294 GI Annotated Clean CC(C)(C)OC(=O)N1CCN(c2cccc3c2cnn3-c2ccccc2F)C1=O ZINC000653848801 GI Annotated Anodyne CC(=O)c1ccc(N2CCN(C(=O)c3nc4cc(Cl)ccc4s3)CC2)cc1 ZINC000653848802 GI Annotated Anodyne O=C1Nc2ccc(Cl)cc2[C@]12ON=C(c1ccccc1)N2c1ccccc1 ZINC000653849081 GI Annotated Anodyne O=C1Nc2cc(Cl)ccc2[C@]12ON=C(c1ccccc1)N2c1ccccc1 ZINC000653849103 GI Annotated Anodyne CCN(Cc1cc(=O)n2c(-c3cccnc3)c(C)sc2n1)c1ccc(F)cc1 ZINC000653850785 GI Annotated Anodyne CC(C)CC(=O)CN1CCN(c2cccc3c2cnn3-c2ccccc2F)C1=O ZINC000653850850 GI Annotated Anodyne O=C1Nc2ccccc2[C@]12ON=C(c1ccccc1)N2c1ccc(Cl)cc1 ZINC000653851640 GI Annotated Anodyne COc1ccc([C@@H]2COc3c(cc(C=O)c4c3C=CC(C)(C)O4)C2)c(OC)c1 ZINC000653856289 GI Annotated Anodyne CCOc1cccc(C)c1NC(=O)c1nnn(-c2cccc(Cl)c2C)c1C ZINC000653856860 GI Annotated Anodyne Cc1ccc(O)c([C@@H](NCc2ccccc2)C2=C(O)C(=O)c3ccccc3C2=O)c1 ZINC000653857549 GI Annotated Mild Cc1ccc(O)c([C@H](NCc2ccccc2)C2=C(O)C(=O)c3ccccc3C2=O)c1 ZINC000653857550 GI Annotated Mild COc1ccc(N[C@H](C2=C(O)C(=O)c3ccccc3C2=O)c2ccccn2)cc1 ZINC000653859550 GI Annotated Mild COc1ccc(N[C@@H](C2=C(O)C(=O)c3ccccc3C2=O)c2ccccn2)cc1 ZINC000653859551 GI Annotated Mild Cc1ccc(Nc2ncnc3cc(OC(C)C)c4c(c23)OCCO4)cc1[N+](=O)[O-] ZINC000653859676 GI Annotated Bother Cn1ccc(CN(c2ccc3[nH]ncc3c2)c2nc(-c3ccccn3)cs2)n1 ZINC000653861619 GI Annotated Anodyne Cc1ccc(Nc2ncnc3cc(OC(C)C)c4c(c23)OCCO4)cc1C#N ZINC000653861927 GI Annotated Mild COc1ccc(N2/C(=N/c3ccc(F)cc3)SC[C@]2(O)C(F)(F)F)cc1 ZINC000653870753 GI Annotated Mild COc1ccc(N2/C(=N/c3ccc(F)cc3)SC[C@@]2(O)C(F)(F)F)cc1 ZINC000653870754 GI Annotated Mild O=C1C(O)=C([C@@H](NCc2ccccc2)c2ccccc2O)C(=O)c2ccccc21 ZINC000653873010 GI Annotated Mild O=C1C(O)=C([C@H](NCc2ccccc2)c2ccccc2O)C(=O)c2ccccc21 ZINC000653873011 GI Annotated Mild COc1ccccc1[C@]1(OCC2CCCCC2)SC=C(C)n2c1noc2=O ZINC000653886023 GI Annotated Anodyne COc1ccccc1[C@@]1(OCC2CCCCC2)SC=C(C)n2c1noc2=O ZINC000653886024 GI Annotated Anodyne CNc1cccc(CCCNc2cccc(CCCNc3ccccn3)n2)n1 ZINC000653887558 GI Annotated Anodyne CN(C)CCCn1cc(-c2ccc3c(c2)C(=O)c2c-3[nH]c3cc(C#N)ccc23)cn1 ZINC000653887588 GI Annotated Mild O=C(N/N=C/c1ccc([N+](=O)[O-])o1)C12C[C@H]3C[C@@H](C1)CC(C1CCCC1)(C3)C2 ZINC000653887838 GI Annotated Reactive O=C(N/N=C/c1ccc([N+](=O)[O-])o1)C12C[C@H]3C[C@@H](C1)CC(c1ccccc1)(C3)C2 ZINC000653887846 GI Annotated Reactive O=c1c2cnccc2nc(/C=C/c2ccc(Cl)cc2)n1-c1cccc(O)c1 ZINC000653894996 GI Annotated Anodyne Oc1ccc(I)c2nc3cc(Cl)c(Cl)cc3nc12 ZINC000653895033 GI Annotated Bother C1=C2CCCN(CCCCNCc3ccccc3)[C@H]2[C@@H]2C[C@H]1[C@H]1CCCCN1C2 ZINC000653895446 GI Annotated Anodyne CC(C)(C)c1nc2c(n1CC1CC1)CCN(/C=C/C(=O)c1ccccc1O)C2 ZINC000653899248 GI Annotated Mild C[C@H](Nc1ccncn1)c1nc2cccc(Cl)c2c(=O)n1-c1ccccc1 ZINC000653899359 GI Annotated Anodyne CN(C)CCCn1cc(-c2ccc3c(c2)-c2[nH]c4cc(C#N)ccc4c2C3=O)cn1 ZINC000653900949 GI Annotated Mild COc1cccc([C@]2(OCC3CCCCC3)SC=C(C)n3c2noc3=O)c1 ZINC000653905141 GI Annotated Anodyne COc1cccc([C@@]2(OCC3CCCCC3)SC=C(C)n3c2noc3=O)c1 ZINC000653905142 GI Annotated Anodyne COc1ccc([C@]2(OCC3CCCCC3)SC=C(C)n3c2noc3=O)cc1 ZINC000653905147 GI Annotated Anodyne COc1ccc([C@@]2(OCC3CCCCC3)SC=C(C)n3c2noc3=O)cc1 ZINC000653905148 GI Annotated Anodyne COC[C@@]1(C)CC[C@H]2[C@@H](CC[C@@H]3C[C@H](OC(=O)CCC(=O)O)CC[C@]23C)C1 ZINC000653909268 GI Annotated Anodyne CCn1cc(-c2csc(N)n2)c(=O)c2cc(N3CCCCC3)c(Cl)cc21 ZINC000653916399 GI Annotated Anodyne CNC[C@@H](Cc1ccccc1)N1CCN(CCC23CC4CC(CC(C4)C2)C3)CC1 ZINC000653918476 GI Annotated Anodyne COc1ccc(/C=C2/C(=O)c3cccn3[C@H]2c2ccc(O)c(OC)c2)c(OC)c1 ZINC000653918558 GI Annotated Mild COc1ccc(/C=C2/C(=O)c3cccn3[C@@H]2c2ccc(O)c(OC)c2)c(OC)c1 ZINC000653918559 GI Annotated Mild NC(=O)c1ccc2c(c1)CCCN2c1ccc(CNC2Cc3ccccc3C2)cc1 ZINC000066058793 GI Annotated Anodyne Cc1cc[s+](-c2c(C3CCC(S(C)(=O)=O)CC3)occ(Cl)c2=O)c1 ZINC000066058839 GI Annotated Anodyne COc1cccc2c1nc(CCc1nc(-c3ccccc3)cn1C)n1nc(C)cc21 ZINC000066058932 GI Annotated Anodyne COc1ccc2c(c1)nc(CCc1nc(-c3ccccc3)cn1C)n1nc(C)cc21 ZINC000066058933 GI Annotated Anodyne CS/C(=N\C(=O)c1sccc1Cl)NC(=O)c1sccc1Cl ZINC000066066039 GI Annotated Mild Cc1ccc(C2=NN(c3nnc(S)n3-c3ccc(Cl)cc3)C(=O)CC2)cc1 ZINC000066066225 GI Annotated Anodyne CCC(C)(C)C(=O)Cc1cc(C)c(C)c(S(=O)(=O)N2CCCCCC2)c1 ZINC000066066308 GI Annotated Anodyne CCOC(=O)c1c(N)oc2c1c(Sc1ccc(O)cc1)c(O)c1ncccc12 ZINC000066066410 GI Annotated Anodyne CC(=O)Oc1cc2c(c(OC(C)=O)c1)C(=O)OCCCCCCCCCC2 ZINC000066066662 GI Annotated Anodyne CSc1ccc(OCc2nc(Br)c(Br)n2C)cc1 ZINC000066074136 GI Annotated Anodyne CC(C)NCc1ccc(-c2cc(-c3cccc(C(=O)N[C@H](C)C#N)c3)no2)cc1 ZINC000066074514 GI Annotated Mild CCN(CC)c1ccc2c(c1)OC(/N=C/N)=C(C#N)[C@@H]2c1ccc(Cl)cc1 ZINC000066074606 GI Annotated Reactive CCN(CC)c1ccc2c(c1)OC(/N=C/N)=C(C#N)[C@H]2c1ccc(Cl)cc1 ZINC000066074607 GI Annotated Reactive Cc1ccc(-n2c(S)nnc2N2N=C(c3ccc(Cl)cc3)CCC2=O)cc1 ZINC000066077891 GI Annotated Anodyne CN1CCN(CCn2c3ccc4ccccc4c3c3nc4ccccc4nc32)CC1 ZINC000066077912 GI Annotated Bother C=C(CC[C@@]1(C)[C@H](C)CCC(=O)[C@@H]1C)[C@H](O)Cc1c(O)cc(C)c(C=O)c1O ZINC000066078010 GI Annotated Mild O=C(O)c1cc2c([nH]c3ccccc32)c(C(=O)c2cccc(Br)c2)n1 ZINC000066078457 GI Annotated Anodyne NNC(=O)Cn1c(-c2ccccc2O)cc(-c2ccccc2)c1-c1ccccc1 ZINC000066078662 GI Annotated Reactive O=[N+]([O-])c1cn(C[C@H](OCc2ccc(F)cc2)c2ccc(F)cc2F)cn1 ZINC000066078754 GI Annotated Bother O=[N+]([O-])c1cn(C[C@@H](OCc2ccc(F)cc2)c2ccc(F)cc2F)cn1 ZINC000066078756 GI Annotated Bother O=[N+]([O-])c1cn(C[C@@H](OCc2cc(F)cc(F)c2)c2ccc(F)cc2F)cn1 ZINC000066078762 GI Annotated Bother O=[N+]([O-])c1cn(C[C@H](OCc2cc(F)cc(F)c2)c2ccc(F)cc2F)cn1 ZINC000066078764 GI Annotated Bother COc1cc(-c2cn(C(C)C)c3cc(NS(C)(=O)=O)ccc23)ccc1C#N ZINC000066079705 GI Annotated Mild N=C(Nc1ccccc1)c1sc(C(=N)Nc2ccccc2)c2c1OCCO2 ZINC000066080207 GI Annotated Anodyne O=C(O)c1cc2c([nH]c3ccccc32)c(C(=O)c2ccccc2Br)n1 ZINC000066097423 GI Annotated Anodyne O=C(Nc1cccc2[nH]ncc12)N[C@@H]1CCOc2cc(OC(F)(F)F)ccc21 ZINC000066098922 GI Annotated Anodyne O=C(Nc1cccc2[nH]ncc12)N[C@H]1CCOc2cc(OC(F)(F)F)ccc21 ZINC000066098928 GI Annotated Anodyne CCCSC(=O)CCCNC(=S)Nc1cc(OC)c(Cl)cc1OC ZINC000066100003 GI Annotated Anodyne O=C(N/N=C\c1ccc(Oc2ccc(Br)cc2)cc1)c1ccncc1 ZINC000066101388 GI Annotated Reactive NCc1ccoc1CN(Cc1nc2ccccc2[nH]1)[C@@H]1CCCc2cccnc21 ZINC000066101750 GI Annotated Anodyne NCc1ccoc1CN(Cc1nc2ccccc2[nH]1)[C@H]1CCCc2cccnc21 ZINC000066101752 GI Annotated Anodyne N#Cc1c(O)nc(Sc2nc3ccccc3nc2Cl)nc1-c1ccccc1 ZINC000066101929 GI Annotated Mild C#Cc1cccc(Nc2nc3cc(C(=O)O)ccc3c3cnc(NC4CC4)nc23)c1 ZINC000066102245 GI Annotated Mild O=C(Cc1ccc(-n2nc(C(F)(F)F)c3c2CCCC3)cc1F)N1CCCC1 ZINC000066102597 GI Annotated Anodyne O=C1CCCN1Cc1ccc(-n2nc(C(F)(F)F)c3c2CCCC3)cc1F ZINC000066102609 GI Annotated Anodyne COc1ccc(CCNc2cc(-c3cccc(C(C)=O)c3)nc(OC)n2)cc1 ZINC000066102675 GI Annotated Anodyne CCCCCCCC[n+]1c(-c2ccc(S(C)(=O)=O)cc2)cn2cccnc21 ZINC000066103865 GI Annotated Mild CC(=O)c1ccc(N2CCC(CC(=O)Nc3nc4ccccc4o3)CC2)cc1 ZINC000066104914 GI Annotated Anodyne O=C(Nc1nnc(-c2ccco2)o1)c1cc(N2CCCCC2)nc2ccccc12 ZINC000066111630 GI Annotated Anodyne O=C([C@@H](F)c1ccc(-n2nc(C(F)(F)F)c3c2CCCC3)cc1)N1CCCC1 ZINC000066112037 GI Annotated Anodyne O=C([C@H](F)c1ccc(-n2nc(C(F)(F)F)c3c2CCCC3)cc1)N1CCCC1 ZINC000066112038 GI Annotated Anodyne C[C@H](C(=O)N1CCCC1)c1ccc(-n2nc(C(F)(F)F)c3c2CCCC3)cc1 ZINC000066112466 GI Annotated Anodyne C[C@@H](C(=O)N1CCCC1)c1ccc(-n2nc(C(F)(F)F)c3c2CCCC3)cc1 ZINC000066112467 GI Annotated Anodyne Nc1nc(-c2ccc(P(=O)(O)O)o2)c(-c2ccc(-c3ccccc3)cc2)s1 ZINC000066112503 GI Annotated Anodyne C#CCN1C(=O)[C@]2(O[C@@H](COc3ccccc3)CC3=C2CCC3)c2ccccc21 ZINC000066113824 GI Annotated Mild C#CCN1C(=O)[C@@]2(O[C@@H](COc3ccccc3)CC3=C2CCC3)c2ccccc21 ZINC000066113825 GI Annotated Mild C#CCN1C(=O)[C@@]2(O[C@H](COc3ccccc3)CC3=C2CCC3)c2ccccc21 ZINC000066113827 GI Annotated Mild O=C1CCCC2=C1[C@@H](c1cccc(F)c1)N=C(Nc1nc3ccccc3o1)N2 ZINC000066114509 GI Annotated Mild O=C1CCCC2=C1[C@H](c1cccc(F)c1)N=C(Nc1nc3ccccc3o1)N2 ZINC000066114511 GI Annotated Mild O=C1CCCC2=C1[C@@H](c1ccc(F)cc1)N=C(Nc1nc3ccccc3o1)N2 ZINC000066123701 GI Annotated Mild O=C1CCCC2=C1[C@H](c1ccc(F)cc1)N=C(Nc1nc3ccccc3o1)N2 ZINC000066123702 GI Annotated Mild Oc1cc(CN2CCCCC2)nc2c(-c3ccccc3)c(C(F)(F)F)nn12 ZINC000066124252 GI Annotated Anodyne C[C@@H](Cc1nnc(NC(=O)COc2ccc(F)cc2Cl)o1)CC(C)(C)C ZINC000066124282 GI Annotated Anodyne C[C@H](Cc1nnc(NC(=O)COc2ccc(F)cc2Cl)o1)CC(C)(C)C ZINC000066124284 GI Annotated Anodyne Cc1ccc([C@H]2N=C(Nc3nc4ccccc4o3)NC3=C2C(=O)CCC3)s1 ZINC000066128859 GI Annotated Mild Cc1ccc([C@@H]2N=C(Nc3nc4ccccc4o3)NC3=C2C(=O)CCC3)s1 ZINC000066128861 GI Annotated Mild O=C(Nc1ccc(Br)cc1)N1CCCN(Cc2ccccc2F)C1 ZINC000066136467 GI Annotated Anodyne O=C(Nc1ccc(N2C(=O)CC3(CCCCC3)C2=O)c(Cl)c1)c1ccccn1 ZINC000066139475 GI Annotated Anodyne CCCCc1nc2c(c3c1C[C@@H](C)OC3)CN(C(=O)Cc1cccs1)CC2 ZINC000066139789 GI Annotated Anodyne CCOc1ccc(C(=O)N[C@@H]2CCCc3c2cnn3-c2ccccc2F)cc1 ZINC000066148764 GI Annotated Anodyne CCOc1ccc(C(=O)N[C@H]2CCCc3c2cnn3-c2ccccc2F)cc1 ZINC000066148766 GI Annotated Anodyne COC(=O)c1sc2cc(Nc3ccc(F)cc3Br)cnc2c1N ZINC000066166778 GI Annotated Anodyne Cc1ccc2[nH]c(=O)c(CN(Cc3ccccc3)C(=O)c3ccccn3)cc2c1 ZINC000066166871 GI Annotated Anodyne CCCCCCCCCCCCn1n[n+](C)c2c1C(=O)c1ccccc1C2=O ZINC000066166979 GI Annotated Mild Cn1c(SCCc2nc3sc4c(c3c(=O)[nH]2)CCCC4)nc2ccccc21 ZINC000066251109 GI Annotated Anodyne COc1ccc(OC)c2c1C(=O)C=C([C@@H](CC=C(C)C)Oc1ccncc1)C2=O ZINC000066251111 GI Annotated Mild COc1cc(/C=C/c2nc3cc(Cl)ccc3c(=O)[nH]2)ccc1-n1cnc(C)c1 ZINC000066251333 GI Annotated Anodyne COc1cc(/C=C/c2nc3sc(C)c(C)c3c(=O)[nH]2)ccc1-n1cnc(C)c1 ZINC000066251336 GI Annotated Anodyne Brc1cccc(-c2c[nH]c(-c3cccc(CN4CCOCC4)c3)n2)c1 ZINC000066251446 GI Annotated Anodyne Cc1ccccc1C(=O)c1cccn1C/C=C/c1cccc(OCC(=O)O)c1 ZINC000066251668 GI Annotated Anodyne COc1ccc(OC)c2c1C(=O)C=C([C@@H](CC=C(C)C)OC(=O)C=C(C)C)C2=O ZINC000066252301 GI Annotated Mild Cc1ccc2[nH]c(=O)c(CN(Cc3ccco3)C(=O)c3ccc(C#N)cc3)cc2c1 ZINC000066252623 GI Annotated Mild CCCC(=O)O[C@H](CC=C(C)C)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O ZINC000066252741 GI Annotated Mild CN(C)CCn1cc2c(n1)N(C)c1ccc(Cl)cc1N(c1ccccc1)C2=O ZINC000066252838 GI Annotated Anodyne COCCn1cnc2c1C(=O)N(c1ccccc1)c1cc(Cl)ccc1N2C ZINC000066258507 GI Annotated Anodyne CC1(C)Oc2cc3oc(=O)ccc3cc2C[C@@H]1OC(=O)/C=C/c1cccs1 ZINC000066259082 GI Annotated Anodyne COc1ccc(/C=N/N(C(=O)c2ccc(Cl)cc2)C(=O)c2cccnc2)cc1 ZINC000066259156 GI Annotated Reactive COC(=O)c1sc2cc(Nc3ccccc3Br)cnc2c1N ZINC000066259494 GI Annotated Anodyne CC1(C)Oc2cc3c4c(c5ccc(O)cc5c3cc2O1)[C@H](O)[C@@H]1CCCN1C4 ZINC000066259524 GI Annotated Bother COc1ccc(OC)c2c1C(=O)C=C([C@@H](CC=C(C)C)Oc1cccnc1)C2=O ZINC000066259618 GI Annotated Mild Cc1ccc(N/N=C(\C(=O)c2ccc(Cl)cc2)c2nc(C)cc(O)n2)cc1 ZINC000066259808 GI Annotated Mild Cc1cccc(N/N=C(\C(=O)c2ccc(Cl)cc2)c2nc(C)cc(O)n2)c1 ZINC000066259809 GI Annotated Mild Cc1cccc(C(=O)c2cccn2C/C=C/c2cccc(OCC(=O)O)c2)c1 ZINC000066259817 GI Annotated Anodyne COc1ccc(OC)c2c1C(=O)C=C([C@@H](CC=C(C)C)Oc1ccco1)C2=O ZINC000066259834 GI Annotated Mild O=C1Nc2ccc(C(=O)Nc3ccccn3)cc2[C@H](c2ccc(Cl)cc2)N1 ZINC000066259936 GI Annotated Anodyne O=C1Nc2ccc(C(=O)Nc3ccccn3)cc2[C@@H](c2ccc(Cl)cc2)N1 ZINC000066259937 GI Annotated Anodyne COc1ccc(C(=O)c2cccn2C/C=C/c2cccc(CC(=O)O)c2)cc1 ZINC000066260032 GI Annotated Anodyne COCCn1cc2c(n1)N(C)c1ccc(Cl)cc1N(c1ccccc1)C2=O ZINC000066261887 GI Annotated Anodyne COc1ccc(OC)c2c1C(=O)C=C([C@@H](CC=C(C)C)Oc1ccoc1)C2=O ZINC000066261916 GI Annotated Mild NC(=O)c1ccc2c(c1)CCCN2c1ccc(CNCCc2cccs2)cc1 ZINC000066263539 GI Annotated Anodyne NC(=O)c1ccc2c(c1)CCCN2c1ccc(CNCc2cccc(F)c2)cc1 ZINC000066263543 GI Annotated Anodyne CC1(C)Oc2cc3oc(=O)ccc3cc2C[C@@H]1OC(=O)CCc1ccccc1 ZINC000066263846 GI Annotated Anodyne NCc1occc1CN(Cc1nc2ccccc2[nH]1)[C@@H]1CCCc2cccnc21 ZINC000066264056 GI Annotated Anodyne NCc1occc1CN(Cc1nc2ccccc2[nH]1)[C@H]1CCCc2cccnc21 ZINC000066264058 GI Annotated Anodyne O=C(N1CC[C@@]2(c3c[nH]c4ncccc34)C[C@@H]12)C1(c2ccc(Cl)cc2)CC1 ZINC000068197798 GI Annotated Anodyne O=C(N1CC[C@]2(c3c[nH]c4ncccc34)C[C@H]12)C1(c2ccc(Cl)cc2)CC1 ZINC000068197800 GI Annotated Anodyne CC[C@H](C)CCCc1c(O)ccc2c1O[C@]1(C2=O)C(Cl)=C(Cl)C(=O)N1C ZINC000068199235 GI Annotated Anodyne O=C(Nc1cnc2[nH]c(Cc3ccc[nH]3)cc2c1)c1ccccc1Br ZINC000068245480 GI Annotated Anodyne O=c1ccn(-c2ccc3ncccc3c2)nc1-c1ccnn1-c1cccc(Cl)c1 ZINC000068245689 GI Annotated Anodyne CN(C)Cc1ccc2c(c1)CCN(C(=O)c1cc3cc(Cl)ccc3n1C)C2 ZINC000068247172 GI Annotated Anodyne COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[C@H]1CC(=O)CCN1C3 ZINC000068267588 GI Annotated Bother COc1ccc(N2C(=O)N(c3ccc(SC)cc3)C(=N)C2=S)c(OC)c1 ZINC000069061658 GI Annotated Anodyne CC1=C[C@H]2[C@@H](CC(Oc3ccccc3)=C[C@H]3C(=C(C)C)C(=O)C[C@@H](C)[C@@]32O)C1=O ZINC000069482510 GI Annotated Mild in-vitro biogenic CCCN(CCC)S(=O)(=O)c1ccc(-c2cc(C(F)(F)F)no2)s1 ZINC000007005397 GI Annotated Anodyne O=[N+]([O-])c1cc(NS(=O)(=O)c2ccc(Cl)c(Cl)c2)ccc1Cl ZINC000007428280 GI Annotated Bother C=C1[C@H]2CC(=O)[C@@H]([C@H](C)OC(C)=O)[C@@H]2[C@@H](C(C)C)C[C@H]1OC(=O)/C=C(\C)CC ZINC000070454428 GI Annotated Mild in-man biogenic CC1(C)OC[C@@H]([C@]2(C)C=C3CC[C@H]4[C@@](C)(C[C@H](O)C[C@@]4(C)CO)[C@@H]3CC2)O1 ZINC000070455257 GI Annotated Anodyne in-vitro biogenic CC(C)(C)c1ccc(C2=C(c3ccccc3)NNC2=C2N=c3ccccc3=N2)cc1 ZINC000070463058 GI Annotated Anodyne O=S(=O)(Nc1ccc(O)c2ccccc12)c1cccc(OC(F)(F)F)c1 ZINC000070725549 GI Annotated Clean Cc1ccccc1CS(=O)(=O)Cc1ccc(C(=O)Nc2ccc(F)cc2)o1 ZINC000071008650 GI Annotated Anodyne O=[N+]([O-])c1ccc(N2CC[C@@H](NCC[C@@H](O)c3csc4ccccc34)C2)cc1 ZINC000071281264 GI Annotated Bother O=[N+]([O-])c1ccc(N2CC[C@@H](NCC[C@H](O)c3csc4ccccc34)C2)cc1 ZINC000071281266 GI Annotated Bother COc1ccc(OC)c(-c2cccc3c(N)c4c(nc23)CN(C2CCC2)C4=O)c1 ZINC000071281465 GI Annotated Anodyne N#Cc1ccc(N2CC[C@H](NCCC(=O)c3csc4ccccc34)C2)cc1 ZINC000071281908 GI Annotated Mild O=C(CCN[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2)C1)c1csc2ccccc12 ZINC000071282030 GI Annotated Bother O=C1OCC2=C1[C@H](c1cncc(Br)c1)c1ccc3ccccc3c1N2 ZINC000071282113 GI Annotated Anodyne O=C1OCC2=C1[C@@H](c1cncc(Br)c1)c1ccc3ccccc3c1N2 ZINC000071282114 GI Annotated Anodyne COc1ccc(-c2ccn(-c3ccc(O)cn3)c2-c2ccc(C(N)=O)cc2C)cc1 ZINC000071294512 GI Annotated Anodyne N#Cc1ccc(N2CCCN(CC[C@@H](O)c3csc4ccccc34)CC2)cc1 ZINC000071294679 GI Annotated Mild N#Cc1ccc(N2CCCN(CC[C@H](O)c3csc4ccccc34)CC2)cc1 ZINC000071294680 GI Annotated Mild O=C(CCN[C@H]1CCN(c2ccc([N+](=O)[O-])cc2)C1)c1csc2ccccc12 ZINC000071295636 GI Annotated Bother COc1ccc(-c2ccn([C@@H](C)CC(=O)O)c2-c2ccc(C(N)=O)cc2C)cc1 ZINC000071295747 GI Annotated Anodyne COc1ccc(-c2ccn([C@H](C)CC(=O)O)c2-c2ccc(C(N)=O)cc2C)cc1 ZINC000071295748 GI Annotated Anodyne N#Cc1ccc(N2CCC(NCC[C@@H](O)c3csc4ccccc34)CC2)cc1 ZINC000071295916 GI Annotated Mild N#Cc1ccc(N2CCC(NCC[C@H](O)c3csc4ccccc34)CC2)cc1 ZINC000071295917 GI Annotated Mild O=C(c1cc2c(s1)CCC2)N1N=C(c2cccnc2)C[C@H]1c1ccccc1O ZINC000071295961 GI Annotated Clean O=C(c1cc2c(s1)CCC2)N1N=C(c2cccnc2)C[C@@H]1c1ccccc1O ZINC000071295962 GI Annotated Clean Cc1cc(C[C@H](CCCCNCc2ccc(F)cc2)C(=O)NO)cc(C)c1F ZINC000071296524 GI Annotated Bother CC(C)c1ccc(-c2c3c(nc4nc(O)[nH]c(=O)c24)-c2ccccc2C3=O)cc1 ZINC000071296741 GI Annotated Clean C[C@@H]1C(=NNC(N)=S)[C@@H](C)[C@H](c2ccc(F)cc2)O[C@@H]1c1ccc(F)cc1 ZINC000071316041 GI Annotated Mild O=C(c1ccc(C2CC2)nc1)N1CC[C@@](O)(c2ccccc2)[C@@H]2CCCC[C@@H]21 ZINC000071316251 GI Annotated Anodyne COC(=O)c1cnc(C(=O)[C@@H]2CCc3cc(Oc4ccccc4)ccc3C2)o1 ZINC000071316272 GI Annotated Anodyne Cc1cc(O[C@H](CCCCNCc2ccc(Cl)cc2)C(=O)NO)ccc1F ZINC000071316733 GI Annotated Bother CC[C@@H]1C(=O)C[C@@H](c2ccccc2)N(C(=O)Cn2ccnc2)[C@H]1c1ccccc1 ZINC000071317518 GI Annotated Anodyne CC[C@H]1C(=O)C[C@@H](c2ccccc2)N(C(=O)Cn2ccnc2)[C@@H]1c1ccccc1 ZINC000071317519 GI Annotated Anodyne CC[C@@H]1C(=O)C[C@@H](c2ccccc2)N(C(=O)Cn2ccnc2)[C@@H]1c1ccccc1 ZINC000071317520 GI Annotated Anodyne Cc1ccc(C(=O)C2=C(O)C(=O)N(C[C@@H](C)O)[C@@H]2c2cccc(C(C)C)c2)cc1 ZINC000071317597 GI Annotated Mild Cc1ccc(C(=O)C2=C(O)C(=O)N(C[C@@H](C)O)[C@H]2c2cccc(C(C)C)c2)cc1 ZINC000071317598 GI Annotated Mild Cc1ccc(C(=O)C2=C(O)C(=O)N(C[C@H](C)O)[C@@H]2c2cccc(C(C)C)c2)cc1 ZINC000071317599 GI Annotated Mild Cc1ccc(C(=O)C2=C(O)C(=O)N(C[C@H](C)O)[C@H]2c2cccc(C(C)C)c2)cc1 ZINC000071317600 GI Annotated Mild CC1(C)C(=O)CC[C@@]2(C)[C@H]1CC[C@]1(C)Oc3c(c(O)cc4c3COC4=O)C[C@@H]12 ZINC000071318700 GI Annotated Anodyne COc1c(C)cc2c([nH]c3c2sc2c3c(=O)c(C(=O)O)cn2C2CC2)c1C ZINC000071318804 GI Annotated Bother O=C(O)[C@@H]1CSc2c(C3CC3)c(COc3cccc4ccccc34)cc(=O)n21 ZINC000071318942 GI Annotated Anodyne CO/N=C1/c2c(cc(F)c(-c3cccc4c(C)c[nH]c34)c2F)NC(C)(C)[C@H]1O ZINC000071318990 GI Annotated Mild CO/N=C1/c2c(cc(F)c(-c3cccc4c(C)c[nH]c34)c2F)NC(C)(C)[C@@H]1O ZINC000071318991 GI Annotated Mild Cc1cccc(C(=O)C2=C(O)C(=O)N(C[C@@H](C)O)[C@@H]2c2ccc(C(C)C)cc2)c1 ZINC000071319122 GI Annotated Mild Cc1cccc(C(=O)C2=C(O)C(=O)N(C[C@@H](C)O)[C@H]2c2ccc(C(C)C)cc2)c1 ZINC000071319123 GI Annotated Mild Cc1cccc(C(=O)C2=C(O)C(=O)N(C[C@H](C)O)[C@@H]2c2ccc(C(C)C)cc2)c1 ZINC000071319124 GI Annotated Mild Cc1cccc(C(=O)C2=C(O)C(=O)N(C[C@H](C)O)[C@H]2c2ccc(C(C)C)cc2)c1 ZINC000071319125 GI Annotated Mild CC1(C)C(=O)N(c2ccc(SC(F)(F)F)cc2)C(=O)N1Cc1ccncc1 ZINC000071329689 GI Annotated Anodyne COC(=O)c1cnc(C(=O)[C@H]2CCc3cc(Oc4ccccc4)ccc3C2)o1 ZINC000071330486 GI Annotated Anodyne CCOC(=O)C(C)(C)Oc1ccc(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1 ZINC000071331165 GI Annotated Mild CN(CCOc1ccc2cc(C(=O)O)n(C)c2c1)c1nc2ccccc2s1 ZINC000071331258 GI Annotated Anodyne CC(C)(CCS(=O)(=O)CCCCCCCC[N+](C)(C)C)N(Cl)Cl ZINC000071331938 GI Annotated Bother O=[N+]([O-])c1ccc(N/N=C2/C(c3ccc(Cl)cc3)=NN=C2C(F)(F)F)cc1 ZINC000071333411 GI Annotated Mild COc1ccccc1[C@@]1(O)C(=O)N(Cc2ccc(Cl)cc2)c2ccccc21 ZINC000071333607 GI Annotated Anodyne COc1ccccc1[C@]1(O)C(=O)N(Cc2ccc(Cl)cc2)c2ccccc21 ZINC000071333608 GI Annotated Anodyne CCCCCN1C(=O)[C@@]2(CCC(=O)c3cc4c(cc32)OCO4)c2ccccc21 ZINC000071334042 GI Annotated Anodyne CCCCCN1C(=O)[C@]2(CCC(=O)c3cc4c(cc32)OCO4)c2ccccc21 ZINC000071334044 GI Annotated Anodyne Cc1ccc([C@@H](NC(=O)c2ccccc2O)C(=O)Nc2c(C)cccc2C)s1 ZINC000071341702 GI Annotated Anodyne Cc1ccc([C@H](NC(=O)c2ccccc2O)C(=O)Nc2c(C)cccc2C)s1 ZINC000071341703 GI Annotated Anodyne Cc1nc(C)n(-c2ccc(Nc3cc(-c4ccn(C)n4)c(Cl)cn3)cc2)n1 ZINC000071341890 GI Annotated Anodyne CCn1c(C(=O)O)cc2ccc(OCCN(C)c3nc4ccccc4s3)cc21 ZINC000071418516 GI Annotated Anodyne COc1ccc(/C=C2\COc3ccc(Br)cc3C2=O)cc1OC ZINC000071826603 GI Annotated Mild O/N=C(/c1cccnc1OCc1ccccc1F)N1CC[C@@H]2CCCC[C@@H]2C1 ZINC000072100815 GI Annotated Mild O/N=C(/c1cccnc1OCc1ccccc1F)N1CC[C@H]2CCCC[C@@H]2C1 ZINC000072100816 GI Annotated Mild O/N=C(/c1cccnc1OCc1ccccc1F)N1CC[C@@H]2CCCC[C@H]2C1 ZINC000072100817 GI Annotated Mild O/N=C(/c1cccnc1OCc1ccccc1F)N1CC[C@H]2CCCC[C@H]2C1 ZINC000072100818 GI Annotated Mild COc1ccccc1CN/C(=N\O)c1ccnc(Oc2ccc(C)cc2OC)c1 ZINC000072100822 GI Annotated Mild COc1cc(-c2nc(CNCCc3ccc(C)cc3)co2)cc(OC)c1OC ZINC000072100933 GI Annotated Anodyne Fc1ccc(-c2nc(CN3CCN(C/C=C/c4ccccc4)CC3)co2)cc1 ZINC000072101078 GI Annotated Anodyne CCN(Cc1ccccc1)Cc1coc(-c2cc(OC)c(OC)c(OC)c2)n1 ZINC000072101230 GI Annotated Anodyne CCOC(=O)[C@@H]1CCCCN1Cc1coc(-c2ccccc2Br)n1 ZINC000072101264 GI Annotated Anodyne CCOC(=O)[C@H]1CCCCN1Cc1coc(-c2ccccc2Br)n1 ZINC000072101265 GI Annotated Anodyne Cc1ccc(/C(=N/O)N(C)C2CCN(C)CC2)c(Oc2cccc(C(C)C)c2)n1 ZINC000072101316 GI Annotated Mild COc1cc(-c2nc(CN(C)CCc3ccccc3)co2)cc(OC)c1OC ZINC000072101369 GI Annotated Anodyne Cc1ccc(/C(=N/O)N2CCSCC2)c(OCc2ccc(C(C)C)cc2)n1 ZINC000072101379 GI Annotated Mild Fc1cccc(-c2nc(CN3CCN(C/C=C/c4ccccc4)CC3)co2)c1 ZINC000072101388 GI Annotated Anodyne COc1ccc(Oc2cc(/C(=N/O)NCc3cc(F)ccc3F)ccn2)cc1 ZINC000072101390 GI Annotated Mild O/N=C(\NCC1CCCCC1)c1ccc(Oc2ccc(-n3ccnc3)cc2)nc1 ZINC000072101440 GI Annotated Mild COc1ccccc1CN/C(=N\O)c1ccc(C)nc1OCc1ccccc1F ZINC000072101606 GI Annotated Mild C=CCc1ccc(Oc2nc(C)ccc2/C(=N/O)NCc2ccco2)c(OC)c1 ZINC000072101659 GI Annotated Mild CCOc1ccccc1CN/C(=N\O)c1cccnc1OCc1ccccc1F ZINC000072101772 GI Annotated Mild CN(C)CCNc1cc(-c2ccccc2)nc2cc(-c3cccc(F)c3)nn12 ZINC000072101836 GI Annotated Anodyne CSc1ccc(Oc2nc(C)ccc2/C(=N/O)N2CCSCC2)cc1 ZINC000072101838 GI Annotated Mild COc1cc(C)ccc1Oc1nc(C)ccc1/C(=N/O)NCc1ccc(C)o1 ZINC000072101947 GI Annotated Mild FC(F)(F)Oc1ccc(-c2nc(CN3CCC(N4CCCC4)CC3)co2)cc1 ZINC000072101948 GI Annotated Anodyne CC(=O)C1=CC[C@H](c2cccc(Cl)c2)N(S(=O)(=O)c2ccc(C)cc2)C1 ZINC000072101980 GI Annotated Mild CC(=O)C1=CC[C@@H](c2cccc(Cl)c2)N(S(=O)(=O)c2ccc(C)cc2)C1 ZINC000072101981 GI Annotated Mild Fc1cc(Cl)ccc1[C@@H](c1cncnc1)N1CCN(c2ccccc2)CC1 ZINC000072102077 GI Annotated Anodyne Fc1cc(Cl)ccc1[C@H](c1cncnc1)N1CCN(c2ccccc2)CC1 ZINC000072102078 GI Annotated Anodyne COc1ccc(Oc2nc(C)ccc2/C(=N/O)NCc2cccc(OC)c2)cc1 ZINC000072102088 GI Annotated Mild COc1cccc(CN/C(=N\O)c2cccnc2Oc2c(F)cccc2F)c1 ZINC000072102120 GI Annotated Mild COc1cc(-c2nc(Cn3cnc(-c4ccccc4)c3)co2)cc(OC)c1OC ZINC000072102126 GI Annotated Anodyne CCN(CC)c1cccc(Oc2ncccc2/C(=N/O)NCc2ccco2)c1 ZINC000072102203 GI Annotated Mild COc1cc(CN(C)Cc2coc(-c3ccccc3C)n2)cc(OC)c1OC ZINC000072102249 GI Annotated Anodyne COc1cccc(CN/C(=N\O)c2ccc(C)nc2OCc2cccc(F)c2)c1 ZINC000072102339 GI Annotated Mild CCOc1ccc(Oc2cc(/C(=N/O)NCc3cc(F)cc(F)c3)ccn2)cc1 ZINC000072102340 GI Annotated Mild CCOc1ccccc1CN/C(=N\O)c1cccnc1OCc1cccc(F)c1 ZINC000072102734 GI Annotated Mild O/N=C(/c1cccnc1OCc1cccc(F)c1)N1CCCc2ccccc21 ZINC000072102762 GI Annotated Mild COc1cc(-c2nc(CN(CCC#N)C3CCCCC3)co2)cc(OC)c1OC ZINC000072102858 GI Annotated Mild COc1ccccc1CN/C(=N\O)c1ccnc(Oc2ccc(F)c(F)c2)c1 ZINC000072102945 GI Annotated Mild Fc1ccc(-c2cc3nc(-c4ccccc4)cc(NC4CCNCC4)n3n2)cc1 ZINC000072102999 GI Annotated Anodyne Fc1cnc(N2CCC(N[C@H](c3ccc(Cl)cc3)c3cccnc3)CC2)nc1 ZINC000072103017 GI Annotated Anodyne Fc1cnc(N2CCC(N[C@@H](c3ccc(Cl)cc3)c3cccnc3)CC2)nc1 ZINC000072103018 GI Annotated Anodyne CSc1ccc(Oc2nc(C)ccc2/C(=N/O)N2CCSC2)cc1C ZINC000072103087 GI Annotated Mild Cc1ccc(/C(=N/O)N2CCCN(C)CC2)c(Oc2cccc(C(C)C)c2)n1 ZINC000072103162 GI Annotated Mild O/N=C(\NCc1cccs1)c1ccc(Oc2c(F)c(F)cc(F)c2F)nc1 ZINC000072103275 GI Annotated Mild COc1cc(CN(C)Cc2coc(-c3cccc(C)c3)n2)cc(OC)c1OC ZINC000072103297 GI Annotated Anodyne O/N=C(\NC[C@@H]1CCCO1)c1ccc(Oc2cc(Cl)ccc2Cl)nc1 ZINC000072103348 GI Annotated Mild O/N=C(\NC[C@H]1CCCO1)c1ccc(Oc2cc(Cl)ccc2Cl)nc1 ZINC000072103349 GI Annotated Mild CCOc1ccccc1CN/C(=N\O)c1cccnc1Oc1ccc(OC)cc1 ZINC000072103560 GI Annotated Mild CC(C)(C)C(=O)N1CCN([C@@H](c2cccnc2)c2ccc(Cl)cc2F)CC1 ZINC000072103575 GI Annotated Anodyne CC(C)(C)C(=O)N1CCN([C@H](c2cccnc2)c2ccc(Cl)cc2F)CC1 ZINC000072103576 GI Annotated Anodyne COc1ccccc1CN/C(=N\O)c1cccnc1Oc1cccc(C)c1C ZINC000072103659 GI Annotated Mild Cc1cc(C)cc(Oc2ccc(/C(=N/O)N3CCN(C4CCCC4)CC3)cn2)c1 ZINC000072103715 GI Annotated Mild c1ccc(-c2nc([C@H](NCc3ccco3)C3CC3)oc2N2CCOCC2)cc1 ZINC000072103742 GI Annotated Anodyne c1ccc(-c2nc([C@@H](NCc3ccco3)C3CC3)oc2N2CCOCC2)cc1 ZINC000072103743 GI Annotated Anodyne CC(=O)C1=CC[C@H](c2ccccc2Cl)N(S(=O)(=O)c2ccc(C)cc2)C1 ZINC000072104261 GI Annotated Mild CC(=O)C1=CC[C@@H](c2ccccc2Cl)N(S(=O)(=O)c2ccc(C)cc2)C1 ZINC000072104262 GI Annotated Mild COC(=O)N1C2=C(c3ccccc3[C@H]1CC(=O)O)[C@H]1O[C@@H](C2)c2ccccc21 ZINC000072104315 GI Annotated Anodyne O[C@@H]1CN(CC2CCCCC2)[C@H](c2ccccc2)C[C@@H]1n1cc(C2CC2)nn1 ZINC000072105239 GI Annotated Anodyne O[C@@H]1CN(CC2CCCCC2)[C@@H](c2ccccc2)C[C@@H]1n1cc(C2CC2)nn1 ZINC000072105240 GI Annotated Anodyne O[C@@H]1CN(CC2CCCCC2)[C@H](c2ccccc2)C[C@H]1n1cc(C2CC2)nn1 ZINC000072105241 GI Annotated Anodyne COc1cc(NN=C2c3ccccc3C(=O)c3ccccc32)cc(OC)c1OC ZINC000072105550 GI Annotated Mild CN(c1cc2ncc(=O)[nH]c2cc1NC(=O)Nc1ccccc1)C1CCCCC1 ZINC000072105969 GI Annotated Anodyne CCCCCCCCCCN1c2nccc[n+]2C[C@@]1(O)c1ccc(OC)cc1 ZINC000072106554 GI Annotated Mild CC(C)n1cc(C(=O)O)c(=O)c2c(O)c(Cc3cccc(Cl)c3F)ccc21 ZINC000072106625 GI Annotated Anodyne CCCn1cc(C(=O)O)c(=O)c2c(O)c(Cc3cccc(Cl)c3F)ccc21 ZINC000072107037 GI Annotated Anodyne O=C(O)c1cn(C2CC2)c2ccc(Cc3cccc(Cl)c3F)c(O)c2c1=O ZINC000072108102 GI Annotated Anodyne N#Cc1c(-c2ccc(C(F)(F)F)cc2)cc(NCCN)n2c1nc1ccccc12 ZINC000072108142 GI Annotated Mild N#Cc1c(-c2cccc(C(F)(F)F)c2)cc(NCCN)n2c1nc1ccccc12 ZINC000072108143 GI Annotated Mild CC(=O)N(C)[C@H]1C=C2C=C[C@@H]3[C@H](CC[C@]45C(=O)O[C@@H](C)[C@H]4CC[C@@H]35)[C@@]2(C)CC1 ZINC000072108165 GI Annotated Anodyne COc1ccc2c(Nc3ccc(/C(C)=N/OCCN)cc3)c3ccoc3nc2c1 ZINC000072108924 GI Annotated Mild Cn1c(CC(=O)NCc2ccc(F)cc2Cl)cnc1-c1ccc(F)cc1F ZINC000072109116 GI Annotated Anodyne C[C@]1(O)c2ccccc2-c2c1c(-n1ccnc1)nc1ccc(Br)cc21 ZINC000072109178 GI Annotated Anodyne C[C@@]1(O)c2ccccc2-c2c1c(-n1ccnc1)nc1ccc(Br)cc21 ZINC000072109179 GI Annotated Anodyne c1ccc2c(CCNc3nccc(-c4c[nH]nc4-c4ccncc4)n3)c[nH]c2c1 ZINC000072109896 GI Annotated Anodyne COc1cc([C@@H]2C(C)=NN(C(C)=O)[C@H]2c2ccc(C)cc2)cc(OC)c1OC ZINC000072109926 GI Annotated Anodyne O=[N+]([O-])c1ccc(NC(=S)N/N=C/c2cc3ccccc3nc2Cl)cc1 ZINC000072110130 GI Annotated Mild COc1ccc(C(=O)N2c3ccccc3[S@@](=O)c3ccc(OC)cc32)cc1 ZINC000072110207 GI Annotated Anodyne COc1ccc(C(=O)N2c3ccccc3[S@](=O)c3ccc(OC)cc32)cc1 ZINC000072110208 GI Annotated Anodyne [C-]#[N+]C(=C\c1ccc(OC)cc1)/C(=C/c1ccc(OS(=O)(=O)O)cc1)[N+]#[C-] ZINC000072110830 GI Annotated Reactive in-vitro COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[C@@H]1CCOCN1C3 ZINC000072112141 GI Annotated Bother COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[C@H]1CCOCN1C3 ZINC000072112402 GI Annotated Bother COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[C@H]1CCOCCN1C3 ZINC000072112632 GI Annotated Bother Cc1cc([C@H](O)c2ccccc2Br)nc(Nc2ccc(C#N)cc2)n1 ZINC000072112964 GI Annotated Mild Cc1cc([C@@H](O)c2ccccc2Br)nc(Nc2ccc(C#N)cc2)n1 ZINC000072112965 GI Annotated Mild CCCCCCCCCCN1c2nccc[n+]2C[C@@]1(O)c1ccc([N+](=O)[O-])cc1 ZINC000072112997 GI Annotated Mild O=C1c2c(Cl)c(Cl)c(Cl)c(Cl)c2C(=O)N1Cc1ccccn1 ZINC000072113491 GI Annotated Anodyne C=CCn1c(-c2cc3c(cc2C=C)OCO3)cc2ccc(OC)c(OC)c2c1=O ZINC000072114150 GI Annotated Mild COc1cc(-c2cn(Cc3cccc4cccnc34)nn2)ccc1-n1cnc(C)c1 ZINC000072114172 GI Annotated Anodyne CC(=O)O[C@H]1C=CC(=O)O[C@@H]1c1nc(-c2ccccc2)oc1-c1ccccc1 ZINC000072114243 GI Annotated Anodyne CO/N=C(/c1cc(OC)c(OC)c(OC)c1)c1csc(-c2ccccc2)n1 ZINC000072114353 GI Annotated Mild CC(C)CN(C)Cc1ccc(-c2ccccc2S(=O)(=O)N2CCCC2)cc1 ZINC000072114372 GI Annotated Anodyne CO/N=C(\c1cc(OC)c(OC)c(OC)c1)c1csc(-c2ccccc2)n1 ZINC000072114892 GI Annotated Mild CC(C)N(C)S(=O)(=O)c1ccccc1-c1ccc(CNC2CCCC2)cc1 ZINC000072115044 GI Annotated Anodyne O=C(CSc1ncnn1-c1ccc(Cl)cc1Cl)Nc1ccccc1F ZINC000072116334 GI Annotated Anodyne CCCN(CCC)c1nc(N(C)c2ccc(OC)cc2Cl)nc2ccnn12 ZINC000072117055 GI Annotated Anodyne CN(C)CCCNCc1nccc2c3ccccc3n(Cc3ccc(F)cc3)c12 ZINC000072118241 GI Annotated Anodyne COc1cc(/C(=N\C#N)c2csc(-c3ccccc3)n2)cc(OC)c1OC ZINC000072118634 GI Annotated Mild O=S(=O)(c1ccccc1)c1cnc2nc3ccccc3n2c1-c1ccccc1 ZINC000072119645 GI Annotated Anodyne CC(C)N1CCN=C1/N=C(/Nc1ccc(Cl)c(Cl)c1)N1CCCCC1 ZINC000072119667 GI Annotated Mild CCCN(CCC)c1cc(N(C)c2ccc(OC)cc2Cl)nc2ncnn12 ZINC000072119699 GI Annotated Anodyne C#CC1=C(N)OC(c2ccccc2)=C(C(=O)OCC)[C@H]1c1ccc(Cl)s1 ZINC000072119763 GI Annotated Mild C#CC1=C(N)OC(c2ccccc2)=C(C(=O)OCC)[C@@H]1c1ccc(Cl)s1 ZINC000072119764 GI Annotated Mild CCCN(CCC)c1c(C)c(Nc2ccc(OC)cc2Cl)nc2ncnn12 ZINC000072119803 GI Annotated Anodyne C[C@H]1C=N[C@H]2/C(=N/CCN3CCCCC3)Nc3cc(-c4ccccc4)sc3N12 ZINC000072120108 GI Annotated Mild C[C@H]1C=N[C@@H]2/C(=N/CCN3CCCCC3)Nc3cc(-c4ccccc4)sc3N12 ZINC000072120109 GI Annotated Mild Cc1ccc([C@@H]2C[C@H](n3cc(C4CC4)nn3)[C@H](O)CN2Cc2cccs2)cc1 ZINC000072120354 GI Annotated Anodyne Cc1ccc([C@@H]2C[C@@H](n3cc(C4CC4)nn3)[C@H](O)CN2Cc2cccs2)cc1 ZINC000072120356 GI Annotated Anodyne COc1ccc(-n2c(C)nc3c(NC(C4CC4)C4CC4)nc(C)nc32)c(C)c1 ZINC000072122663 GI Annotated Anodyne CCCN1CCN(c2nccc(NC(c3ccccc3)c3ccccc3)n2)CC1 ZINC000072122710 GI Annotated Anodyne O=[N+]([O-])c1cn2c(n1)OC[C@@H](OC/C=C/c1ccc(-c3ccc(F)cc3)cc1)C2 ZINC000072122831 GI Annotated Bother Cc1nnc(C2CCN(c3ccccn3)CC2)n1-c1ccc(C(F)(F)F)cc1 ZINC000072122898 GI Annotated Anodyne O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCCCc1ccc(-c3ccc(F)cc3)cc1)C2 ZINC000072123337 GI Annotated Bother C[C@H](O[C@@H]1COc2nc([N+](=O)[O-])cn2C1)c1ccc(-c2ccc(F)cc2)cc1 ZINC000072123607 GI Annotated Bother C[C@@H](O[C@@H]1COc2nc([N+](=O)[O-])cn2C1)c1ccc(-c2ccc(F)cc2)cc1 ZINC000072123608 GI Annotated Bother Cc1ccc(S(=O)(=O)c2nc3ccccc3nc2Nc2ccc(N)cc2)cc1 ZINC000072124958 GI Annotated Clean Cc1ccc(S(=O)(=O)c2nc3ccccc3nc2Nc2cccc(N)c2)cc1 ZINC000072124959 GI Annotated Anodyne CC(C)CN(CC(=O)Nc1cc(F)cc(F)c1)C(=O)c1ccc(Cl)cc1 ZINC000072128566 GI Annotated Anodyne Cc1ccc([C@@H]2C[C@H](O)[C@H](n3cc(C4CC4)nn3)CN2Cc2cccs2)cc1 ZINC000072135004 GI Annotated Anodyne Cc1ccc([C@@H]2C[C@@H](O)[C@H](n3cc(C4CC4)nn3)CN2Cc2cccs2)cc1 ZINC000072135006 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3ccco3)c(Cc3ccc(OC)cc3C)n2c1 ZINC000072135911 GI Annotated Anodyne Cc1ccc([C@@H]2C[C@H](n3cc(C4CC4)nn3)[C@H](O)CN2CC2CCCCC2)cc1 ZINC000072135912 GI Annotated Anodyne Cc1ccc([C@@H]2C[C@@H](n3cc(C4CC4)nn3)[C@H](O)CN2CC2CCCCC2)cc1 ZINC000072135914 GI Annotated Anodyne C=CCCC(=O)N1C[C@H]2CCN(C)[C@H]2C[C@H]1c1ccc(Br)cc1 ZINC000072136388 GI Annotated Mild CC(=O)C1=CC[C@H](c2ccc(Cl)cc2)N(S(=O)(=O)c2ccc(C)cc2)C1 ZINC000072136468 GI Annotated Mild CC(=O)C1=CC[C@@H](c2ccc(Cl)cc2)N(S(=O)(=O)c2ccc(C)cc2)C1 ZINC000072136469 GI Annotated Mild Cc1ccc(CN2C(=O)[C@@H](CC(C)C)Nc3ncnc(N4CCCCC4)c32)cc1 ZINC000072137609 GI Annotated Anodyne Cc1ccc(CN2C(=O)[C@H](CC(C)C)Nc3ncnc(N4CCCCC4)c32)cc1 ZINC000072137610 GI Annotated Anodyne CC(C)[C@@H]1COCCS(=O)(=O)N1Cc1ccccc1-c1cccc(Cl)c1 ZINC000072137639 GI Annotated Anodyne CN1OC[C@@H]2CN(Cc3ccccc3)[C@H](c3ccc(N4CCCCC4)cc3)C[C@@H]21 ZINC000072138167 GI Annotated Clean COc1ccc(CN2Cc3cc(-c4ccccc4)ccc3-n3nncc3C2)cc1 ZINC000072138372 GI Annotated Anodyne CC(=O)C1=CC[C@H](c2ccc(Cl)cc2)N(S(=O)(=O)c2ccccc2C)C1 ZINC000072138413 GI Annotated Mild CC(=O)C1=CC[C@@H](c2ccc(Cl)cc2)N(S(=O)(=O)c2ccccc2C)C1 ZINC000072138414 GI Annotated Mild CCOc1cccc(-c2nc(CNCCc3cc(OC)ccc3OC)co2)c1 ZINC000072139615 GI Annotated Anodyne CCOc1ccccc1-c1nc(CNCc2cc(OC)c(OC)c(OC)c2)co1 ZINC000072139702 GI Annotated Anodyne Cc1ccc([C@@H]2C[C@H](O)[C@H](n3cc(C4CC4)nn3)CN2CC2CCCCC2)cc1 ZINC000072140770 GI Annotated Anodyne Cc1ccc([C@@H]2C[C@@H](O)[C@H](n3cc(C4CC4)nn3)CN2CC2CCCCC2)cc1 ZINC000072140772 GI Annotated Anodyne C=CC[C@H]1C=C[C@@H](O/N=C/[C@@H](C)[C@@H](OCc2ccccc2)C(C)C)[C@@H](CO)O1 ZINC000072140974 GI Annotated Mild Fc1cccc(F)c1NC(=S)N/N=C/c1cc2ccccc2nc1Cl ZINC000072141121 GI Annotated Mild CC(C)C[C@@H]1COc2c(Cl)cccc2S(=O)(=O)N1Cc1ccc(F)cc1 ZINC000072141276 GI Annotated Anodyne CC(C)C[C@H]1COc2c(Cl)cccc2S(=O)(=O)N1Cc1ccc(F)cc1 ZINC000072141277 GI Annotated Anodyne Cc1oc(-c2ccccc2C(=O)N(C)C)cc1C(=O)Nc1nc2c(s1)CCC2 ZINC000072141376 GI Annotated Anodyne O=C(CCc1ccccc1)N1Cc2cc(-c3ccccc3)ccc2-n2nncc2C1 ZINC000072141695 GI Annotated Anodyne CCCCCCN1C[C@H](n2cc(C3CC3)nn2)[C@H](O)C[C@@H]1c1ccc(C)cc1 ZINC000072141717 GI Annotated Anodyne COc1cccc(CN/C(=N\O)c2ccc(Oc3cc(C)cc(C)c3)nc2)c1 ZINC000072142359 GI Annotated Mild O=[N+]([O-])c1ccc(Cl)c(/C=C/c2nc3ncc(Br)cc3[nH]2)c1 ZINC000072142441 GI Annotated Bother Cc1ccc(C(=O)N/C(C(=O)N2CCCCC2)=C(\Cl)c2ccccc2)cc1 ZINC000072142541 GI Annotated Anodyne CCOc1ccc(-c2nc(CNCCc3cc(OC)ccc3OC)co2)cc1 ZINC000072142614 GI Annotated Anodyne COc1cc([C@@H](CC=C(C)C)OC(=O)C(C)C)c(OC)c2c1C(=O)C=CC2=O ZINC000072175232 GI Annotated Mild CC1(C)C[C@H](NC(=S)Nc2ccc(Cl)cc2)c2cc(NC=O)ccc2O1 ZINC000072175291 GI Annotated Anodyne CC1(C)C[C@@H](NC(=S)Nc2ccc(Cl)cc2)c2cc(NC=O)ccc2O1 ZINC000072175292 GI Annotated Anodyne CCCOc1ccc(-c2ccc(Cn3ccc4c3C(=O)NCCC4=O)cc2)cc1 ZINC000072175371 GI Annotated Anodyne CC1(C)C[C@H](NC(=S)Nc2cccc(Cl)c2)c2cc(NC=O)ccc2O1 ZINC000072175414 GI Annotated Anodyne CC1(C)C[C@@H](NC(=S)Nc2cccc(Cl)c2)c2cc(NC=O)ccc2O1 ZINC000072175415 GI Annotated Anodyne COc1ccccc1Oc1ncccc1/C(=N/O)NCc1c(F)cccc1F ZINC000072175597 GI Annotated Mild O=C1/C(=C\Nc2cc(-c3ccco3)[nH]n2)C(c2ccccc2)=NN1c1ccccc1 ZINC000072175849 GI Annotated Clean COc1cc(-c2ccc(NCc3ccc(F)cc3)nn2)ccc1-n1cnc(C)c1 ZINC000072176508 GI Annotated Anodyne Cc1cc(-c2cccc(Cl)c2)ncc1[C@@H]1C[C@H](F)CN1C(=O)c1cnccn1 ZINC000072176626 GI Annotated Anodyne Cc1cc(-c2cccc(Cl)c2)ncc1[C@H]1C[C@H](F)CN1C(=O)c1cnccn1 ZINC000072176627 GI Annotated Anodyne Cc1cc(-c2cccc(Cl)c2)ncc1[C@@H]1C[C@@H](F)CN1C(=O)c1cnccn1 ZINC000072176628 GI Annotated Anodyne Cc1cc(-c2cccc(Cl)c2)ncc1[C@H]1C[C@@H](F)CN1C(=O)c1cnccn1 ZINC000072176629 GI Annotated Anodyne Cc1cc(-c2cc(F)cc(F)c2)ncc1[C@@H]1CCCN1C(=O)c1cnccn1 ZINC000072176659 GI Annotated Anodyne Cc1cc(-c2cc(F)cc(F)c2)ncc1[C@H]1CCCN1C(=O)c1cnccn1 ZINC000072176660 GI Annotated Anodyne Cc1cc(-c2cccc(Cl)c2)ncc1[C@@H]1C[C@H](O)CN1C(=O)c1nccs1 ZINC000072176834 GI Annotated Anodyne Cc1cc(-c2cccc(Cl)c2)ncc1[C@H]1C[C@H](O)CN1C(=O)c1nccs1 ZINC000072176835 GI Annotated Anodyne Cc1cc(-c2cccc(Cl)c2)ncc1[C@@H]1C[C@@H](O)CN1C(=O)c1nccs1 ZINC000072176836 GI Annotated Anodyne Cc1cc(-c2cccc(Cl)c2)ncc1[C@H]1C[C@@H](O)CN1C(=O)c1nccs1 ZINC000072176837 GI Annotated Anodyne C[C@@H]1CCCN(C(=O)/C(NC(=O)c2ccccc2)=C(/Cl)c2ccccc2)C1 ZINC000072177660 GI Annotated Anodyne C[C@H]1CCCN(C(=O)/C(NC(=O)c2ccccc2)=C(/Cl)c2ccccc2)C1 ZINC000072177661 GI Annotated Anodyne O=C1/C(=N/Nc2ccc([N+](=O)[O-])cc2)C(O)=Nc2c1ccc(Cl)c2Cl ZINC000072177701 GI Annotated Mild CCNCc1cncc(-c2ccc3[nH]nc(-c4nc5c([nH]4)CCCC5)c3c2)c1C ZINC000072177727 GI Annotated Anodyne C[C@@H]1CCCCCCCCC[C@H](O)C(=O)C[C@H](SCC(F)(F)F)C(=O)O1 ZINC000072177835 GI Annotated Anodyne C[C@@H]1CCCCCCCCC[C@H](O)C(=O)C[C@@H](SCC(F)(F)F)C(=O)O1 ZINC000072177836 GI Annotated Anodyne C[C@@]1([C@H](O)c2ccc(Cl)cc2)OC(=S)N(c2ccc(Cl)cc2)C1=O ZINC000072178063 GI Annotated Anodyne C[C@]1([C@H](O)c2ccc(Cl)cc2)OC(=S)N(c2ccc(Cl)cc2)C1=O ZINC000072178064 GI Annotated Anodyne C[C@@]1([C@@H](O)c2ccc(Cl)cc2)OC(=S)N(c2ccc(Cl)cc2)C1=O ZINC000072178065 GI Annotated Anodyne C[C@]1([C@@H](O)c2ccc(Cl)cc2)OC(=S)N(c2ccc(Cl)cc2)C1=O ZINC000072178066 GI Annotated Anodyne O=C(N[C@@H](c1ccc(Cl)c(Cl)c1)C1CNC1)c1ccc2cnccc2c1 ZINC000072178908 GI Annotated Anodyne CSc1nn(-c2ccccc2)c2cc(NC(=O)CC3CCNCC3)ccc12 ZINC000072179009 GI Annotated Anodyne Cc1ncc([N+](=O)[O-])n1C[C@@H](C)OC(=O)/C=C/c1ccc(-c2ccccc2)cc1 ZINC000072179015 GI Annotated Bother Cc1ncc([N+](=O)[O-])n1C[C@H](C)OC(=O)/C=C/c1ccc(-c2ccccc2)cc1 ZINC000072179016 GI Annotated Bother CCc1nn(-c2ccccc2)c2cc(N3CCN(c4ccncc4)CC3)ccc12 ZINC000072179082 GI Annotated Anodyne CCOc1ccc2c(c1)sc1nc(-c3ccccc3)c(CN3CCOCC3)n12 ZINC000072179367 GI Annotated Anodyne O=C(N[C@H](c1ccc(Cl)c(Cl)c1)C1CNC1)c1ccc2cnccc2c1 ZINC000072179488 GI Annotated Anodyne CCCC(=O)O[C@H](CC=C(C)C)c1cc(OC)c2c(c1OC)C(=O)C=CC2=O ZINC000072179648 GI Annotated Mild Cc1ncc([N+](=O)[O-])n1C[C@@H](C)OC(=O)/C=C/c1ccc(Cl)cc1Cl ZINC000072179810 GI Annotated Bother Cc1ncc([N+](=O)[O-])n1C[C@H](C)OC(=O)/C=C/c1ccc(Cl)cc1Cl ZINC000072179811 GI Annotated Bother C/C=C/C(=O)O[C@H](CC=C(C)C)c1cc(OC)c2c(c1OC)C(=O)C=CC2=O ZINC000072179812 GI Annotated Mild CSc1ccc(Oc2ncccc2/C(=N/O)NCc2cccnc2)cc1C ZINC000072179868 GI Annotated Mild O=C(N[C@@H](c1cccc(Cl)c1)C1CCNCC1)c1ccc2cnccc2c1 ZINC000072179882 GI Annotated Anodyne O=C(N[C@H](c1cccc(Cl)c1)C1CCNCC1)c1ccc2cnccc2c1 ZINC000072179883 GI Annotated Anodyne CCOc1ccc(Oc2cc(/C(=N/O)NCc3cc(F)ccc3F)ccn2)cc1 ZINC000072179947 GI Annotated Mild COCCN(/C(=N\O)c1cccnc1Oc1ccc2c(c1)CCCC2)C(C)C ZINC000072180113 GI Annotated Mild O/N=C(/c1cccnc1OCc1ccccc1F)N1CCCc2ccccc21 ZINC000072180178 GI Annotated Mild COc1cccc(CN/C(=N\O)c2cccnc2Oc2cccc(C)c2C)c1 ZINC000072180314 GI Annotated Mild CN(C)c1cccc(COc2nc3cccnc3nc2C#Cc2ccccc2)c1 ZINC000072180553 GI Annotated Mild CC1(C)C=Cc2cc([C@H](O)c3cn(C45CC6CC(CC(C6)C4)C5)nn3)ccc2O1 ZINC000072180677 GI Annotated Anodyne CC1(C)C=Cc2cc([C@@H](O)c3cn(C45CC6CC(CC(C6)C4)C5)nn3)ccc2O1 ZINC000072180678 GI Annotated Anodyne CC(C)CCc1c(OCCCCCCCC(=O)NO)ccc2c1OC(=O)CC2 ZINC000072180712 GI Annotated Bother O/N=C(/c1ccc(Oc2cc(Cl)ccc2Cl)nc1)N1CCSCC1 ZINC000072180799 GI Annotated Mild C[C@@H]1CCCCN1CCCNCc1coc(-c2ccccc2Br)n1 ZINC000072180800 GI Annotated Anodyne C[C@H]1CCCCN1CCCNCc1coc(-c2ccccc2Br)n1 ZINC000072180801 GI Annotated Anodyne COC(=O)c1c(C)noc1-c1ccc2cc(CCN3CCC[C@H]3C)ccc2n1 ZINC000072180936 GI Annotated Anodyne CC(=O)Oc1cccc(-c2cc(C(=O)Nc3nc4c(s3)CCC4)c(C)o2)c1 ZINC000072180986 GI Annotated Anodyne COC(=O)c1ccccc1-c1cc(C(=O)Nc2nc3c(s2)CCC3)c(C)o1 ZINC000072180987 GI Annotated Anodyne COc1ccc(Oc2nc(C)ccc2/C(=N/O)N2Cc3ccccc3C2)cc1 ZINC000072181034 GI Annotated Mild CC(=O)OC1CCN([C@@H](c2ccncc2)c2c(O)ccc3ccccc23)CC1 ZINC000072181113 GI Annotated Clean CC(=O)OC1CCN([C@H](c2ccncc2)c2c(O)ccc3ccccc23)CC1 ZINC000072181114 GI Annotated Clean CC(=O)OC1CCN([C@@H](c2ccccn2)c2c(O)ccc3ccccc23)CC1 ZINC000072181115 GI Annotated Clean CC(=O)OC1CCN([C@H](c2ccccn2)c2c(O)ccc3ccccc23)CC1 ZINC000072181116 GI Annotated Clean O=C(O)[C@@H]1C=C[C@@H]2C[C@H]3[C@H](CCCc4ccc5c(c4)OCO5)[C@H]4C=C[C@@H]1[C@@H]2[C@@H]34 ZINC000072181117 GI Annotated Anodyne CC1CCC(N/C(=N\O)c2ccc(Oc3ccc(-n4ccnc4)cc3)nc2)CC1 ZINC000072181188 GI Annotated Mild CC(=O)Oc1ccccc1-c1cc(C(=O)Nc2nc3c(s2)CCC3)c(C)o1 ZINC000072181221 GI Annotated Anodyne CCOc1ccc(Oc2cc(/C(=N/O)NCc3cccc(OC)c3)ccn2)cc1 ZINC000072181257 GI Annotated Mild CC(C)N(CCOc1nc2cccnc2nc1C#Cc1cccc(F)c1)C(C)C ZINC000072181523 GI Annotated Mild COCCN(/C(=N\O)c1ccc(C)nc1Oc1cccc2cnccc12)C(C)C ZINC000072181549 GI Annotated Mild COc1cc(-c2nc(CN3CC[C@@H]4CCCC[C@@H]4C3)co2)cc(OC)c1OC ZINC000072181562 GI Annotated Anodyne Cc1cc(Oc2nc(C)ccc2/C(=N/O)N2CC[C@H](N(C)C)C2)cc(C(C)C)c1 ZINC000072181685 GI Annotated Mild Cc1cc(Oc2nc(C)ccc2/C(=N/O)N2CC[C@@H](N(C)C)C2)cc(C(C)C)c1 ZINC000072181686 GI Annotated Mild CCOc1ccccc1CN/C(=N\O)c1ccnc(Oc2ccc(F)c(F)c2)c1 ZINC000072181770 GI Annotated Mild COCCN(/C(=N\O)c1cccnc1Oc1ccccc1SC)C(C)C ZINC000072181794 GI Annotated Mild CCOc1ccccc1CN/C(=N\O)c1cccnc1Oc1ccc(F)cc1 ZINC000072181851 GI Annotated Mild O/N=C(/c1ccc(Oc2c(F)c(F)cc(F)c2F)nc1)N1CCCCCC1 ZINC000072181965 GI Annotated Mild COc1ccccc1CN/C(=N\O)c1ccc(Oc2ccc(Cl)cc2)nc1 ZINC000072181980 GI Annotated Mild O/N=C(\NCc1c(F)cccc1F)c1cccnc1Oc1c(F)cccc1F ZINC000072182103 GI Annotated Mild CC1CCN(/C(=N\O)c2ccc(Oc3c(F)c(F)cc(F)c3F)nc2)CC1 ZINC000072182104 GI Annotated Mild C=CCc1ccc(Oc2nc(C)ccc2/C(=N/O)N2CCSCC2)c(OC)c1 ZINC000072182122 GI Annotated Mild Cc1ccc(Oc2nc(C)ccc2/C(=N/O)NCCN2CCCCC2)c(C)c1 ZINC000072182128 GI Annotated Mild COc1cc(-c2nc(CN[C@@H]3CCc4ccccc43)co2)cc(OC)c1OC ZINC000072182270 GI Annotated Anodyne COc1cc(-c2nc(CN[C@H]3CCc4ccccc43)co2)cc(OC)c1OC ZINC000072182271 GI Annotated Anodyne COc1cc(-c2nc(CN3CC[C@H]4CCCC[C@@H]4C3)co2)cc(OC)c1OC ZINC000072182331 GI Annotated Anodyne COc1cc(-c2nc(CNCCCc3ccccc3)co2)cc(OC)c1OC ZINC000072182444 GI Annotated Anodyne CCOc1cccc(-c2nc(CNCCc3ccc(OC)c(OC)c3)co2)c1 ZINC000072182449 GI Annotated Anodyne CN(C)CCCNCc1coc(-c2ccc(OCCc3ccccc3)cc2)n1 ZINC000072182458 GI Annotated Anodyne CCc1ccc(Oc2ncccc2/C(=N/O)NCc2ccccc2OC)cc1 ZINC000072182527 GI Annotated Mild CCOc1ccc(Oc2cc(/C(=N/O)NCc3ccccc3OC)ccn2)cc1 ZINC000072182529 GI Annotated Mild CCOc1ccccc1-c1nc(CN(C)CCc2ccc(OC)c(OC)c2)co1 ZINC000072182592 GI Annotated Anodyne Cc1ccc(/C(=N/O)NC[C@@H]2CCCO2)c(Oc2cc(Cl)ccc2Cl)n1 ZINC000072182681 GI Annotated Mild Cc1ccc(/C(=N/O)NC[C@H]2CCCO2)c(Oc2cc(Cl)ccc2Cl)n1 ZINC000072182682 GI Annotated Mild O/N=C(\NCc1ccccc1)c1cccnc1Oc1c(F)c(F)cc(F)c1F ZINC000072182846 GI Annotated Mild CN(/C(=N\O)c1ccc(Oc2ccc(-n3ccnc3)cc2)nc1)C1CCCCC1 ZINC000072182873 GI Annotated Mild COCCN(/C(=N\O)c1ccc(C)nc1Oc1ccc(Cl)cc1)C(C)C ZINC000072183012 GI Annotated Mild COc1ccc(Oc2cc(/C(=N/O)NCc3cc(F)cc(F)c3)ccn2)cc1 ZINC000072183415 GI Annotated Mild CCOc1ccc(-c2nc(CN(C)CCc3ccc(OC)c(OC)c3)co2)cc1 ZINC000072183610 GI Annotated Anodyne COc1cc(CN(C)Cc2coc(-c3cccc(F)c3)n2)cc(OC)c1OC ZINC000072183641 GI Annotated Anodyne COc1ccc(Oc2nc(C)ccc2/C(=N/O)NCc2cc(F)ccc2F)cc1 ZINC000072183642 GI Annotated Mild CSc1ccc(Oc2ncccc2/C(=N/O)NCc2ccccn2)cc1C ZINC000072183701 GI Annotated Mild CSc1ccc(Oc2ncccc2/C(=N/O)NCc2ccncc2)cc1C ZINC000072183733 GI Annotated Mild COc1ccc(CN/C(=N\O)c2ccc(C)nc2Oc2ccc(C)cc2)cc1 ZINC000072183904 GI Annotated Mild COc1cc(-c2nc(CNC[C@H](C)c3ccccc3)co2)cc(OC)c1OC ZINC000072183914 GI Annotated Anodyne COc1cc(-c2nc(CNC[C@@H](C)c3ccccc3)co2)cc(OC)c1OC ZINC000072183915 GI Annotated Anodyne CCOc1ccc(Oc2cc(/C(=N/O)NCc3ccc(OC)cc3)ccn2)cc1 ZINC000072184112 GI Annotated Mild COCCN(/C(=N\O)c1ccc(C)nc1Oc1ccc(SC)cc1)C(C)C ZINC000072184132 GI Annotated Mild Cc1ccc(/C(=N/O)N2CC[C@H](N(C)C)C2)c(Oc2ccc3ccccc3c2)n1 ZINC000072184135 GI Annotated Mild Cc1ccc(/C(=N/O)N2CC[C@@H](N(C)C)C2)c(Oc2ccc3ccccc3c2)n1 ZINC000072184136 GI Annotated Mild COc1ccc(Oc2ncccc2/C(=N/O)NCc2cc(C)cc(C)c2)cc1 ZINC000072184154 GI Annotated Mild COc1cccc(-c2nc(CN(C)Cc3cc(OC)c(OC)c(OC)c3)co2)c1 ZINC000072184212 GI Annotated Anodyne CN(Cc1ccco1)/C(=N\O)c1ccc(Oc2c(F)c(F)cc(F)c2F)nc1 ZINC000072184232 GI Annotated Mild COc1ccccc1CN/C(=N\O)c1ccc(Oc2cc(C)cc(C)c2)nc1 ZINC000072184287 GI Annotated Mild N#CCCN(Cc1coc(-c2ccc(C(F)(F)F)cc2)n1)C[C@@H]1CCCO1 ZINC000072184289 GI Annotated Mild N#CCCN(Cc1coc(-c2ccc(C(F)(F)F)cc2)n1)C[C@H]1CCCO1 ZINC000072184290 GI Annotated Mild COc1ccc(-c2nc(CN(Cc3ccccn3)Cc3ccccn3)co2)cc1 ZINC000072184413 GI Annotated Anodyne COc1cccc(OC)c1CNCc1coc(-c2ccc(OC(C)C)cc2)n1 ZINC000072184455 GI Annotated Anodyne COc1cc(-c2nc(CN[C@@H](C)CCc3ccccc3)co2)cc(OC)c1OC ZINC000072184567 GI Annotated Anodyne COc1cc(-c2nc(CN[C@H](C)CCc3ccccc3)co2)cc(OC)c1OC ZINC000072184568 GI Annotated Anodyne COc1ccc(Oc2ncccc2/C(=N/O)NCc2cc(F)cc(F)c2)cc1 ZINC000072184705 GI Annotated Mild CCOc1ccccc1CN/C(=N\O)c1ccnc(Oc2cccc(F)c2)c1 ZINC000072184815 GI Annotated Mild COc1ccc(Oc2ncccc2/C(=N/O)N[C@@H]2CCc3ccccc32)cc1 ZINC000072184915 GI Annotated Mild COc1ccc(Oc2ncccc2/C(=N/O)N[C@H]2CCc3ccccc32)cc1 ZINC000072184916 GI Annotated Mild CCOc1ccc(-c2nc(CN3CCN(c4ccc(OC)cc4)CC3)co2)cc1 ZINC000072184938 GI Annotated Clean CCOc1ccc(Oc2cc(/C(=N/O)N3Cc4ccccc4C3)ccn2)cc1 ZINC000072184948 GI Annotated Mild CN(Cc1cccnc1)/C(=N\O)c1ccnc(Oc2cccc3c2CCCC3)c1 ZINC000072184963 GI Annotated Mild COc1ccccc1CN/C(=N\O)c1ccc(C)nc1Oc1cccc(F)c1 ZINC000072185025 GI Annotated Mild COc1ccc(Oc2nc(C)ccc2/C(=N/O)NCc2cc(F)cc(F)c2)cc1 ZINC000072185083 GI Annotated Mild O/N=C(/c1ccc(Oc2ccc3oc4ccccc4c3c2)nc1)N1CCOCC1 ZINC000072185178 GI Annotated Mild Cc1cc(C)cc(CN/C(=N\O)c2cccnc2OCc2ccccc2F)c1 ZINC000072185188 GI Annotated Mild COCCN/C(=N\O)c1ccc(C)nc1Oc1ccc2oc3ccccc3c2c1 ZINC000072185268 GI Annotated Mild CC(=O)c1ccc(N2CCN(Cc3coc(-c4ccccc4C)n3)CC2)cc1 ZINC000072185271 GI Annotated Anodyne CCOc1ccccc1CNCc1coc(-c2cc(OC)c(OC)c(OC)c2)n1 ZINC000072185317 GI Annotated Anodyne COc1cc(C)ccc1Oc1nc(C)ccc1/C(=N/O)NCc1ccccc1 ZINC000072185333 GI Annotated Mild COc1cc(-c2nc(CN3CCCc4ccccc43)co2)cc(OC)c1OC ZINC000072185463 GI Annotated Anodyne C[C@H]1CC[C@@H](C)N1/C(=N\O)c1ccc(Oc2c(F)c(F)cc(F)c2F)nc1 ZINC000072185505 GI Annotated Mild C[C@H]1CC[C@H](C)N1/C(=N\O)c1ccc(Oc2c(F)c(F)cc(F)c2F)nc1 ZINC000072185506 GI Annotated Mild C[C@@H]1CC[C@@H](C)N1/C(=N\O)c1ccc(Oc2c(F)c(F)cc(F)c2F)nc1 ZINC000072185507 GI Annotated Mild COc1ccccc1CCNCc1coc(-c2ccccc2Br)n1 ZINC000072185639 GI Annotated Anodyne CCOc1ccc(Oc2cc(/C(=N/O)NCc3ccccc3F)ccn2)cc1 ZINC000072185672 GI Annotated Mild Cc1ccc(/C(=N/O)N[C@@H]2C[C@H](C)CC(C)(C)C2)c(OCc2ccccn2)n1 ZINC000072185803 GI Annotated Mild Cc1ccc(/C(=N/O)N[C@H]2C[C@H](C)CC(C)(C)C2)c(OCc2ccccn2)n1 ZINC000072185804 GI Annotated Mild Cc1ccc(/C(=N/O)N[C@@H]2C[C@@H](C)CC(C)(C)C2)c(OCc2ccccn2)n1 ZINC000072185805 GI Annotated Mild Cc1ccc(/C(=N/O)N[C@H]2C[C@@H](C)CC(C)(C)C2)c(OCc2ccccn2)n1 ZINC000072185806 GI Annotated Mild Cc1ccc(/C(=N/O)N2CCCN(C)CC2)c(Oc2ccc3ccccc3c2)n1 ZINC000072185835 GI Annotated Mild COc1ccc(CN/C(=N\O)c2cccnc2Oc2c(F)cccc2F)cc1 ZINC000072185838 GI Annotated Mild COc1ccc(Oc2nc(C)ccc2/C(=N/O)NCc2ccccc2F)cc1 ZINC000072185989 GI Annotated Mild COc1cccc(CN/C(=N\O)c2cccnc2Oc2ccc(Cl)cc2)c1 ZINC000072186181 GI Annotated Mild N#CCCN(Cc1coc(-c2ccc(OC(F)(F)F)cc2)n1)C[C@@H]1CCCO1 ZINC000072186221 GI Annotated Mild N#CCCN(Cc1coc(-c2ccc(OC(F)(F)F)cc2)n1)C[C@H]1CCCO1 ZINC000072186222 GI Annotated Mild O/N=C(\NC1CCCCC1)c1ccc(Oc2c(F)c(F)cc(F)c2F)nc1 ZINC000072186283 GI Annotated Mild Cc1ccc(CN/C(=N\O)c2ccc(Oc3c(F)c(F)cc(F)c3F)nc2)o1 ZINC000072186321 GI Annotated Mild CCc1ccc(Oc2ccc(/C(=N/O)NCc3ccc(OC)cc3)cn2)cc1 ZINC000072186322 GI Annotated Mild CSc1ccc(Oc2nc(C)ccc2/C(=N/O)N2CCSCC2)cc1C ZINC000072186330 GI Annotated Mild COc1ccc(CN/C(=N\O)c2ccc(C)nc2OCc2ccccc2F)cc1 ZINC000072186372 GI Annotated Mild CCOc1ccc(-c2nc(CNCc3cc(OC)c(OC)c(OC)c3)co2)cc1 ZINC000072186426 GI Annotated Anodyne O/N=C(\NCc1ccccc1)c1ccc(Oc2c(F)c(F)cc(F)c2F)nc1 ZINC000072186485 GI Annotated Mild COc1ccccc1CN/C(=N\O)c1ccc(C)nc1OCc1cccc(F)c1 ZINC000072186498 GI Annotated Mild CCOc1ccccc1CN/C(=N\O)c1cccnc1Oc1c(F)cccc1F ZINC000072186566 GI Annotated Mild Cn1c2c(c3cc(S(=O)(=O)c4cccc(Cl)c4)ccc31)[C@@H]1CC[C@H](C2)N1 ZINC000072316665 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4cccc(Cl)c4)ccc31)[C@H]1CC[C@@H](C2)N1 ZINC000072316666 GI Annotated Anodyne CNc1cccc(NCCCc2cccc(NCCCc3ccccn3)n2)n1 ZINC000072316765 GI Annotated Anodyne COc1ccc(SCc2nnc(-c3ccc4[nH]cnc4c3)s2)cc1OC ZINC000072317049 GI Annotated Anodyne COC(=O)c1cccc(-c2nccnc2C2CN(c3ccc4ccccc4n3)C2)c1 ZINC000072318356 GI Annotated Anodyne COc1ccccc1-c1nnc(NC(=O)c2cnc3c(C)csc3c2)s1 ZINC000072323064 GI Annotated Anodyne COc1ccc(-c2nnc(NC(=O)c3cnc4c(C)csc4c3)s2)cc1 ZINC000072323065 GI Annotated Anodyne O=C(NCc1c(F)cccc1F)c1cn(Cc2ccccc2)c2ncccc12 ZINC000072323322 GI Annotated Anodyne CC(=O)c1cc2ncc(C(=O)NCc3cc(-c4ccc(Cl)cc4)on3)cc2[nH]1 ZINC000072323403 GI Annotated Anodyne N#Cc1cn(Cc2ccccc2)c2ncc(C(=O)NCCCc3ccccc3)cc12 ZINC000072323771 GI Annotated Mild N#Cc1cn(Cc2ccccc2)c2ncc(C(=O)Nc3ccc(F)cc3F)cc12 ZINC000072323787 GI Annotated Mild N#Cc1cn(Cc2ccccc2)c2ncc(C(=O)NCCc3ccc(F)cc3)cc12 ZINC000072323823 GI Annotated Mild Cc1ccc(O[C@@H]2[C@H](O)CO[C@@H]2/C=C\C#Cc2ccc(C(C)(C)C)cc2)cc1 ZINC000073113860 GI Annotated Anodyne CCOC(=O)c1c(N)nc2c(c1-c1cccnc1)CCc1c-2[nH]c2ccc(C)cc12 ZINC000073139315 GI Annotated Anodyne O=C1NCCN1c1ccc(S(=O)(=O)Nc2ccc(C3CCCCC3)cc2)cc1 ZINC000073140690 GI Annotated Anodyne Cc1ccc2c(NC3CC3)noc2c1-c1ccc2c(c1)NC(=O)C21CCOCC1 ZINC000073141274 GI Annotated Anodyne O=S(=O)(O[C@@H](CNCc1ccccc1)c1ccccc1)c1ccc(F)cc1 ZINC000073141486 GI Annotated Mild O=S(=O)(O[C@H](CNCc1ccccc1)c1ccccc1)c1ccc(F)cc1 ZINC000073141488 GI Annotated Mild CC(C)=NNC(=O)c1cc2c([nH]c3ccccc32)c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000073141869 GI Annotated Reactive CCCCOc1ccc(C2=NN(C(C)=O)[C@H](c3ccc([N+](=O)[O-])s3)O2)cc1 ZINC000073142189 GI Annotated Bother CCCCOc1ccc(C2=NN(C(C)=O)[C@@H](c3ccc([N+](=O)[O-])s3)O2)cc1 ZINC000073142192 GI Annotated Bother CSc1nc(Cl)cc(N2C(=O)CS[C@H]2c2c(F)cccc2Cl)n1 ZINC000073157194 GI Annotated Anodyne CSc1nc(Cl)cc(N2C(=O)CS[C@@H]2c2c(F)cccc2Cl)n1 ZINC000073157200 GI Annotated Anodyne CCOc1cc2c(cc1OCC)C(c1cc3ccccc3s1)=NN(C)C(=O)C2 ZINC000073157713 GI Annotated Anodyne N#C/C(=C\c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@@H](c1ccccc1)C1CC1 ZINC000073159686 GI Annotated Reactive N#C/C(=C\c1ccc(Cl)c([N+](=O)[O-])c1)C(=O)N[C@H](c1ccccc1)C1CC1 ZINC000073159692 GI Annotated Reactive COc1cccc(OC)c1-c1c2nccc(-c3ccc(F)cc3F)c2cc[n+]1[O-] ZINC000073160480 GI Annotated Anodyne CC(C)=NNC(=O)c1cc2c([nH]c3ccccc32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000073162653 GI Annotated Reactive CS(=O)(=O)Oc1c(-c2ccccc2)c(-c2ccccc2)n2ccc(C#N)cc12 ZINC000073162734 GI Annotated Mild c1ccc(C(CCNCc2nnnn2C2CCCCC2)c2ccccc2)cc1 ZINC000073168594 GI Annotated Anodyne c1ccc(Cn2nnnc2CNCCC(c2ccccc2)c2ccccc2)cc1 ZINC000073168596 GI Annotated Anodyne c1ccc(Cn2nnnc2CNCCCC(c2ccccc2)c2ccccc2)cc1 ZINC000073169407 GI Annotated Anodyne Cc1c(COc2cccc(OCC3CCOCC3)c2)[nH]c2ccc(F)cc2c1=O ZINC000073169489 GI Annotated Anodyne Cn1cc(C(=O)C(=O)Nc2ccc(-n3cccc3)cc2)c2ccc(Cl)cc21 ZINC000073172127 GI Annotated Anodyne ON(c1ccc(Br)cn1)[C@@H]1CCC=C[C@H]1OCc1ccccc1 ZINC000073195729 GI Annotated Anodyne N#CC1=C(N)Oc2c(ccc3ccccc23)[C@H]1c1cccc(C#CCCCO)c1 ZINC000073195813 GI Annotated Reactive N#CC1=C(N)Oc2c(ccc3ccccc23)[C@@H]1c1cccc(C#CCCCO)c1 ZINC000073195814 GI Annotated Reactive N#CC1=C(N)Oc2ccc3ccccc3c2[C@@H]1c1cccc(C#CCCCO)c1 ZINC000073195815 GI Annotated Reactive N#CC1=C(N)Oc2ccc3ccccc3c2[C@H]1c1cccc(C#CCCCO)c1 ZINC000073195816 GI Annotated Reactive Fc1ccccc1Cc1nc(-c2nc(Cc3ccccc3)n[nH]2)n2ccccc12 ZINC000073195927 GI Annotated Anodyne O=C(COc1ccccc1Br)c1ccc(N2CCCCC2)nc1 ZINC000073196343 GI Annotated Anodyne CNC(=O)c1cccc2c1c(Sc1ccc(Cl)cc1)c(C)n2CC(=O)O ZINC000073196391 GI Annotated Anodyne O=[N+]([O-])c1nccn1CCCNCc1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000073196678 GI Annotated Bother O=S(=O)(c1ccc2c(c1)O[C@H]1CNCC[C@@H]21)c1ccccc1-c1ccccc1 ZINC000073197838 GI Annotated Anodyne COc1cccc2cc(-c3cn(-c4cccc(C(=O)O)c4)c(=S)[nH]3)c(=O)oc12 ZINC000073197893 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4Cl)ccc31)[C@@H]1CC[C@H](C2)N1 ZINC000073198009 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4Cl)ccc31)[C@H]1CC[C@@H](C2)N1 ZINC000073198010 GI Annotated Anodyne CN1C(=O)c2cc(C(=O)NCc3ccccc3)nc3c(Cl)cc(Cl)c1c23 ZINC000073198877 GI Annotated Anodyne CCOC(=O)c1c(N)oc2c1c(Sc1ccc(C)cc1)c(O)c1ncncc12 ZINC000073218959 GI Annotated Anodyne COc1cc(N[C@@H](C)CCCNC(=O)OCC(F)(F)F)c2ncccc2c1 ZINC000073219148 GI Annotated Anodyne COc1cc(N[C@H](C)CCCNC(=O)OCC(F)(F)F)c2ncccc2c1 ZINC000073219152 GI Annotated Anodyne Cc1ccc(O)c(-c2cc(-c3ccc(I)cc3)[nH]n2)c1 ZINC000073220316 GI Annotated Anodyne CCC(CC)c1cc(C)n2nc(-c3cnc(OC(F)F)cc3C)n(C)c(=O)c12 ZINC000073222018 GI Annotated Anodyne Cc1ccc(OCCOc2ccc(Br)cc2Cl)c([N+](=O)[O-])n1 ZINC000073222296 GI Annotated Bother CCOC(=O)c1c(N)oc2c1c(Sc1ccc(F)cc1)c(O)c1ncncc12 ZINC000073222299 GI Annotated Anodyne CCC(CC)c1cc(C)n2nc(-c3ccc(OC(F)F)nc3C)n(C)c(=O)c12 ZINC000073223105 GI Annotated Anodyne CC(C)=CC[C@]12CCN(C)[C@H]1N(S(=O)(=O)c1ccccc1)c1ccccc12 ZINC000073242248 GI Annotated Anodyne CCCCCCC1=NO[C@H]([C@@H](c2cc[nH]c2)N(C)[C@H](C(=O)OC)C(C)C)C1 ZINC000073258076 GI Annotated Anodyne CCCCCCC1=NO[C@@H]([C@@H](c2cc[nH]c2)N(C)[C@H](C(=O)OC)C(C)C)C1 ZINC000073258077 GI Annotated Anodyne CCCCCCC1=NO[C@H]([C@H](c2cc[nH]c2)N(C)[C@H](C(=O)OC)C(C)C)C1 ZINC000073258078 GI Annotated Anodyne CCCCCCC1=NO[C@@H]([C@H](c2cc[nH]c2)N(C)[C@H](C(=O)OC)C(C)C)C1 ZINC000073258079 GI Annotated Anodyne O=C(N1CCCCC1)N1CC(O[C@@H](c2ccccc2)c2cccnc2Cl)C1 ZINC000073258807 GI Annotated Anodyne O=C(N1CCCCC1)N1CC(O[C@H](c2ccccc2)c2cccnc2Cl)C1 ZINC000073258808 GI Annotated Anodyne Cc1ncccc1[C@H](OC1CN(C(=O)N2CCCCC2)C1)c1ccc(Cl)cc1 ZINC000073275769 GI Annotated Anodyne Cc1ncccc1[C@@H](OC1CN(C(=O)N2CCCCC2)C1)c1ccc(Cl)cc1 ZINC000073275773 GI Annotated Anodyne C[C@@H](c1ccccc1)N(CC#N)[C@H]1CCC[C@]1(O)/C=C/c1ccc2c(c1)OCO2 ZINC000073276243 GI Annotated Mild COc1cc2c3c(c4cc5c(cc4c2cc1OC)OCO5)CN1CCC[C@H]1C3 ZINC000073280759 GI Annotated Bother COc1cc2c3c(c4cc5c(cc4c2cc1OC)OCO5)CN1CCC[C@@H]1C3 ZINC000073280762 GI Annotated Bother O=Cc1cccc(-c2cnc3nc(N4CCC(N5CCCCC5)CC4)oc3c2)c1 ZINC000073280766 GI Annotated Anodyne Cc1cc(C(N)=O)ccc1-n1c(CCC(=O)O)ccc1-c1ccc(Cl)cc1 ZINC000073291771 GI Annotated Clean C[C@@H](C(=O)Nc1ccc2c(c1)OCC2)n1c(-c2cscn2)nc2ccccc21 ZINC000073293946 GI Annotated Anodyne C[C@H](C(=O)Nc1ccc2c(c1)OCC2)n1c(-c2cscn2)nc2ccccc21 ZINC000073293948 GI Annotated Anodyne Clc1cccc(-c2cnc3nc(N4CCC(N5CCCCC5)CC4)oc3c2)n1 ZINC000073294404 GI Annotated Anodyne COc1ccc(Br)c(-c2nnc3n2N[C@H](c2ccccc2)S3)c1 ZINC000073294536 GI Annotated Anodyne COc1ccc(Br)c(-c2nnc3n2N[C@@H](c2ccccc2)S3)c1 ZINC000073294538 GI Annotated Anodyne C[C@@](O)(CSc1ccc(Br)cc1)c1nc(-c2ccccc2)no1 ZINC000073294810 GI Annotated Anodyne C[C@](O)(CSc1ccc(Br)cc1)c1nc(-c2ccccc2)no1 ZINC000073294812 GI Annotated Anodyne COc1cc2c3c(c4cc5c(cc4c2cc1OC)OCCO5)CN1CCC[C@H]1C3 ZINC000073295262 GI Annotated Bother COc1cc2c3c(c4cc5c(cc4c2cc1OC)OCCO5)CN1CCC[C@@H]1C3 ZINC000073295264 GI Annotated Bother c1c2c(cc3c1c1c(c4cc5c(cc43)OCCO5)CN3CCC[C@H]3C1)OCCO2 ZINC000073295266 GI Annotated Bother c1c2c(cc3c1c1c(c4cc5c(cc43)OCCO5)CN3CCC[C@@H]3C1)OCCO2 ZINC000073295268 GI Annotated Bother COc1ncc2c(Nc3cc(C)ccc3Sc3ccc(O)cc3)ncnc2n1 ZINC000073296283 GI Annotated Anodyne N#Cc1ccc(-c2cnc3nc(N4CCC(N5CCCCC5)CC4)oc3c2)cc1 ZINC000073296384 GI Annotated Mild CCc1cccc(-c2cnc3nc(N4CCC(N5CCCCC5)CC4)oc3c2)n1 ZINC000073296503 GI Annotated Anodyne O=C(N/N=C/c1ccc([N+](=O)[O-])cc1)c1coc2c(Cl)cc(Cl)cc12 ZINC000073298196 GI Annotated Reactive COc1cc2c3c(c4cc5c(cc4c2cc1OC)OCCO5)C[C@H]1CCCN1C3 ZINC000073311674 GI Annotated Bother COc1cc2c3c(c4cc5c(cc4c2cc1OC)OCCO5)C[C@@H]1CCCN1C3 ZINC000073311677 GI Annotated Bother C=C(C(=O)OCCCCCCn1cncn1)[C@@H]1CC[C@H](C)[C@@H]2CC(=O)C(C)=C2C1 ZINC000073314735 GI Annotated Mild N[C@H](Cc1cccc2ccccc12)C(=O)Nc1cncc(/C=C/c2ccncc2)c1 ZINC000073331218 GI Annotated Anodyne CCCCCCCCCCCC[C@@H]1NC(=N)N[C@]2(CCCO2)[C@H]1C(=O)OC ZINC000073353754 GI Annotated Mild CCCn1c(-c2ccc(F)cc2)nc2c(NC[C@@H]3CCCN3CC)nc(C)nc21 ZINC000007991769 GI Annotated Anodyne CCCn1c(-c2ccc(F)cc2)nc2c(NC[C@H]3CCCN3CC)nc(C)nc21 ZINC000007991770 GI Annotated Anodyne CCCn1c(-c2ccc(F)cc2)nc2c(NCCCN(CC)CC)nc(C)nc21 ZINC000007991771 GI Annotated Anodyne CCCn1c(-c2ccc(F)cc2)nc2c(NCCN(CC)CC)nc(C)nc21 ZINC000007991772 GI Annotated Anodyne CCCn1c(-c2ccc(F)cc2)nc2c(NCCN3CCCCC3)nc(C)nc21 ZINC000007991776 GI Annotated Anodyne CCCn1c(-c2ccc(F)cc2)nc2c(NCC(C)(C)CN(C)C)nc(C)nc21 ZINC000007991779 GI Annotated Anodyne CCCn1c(-c2ccc(F)cc2)nc2c(NCCCCN(C)C)nc(C)nc21 ZINC000007991786 GI Annotated Anodyne CCCn1c(-c2ccc(F)cc2)nc2c(NCC3CCN(C)CC3)nc(C)nc21 ZINC000007991790 GI Annotated Anodyne Cc1nc(NC2CCCCC2)c2nc(-c3ccccc3)n(CCCN(C)C)c2n1 ZINC000007991799 GI Annotated Anodyne Cc1nc(NC2CCCCC2)c2nc(-c3ccccc3)n(CCN(C)C)c2n1 ZINC000007991812 GI Annotated Anodyne CCCCNc1nc(C)nc2c1nc(-c1ccccc1)n2CC1CCN(C)CC1 ZINC000007991847 GI Annotated Anodyne CCCCNc1nc(C)nc2c1nc(-c1ccccc1)n2C[C@@H]1CCCN1CC ZINC000007991853 GI Annotated Anodyne CCCCNc1nc(C)nc2c1nc(-c1ccccc1)n2C[C@H]1CCCN1CC ZINC000007991854 GI Annotated Anodyne CCCCc1nc2c(c3c1C[C@@H](C)OC3)CN(CCOc1ccccc1)CC2 ZINC000007991987 GI Annotated Anodyne CCCCc1nc2c(c3c1C[C@H](C)OC3)CN(CCOc1ccccc1)CC2 ZINC000007991988 GI Annotated Anodyne CCOC(=O)OC[C@@H]1O[C@@H](c2ccccc2)C=C[C@H]1Oc1cccc(N(C)C)c1 ZINC000007992147 GI Annotated Anodyne CCOC(=O)OC[C@H]1O[C@@H](c2ccccc2)C=C[C@@H]1Oc1cccc(N(C)C)c1 ZINC000007992148 GI Annotated Anodyne CCOC(=O)OC[C@@H]1O[C@@H](c2ccccc2)C=C[C@@H]1Oc1cccc(N(C)C)c1 ZINC000007992149 GI Annotated Anodyne CCCCCCC1=Cc2cc(OC)c(OC)cc2[C@H]([C@@H](C(C)=O)C(=O)OC)O1 ZINC000007992232 GI Annotated Anodyne CCCCCCC1=Cc2cc(OC)c(OC)cc2[C@@H]([C@@H](C(C)=O)C(=O)OC)O1 ZINC000007992233 GI Annotated Anodyne CCCCCCC1=Cc2cc(OC)c(OC)cc2[C@H]([C@H](C(C)=O)C(=O)OC)O1 ZINC000007992234 GI Annotated Anodyne CCCCCCC1=Cc2cc(OC)c(OC)cc2[C@@H]([C@H](C(C)=O)C(=O)OC)O1 ZINC000007992235 GI Annotated Anodyne CCOC(=O)OC[C@@H]1O[C@@H](c2cc(C)cc(C)c2)C=C[C@H]1OC(=O)OCC ZINC000007992557 GI Annotated Anodyne CCOC(=O)OC[C@H]1O[C@@H](c2cc(C)cc(C)c2)C=C[C@@H]1OC(=O)OCC ZINC000007992558 GI Annotated Anodyne CCOC(=O)OC[C@@H]1O[C@@H](c2cc(C)cc(C)c2)C=C[C@@H]1OC(=O)OCC ZINC000007992559 GI Annotated Anodyne COc1ccc(O[C@@H]2C=C[C@@H](C#Cc3ccc(C(C)(C)C)cc3)O[C@H]2CO)cc1 ZINC000007992574 GI Annotated Mild COc1ccc(O[C@@H]2C=C[C@H](C#Cc3ccc(C(C)(C)C)cc3)O[C@H]2CO)cc1 ZINC000007992575 GI Annotated Mild Cc1ccc(O[C@@H]2[C@H](O)CO[C@@H]2/C=C/C#Cc2ccc(C(C)(C)C)cc2)cc1 ZINC000007992596 GI Annotated Mild Cc1ccc(O[C@H]2[C@H](O)CO[C@@H]2/C=C/C#Cc2ccc(C(C)(C)C)cc2)cc1 ZINC000007992597 GI Annotated Mild Cc1ccc(O[C@@H]2[C@@H](O)CO[C@@H]2/C=C/C#Cc2ccc(C(C)(C)C)cc2)cc1 ZINC000007992598 GI Annotated Mild Cc1ccc(O[C@H]2[C@@H](O)CO[C@@H]2/C=C/C#Cc2ccc(C(C)(C)C)cc2)cc1 ZINC000007992599 GI Annotated Mild OC[C@@H]1O[C@H](c2ccc3c(c2)OCO3)C=C[C@@H]1Oc1cc(Cl)cc(Cl)c1 ZINC000007992644 GI Annotated Anodyne OC[C@@H]1O[C@@H](c2ccc3c(c2)OCO3)C=C[C@@H]1Oc1cc(Cl)cc(Cl)c1 ZINC000007992645 GI Annotated Anodyne OC[C@@H]1O[C@H](c2ccc3c(c2)OCO3)C=C[C@H]1Oc1cc(Cl)cc(Cl)c1 ZINC000007992646 GI Annotated Anodyne OC[C@@H]1O[C@@H](c2ccc3c(c2)OCO3)C=C[C@H]1Oc1cc(Cl)cc(Cl)c1 ZINC000007992647 GI Annotated Anodyne C#C[C@@]1(OC(C)=O)CC[C@@H]2[C@@H]3CCC4=C[C@@H](OC(C)=O)CC[C@H]4[C@H]3CC[C@]21C ZINC000007997643 GI Annotated Anodyne CCCNC(=O)OC[C@@H]1O[C@H](c2ccccc2)C=C[C@@H]1Oc1ccc(OC)cc1 ZINC000007998341 GI Annotated Anodyne C=CC[C@@H]1C=C[C@H](O/N=C\[C@@H](C)[C@H](OCc2ccccc2)C(C)C)[C@H](CO)O1 ZINC000007998393 GI Annotated Mild CC(C)[C@@H](OCc1ccccc1)[C@H](C)/C=N\OC[C@@H](O)COCc1ccco1 ZINC000007998394 GI Annotated Mild Nc1cc(=O)[nH]c(SC(c2ccccc2)(c2ccccc2)c2ccccc2)n1 ZINC000008016374 GI Annotated Anodyne CCc1cc(O)nc(SCc2nc3ccc(C(=O)c4ccccc4)cc3[nH]2)n1 ZINC000008021710 GI Annotated Anodyne CN(c1ccc(-c2csc(C(C#N)=C3CCCCC3)n2)cc1)S(C)(=O)=O ZINC000008209783 GI Annotated Reactive CCN(c1ccc(-c2csc(C(C#N)=C3CCCC3)n2)cc1)S(C)(=O)=O ZINC000008209916 GI Annotated Reactive CCOc1cc([C@@H]2C3=C(CCCC3=O)N=C3CCCC(=O)[C@@H]32)cc(Cl)c1O ZINC000008463257 GI Annotated Mild Cc1nc(CCNC(=O)Nc2nnc(-c3cccs3)s2)sc1Cl ZINC000082039604 GI Annotated Anodyne C=C1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN(C)C[C@](C)(O)c4ccccc4)[C@H]3C[C@@H]12 ZINC000082051369 GI Annotated Mild C=C1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN(C)C[C@](C)(O)c4ccccc4)[C@H]3C[C@H]12 ZINC000082051371 GI Annotated Mild C=C1CCC[C@]2(C)C[C@H]3OC(=O)[C@H](CN(C)[C@H](C)[C@H](O)c4ccccc4)[C@H]3C[C@H]12 ZINC000082051382 GI Annotated Mild C=C1CCC[C@]2(C)C[C@H]3OC(=O)[C@@H](CN(C)[C@H](C)[C@H](O)c4ccccc4)[C@H]3C[C@H]12 ZINC000082051383 GI Annotated Mild CCOP(=O)(OCC)[C@@H](c1nc2cc(C)c(C)cc2[nH]c1=O)C(F)(F)F ZINC000082053253 GI Annotated Anodyne CCOP(=O)(OCC)[C@H](c1nc2cc(C)c(C)cc2[nH]c1=O)C(F)(F)F ZINC000082053255 GI Annotated Anodyne CCN(CC)c1nc(NCc2ccccc2F)nc(Oc2ccc(OC)cc2)n1 ZINC000082066199 GI Annotated Anodyne CCN(CC)c1nc(NCc2ccccc2C)nc(Oc2ccc(OC)cc2)n1 ZINC000082066238 GI Annotated Anodyne C=CCN(C)c1nc(NCc2cccc(C)c2)nc(Oc2ccc(OC)cc2)n1 ZINC000082066322 GI Annotated Mild C=CCN(C)c1nc(NCc2ccc(F)cc2)nc(Oc2ccc(OC)cc2)n1 ZINC000082066333 GI Annotated Mild C=CCN(C)c1nc(NCc2ccccc2F)nc(Oc2ccc(OC)cc2)n1 ZINC000082066346 GI Annotated Mild C=CCN(C)c1nc(NCc2ccccc2C)nc(Oc2ccc(OC)cc2)n1 ZINC000082066384 GI Annotated Mild COc1ccc(Oc2nc(N[C@@H](C)CC#N)nc(N(C)C3CCCCC3)n2)cc1 ZINC000082066432 GI Annotated Mild COc1ccc(Oc2nc(N[C@H](C)CC#N)nc(N(C)C3CCCCC3)n2)cc1 ZINC000082066433 GI Annotated Mild CCCN(CC1CC1)c1nc(N[C@@H](C)CC#N)nc(Oc2ccc(OC)cc2)n1 ZINC000082066443 GI Annotated Mild CCCN(CC1CC1)c1nc(N[C@H](C)CC#N)nc(Oc2ccc(OC)cc2)n1 ZINC000082066444 GI Annotated Mild C=C(C)CN(CC)c1nc(NCc2ccco2)nc(Oc2ccc(OC)cc2)n1 ZINC000082066458 GI Annotated Mild COc1ccc(Oc2nc(NCc3ccco3)nc(N3CCC(C)CC3)n2)cc1 ZINC000082066610 GI Annotated Anodyne CC[C@@H]1CCCCN1c1nc(N[C@@H](C)CC#N)nc(Oc2ccc(OC)cc2)n1 ZINC000082066681 GI Annotated Mild CC[C@H]1CCCCN1c1nc(N[C@@H](C)CC#N)nc(Oc2ccc(OC)cc2)n1 ZINC000082066683 GI Annotated Mild COc1ccc(Oc2nc(NCC3CCCCC3)nc(N3CC=CCC3)n2)cc1 ZINC000082066800 GI Annotated Anodyne CC[C@@H](C)Nc1nc(Oc2ccc(OC)cc2)nc(N2C[C@@H](C)C[C@@H](C)C2)n1 ZINC000082066828 GI Annotated Anodyne CC[C@H](C)Nc1nc(Oc2ccc(OC)cc2)nc(N2C[C@@H](C)C[C@@H](C)C2)n1 ZINC000082066829 GI Annotated Anodyne CC[C@@H](C)Nc1nc(Oc2ccc(OC)cc2)nc(N2C[C@@H](C)C[C@H](C)C2)n1 ZINC000082066830 GI Annotated Anodyne CC[C@H](C)Nc1nc(Oc2ccc(OC)cc2)nc(N2C[C@@H](C)C[C@H](C)C2)n1 ZINC000082066831 GI Annotated Anodyne CCCCN(CC)c1nc(N[C@@H](C)CC#N)nc(Oc2ccc(OC)cc2)n1 ZINC000082067000 GI Annotated Mild CCCCN(CC)c1nc(N[C@H](C)CC#N)nc(Oc2ccc(OC)cc2)n1 ZINC000082067001 GI Annotated Mild C=CCN(CC=C)c1nc(NCc2ccco2)nc(Oc2ccc(OC)cc2)n1 ZINC000082067013 GI Annotated Mild CCN(CC)c1nc(NCc2cccc(F)c2)nc(Oc2ccc(OC)cc2)n1 ZINC000082067064 GI Annotated Anodyne C=CCN(C)c1nc(NCC2CCCCC2)nc(Oc2ccc(OC)cc2)n1 ZINC000082067131 GI Annotated Mild CCCCCCN(C)c1nc(N[C@@H](C)CC#N)nc(Oc2ccc(OC)cc2)n1 ZINC000082067153 GI Annotated Mild CCCCCCN(C)c1nc(N[C@H](C)CC#N)nc(Oc2ccc(OC)cc2)n1 ZINC000082067154 GI Annotated Mild C=CCN(C)c1nc(NCc2cccc(F)c2)nc(Oc2ccc(OC)cc2)n1 ZINC000082067262 GI Annotated Mild C=CCN(C)c1nc(NCc2ccc(C)cc2)nc(Oc2ccc(OC)cc2)n1 ZINC000082067284 GI Annotated Mild COc1cc(CNc2cc(Oc3cccc(F)c3)ncn2)cc(OC)c1OC ZINC000082067453 GI Annotated Anodyne COc1cc(CNc2cc(Oc3ccc(F)cc3)ncn2)cc(OC)c1OC ZINC000082067454 GI Annotated Anodyne COc1cc(CNc2cc(Oc3ccccc3F)ncn2)cc(OC)c1OC ZINC000082067462 GI Annotated Anodyne O=C1CCCN1CCCNc1cc(Oc2ccc(-c3ccccc3)cc2)ncn1 ZINC000082067660 GI Annotated Anodyne COc1cccc(CNc2cc(Oc3cccc4cccnc34)ncn2)c1OC ZINC000082067669 GI Annotated Anodyne CCOc1ccccc1CNc1cc(Oc2cc(OC)cc(OC)c2)ncn1 ZINC000082068288 GI Annotated Anodyne C1=C(CCNc2cncc(Oc3cccc(N4CCOCC4)c3)n2)CCCC1 ZINC000082068436 GI Annotated Anodyne OCCCCNc1cncc(Oc2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1 ZINC000082068620 GI Annotated Anodyne COc1cccc(CNc2cncc(Oc3cccc4cccnc34)n2)c1OC ZINC000082068667 GI Annotated Anodyne C[C@@H]1C[C@H](Nc2cncc(Oc3ccc(-n4cncn4)cc3)n2)CC(C)(C)C1 ZINC000082068724 GI Annotated Anodyne C[C@H]1C[C@H](Nc2cncc(Oc3ccc(-n4cncn4)cc3)n2)CC(C)(C)C1 ZINC000082068725 GI Annotated Anodyne C[C@@H]1C[C@@H](Nc2cncc(Oc3ccc(-n4cncn4)cc3)n2)CC(C)(C)C1 ZINC000082068726 GI Annotated Anodyne C[C@H]1C[C@@H](Nc2cncc(Oc3ccc(-n4cncn4)cc3)n2)CC(C)(C)C1 ZINC000082068727 GI Annotated Anodyne CC(=O)Nc1cccc(Oc2cncc(NC[C@]3(C)C[C@H](O)CC(C)(C)C3)n2)c1 ZINC000082068884 GI Annotated Anodyne CC(=O)Nc1cccc(Oc2cncc(NC[C@@]3(C)C[C@H](O)CC(C)(C)C3)n2)c1 ZINC000082068885 GI Annotated Anodyne CC(=O)Nc1cccc(Oc2cncc(NC[C@]3(C)C[C@@H](O)CC(C)(C)C3)n2)c1 ZINC000082068886 GI Annotated Anodyne CC(=O)Nc1cccc(Oc2cncc(NC[C@@]3(C)C[C@@H](O)CC(C)(C)C3)n2)c1 ZINC000082068887 GI Annotated Anodyne CCc1nc(C(=O)N2CCC[C@H](C(=O)OCCC3CCCCC3)C2)cs1 ZINC000082069670 GI Annotated Anodyne CCc1nc(C(=O)N2CCC[C@@H](C(=O)OCCC3CCCCC3)C2)cs1 ZINC000082069671 GI Annotated Anodyne Cc1ccccc1-c1nc(C(=O)N[C@@H](C)C(=O)OCCC2CCCCC2)co1 ZINC000082070850 GI Annotated Anodyne Cc1ccccc1-c1nc(C(=O)N[C@H](C)C(=O)OCCC2CCCCC2)co1 ZINC000082070851 GI Annotated Anodyne CN(C)CCOC(=O)c1coc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)n1 ZINC000082075115 GI Annotated Anodyne C[C@@H]1CC[C@H]2[C@@]3(C)COC(C)(C)O[C@H]3CC[C@@]2(C)[C@]12CC[C@@]1(COC(=O)C1)O2 ZINC000082077834 GI Annotated Anodyne C[C@@H]1CC[C@@H]2[C@@]3(C)COC(C)(C)O[C@H]3CC[C@@]2(C)[C@]12CC[C@@]1(COC(=O)C1)O2 ZINC000082077836 GI Annotated Anodyne C[C@@H]1CC[C@H]2[C@@]3(C)COC(C)(C)O[C@H]3CC[C@@]2(C)[C@]12CC[C@]1(COC(=O)C1)O2 ZINC000082077837 GI Annotated Anodyne C[C@@H]1CC[C@@H]2[C@@]3(C)COC(C)(C)O[C@H]3CC[C@@]2(C)[C@]12CC[C@]1(COC(=O)C1)O2 ZINC000082077842 GI Annotated Anodyne CN(C)C(=O)c1ccc(-c2cc3c(Nc4cccc(O)c4)nccc3n2C)cc1 ZINC000082078160 GI Annotated Anodyne O[C@@H](c1ccc2ccccc2c1)c1nnc(Nc2ccc3c(c2)OCO3)s1 ZINC000082078554 GI Annotated Anodyne O[C@H](c1ccc2ccccc2c1)c1nnc(Nc2ccc3c(c2)OCO3)s1 ZINC000082078556 GI Annotated Anodyne CN(c1ccccc1)c1nnc([C@H](O)c2c(F)c(F)c(F)c(F)c2F)s1 ZINC000082078625 GI Annotated Anodyne CN(c1ccccc1)c1nnc([C@@H](O)c2c(F)c(F)c(F)c(F)c2F)s1 ZINC000082078627 GI Annotated Anodyne Cn1cc(-c2cc3c[nH]/c(=N\c4cccc(OC(F)(F)F)c4)cc3n2C)cn1 ZINC000082078660 GI Annotated Anodyne COc1ccc(-c2nccc3[nH]nc(-c4cc(OC)c(OC)c(OC)c4)c23)cc1 ZINC000082078662 GI Annotated Anodyne COc1cc(-c2n[nH]c3ccnc(-c4cccc(F)c4)c23)cc(OC)c1OC ZINC000082078863 GI Annotated Anodyne COc1cc(-c2n[nH]c3ccnc(-c4ccc(C#N)cc4)c23)cc(OC)c1OC ZINC000082079092 GI Annotated Anodyne O/C(=N\c1ccc2nc(-c3cccc(C(F)(F)F)c3)nn2c1)C1CCOCC1 ZINC000082081625 GI Annotated Mild COc1ccc(/C(O)=N/c2ccc3nc(-c4cccc(F)c4)nn3c2)cc1F ZINC000082081720 GI Annotated Mild CC(=O)c1cccc(/N=C(\O)Nc2ccc3nc(Cc4ccccc4)nn3c2)c1 ZINC000082081762 GI Annotated Mild CC(=O)c1ccc(N/C(O)=N/c2ccc3nc(-c4cccs4)nn3c2)cc1 ZINC000082081843 GI Annotated Mild C/N=c1\[nH]c2cnc(Nc3cccc(C(F)(F)F)c3)cc2n1Cc1ccco1 ZINC000082081845 GI Annotated Anodyne C/N=c1\[nH]c2cnc(Nc3cc(C(F)(F)F)ccc3F)cc2n1CC1CC1 ZINC000082081877 GI Annotated Anodyne COc1ccc(/C(O)=N/c2ccc3nc(-c4ccsc4)nn3c2)cc1OC ZINC000082081903 GI Annotated Mild O/C(=N\c1cccc(C(F)(F)F)c1)Nc1ccc2nc(-c3ccncc3)nn2c1 ZINC000082081931 GI Annotated Mild C/N=c1\[nH]c2cnc(Nc3ccc(Oc4ccccc4)cc3)cc2n1CCOC ZINC000082081967 GI Annotated Anodyne C/N=c1\[nH]c2cnc(Nc3cccc(Oc4ccccc4)c3)cc2n1CCOC ZINC000082082010 GI Annotated Anodyne Cn1c(-c2ccccc2)cc2c(Nc3cccc(NS(C)(=O)=O)c3)nccc21 ZINC000082082014 GI Annotated Anodyne Cn1c(-c2ccsc2)cc2c(Nc3cccc(NS(C)(=O)=O)c3)nccc21 ZINC000082082232 GI Annotated Anodyne NC1CCC(Nc2nccc3[nH]c(-c4cccc(C(F)(F)F)c4)nc23)CC1 ZINC000082082240 GI Annotated Anodyne Cn1c(-c2ccsc2)cc2c(Nc3ccc(S(C)(=O)=O)cc3)nccc21 ZINC000082082280 GI Annotated Anodyne COCC/N=C(\O)c1cccc(-c2nc3c(NC4CCCCC4)nccc3[nH]2)c1 ZINC000082082488 GI Annotated Mild COc1cc(/N=c2\[nH]ccc3[nH]c(-c4ccc(C)cc4)nc23)cc(OC)c1OC ZINC000082082492 GI Annotated Anodyne C/C(O)=N\c1ccc(-c2nnc3ccc(-c4cccc(C(=O)N(C)C)c4)cn23)cc1 ZINC000082082565 GI Annotated Mild Cn1cc(-c2cc3cnc(N=c4cc[nH]cc4)cc3n2Cc2ccccc2)cn1 ZINC000082082599 GI Annotated Anodyne COc1cc(-c2cnc3ccc(Cc4ccc(F)cc4)nn23)cc(OC)c1OC ZINC000082082704 GI Annotated Anodyne OCC/N=C(\O)c1cccc(-c2ccc3ncc(-c4cccc(Cl)c4)n3n2)c1 ZINC000082082819 GI Annotated Anodyne CN(C)c1cccc([C@H](O)c2nnc(Nc3ccc(F)c(Cl)c3)s2)c1 ZINC000082083101 GI Annotated Anodyne CN(C)c1cccc([C@@H](O)c2nnc(Nc3ccc(F)c(Cl)c3)s2)c1 ZINC000082083102 GI Annotated Anodyne COc1ccc(Nc2cc3c(cn2)nc(-c2ccc(OC)c(OC)c2)n3C)cc1 ZINC000082083105 GI Annotated Anodyne Cc1cccc(Cc2ccc3ncc(-c4ccc(N5CCOCC5)cc4)n3n2)c1 ZINC000082083408 GI Annotated Anodyne CC(C)CNc1ccc2c(n1)C(=O)N([C@H](C)/C(O)=N/[C@H]1CCc3ccccc31)C2 ZINC000082083519 GI Annotated Mild Cn1cc(-c2cc3c[nH]/c(=N\c4cccc(O)c4)cc3n2Cc2ccccc2)cn1 ZINC000082083530 GI Annotated Anodyne CC(C)CNc1ccc2c(n1)C(=O)N([C@H](C)/C(O)=N/[C@@H](C)c1ccc(F)cc1)C2 ZINC000082083531 GI Annotated Mild CCN(CC)CC/N=C(\O)c1csc([C@H](O)c2ccc(C(C)(C)C)cc2)n1 ZINC000082083885 GI Annotated Mild CCN(CC)CC/N=C(\O)c1csc([C@@H](O)c2ccc(C(C)(C)C)cc2)n1 ZINC000082083887 GI Annotated Mild C[C@H](NC(=O)c1coc(-c2cccs2)n1)C(=O)OCCC1CCCCC1 ZINC000082083946 GI Annotated Anodyne C[C@@H](NC(=O)c1coc(-c2cccs2)n1)C(=O)OCCC1CCCCC1 ZINC000082083949 GI Annotated Anodyne C[C@@H](/N=C(\O)CN1Cc2ccc(-c3ccc(C#N)cc3)nc2C1=O)c1ccccc1 ZINC000082083970 GI Annotated Mild CC(C)CNc1ccc2c(n1)C(=O)N([C@H](C)/C(O)=N/[C@H](C)c1ccccc1)C2 ZINC000082083983 GI Annotated Mild CC(C)CNc1ccc2c(n1)C(=O)N([C@H](C)/C(O)=N/[C@@H](C)c1ccccc1)C2 ZINC000082084033 GI Annotated Mild O=C(NCCC1=CCCCC1)[C@H]1CCCN1C(=O)c1coc(-c2cccs2)n1 ZINC000082085174 GI Annotated Anodyne O=C(NCCC1=CCCCC1)[C@@H]1CCCN1C(=O)c1coc(-c2cccs2)n1 ZINC000082085175 GI Annotated Anodyne Cc1ccccc1-c1nc(C(=O)N(C)CC(=O)OCCC2CCCCC2)co1 ZINC000082088105 GI Annotated Anodyne CCCC[C@@H](CC)CNc1nc(NC[C@@H](C)O)c2cc(OC)c(OC)cc2n1 ZINC000082129375 GI Annotated Anodyne CCCC[C@H](CC)CNc1nc(NC[C@@H](C)O)c2cc(OC)c(OC)cc2n1 ZINC000082129377 GI Annotated Anodyne CCCC[C@@H](CC)CNc1nc(NC[C@H](C)O)c2cc(OC)c(OC)cc2n1 ZINC000082129378 GI Annotated Anodyne CCCC[C@H](CC)CNc1nc(NC[C@H](C)O)c2cc(OC)c(OC)cc2n1 ZINC000082129381 GI Annotated Anodyne Cc1ccc(CNc2ncc(C(=O)N(C)CC(C)C)c(-c3ccccc3)n2)o1 ZINC000082132326 GI Annotated Anodyne CCN(C)c1ncc(C(=O)N[C@H]2C[C@H]3C[C@@H]([C@H]2C)C3(C)C)c(-c2ccccc2)n1 ZINC000082132880 GI Annotated Anodyne Cc1ccc(CNc2ncc(C(=O)N3CCCCC3)c(-c3ccccc3)n2)o1 ZINC000082133150 GI Annotated Anodyne CC(C)CN(C)c1ncc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)c(-c2ccccc2)n1 ZINC000082133186 GI Annotated Anodyne CC(C)CN(C)c1ncc(C(=O)N2C[C@@H](C)C[C@H](C)C2)c(-c2ccccc2)n1 ZINC000082133187 GI Annotated Anodyne CC(C)CN(C)c1ncc(C(=O)N2C[C@H](C)C[C@@H](C)C2)c(-c2ccccc2)n1 ZINC000082133188 GI Annotated Anodyne C[C@H]1C[C@@H](C)CN(c2ncc(C(=O)N3CCCCC3)c(-c3ccccc3)n2)C1 ZINC000082133295 GI Annotated Anodyne C[C@H]1C[C@H](C)CN(c2ncc(C(=O)N3CCCCC3)c(-c3ccccc3)n2)C1 ZINC000082133296 GI Annotated Anodyne C[C@@H]1C[C@@H](C)CN(c2ncc(C(=O)N3CCCCC3)c(-c3ccccc3)n2)C1 ZINC000082133297 GI Annotated Anodyne CC1CCN(C(=O)c2cnc(N3C[C@@H](C)C[C@@H](C)C3)nc2-c2ccccc2)CC1 ZINC000082133344 GI Annotated Anodyne CC1CCN(C(=O)c2cnc(N3C[C@@H](C)C[C@H](C)C3)nc2-c2ccccc2)CC1 ZINC000082133345 GI Annotated Anodyne CC1CCN(C(=O)c2cnc(N3C[C@H](C)C[C@@H](C)C3)nc2-c2ccccc2)CC1 ZINC000082133346 GI Annotated Anodyne CC(C)CN(CC(C)C)C(=O)c1cnc(N2CCCC2)nc1-c1ccccc1 ZINC000082134002 GI Annotated Anodyne CC(C)CN(C)C(=O)c1cnc(NC2CCCC2)nc1-c1cccc([N+](=O)[O-])c1 ZINC000082134443 GI Annotated Bother O=C(c1cnc(NC2CCCCC2)nc1-c1cccc([N+](=O)[O-])c1)N1CCCC1 ZINC000082135250 GI Annotated Bother O=C(c1cnc(NC2CCCC2)nc1-c1cccc([N+](=O)[O-])c1)N1CCCCC1 ZINC000082135524 GI Annotated Bother Cc1ccccc1-n1nnnc1[C@@H](c1ccccc1)N(C)Cc1ccc(F)cc1 ZINC000082135643 GI Annotated Anodyne Cc1ccccc1-n1nnnc1[C@H](c1ccccc1)N(C)Cc1ccc(F)cc1 ZINC000082135645 GI Annotated Anodyne CC[C@@H](C)Nc1ncc(C(=O)N2CCC(C)CC2)c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000082135834 GI Annotated Bother CC[C@H](C)Nc1ncc(C(=O)N2CCC(C)CC2)c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000082135836 GI Annotated Bother C[C@@H]1CCCC[C@@H]1NC(=O)c1cnc(N2CCCC2)nc1-c1ccc(F)cc1 ZINC000082136372 GI Annotated Anodyne C[C@H]1CCCC[C@@H]1NC(=O)c1cnc(N2CCCC2)nc1-c1ccc(F)cc1 ZINC000082136373 GI Annotated Anodyne C[C@@H]1CCCC[C@H]1NC(=O)c1cnc(N2CCCC2)nc1-c1ccc(F)cc1 ZINC000082136374 GI Annotated Anodyne C[C@H]1CCCC[C@H]1NC(=O)c1cnc(N2CCCC2)nc1-c1ccc(F)cc1 ZINC000082136375 GI Annotated Anodyne CC(C)CN(C)C(=O)c1cnc(N2C[C@@H](C)C[C@@H](C)C2)nc1-c1ccc(F)cc1 ZINC000082139302 GI Annotated Anodyne CC(C)CN(C)C(=O)c1cnc(N2C[C@@H](C)C[C@H](C)C2)nc1-c1ccc(F)cc1 ZINC000082139305 GI Annotated Anodyne CC(C)CN(C)C(=O)c1cnc(N2C[C@H](C)C[C@@H](C)C2)nc1-c1ccc(F)cc1 ZINC000082139307 GI Annotated Anodyne CC(C)CN(C)C(=O)c1cnc(N2CCC(C)CC2)nc1-c1ccc(F)cc1 ZINC000082139310 GI Annotated Anodyne O=C(NCC1CCCCC1)c1cnc(N2CCCC2)nc1-c1ccc(F)cc1 ZINC000082139316 GI Annotated Anodyne CN(C(=O)c1cnc(N2CCCC2)nc1-c1ccc(F)cc1)C1CCCCC1 ZINC000082139859 GI Annotated Anodyne C[C@H]1C[C@@H](C)CN(c2ncc(C(=O)N3CCCC3)c(-c3ccc(F)cc3)n2)C1 ZINC000082139997 GI Annotated Anodyne C[C@H]1C[C@H](C)CN(c2ncc(C(=O)N3CCCC3)c(-c3ccc(F)cc3)n2)C1 ZINC000082140000 GI Annotated Anodyne C[C@@H]1C[C@@H](C)CN(c2ncc(C(=O)N3CCCC3)c(-c3ccc(F)cc3)n2)C1 ZINC000082140003 GI Annotated Anodyne Cc1ccc(CNc2ncc(C(=O)N3CCCCC3)c(-c3ccc(F)cc3)n2)o1 ZINC000082140392 GI Annotated Anodyne CC(C)CN(C)c1ncc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)c(-c2ccc(F)cc2)n1 ZINC000082140470 GI Annotated Anodyne CC(C)CN(C)c1ncc(C(=O)N2C[C@@H](C)C[C@H](C)C2)c(-c2ccc(F)cc2)n1 ZINC000082140472 GI Annotated Anodyne CC(C)CN(C)c1ncc(C(=O)N2C[C@H](C)C[C@@H](C)C2)c(-c2ccc(F)cc2)n1 ZINC000082140477 GI Annotated Anodyne CC(C)CN(C)c1ncc(C(=O)N2CCC(C)CC2)c(-c2ccc(F)cc2)n1 ZINC000082140528 GI Annotated Anodyne CC[C@@H](C)NC(=O)c1cnc(NCc2ccc(C)o2)nc1-c1ccc(F)cc1 ZINC000082140591 GI Annotated Anodyne CC[C@H](C)NC(=O)c1cnc(NCc2ccc(C)o2)nc1-c1ccc(F)cc1 ZINC000082140595 GI Annotated Anodyne C[C@H]1C[C@@H](C)CN(c2ncc(C(=O)N3CCCCC3)c(-c3ccc(F)cc3)n2)C1 ZINC000082140729 GI Annotated Anodyne C[C@H]1C[C@H](C)CN(c2ncc(C(=O)N3CCCCC3)c(-c3ccc(F)cc3)n2)C1 ZINC000082140731 GI Annotated Anodyne C[C@@H]1C[C@@H](C)CN(c2ncc(C(=O)N3CCCCC3)c(-c3ccc(F)cc3)n2)C1 ZINC000082140733 GI Annotated Anodyne C[C@H]1C[C@@H](C)CN(C(=O)c2cnc(N3CCCCC3)nc2-c2ccc(F)cc2)C1 ZINC000082140787 GI Annotated Anodyne C[C@H]1C[C@H](C)CN(C(=O)c2cnc(N3CCCCC3)nc2-c2ccc(F)cc2)C1 ZINC000082140788 GI Annotated Anodyne C[C@@H]1C[C@@H](C)CN(C(=O)c2cnc(N3CCCCC3)nc2-c2ccc(F)cc2)C1 ZINC000082140791 GI Annotated Anodyne CC[C@@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@@H](C)C2)nc1-c1ccc(F)cc1 ZINC000082140902 GI Annotated Anodyne CC[C@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@@H](C)C2)nc1-c1ccc(F)cc1 ZINC000082140905 GI Annotated Anodyne CC[C@@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@H](C)C2)nc1-c1ccc(F)cc1 ZINC000082140907 GI Annotated Anodyne CC[C@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@H](C)C2)nc1-c1ccc(F)cc1 ZINC000082140912 GI Annotated Anodyne CC1CCN(c2ncc(C(=O)N[C@@H]3CCCC[C@@H]3C)c(-c3ccco3)n2)CC1 ZINC000082141893 GI Annotated Anodyne CC1CCN(c2ncc(C(=O)N[C@H]3CCCC[C@@H]3C)c(-c3ccco3)n2)CC1 ZINC000082141896 GI Annotated Anodyne CC1CCN(c2ncc(C(=O)N[C@@H]3CCCC[C@H]3C)c(-c3ccco3)n2)CC1 ZINC000082141898 GI Annotated Anodyne CC1CCN(c2ncc(C(=O)N[C@H]3CCCC[C@H]3C)c(-c3ccco3)n2)CC1 ZINC000082141900 GI Annotated Anodyne CC(C)CN(C)C(=O)c1cnc(NCCc2cccc(F)c2)nc1-c1ccco1 ZINC000082141946 GI Annotated Anodyne C[C@H]1[C@@H](NC(=O)c2cnc(N3CCCC3)nc2-c2ccco2)C[C@H]2C[C@@H]1C2(C)C ZINC000082141994 GI Annotated Anodyne Cc1ccc(CCNc2ncc(C(=O)N(C)CC(C)C)c(-c3ccco3)n2)cc1 ZINC000082142191 GI Annotated Anodyne CC1CCN(c2ncc(C(=O)N(C)C3CCCCC3)c(-c3ccco3)n2)CC1 ZINC000082142452 GI Annotated Anodyne CCN(Cc1cccc(C)c1)C(=O)c1cnc(N(C)CC)nc1-c1ccco1 ZINC000082142725 GI Annotated Anodyne CCN(C)C(=O)c1cnc(N[C@H]2C[C@H]3C[C@@H]([C@H]2C)C3(C)C)nc1-c1ccco1 ZINC000082142898 GI Annotated Anodyne CCN(Cc1ccccc1)C(=O)c1cnc(N(C)CC(C)C)nc1-c1ccco1 ZINC000082142922 GI Annotated Anodyne CC(C)N(Cc1ccccc1)C(=O)c1cnc(N2CCCC2)nc1-c1ccco1 ZINC000082143025 GI Annotated Anodyne CC(C)CN(CC(C)C)C(=O)c1cnc(N2CCCCC2)nc1-c1ccco1 ZINC000082143062 GI Annotated Anodyne Cc1cccc(-c2nc(NCc3ccc(C)o3)ncc2C(=O)N2CCCC2)c1 ZINC000082145641 GI Annotated Anodyne CC[C@@H](C)NC(=O)c1cnc(NCc2ccc(C)o2)nc1-c1cccc(C)c1 ZINC000082146072 GI Annotated Anodyne CC[C@H](C)NC(=O)c1cnc(NCc2ccc(C)o2)nc1-c1cccc(C)c1 ZINC000082146073 GI Annotated Anodyne Cc1cccc(-c2nc(N3C[C@@H](C)C[C@@H](C)C3)ncc2C(=O)N2CCCC2)c1 ZINC000082146206 GI Annotated Anodyne Cc1cccc(-c2nc(N3C[C@@H](C)C[C@H](C)C3)ncc2C(=O)N2CCCC2)c1 ZINC000082146209 GI Annotated Anodyne Cc1cccc(-c2nc(N3C[C@H](C)C[C@@H](C)C3)ncc2C(=O)N2CCCC2)c1 ZINC000082146214 GI Annotated Anodyne CC[C@@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@@H](C)C2)nc1-c1cccc(C)c1 ZINC000082146405 GI Annotated Anodyne CC[C@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@@H](C)C2)nc1-c1cccc(C)c1 ZINC000082146409 GI Annotated Anodyne CC[C@@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@H](C)C2)nc1-c1cccc(C)c1 ZINC000082146411 GI Annotated Anodyne CC[C@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@H](C)C2)nc1-c1cccc(C)c1 ZINC000082146412 GI Annotated Anodyne CC(C)CN(C)C(=O)c1cnc(NC2CCCC2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000082147690 GI Annotated Bother C[C@H]1C[C@H](C)CN(C(=O)c2ccc(SCc3ccccn3)c([N+](=O)[O-])c2)C1 ZINC000082149421 GI Annotated Anodyne C[C@@H]1C[C@@H](C)CN(C(=O)c2ccc(SCc3ccccn3)c([N+](=O)[O-])c2)C1 ZINC000082149424 GI Annotated Anodyne C[C@@H]1CCCC[C@@H]1NC(=O)c1cnc(N2CCCC2)nc1-c1ccccc1F ZINC000082150728 GI Annotated Anodyne C[C@H]1CCCC[C@@H]1NC(=O)c1cnc(N2CCCC2)nc1-c1ccccc1F ZINC000082150732 GI Annotated Anodyne C[C@@H]1CCCC[C@H]1NC(=O)c1cnc(N2CCCC2)nc1-c1ccccc1F ZINC000082150736 GI Annotated Anodyne C[C@H]1CCCC[C@H]1NC(=O)c1cnc(N2CCCC2)nc1-c1ccccc1F ZINC000082150739 GI Annotated Anodyne CC(C)CN(C)C(=O)c1cnc(N2C[C@@H](C)C[C@@H](C)C2)nc1-c1ccccc1F ZINC000082151118 GI Annotated Anodyne CC(C)CN(C)C(=O)c1cnc(N2C[C@@H](C)C[C@H](C)C2)nc1-c1ccccc1F ZINC000082151121 GI Annotated Anodyne CC(C)CN(C)C(=O)c1cnc(N2C[C@H](C)C[C@@H](C)C2)nc1-c1ccccc1F ZINC000082151125 GI Annotated Anodyne COc1ccc2oc(=O)c(-c3cn(-c4cccc(C(=O)O)c4)c(=S)[nH]3)cc2c1 ZINC000082151308 GI Annotated Anodyne C[C@H]1C[C@@H](C)CN(c2ncc(C(=O)N3CCCC3)c(-c3ccccc3F)n2)C1 ZINC000082151609 GI Annotated Anodyne C[C@H]1C[C@H](C)CN(c2ncc(C(=O)N3CCCC3)c(-c3ccccc3F)n2)C1 ZINC000082151611 GI Annotated Anodyne C[C@@H]1C[C@@H](C)CN(c2ncc(C(=O)N3CCCC3)c(-c3ccccc3F)n2)C1 ZINC000082151614 GI Annotated Anodyne CN(C(=O)c1cnc(N2CCCC2)nc1-c1ccccc1F)C1CCCCC1 ZINC000082151777 GI Annotated Anodyne CC(C)CN(C)c1ncc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)c(-c2ccccc2F)n1 ZINC000082151974 GI Annotated Anodyne CC(C)CN(C)c1ncc(C(=O)N2C[C@@H](C)C[C@H](C)C2)c(-c2ccccc2F)n1 ZINC000082151978 GI Annotated Anodyne CC(C)CN(C)c1ncc(C(=O)N2C[C@H](C)C[C@@H](C)C2)c(-c2ccccc2F)n1 ZINC000082151979 GI Annotated Anodyne Cc1ccc(CNc2ncc(C(=O)N3CCCCC3)c(-c3ccccc3F)n2)o1 ZINC000082152038 GI Annotated Anodyne C[C@H]1C[C@@H](C)CN(c2ncc(C(=O)N3CCCCC3)c(-c3ccccc3F)n2)C1 ZINC000082152306 GI Annotated Anodyne C[C@H]1C[C@H](C)CN(c2ncc(C(=O)N3CCCCC3)c(-c3ccccc3F)n2)C1 ZINC000082152309 GI Annotated Anodyne C[C@@H]1C[C@@H](C)CN(c2ncc(C(=O)N3CCCCC3)c(-c3ccccc3F)n2)C1 ZINC000082152312 GI Annotated Anodyne C[C@H]1C[C@@H](C)CN(C(=O)c2cnc(N3CCCCC3)nc2-c2ccccc2F)C1 ZINC000082152314 GI Annotated Anodyne C[C@H]1C[C@H](C)CN(C(=O)c2cnc(N3CCCCC3)nc2-c2ccccc2F)C1 ZINC000082152318 GI Annotated Anodyne C[C@@H]1C[C@@H](C)CN(C(=O)c2cnc(N3CCCCC3)nc2-c2ccccc2F)C1 ZINC000082152320 GI Annotated Anodyne CC[C@@H](C)NC(=O)c1cnc(NCc2ccc(C)o2)nc1-c1ccccc1F ZINC000082152393 GI Annotated Anodyne CC[C@H](C)NC(=O)c1cnc(NCc2ccc(C)o2)nc1-c1ccccc1F ZINC000082152395 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc(Cl)cc4)ccc31)[C@@H]1CC[C@H](C2)N1 ZINC000082152426 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc(Cl)cc4)ccc31)[C@H]1CC[C@@H](C2)N1 ZINC000082152427 GI Annotated Anodyne Cc1ccc(Cn2cnc(C(=O)N(C#N)Cc3ccccc3Cl)c2C)cc1 ZINC000082152434 GI Annotated Anodyne C[C@H]1C[C@@H](C)CN(C(=O)c2cnc(N3CCCC3)nc2-c2ccccc2F)C1 ZINC000082152483 GI Annotated Anodyne C[C@H]1C[C@H](C)CN(C(=O)c2cnc(N3CCCC3)nc2-c2ccccc2F)C1 ZINC000082152489 GI Annotated Anodyne C[C@@H]1C[C@@H](C)CN(C(=O)c2cnc(N3CCCC3)nc2-c2ccccc2F)C1 ZINC000082152492 GI Annotated Anodyne CC[C@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@H](C)C2)nc1-c1ccccc1F ZINC000082152541 GI Annotated Anodyne Cc1ccc(S(=O)(=O)N2c3ccccc3[C@H]3COc4ccccc4[C@H]32)cc1 ZINC000082152791 GI Annotated Anodyne CC(=O)c1cc(C(=O)O)c2sc3ccc(OC4CCCCC4)cc3n2c1=O ZINC000082152920 GI Annotated Anodyne CC(C)n1c2c(c3cc(S(=O)(=O)c4ccccc4)ccc31)[C@@H]1CC[C@H](C2)N1 ZINC000082153135 GI Annotated Anodyne CC(C)n1c2c(c3cc(S(=O)(=O)c4ccccc4)ccc31)[C@H]1CC[C@@H](C2)N1 ZINC000082153138 GI Annotated Anodyne CCCCS(=O)(=O)N(Cc1ccc2c(n1)C=CC(C)(C)O2)c1ccccc1 ZINC000082158437 GI Annotated Anodyne CC(C)CS(=O)(=O)N(Cc1ccc2c(n1)C=CC(C)(C)O2)c1ccccc1 ZINC000082158439 GI Annotated Anodyne CC[C@@H]1CC[C@H](C)N(C(=O)c2cnc(N(C)CC)nc2-c2ccc(C#N)cc2)C1 ZINC000082158592 GI Annotated Mild CC[C@H]1CC[C@H](C)N(C(=O)c2cnc(N(C)CC)nc2-c2ccc(C#N)cc2)C1 ZINC000082158593 GI Annotated Mild CC[C@@H]1CC[C@@H](C)N(C(=O)c2cnc(N(C)CC)nc2-c2ccc(C#N)cc2)C1 ZINC000082158594 GI Annotated Mild CC[C@H]1CC[C@@H](C)N(C(=O)c2cnc(N(C)CC)nc2-c2ccc(C#N)cc2)C1 ZINC000082158595 GI Annotated Mild CC[C@@H](C)NC(=O)c1cnc(NCc2ccc(C)o2)nc1-c1ccc(C#N)cc1 ZINC000082158647 GI Annotated Mild CC[C@H](C)NC(=O)c1cnc(NCc2ccc(C)o2)nc1-c1ccc(C#N)cc1 ZINC000082158648 GI Annotated Mild CC[C@@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@@H](C)C2)nc1-c1ccc(C#N)cc1 ZINC000082158770 GI Annotated Mild CC[C@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@@H](C)C2)nc1-c1ccc(C#N)cc1 ZINC000082158771 GI Annotated Mild CC[C@@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@H](C)C2)nc1-c1ccc(C#N)cc1 ZINC000082158772 GI Annotated Mild CC[C@H](C)NC(=O)c1cnc(N2C[C@@H](C)C[C@H](C)C2)nc1-c1ccc(C#N)cc1 ZINC000082158773 GI Annotated Mild CC[C@@H](C)Nc1ncc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)c(-c2ccc(C#N)cc2)n1 ZINC000082158878 GI Annotated Mild CC[C@H](C)Nc1ncc(C(=O)N2C[C@@H](C)C[C@@H](C)C2)c(-c2ccc(C#N)cc2)n1 ZINC000082158879 GI Annotated Mild CC[C@@H](C)Nc1ncc(C(=O)N2C[C@@H](C)C[C@H](C)C2)c(-c2ccc(C#N)cc2)n1 ZINC000082158880 GI Annotated Mild CC[C@H](C)Nc1ncc(C(=O)N2C[C@@H](C)C[C@H](C)C2)c(-c2ccc(C#N)cc2)n1 ZINC000082158882 GI Annotated Mild CC(C)CN(C)C(=O)c1cnc(NCc2ccccc2)nc1-c1ccc(C#N)cc1 ZINC000082159505 GI Annotated Mild CCN(C)c1ncc(C(=O)N(CC(C)C)CC(C)C)c(-c2ccc(C#N)cc2)n1 ZINC000082159860 GI Annotated Mild Cc1cccc(-c2nc(N(C)CC(C)C)ncc2C(=O)N2CCC(C)CC2)c1 ZINC000082160165 GI Annotated Anodyne COc1ccc(OC)c(-c2cc(NCCCN(C)c3ccccc3)ncn2)c1 ZINC000082161023 GI Annotated Anodyne CCCOCCCNc1ncc(-c2ncc(C)o2)c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000082163417 GI Annotated Bother CCc1cnc(-c2cnc(NCCCOC)nc2-c2cccc([N+](=O)[O-])c2)s1 ZINC000082163458 GI Annotated Bother COCCCNc1ncc(-c2nc(C)c(C)s2)c(-c2cccc([N+](=O)[O-])c2)n1 ZINC000082163459 GI Annotated Bother Cc1nc(-c2cnc(N(C)CC(C)C)nc2-c2cccc([N+](=O)[O-])c2)oc1C ZINC000082163512 GI Annotated Bother CCc1cnc(-c2cnc(N3CCCC3)nc2-c2cccc([N+](=O)[O-])c2)s1 ZINC000082163584 GI Annotated Bother Cc1nc(-c2cnc(N3CCCC3)nc2-c2cccc([N+](=O)[O-])c2)sc1C ZINC000082163585 GI Annotated Bother Cc1nc(-c2cnc(N3CCCCC3)nc2-c2cccc([N+](=O)[O-])c2)oc1C ZINC000082163644 GI Annotated Bother Cc1cnc(-c2cnc(N3C[C@@H](C)C[C@@H](C)C3)nc2-c2cccc([N+](=O)[O-])c2)o1 ZINC000082163674 GI Annotated Bother Cc1cnc(-c2cnc(N3C[C@@H](C)C[C@H](C)C3)nc2-c2cccc([N+](=O)[O-])c2)o1 ZINC000082163675 GI Annotated Bother Cc1cnc(-c2cnc(N3C[C@H](C)C[C@@H](C)C3)nc2-c2cccc([N+](=O)[O-])c2)o1 ZINC000082163676 GI Annotated Bother Cc1cnc(-c2cnc(N3CCC(C)CC3)nc2-c2cccc([N+](=O)[O-])c2)o1 ZINC000082163709 GI Annotated Bother Fc1ccc(-c2nc(N3CCOCC3)ncc2-c2nc3ccccc3s2)cc1 ZINC000082164513 GI Annotated Anodyne Cc1nc(-c2cnc(NCCOc3ccccc3)nc2-c2ccco2)oc1C ZINC000082165642 GI Annotated Anodyne Cc1oc(-c2cnc(N3CCOCC3)nc2-c2ccco2)nc1-c1ccccc1 ZINC000082165751 GI Annotated Anodyne CCCCCc1nc(-c2cnc(N3CCOCC3)nc2-c2ccco2)oc1C ZINC000082165757 GI Annotated Anodyne c1ccc(-c2cnc(-c3cnc(N4CCOCC4)nc3-c3ccco3)s2)cc1 ZINC000082165766 GI Annotated Anodyne CCCCCc1nc(-c2cnc(N3CCC(O)CC3)nc2-c2ccco2)oc1C ZINC000082165880 GI Annotated Anodyne COCCNc1ncc(-c2nc(-c3ccccc3)c(C)o2)c(-c2ccco2)n1 ZINC000082166279 GI Annotated Anodyne COc1ccccc1CCNc1ncc(-c2ncc(C)o2)c(-c2ccco2)n1 ZINC000082166311 GI Annotated Anodyne COc1ccc(CCNc2ncc(-c3ncc(C)o3)c(-c3ccco3)n2)cc1 ZINC000082166373 GI Annotated Anodyne CCCCNc1ncc(-c2ncc(C)o2)c(-c2cc(OC)c(OC)c(OC)c2)n1 ZINC000082166484 GI Annotated Anodyne CC[C@@H](C)Nc1ncc(-c2ncc(C)o2)c(-c2cc(OC)c(OC)c(OC)c2)n1 ZINC000082167247 GI Annotated Anodyne CC[C@H](C)Nc1ncc(-c2ncc(C)o2)c(-c2cc(OC)c(OC)c(OC)c2)n1 ZINC000082167249 GI Annotated Anodyne COc1cc(CNc2cc(-c3cc(C)ccc3C)ncn2)cc(OC)c1OC ZINC000082167609 GI Annotated Anodyne COc1cc(CNc2cc(-c3cc(F)cc(F)c3)ncn2)cc(OC)c1OC ZINC000082168158 GI Annotated Anodyne CCc1cnc(-c2cnc(N3CCC(O)CC3)nc2-c2cccc(C)c2)s1 ZINC000082173460 GI Annotated Anodyne Cc1cccc(-c2nc(N3CCC(O)CC3)ncc2-c2nc(C)c(C)s2)c1 ZINC000082173463 GI Annotated Anodyne CCCOCCCNc1ncc(-c2ncc(C)o2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000082174054 GI Annotated Bother CCc1cnc(-c2cnc(NCCCOC)nc2-c2ccc([N+](=O)[O-])cc2)s1 ZINC000082174140 GI Annotated Bother COCCCNc1ncc(-c2nc(C)c(C)s2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000082174142 GI Annotated Bother Cc1nc(-c2cnc(N(C)CC(C)C)nc2-c2ccc([N+](=O)[O-])cc2)oc1C ZINC000082174250 GI Annotated Bother CCc1cnc(-c2cnc(N3CCCC3)nc2-c2ccc([N+](=O)[O-])cc2)s1 ZINC000082174410 GI Annotated Bother Cc1nc(-c2cnc(N3CCCC3)nc2-c2ccc([N+](=O)[O-])cc2)sc1C ZINC000082174412 GI Annotated Bother Cc1cnc(-c2cnc(N3C[C@@H](C)C[C@@H](C)C3)nc2-c2ccc([N+](=O)[O-])cc2)o1 ZINC000082174593 GI Annotated Bother Cc1cnc(-c2cnc(N3C[C@@H](C)C[C@H](C)C3)nc2-c2ccc([N+](=O)[O-])cc2)o1 ZINC000082174596 GI Annotated Bother Cc1cnc(-c2cnc(N3C[C@H](C)C[C@@H](C)C3)nc2-c2ccc([N+](=O)[O-])cc2)o1 ZINC000082174597 GI Annotated Bother Fc1ccccc1-c1nc(N2CCOCC2)ncc1-c1nc2ccccc2s1 ZINC000082175654 GI Annotated Anodyne CCc1cnc(-c2cnc(N3CCC(O)CC3)nc2-c2ccccc2C)s1 ZINC000082177493 GI Annotated Anodyne Cc1ccccc1-c1nc(N2CCC(O)CC2)ncc1-c1nc(C)c(C)s1 ZINC000082177494 GI Annotated Anodyne CC(C)CNc1ncnc2c1nc(-c1ccccc1)n2CCN1CCCCC1 ZINC000082177767 GI Annotated Anodyne CC(C)CNc1ncnc2c1nc(-c1ccccc1)n2CC[C@@H]1CCCN1C ZINC000082177778 GI Annotated Anodyne CC(C)CNc1ncnc2c1nc(-c1ccccc1)n2CC[C@H]1CCCN1C ZINC000082177779 GI Annotated Anodyne CCCCCn1c(-c2ccc(O)c(OC)c2)nc2c(NCC(C)C)ncnc21 ZINC000082177818 GI Annotated Anodyne CC[C@@H](C)Cn1c(-c2ccc(O)c(OC)c2)nc2c(NCC(C)C)ncnc21 ZINC000082177824 GI Annotated Anodyne CC[C@H](C)Cn1c(-c2ccc(O)c(OC)c2)nc2c(NCC(C)C)ncnc21 ZINC000082177826 GI Annotated Anodyne CC(C)c1nc2c(NCc3cccs3)ncnc2n1CCN1CCCCC1 ZINC000082177833 GI Annotated Anodyne CC[C@@H](C)Cn1c(-c2ccc(C(=O)OC)cc2)nc2c(NCC(C)C)ncnc21 ZINC000082177899 GI Annotated Anodyne CC[C@H](C)Cn1c(-c2ccc(C(=O)OC)cc2)nc2c(NCC(C)C)ncnc21 ZINC000082177900 GI Annotated Anodyne CC(C)CNc1ncnc2c1nc(-c1ccsc1)n2CCN1CCCCC1 ZINC000082177961 GI Annotated Anodyne CC(C)CNc1ncnc2c1nc(-c1ccsc1)n2CCc1ccccn1 ZINC000082177965 GI Annotated Anodyne CC(C)CNc1ncnc2c1nc(-c1ccsc1)n2CC[C@@H]1CCCN1C ZINC000082177968 GI Annotated Anodyne CC(C)CNc1ncnc2c1nc(-c1ccsc1)n2CC[C@H]1CCCN1C ZINC000082177969 GI Annotated Anodyne CC(C)CNc1ncnc2c1nc(C1CCCCC1)n2CCN1CCCCC1 ZINC000082177980 GI Annotated Anodyne CC(C)CNc1ncnc2c1nc(C1CCCCC1)n2CC[C@@H]1CCCN1C ZINC000082177993 GI Annotated Anodyne CC(C)CNc1ncnc2c1nc(C1CCCCC1)n2CC[C@H]1CCCN1C ZINC000082177994 GI Annotated Anodyne Cc1ccc(-c2nc3c(NCC(C)C)ncnc3n2CCc2ccccn2)o1 ZINC000082178021 GI Annotated Anodyne CC(C)CNc1ncnc2c1nc(-c1cccs1)n2CCN1CCCCC1 ZINC000082178032 GI Annotated Anodyne CC(C)CNc1ncnc2c1nc(-c1cccs1)n2CCc1ccccn1 ZINC000082178040 GI Annotated Anodyne CC(C)CNc1ncnc2c1nc(-c1cccs1)n2CC[C@@H]1CCCN1C ZINC000082178045 GI Annotated Anodyne CC(C)CNc1ncnc2c1nc(-c1cccs1)n2CC[C@H]1CCCN1C ZINC000082178046 GI Annotated Anodyne CC(C)(C)Cc1nc2c(NCc3cccs3)ncnc2n1C[C@@H]1CCCO1 ZINC000082178186 GI Annotated Anodyne CC(C)(C)Cc1nc2c(NCc3cccs3)ncnc2n1C[C@H]1CCCO1 ZINC000082178187 GI Annotated Anodyne CC(C)Cc1nc2c(NCc3cccs3)ncnc2n1CCc1ccccn1 ZINC000082178203 GI Annotated Anodyne CC(C)c1nc2c(NCc3cccs3)ncnc2n1CCc1ccccn1 ZINC000082178259 GI Annotated Anodyne CCCc1nc2c(NCc3cccs3)ncnc2n1CCc1ccccn1 ZINC000082178279 GI Annotated Anodyne c1ccc(CCn2c(C3CC3)nc3c(NCc4cccs4)ncnc32)nc1 ZINC000082178298 GI Annotated Anodyne c1ccc(CNc2ncnc3c2nc(-c2ccoc2)n3CCc2ccccn2)cc1 ZINC000082178407 GI Annotated Anodyne CC(C)Cc1nc2c(NCc3ccccc3)ncnc2n1CCc1ccccn1 ZINC000082178554 GI Annotated Anodyne COCCn1c(-c2ccsc2)nc2c(NCc3ccc(C)cc3)ncnc21 ZINC000082179221 GI Annotated Anodyne COCCn1c(C2CCCCC2)nc2c(NCc3ccc(C)cc3)ncnc21 ZINC000082179235 GI Annotated Anodyne COCCn1c(-c2cccs2)nc2c(NCc3ccc(C)cc3)ncnc21 ZINC000082179275 GI Annotated Anodyne Cc1ccc(CNc2ncnc3c2nc(CC(C)C)n3C[C@@H]2CCCO2)cc1 ZINC000082179290 GI Annotated Anodyne Cc1ccc(CNc2ncnc3c2nc(CC(C)C)n3C[C@H]2CCCO2)cc1 ZINC000082179291 GI Annotated Anodyne Cc1ccc(CNc2ncnc3c2nc(C(C)C)n3CCN2CCCCC2)cc1 ZINC000082179348 GI Annotated Anodyne Cc1ccc(CNc2ncnc3c2nc(C(C)C)n3CC[C@@H]2CCCN2C)cc1 ZINC000082179355 GI Annotated Anodyne Cc1ccc(CNc2ncnc3c2nc(C(C)C)n3CC[C@H]2CCCN2C)cc1 ZINC000082179356 GI Annotated Anodyne CCCc1nc2c(NCc3ccc(C)cc3)ncnc2n1CCN1CCCCC1 ZINC000082179362 GI Annotated Anodyne CCCc1nc2c(NCc3ccc(C)cc3)ncnc2n1CCc1ccccn1 ZINC000082179366 GI Annotated Anodyne CCCc1nc2c(NCc3ccc(C)cc3)ncnc2n1CC[C@@H]1CCCN1C ZINC000082179369 GI Annotated Anodyne CCCc1nc2c(NCc3ccc(C)cc3)ncnc2n1CC[C@H]1CCCN1C ZINC000082179370 GI Annotated Anodyne Cc1ccc(CNc2ncnc3c2nc(C2CC2)n3CCN2CCCCC2)cc1 ZINC000082179390 GI Annotated Anodyne Cc1ccc(CNc2ncnc3c2nc(C2CC2)n3CCc2ccccn2)cc1 ZINC000082179394 GI Annotated Anodyne Cc1ccc(CNc2ncnc3c2nc(C2CC2)n3CC[C@@H]2CCCN2C)cc1 ZINC000082179397 GI Annotated Anodyne Cc1ccc(CNc2ncnc3c2nc(C2CC2)n3CC[C@H]2CCCN2C)cc1 ZINC000082179398 GI Annotated Anodyne COCCn1c(C2CCCCC2)nc2c(NCCc3cccc(F)c3)ncnc21 ZINC000082179582 GI Annotated Anodyne CCC(CC)c1nc2c(NCCc3cccc(F)c3)ncnc2n1CCOC ZINC000082179715 GI Annotated Anodyne CCCCCn1c(-c2ccc(C(=O)OC)cc2)nc2c(NCC3CC3)ncnc21 ZINC000082179741 GI Annotated Anodyne COCCn1c(-c2ccccc2)nc2c(NCCCc3ccccc3)ncnc21 ZINC000082179760 GI Annotated Anodyne COCCn1c(-c2ccc(C)o2)nc2c(NCCCc3ccccc3)ncnc21 ZINC000082179941 GI Annotated Anodyne COCCn1c(-c2cccs2)nc2c(NCCCc3ccccc3)ncnc21 ZINC000082179956 GI Annotated Anodyne CC[C@@H](C)Cn1c(-c2ccc(O)c(OC)c2)nc2c(NCC3CC3)ncnc21 ZINC000082180000 GI Annotated Anodyne CC[C@H](C)Cn1c(-c2ccc(O)c(OC)c2)nc2c(NCC3CC3)ncnc21 ZINC000082180001 GI Annotated Anodyne CCC(CC)c1nc2c(NCCCc3ccccc3)ncnc2n1CCOC ZINC000082180063 GI Annotated Anodyne CC[C@@H](C)Cn1c(-c2ccc(C(=O)OC)cc2)nc2c(NCC3CC3)ncnc21 ZINC000082180082 GI Annotated Anodyne CC[C@H](C)Cn1c(-c2ccc(C(=O)OC)cc2)nc2c(NCC3CC3)ncnc21 ZINC000082180083 GI Annotated Anodyne COCCn1c(CC(C)(C)C)nc2c(NCCCc3ccccc3)ncnc21 ZINC000082180085 GI Annotated Anodyne COCCn1c(-c2ccsc2)nc2c(NCc3ccccc3C)ncnc21 ZINC000082180258 GI Annotated Anodyne COCCn1c(C2CCCCC2)nc2c(NCc3ccccc3C)ncnc21 ZINC000082180273 GI Annotated Anodyne Cc1ccccc1CNc1ncnc2c1nc(C(C)C)n2CCN1CCCCC1 ZINC000082180439 GI Annotated Anodyne Cc1ccccc1CNc1ncnc2c1nc(C(C)C)n2CC[C@@H]1CCCN1C ZINC000082180455 GI Annotated Anodyne Cc1ccccc1CNc1ncnc2c1nc(C(C)C)n2CC[C@H]1CCCN1C ZINC000082180457 GI Annotated Anodyne c1nc(NCC2CC2)c2nc(C3CCCCC3)n(CCN3CCCCC3)c2n1 ZINC000082180467 GI Annotated Anodyne CCCc1nc2c(NCc3ccccc3C)ncnc2n1CCN1CCCCC1 ZINC000082180469 GI Annotated Anodyne CCCc1nc2c(NCc3ccccc3C)ncnc2n1CCc1ccccn1 ZINC000082180477 GI Annotated Anodyne CCCc1nc2c(NCc3ccccc3C)ncnc2n1CC[C@@H]1CCCN1C ZINC000082180481 GI Annotated Anodyne CCCc1nc2c(NCc3ccccc3C)ncnc2n1CC[C@H]1CCCN1C ZINC000082180483 GI Annotated Anodyne Cc1ccccc1CNc1ncnc2c1nc(C1CC1)n2CCN1CCCCC1 ZINC000082180518 GI Annotated Anodyne Cc1ccccc1CNc1ncnc2c1nc(C1CC1)n2CCc1ccccn1 ZINC000082180526 GI Annotated Anodyne Cc1ccccc1CNc1ncnc2c1nc(C1CC1)n2CC[C@@H]1CCCN1C ZINC000082180532 GI Annotated Anodyne Cc1ccccc1CNc1ncnc2c1nc(C1CC1)n2CC[C@H]1CCCN1C ZINC000082180534 GI Annotated Anodyne COCCn1c(C2CCCCC2)nc2c(NCCc3ccccc3F)ncnc21 ZINC000082180784 GI Annotated Anodyne c1ccc(CCn2c(C3CCCCC3)nc3c(NCC4CC4)ncnc32)nc1 ZINC000082180970 GI Annotated Anodyne CCC(CC)c1nc2c(NCCc3ccccc3F)ncnc2n1CCOC ZINC000082181000 GI Annotated Anodyne CN1CCC[C@@H]1CCn1c(C2CCCCC2)nc2c(NCC3CC3)ncnc21 ZINC000082181353 GI Annotated Anodyne CN1CCC[C@H]1CCn1c(C2CCCCC2)nc2c(NCC3CC3)ncnc21 ZINC000082181354 GI Annotated Anodyne COCCn1c(-c2ccccc2)nc2c(NCc3ccc(Cl)cc3)ncnc21 ZINC000082184767 GI Annotated Anodyne COCCn1c(-c2ccsc2)nc2c(NCc3ccc(Cl)cc3)ncnc21 ZINC000082184979 GI Annotated Anodyne COCCn1c(-c2cccs2)nc2c(NCc3ccc(Cl)cc3)ncnc21 ZINC000082185083 GI Annotated Anodyne NC(=O)c1ccc2c(c1)[C@H](NCCc1ccccc1F)CC1(CCCCC1)O2 ZINC000082185395 GI Annotated Anodyne NC(=O)c1ccc2c(c1)[C@@H](NCCc1ccccc1F)CC1(CCCCC1)O2 ZINC000082185397 GI Annotated Anodyne Fc1ccc(CNc2ncnc3c2nc(-c2ccoc2)n3C[C@@H]2CCCO2)cc1 ZINC000082185536 GI Annotated Anodyne Fc1ccc(CNc2ncnc3c2nc(-c2ccoc2)n3C[C@H]2CCCO2)cc1 ZINC000082185541 GI Annotated Anodyne COCCn1c(C2CCCCC2)nc2c(NCc3ccc(F)cc3)ncnc21 ZINC000082185692 GI Annotated Anodyne CC(C)c1nc2c(NCc3ccc(F)cc3)ncnc2n1CCN1CCCCC1 ZINC000082185930 GI Annotated Anodyne CC(C)c1nc2c(NCc3ccc(F)cc3)ncnc2n1CC[C@@H]1CCCN1C ZINC000082185945 GI Annotated Anodyne CC(C)c1nc2c(NCc3ccc(F)cc3)ncnc2n1CC[C@H]1CCCN1C ZINC000082185947 GI Annotated Anodyne CCCc1nc2c(NCc3ccc(F)cc3)ncnc2n1CCN1CCCCC1 ZINC000082185961 GI Annotated Anodyne CCCc1nc2c(NCc3ccc(F)cc3)ncnc2n1CC[C@@H]1CCCN1C ZINC000082185981 GI Annotated Anodyne CCCc1nc2c(NCc3ccc(F)cc3)ncnc2n1CC[C@H]1CCCN1C ZINC000082185984 GI Annotated Anodyne CC(C)(C)Cc1nc2c(NCc3ccc(F)cc3)ncnc2n1C[C@@H]1CCCO1 ZINC000082186081 GI Annotated Anodyne CC(C)(C)Cc1nc2c(NCc3ccc(F)cc3)ncnc2n1C[C@H]1CCCO1 ZINC000082186084 GI Annotated Anodyne CCCCCNc1ncnc2c1nc(-c1ccoc1)n2CCc1ccccn1 ZINC000082186300 GI Annotated Anodyne CCCCCNc1ncnc2c1nc(-c1ccoc1)n2CC[C@@H]1CCCN1C ZINC000082186310 GI Annotated Anodyne CCCCCNc1ncnc2c1nc(-c1ccoc1)n2CC[C@H]1CCCN1C ZINC000082186311 GI Annotated Anodyne CCCCCNc1ncnc2c1nc(-c1cccnc1)n2CCc1ccccn1 ZINC000082186414 GI Annotated Anodyne CCCCCNc1ncnc2c1nc(-c1ccc(C)o1)n2CC[C@@H]1CCCN1C ZINC000082186590 GI Annotated Anodyne CCCCCNc1ncnc2c1nc(-c1ccc(C)o1)n2CC[C@H]1CCCN1C ZINC000082186593 GI Annotated Anodyne COCCn1c(C2CCCCC2)nc2c(NCCc3ccc(F)cc3)ncnc21 ZINC000082187284 GI Annotated Anodyne CCC(CC)c1nc2c(NCCc3ccc(F)cc3)ncnc2n1CCOC ZINC000082187584 GI Annotated Anodyne COCCn1c(-c2ccsc2)nc2c(NC[C@H](C)c3ccccc3)ncnc21 ZINC000082188222 GI Annotated Anodyne COCCn1c(-c2ccsc2)nc2c(NC[C@@H](C)c3ccccc3)ncnc21 ZINC000082188225 GI Annotated Anodyne COCCn1c(-c2ccc(C)o2)nc2c(NC[C@@H](C)c3ccccc3)ncnc21 ZINC000082188379 GI Annotated Anodyne COCCn1c(-c2ccc(C)o2)nc2c(NC[C@H](C)c3ccccc3)ncnc21 ZINC000082188381 GI Annotated Anodyne COCCn1c(-c2cccs2)nc2c(NC[C@H](C)c3ccccc3)ncnc21 ZINC000082188430 GI Annotated Anodyne COCCn1c(-c2cccs2)nc2c(NC[C@@H](C)c3ccccc3)ncnc21 ZINC000082188432 GI Annotated Anodyne COCCn1c(CC(C)(C)C)nc2c(NC[C@H](C)c3ccccc3)ncnc21 ZINC000082188915 GI Annotated Anodyne COCCn1c(CC(C)(C)C)nc2c(NC[C@@H](C)c3ccccc3)ncnc21 ZINC000082188919 GI Annotated Anodyne CSCC[C@H](Nc1nc(-c2ccc(C)cc2C)cs1)C(=O)NC(C)C ZINC000082191820 GI Annotated Anodyne CCc1ccc(-c2csc(N[C@@H](CCSC)C(=O)NC(C)C)n2)cc1 ZINC000082191832 GI Annotated Anodyne CSCC[C@H](Nc1nc(-c2ccccc2C)cs1)C(=O)NCC(C)C ZINC000082191854 GI Annotated Anodyne CSCC[C@H](Nc1nc(-c2ccc(C)cc2)cs1)C(=O)NCC(C)C ZINC000082191860 GI Annotated Anodyne CSCC[C@H](Nc1nc(-c2ccccc2F)cs1)C(=O)NCC(C)C ZINC000082192276 GI Annotated Anodyne CSCC[C@H](Nc1nc(-c2ccc(F)cc2F)cs1)C(=O)NCC(C)C ZINC000082192280 GI Annotated Anodyne COc1ccc(-c2csc(N[C@@H](CCSC)C(=O)NCC(C)C)n2)cc1 ZINC000082192289 GI Annotated Anodyne COc1ccccc1-c1csc(N[C@@H](CCSC)C(=O)NCC(C)C)n1 ZINC000082192295 GI Annotated Anodyne COc1ccccc1-c1csc(N2CCC[C@H]2C(=O)NC2CCCCC2)n1 ZINC000082192402 GI Annotated Anodyne CC[C@H](C)[C@H](Nc1nc(-c2ccc(C)c(C)c2)cs1)C(=O)NCCOC ZINC000082192469 GI Annotated Anodyne O=C(NCC(F)(F)F)[C@@H]1CCCN1c1nc(-c2cc3ccccc3o2)cs1 ZINC000082195584 GI Annotated Anodyne CCOc1ccc(-c2csc(N[C@@H](CCSC)C(=O)NC(C)C)n2)cc1 ZINC000082195809 GI Annotated Anodyne O=C(NCC(F)(F)F)[C@@H]1CCCN1c1nc(-c2ccc(Cl)s2)cs1 ZINC000082195963 GI Annotated Anodyne Cc1cnc(N2CCN(c3ccccn3)CC2)nc1N[C@@H]1C[C@H](C)CC(C)(C)C1 ZINC000082204096 GI Annotated Anodyne Cc1cnc(N2CCN(c3ccccn3)CC2)nc1N[C@H]1C[C@H](C)CC(C)(C)C1 ZINC000082204098 GI Annotated Anodyne Cc1cnc(N2CCN(c3ccccn3)CC2)nc1N[C@@H]1C[C@@H](C)CC(C)(C)C1 ZINC000082204099 GI Annotated Anodyne Cc1cnc(N2CCN(c3ccccn3)CC2)nc1N[C@H]1C[C@@H](C)CC(C)(C)C1 ZINC000082204102 GI Annotated Anodyne Cc1cnc(N2C[C@H](C)O[C@H](C)C2)nc1NCc1cccc(C(F)(F)F)c1 ZINC000082204216 GI Annotated Anodyne Cc1cnc(N2C[C@@H](C)O[C@H](C)C2)nc1NCc1cccc(C(F)(F)F)c1 ZINC000082204218 GI Annotated Anodyne Cc1cnc(N2C[C@H](C)O[C@@H](C)C2)nc1NCc1cccc(C(F)(F)F)c1 ZINC000082204223 GI Annotated Anodyne CCCn1c(=O)c(NCC(CC)CC)c2n(c1=O)C[C@H](CC1CCCCC1)N2 ZINC000082208171 GI Annotated Anodyne CCC(CC)CNc1c2n(c(=O)n(C(C)C)c1=O)C[C@H](CC1CCCCC1)N2 ZINC000082208325 GI Annotated Anodyne CCCn1c(=O)c(NCCC(C)(C)C)c2n(c1=O)C[C@H](CC1CCCCC1)N2 ZINC000082208936 GI Annotated Anodyne CC(C)CN(C)C(=O)c1cnc(N2C[C@@H](C)C[C@@H](C)C2)nc1-c1ccccc1 ZINC000082214702 GI Annotated Anodyne CC(C)CN(C)C(=O)c1cnc(N2C[C@@H](C)C[C@H](C)C2)nc1-c1ccccc1 ZINC000082214704 GI Annotated Anodyne CC(C)CN(C)C(=O)c1cnc(N2C[C@H](C)C[C@@H](C)C2)nc1-c1ccccc1 ZINC000082214706 GI Annotated Anodyne Cc1ccc(CNc2ncc(C(=O)N3CCCC3)c(-c3ccc(F)cc3)n2)o1 ZINC000082215032 GI Annotated Anodyne CCN(C)c1ncc(C(=O)N(CC(C)C)CC(C)C)c(-c2ccc(F)cc2)n1 ZINC000082216473 GI Annotated Anodyne CC(C)CN(C)C(=O)c1cnc(N2CCC(C)CC2)nc1-c1ccccc1F ZINC000082217125 GI Annotated Anodyne CCCCNC(=O)c1cnc(N2C[C@@H](C)C[C@@H](C)C2)nc1-c1ccc(C#N)cc1 ZINC000082217228 GI Annotated Mild CCCCNC(=O)c1cnc(N2C[C@@H](C)C[C@H](C)C2)nc1-c1ccc(C#N)cc1 ZINC000082217229 GI Annotated Mild CCCCNC(=O)c1cnc(N2C[C@H](C)C[C@@H](C)C2)nc1-c1ccc(C#N)cc1 ZINC000082217231 GI Annotated Mild Cc1nc(-c2cnc(N3CCCCC3)nc2-c2ccc([N+](=O)[O-])cc2)oc1C ZINC000082221482 GI Annotated Bother COCCn1c(-c2ccsc2)nc2c(NCCCc3ccccc3)ncnc21 ZINC000082221736 GI Annotated Anodyne c1ccc(CCCNc2ncnc3c2nc(C2CC2)n3CCc2ccccn2)cc1 ZINC000082221756 GI Annotated Anodyne CSCC[C@H](Nc1nc(-c2ccc(F)cc2F)cs1)C(=O)NC(C)C ZINC000082222813 GI Annotated Anodyne CC(C)n1c(=O)c(NCCC(C)(C)C)c2n(c1=O)C[C@H](CC1CCCCC1)N2 ZINC000082224423 GI Annotated Anodyne CC(C)Cc1nc2nc(N3CC=C(c4ccc(Cl)cc4)CC3)ccc2[nH]c1=O ZINC000082231794 GI Annotated Anodyne CC(C)c1nc2nc(N3CC=C(c4ccc(Cl)cc4)CC3)ccc2[nH]c1=O ZINC000082231806 GI Annotated Anodyne C=C[C@@]1(C)CC=C2[C@H](CC[C@H]3C(C)(C)[C@@H](OCC(=O)C(=O)NO)CC[C@@]23C)C1 ZINC000083923070 GI Annotated Mild in-vitro C=C[C@@]1(C)CC=C2[C@H](CC[C@@H]3C(C)(C)[C@@H](OCC(=O)C(=O)NO)CC[C@@]23C)C1 ZINC000083923071 GI Annotated Mild in-vitro C=C[C@@]1(C)CC=C2[C@@H](CC[C@H]3C(C)(C)[C@@H](OCC(=O)C(=O)NO)CC[C@@]23C)C1 ZINC000083923073 GI Annotated Mild in-vitro C=C[C@@]1(C)CC=C2[C@@H](CC[C@@H]3C(C)(C)[C@@H](OCC(=O)C(=O)NO)CC[C@@]23C)C1 ZINC000083923074 GI Annotated Mild in-vitro CC(C)CCn1c(CN2C(=O)[C@H](CC(=O)O)c3ccccc32)nc2ccccc21 ZINC000084375197 GI Annotated Anodyne COC(=O)[C@]1(C)CCC[C@@]2(C)[C@H]3CC[C@]4(OC(C)=O)C[C@@]3(CC[C@H]21)C/C4=N/O ZINC000084460122 GI Annotated Mild COC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@]4(OC(C)=O)C[C@@]3(CC[C@H]21)C/C4=N/O ZINC000084460124 GI Annotated Mild O=C(Nc1ccc(F)cc1F)[C@H]1C(=O)N2c3ccccc3Oc3cccc1c32 ZINC000084462507 GI Annotated Anodyne N[C@H](Cc1cccc2ccccc12)C(=O)Nc1cncc(/C=C\c2ccncc2)c1 ZINC000084574501 GI Annotated Anodyne CNC(=O)/C=C\c1cnc(N)c2c(-c3ccc4sc(C)nc4c3)csc12 ZINC000084581644 GI Annotated Anodyne CC(C)=CCC1=C(OS(=O)(=O)c2ccc(C)cc2)C(=O)c2ccccc2C1=O ZINC000084596091 GI Annotated Mild COc1ccc(N(C(=O)N(C)C)c2nnc(-c3ccccc3)s2)cc1OC ZINC000084596200 GI Annotated Anodyne Cc1nnc(-c2sc(N3CCOCC3)c(C#N)c2-c2ccc(Cl)cc2)o1 ZINC000084596328 GI Annotated Mild O=C(O)CCc1ccc(-c2ccc(-n3ccnc3)s2)n1-c1ccc(O)cc1 ZINC000084602092 GI Annotated Clean Cc1nc2ccc(OC(F)(F)F)cc2n1-c1ccc(C(=O)NC2CC2)s1 ZINC000084602841 GI Annotated Anodyne CCC1=C(c2nc(C3CCCCC3)c[nH]2)[C@H](c2ccc(O)c(F)c2)NC(=O)N1 ZINC000084603047 GI Annotated Anodyne Cc1cc(O)ccc1-n1c(CCC(=O)O)ccc1-c1ccc(-n2ccnc2)cc1 ZINC000084603499 GI Annotated Clean Cc1nc2c(Br)cccc2n1-c1ccc(C(=O)NC2CC2)s1 ZINC000084603868 GI Annotated Anodyne C[C@H](C(=O)NNC(=O)NCC1CCCCC1)c1cccc(Oc2ccccc2)c1 ZINC000084604009 GI Annotated Reactive C[C@@H](C(=O)NNC(=O)NCC1CCCCC1)c1cccc(Oc2ccccc2)c1 ZINC000084604011 GI Annotated Reactive COc1cc(-c2cccc3c(C#CCCO)c(OC)ccc23)cc(OC)c1OC ZINC000084604499 GI Annotated Mild COc1cc(-c2cccc3c(CCCO)c(OC)ccc23)cc(OC)c1OC ZINC000084604501 GI Annotated Anodyne Cc1nccn1-c1ccc(-c2ccc(CCC(=O)O)n2-c2ccc(O)cc2)cc1 ZINC000084604882 GI Annotated Clean Cc1nccn1-c1ccc(-c2ccc(CCC(=O)O)n2-c2ccc(O)cc2)s1 ZINC000084604883 GI Annotated Clean Cc1nccn1-c1csc(-c2ccc(CCC(=O)O)n2-c2ccc(O)cc2)c1 ZINC000084604885 GI Annotated Clean Cc1nccn1-c1cc(-c2ccc(CCC(=O)O)n2-c2ccc(O)cc2)cs1 ZINC000084604887 GI Annotated Clean CCC1=C(C(=O)CCc2ccccc2)[C@H](c2ccc(O)c(Cl)c2)NC(=O)N1 ZINC000084605363 GI Annotated Mild Cc1cc(N)ccc1-n1c(CCC(=O)O)ccc1-c1ccc(-n2ccnc2)cc1 ZINC000084614837 GI Annotated Clean N#Cc1ccc(-n2c(=O)n(Cc3ccccn3)c3ccccc32)cc1C(F)(F)F ZINC000084617038 GI Annotated Mild N#Cc1ccc(-n2c(=O)n(Cc3cccnc3)c3ccccc32)cc1C(F)(F)F ZINC000084617040 GI Annotated Mild N#Cc1ncc(-n2c(=O)n(Cc3ccccc3)c3ccccc32)cc1C(F)(F)F ZINC000084618758 GI Annotated Mild N#Cc1ccc(-n2c(=O)n(Cc3ccccc3)c3cccnc32)cc1C(F)(F)F ZINC000084618760 GI Annotated Mild N#Cc1ccc(-n2c(=O)n(Cc3ccccc3)c3ncccc32)cc1C(F)(F)F ZINC000084618762 GI Annotated Mild CCCCc1cn(-c2cc(-n3cc(CCCC)nn3)c3ccccc3n2)nn1 ZINC000084635902 GI Annotated Anodyne C=CCN1C[C@@H]2[C@H](COc3ccccc3)CC[C@H]1CN2Cc1ccc(OC)cc1 ZINC000084641254 GI Annotated Mild C=CCN1C[C@H]2[C@@H](COc3ccccc3)CC[C@@H]1CN2Cc1ccc(OC)cc1 ZINC000084641257 GI Annotated Mild C=CCN1C[C@@H]2[C@@H](COc3ccccc3)CC[C@H]1CN2Cc1ccc(OC)cc1 ZINC000084641261 GI Annotated Mild C=CCN1C[C@H]2[C@H](COc3ccccc3)CC[C@@H]1CN2Cc1ccc(OC)cc1 ZINC000084641264 GI Annotated Mild CNC(=O)/C=C\c1cnc(N)c2c(-c3cc(F)c4[nH]c(C)cc4c3)csc12 ZINC000084651827 GI Annotated Anodyne Cc1cccc(CCc2cc(=O)n3c(c2-c2ccccc2)SC[C@H]3C(=O)O)c1 ZINC000084652048 GI Annotated Anodyne c1cnc2c(-c3nnc(N4CCC(N5CCCCC5)CC4)s3)cccc2c1 ZINC000084652323 GI Annotated Anodyne CN1CCC(Nc2nc(N/N=C/c3ccc(Cl)cc3)nc3ccccc23)CC1 ZINC000084652460 GI Annotated Mild CN(C)c1ccc2c(c1)OC(N)=C(C#N)[C@@H]2c1ccc(N(C)C)c2ccccc12 ZINC000084652793 GI Annotated Reactive CN(C)c1ccc2c(c1)OC(N)=C(C#N)[C@H]2c1ccc(N(C)C)c2ccccc12 ZINC000084652794 GI Annotated Reactive O=C(O)Cn1c(SCc2ccccc2Br)nc2ccccc21 ZINC000084652907 GI Annotated Anodyne O=C(O)C1=CNC=C(C(=O)OC/C=C/c2ccccc2)[C@H]1c1ccc(Cl)cc1 ZINC000084653619 GI Annotated Anodyne O=C(O)C1=CNC=C(C(=O)OC/C=C/c2ccccc2)[C@@H]1c1ccc(Cl)cc1 ZINC000084653620 GI Annotated Anodyne COc1cc(Nc2nnc(Cc3c[nH]c4ccccc34)s2)cc(OC)c1OC ZINC000084654317 GI Annotated Anodyne COc1nn(Cc2ccccc2Cn2nc(OC)c3ccccc32)c2ccccc12 ZINC000084654355 GI Annotated Anodyne O=C(O)Cn1c(SCc2cccc(Br)c2)nc2ccccc21 ZINC000084654807 GI Annotated Anodyne O=C(O)CCN1C(=O)/C(=C/c2csc3ccc(Cl)cc23)SC1=S ZINC000084668923 GI Annotated Clean Cc1ccc(NC(=O)CSc2nc(O)c(C#N)c(C3CCCCC3)n2)cc1 ZINC000084669076 GI Annotated Mild c1cc(-c2nnc(N3CCC(N4CCCCC4)CC3)s2)c2ccncc2c1 ZINC000084670288 GI Annotated Anodyne Cc1noc(/C=C/c2ccccc2)c1N1CN=C2Oc3ccccc3C=C2C1=O ZINC000084670420 GI Annotated Anodyne Cc1nc2cc(-c3nnc(N4CCC(N5CCCCC5)CC4)s3)ccc2o1 ZINC000084671240 GI Annotated Anodyne Cc1cc(NCCc2ccc[n+]([O-])c2)nc(-c2ccc(Cl)c(Cl)c2)n1 ZINC000084671909 GI Annotated Anodyne N=C(N)SCc1ccccc1Sc1cc(F)ccc1CSC(=N)N ZINC000084672008 GI Annotated Anodyne CCOC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@@]4(C)C[C@]3(CC[C@@H]21)C(=O)/C4=N\O ZINC000084672172 GI Annotated Mild N=C(N)SCc1ccccc1Sc1ccc(F)cc1CSC(=N)N ZINC000084672382 GI Annotated Anodyne CS[C@@H]1C(c2ccc(F)cc2)=NN(C(=O)Nc2ccc(C#N)cc2)C1(C)C ZINC000084687369 GI Annotated Mild CS[C@H]1C(c2ccc(F)cc2)=NN(C(=O)Nc2ccc(C#N)cc2)C1(C)C ZINC000084687370 GI Annotated Mild CC(C)(C)OC(=O)N1CCC(CCCNc2ccc3c(c2)C(=O)CCO3)CC1 ZINC000084687566 GI Annotated Anodyne COc1ccc(C(=O)[C@H]2C[C@@H]2CN(Cc2ccccn2)Cc2ccccn2)cc1 ZINC000084687679 GI Annotated Anodyne COc1cnc(-c2ccccn2)nc1NCc1ccc(F)cc1C(F)(F)F ZINC000084688242 GI Annotated Anodyne CCOC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@](C)(C(=O)O)C[C@@]3(C(=O)O)CC[C@H]12 ZINC000084688512 GI Annotated Anodyne O=C(O)C1=C[C@@H](O)[C@@H]2C[C@H]3[C@H](CCCCCc4ccccc4)[C@H]4C=C[C@@H]1[C@@H]2[C@@H]34 ZINC000084688546 GI Annotated Anodyne CC(=O)N(C)c1ccc(Oc2ccnc(NCc3c(C)cccc3C)n2)cc1 ZINC000084688641 GI Annotated Anodyne Cc1cc(Br)ccc1C(=O)Nc1ccc2sc(CO)nc2c1 ZINC000084688974 GI Annotated Anodyne N=C(N)SCc1ccccc1Sc1cc(F)c(F)cc1CSC(=N)N ZINC000084689409 GI Annotated Anodyne Cc1ccc(Sc2ccccc2CSC(=N)N)c(CSC(=N)N)c1 ZINC000084689410 GI Annotated Anodyne N=C(N)SCc1cccc2c1Oc1c(CSC(=N)N)cccc1S2 ZINC000084689487 GI Annotated Anodyne N=C(N)SCc1cccc2c1sc1c(CSC(=N)N)cc(F)cc12 ZINC000084689490 GI Annotated Anodyne CO[C@@]12C=C(Br)C(=O)C[C@@H]1/C(=C(/OC(C)=O)c1ccccc1)CC2 ZINC000084689633 GI Annotated Mild N=C(N)SCc1cc(F)ccc1Oc1cc(F)ccc1CSC(=N)N ZINC000084689683 GI Annotated Anodyne COc1ccc(OC)c(CN(C(=O)CF)c2cc(F)ccc2OC(C)C)c1 ZINC000084689971 GI Annotated Anodyne CCOC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@@]4(C)C[C@]3(CC[C@@H]21)[C@@H](O)/C4=N\O ZINC000084690107 GI Annotated Mild CCOC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@@]4(C)C[C@]3(CC[C@@H]21)[C@H](C=O)[C@H]4O ZINC000084690108 GI Annotated Mild CCOC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@@]4(C)C[C@]3(CC[C@@H]21)[C@H](/C=N/O)[C@H]4O ZINC000084690109 GI Annotated Mild Cc1cccc(CSC(=N)N)c1Sc1ccccc1CSC(=N)N ZINC000084690338 GI Annotated Anodyne CCCC/C=C/c1c(O)cc2c(c1O)C(=O)c1c(cc(O)c(Cl)c1O)C2=O ZINC000084690417 GI Annotated Clean CCN(CC(F)F)c1ncc(-c2cnnc3cc(OC)c(OC)cc23)cc1C ZINC000084690537 GI Annotated Anodyne COc1ccc(Sc2ccccc2CSC(=N)N)c(CSC(=N)N)c1 ZINC000084690960 GI Annotated Anodyne CCOC(=O)[C@]1(C)CCC[C@@]2(C)[C@@H]3CC[C@@]4(C)C[C@]3(CC[C@H]12)C(=O)OC4=O ZINC000084690973 GI Annotated Reactive O=C(O)[C@@H]1CSc2c(C3CC3)c(Cc3csc4ccccc34)cc(=O)n21 ZINC000084706050 GI Annotated Anodyne Cc1ccc(-c2cc(-c3ccc(S(C)(=O)=O)cc3)cnc2N)c2cccnc12 ZINC000084707656 GI Annotated Anodyne COc1ccc(SC[C@H](O)Cn2c3c(c4ccccc42)CCC3)c(OC)c1 ZINC000084708836 GI Annotated Anodyne COc1ccc(SC[C@@H](O)Cn2c3c(c4ccccc42)CCC3)c(OC)c1 ZINC000084708838 GI Annotated Anodyne CNCc1cc(-c2ccccc2)n(S(=O)(=O)c2ccc(C(F)(F)F)cc2)c1 ZINC000084709436 GI Annotated Anodyne COc1ccc(COc2nc3c(Cl)ccc(Cl)c3n3cnnc23)cc1 ZINC000084709825 GI Annotated Anodyne COc1cc(C(=O)O)c(O)c2ccc3c(c12)C=C1/C(=C(\C)C=O)CC[C@@]1(C)O3 ZINC000084710411 GI Annotated Reactive COc1cc(C(=O)O)c(O)c2ccc3c(c12)C=C1/C(=C(\C)C=O)CC[C@]1(C)O3 ZINC000084710413 GI Annotated Reactive Cc1ccc(C)c(Cn2c(Sc3cccc(Cl)c3)c(C)c(=O)[nH]c2=O)c1 ZINC000084710585 GI Annotated Anodyne CC1CCC(C(=O)N(c2cc(C#CC(C)(C)C)sc2C(=O)O)N(C)C)CC1 ZINC000084712493 GI Annotated Reactive COC(=O)C1=C(Nc2ccccc2)C(=O)N(C2CCCCC2)[C@@H]1c1ccccc1 ZINC000084713193 GI Annotated Anodyne COC(=O)C1=C(Nc2ccccc2)C(=O)N(C2CCCCC2)[C@H]1c1ccccc1 ZINC000084713195 GI Annotated Anodyne CCN(CC)CCCCOc1cc2c(cc1OC)C/C(=C/c1ccncc1)C2=O ZINC000084713328 GI Annotated Mild COc1ccc(-c2ccnc3c2nc(C)c(=O)n3C(C2CC2)C2CC2)c(C)c1 ZINC000084713878 GI Annotated Anodyne Cc1noc(C(C)C)c1C(=O)N[C@@H](C(=O)c1ccc(C#N)c(F)c1)C(C)(C)C ZINC000084714855 GI Annotated Mild Cc1noc(C(C)C)c1C(=O)N[C@H](C(=O)c1ccc(C#N)c(F)c1)C(C)(C)C ZINC000084714857 GI Annotated Mild Cc1ccccc1CN(C)C(=O)c1cc2c(Cc3ccccc3)n[nH]c2cc1O ZINC000084722883 GI Annotated Anodyne CCc1cnc(N2CCC(CCCNc3ccc4c(c3)C(=O)CC4)CC2)nc1 ZINC000084728375 GI Annotated Anodyne CN(Cc1ccccc1F)C(=O)c1cc2c(Cc3ccccc3)n[nH]c2cc1O ZINC000084729527 GI Annotated Anodyne CC(C)c1noc(N2CCC(CCCNc3ccc4c(c3)C(=O)CC4)CC2)n1 ZINC000084729705 GI Annotated Anodyne COc1ccc(-c2cc3ccc(OC4CCN(C)CC4)c(C)c3oc2=O)cc1 ZINC000084730158 GI Annotated Anodyne CCOS(=O)(=O)/C=C/c1ccc(OCc2cc(-c3ccccc3)on2)cc1 ZINC000084731114 GI Annotated Mild CCN(CC)C[C@H](O)CN(/N=C/c1ccc(N(CC)CC)cc1)c1ccccc1 ZINC000084731303 GI Annotated Mild CCN(CC)C[C@@H](O)CN(/N=C/c1ccc(N(CC)CC)cc1)c1ccccc1 ZINC000084731308 GI Annotated Mild OCCN1CCN(Cc2ccccc2Sc2ccc3ccccc3c2)CC1 ZINC000084732488 GI Annotated Anodyne C#CCCC(=O)Nc1ccc2c(Cl)c(OCCc3ccccc3)oc(=O)c2c1 ZINC000084733852 GI Annotated Mild Cc1nnc(O)c2c1c1cc(Br)ccc1n2Cc1cccc(C#N)c1 ZINC000084739461 GI Annotated Mild C=CCNCCS(=O)(=O)c1cccc(Nc2ccc(-c3ccsc3)cn2)c1 ZINC000084739662 GI Annotated Mild Cc1c2ccccc2nc2c1c1cc(NCCN(C)C)ccc1n2CCN(C)C ZINC000084742314 GI Annotated Bother O=[N+]([O-])[C@@H]1C/C(=N\N=c2\[nH]c(-c3ccc(Cl)cc3)cs2)c2ccccc21 ZINC000084756828 GI Annotated Mild O=[N+]([O-])[C@H]1C/C(=N\N=c2\[nH]c(-c3ccc(Cl)cc3)cs2)c2ccccc21 ZINC000084756833 GI Annotated Mild CC(=O)N1c2ccccc2C[C@@]1(Cc1ccccc1)C(=O)OCc1ccccc1 ZINC000084758342 GI Annotated Anodyne CC(=O)N1c2ccccc2C[C@]1(Cc1ccccc1)C(=O)OCc1ccccc1 ZINC000084758343 GI Annotated Anodyne COc1cc2c(cc1OC)/C(=N/N=c1/[nH]c(-c3ccc(C)cc3)cs1)CC2 ZINC000084759548 GI Annotated Mild O=C1CCn2c(nc3ccccc32)[C@H]1C(=O)Nc1ccc(-c2ccccc2)cc1 ZINC000008580281 GI Annotated Anodyne Cc1ccc(-n2c(C)cc(/C=c3\sc4nc5ccccc5n4c3=O)c2C)cc1 ZINC000008580975 GI Annotated Clean CC(C)(Nc1nc(O)nc(Nc2ccc3ncsc3c2)n1)c1ccccc1 ZINC000008582014 GI Annotated Anodyne CCc1ccc2nc(O)c(CN(CCN(C)C)C(=O)Nc3ccccc3)cc2c1 ZINC000008582743 GI Annotated Anodyne CCSc1nc(O)c2c(n1)N=C(C)/C(=C(/O)OC(C)C)[C@@H]2c1cccnc1 ZINC000008584108 GI Annotated Anodyne C=CC[C@H]1C=C[C@@H](O/N=C\[C@@H](C)[C@@H](OCc2ccccc2)C(C)C)[C@@H](CO)O1 ZINC000008585496 GI Annotated Mild CSC1=NC2(CCN(C(=O)NC3CCCCC3)CC2)N=C1c1ccc(C)cc1 ZINC000008598070 GI Annotated Anodyne Cc1nn(CCc2nc(-c3ccco3)cs2)c2[nH]c(=O)cc(C(F)(F)F)c12 ZINC000008607182 GI Annotated Anodyne CC(=N)[C@H](C#N)C(=O)CSc1nnc(SCc2ccc(Cl)cc2)s1 ZINC000008656277 GI Annotated Mild CCCCNC(=O)c1onc(CSc2cccc3ccccc23)c1C(=O)O ZINC000008672370 GI Annotated Anodyne CCN(CCNC(=O)Nc1ccc(Br)cc1)c1cccc(C)c1 ZINC000008674857 GI Annotated Anodyne COC(=O)C1=C(C)N(Cc2ccco2)C(=O)N[C@@H]1c1cccc(C(F)(F)F)c1 ZINC000008682063 GI Annotated Anodyne COC(=O)C1=C(C)N(Cc2ccco2)C(=O)N[C@H]1c1cccc(C(F)(F)F)c1 ZINC000008682072 GI Annotated Anodyne N#CCCCSc1nnnn1-c1cc(C(F)(F)F)cc(C(F)(F)F)c1 ZINC000008682155 GI Annotated Mild CCCCNC(=O)c1onc(CSc2ccc(C(C)C)cc2)c1C(=O)O ZINC000008691317 GI Annotated Anodyne CC(C)NC(=S)N/N=C/c1sc(N2CCCCC2)nc1-c1cccs1 ZINC000008693983 GI Annotated Mild NC(=S)/N=N\c1c(O)n(Cc2ccc(Br)cc2)c2ccccc12 ZINC000008829957 GI Annotated Clean O=C(Nc1ccc(F)cc1F)[C@H](Cc1ccccc1)N1Cc2ccccc2C1=O ZINC000008831008 GI Annotated Anodyne O=C(Nc1ccc(F)cc1F)[C@@H](Cc1ccccc1)N1Cc2ccccc2C1=O ZINC000008831011 GI Annotated Anodyne CCCCCCCC1=CC2=C(Cl)C(=O)[C@@](C)(OC(C)=O)C(=O)C2=CN1C ZINC000008860401 GI Annotated Mild CCCCCCCC1=CC2=C(Cl)C(=O)[C@](C)(OC(C)=O)C(=O)C2=CN1C ZINC000008860402 GI Annotated Mild CNC/C(=C\CCC(=O)O)CCCCCCC[C@H](C=O)[C@@H]1C=C(CCN)CC1 ZINC000085489190 GI Annotated Mild in-vitro biogenic CC1(C)OC[C@@H]([C@]2(C)C=C3CC[C@@H]4[C@@](C)(C[C@H](O)C[C@@]4(C)CO)[C@H]3CC2)O1 ZINC000085509856 GI Annotated Anodyne in-vitro biogenic CC(C)=CC[C@](C)(OC(=O)CC(C)C)C1=CC(=O)c2c(O)ccc(O)c2C1=O ZINC000085510140 GI Annotated Mild in-vitro biogenic C[C@H](C=O)CC[C@H](N)CC[C@H](CCCC/C=C/C(=O)O)Cc1ccc(O)cc1 ZINC000085510452 GI Annotated Mild in-vitro biogenic CO[C@@H]1[C@@H](C)C=C[C@H]1Cc1ccc(C[C@H]2C=C(C)[C@@H](O)C[C@@H]2C(C)(C)O)cc1 ZINC000085510767 GI Annotated Anodyne in-vitro biogenic C/C=C(/C)C(=O)O[C@@H]1C[C@H](C)[C@@H]2CC(=O)[C@@H](C)[C@H]2C[C@@H]1C(C)(C)OC(C)=O ZINC000085541123 GI Annotated Anodyne in-vitro biogenic C=C1[C@@H](OC(=O)/C=C(\C)CC)C[C@H](C(C)C)[C@@H]2[C@H]1CC(=O)[C@H]2[C@@H](C)OC(C)=O ZINC000085541429 GI Annotated Mild in-man biogenic CC1(C)O[C@@]23CC[C@@H]1[C@H](N)[C@H]2C#CCc1cc(O)ccc1C[C@@H]1CCC[C@H]3C1 ZINC000085543213 GI Annotated Mild in-vitro biogenic CC1(C)O[C@@]2([C@H]3CCC[C@H](Cc4ccc(O)cc4)C3)CC[C@@H]1[C@](N)(CCO)C2 ZINC000085543236 GI Annotated Anodyne in-vitro biogenic CNCc1cc(O)ccc1C[C@H]1CCC[C@H]([C@]23CC[C@H]([C@@H](N)C2)C(C)(C)O3)C1 ZINC000085543249 GI Annotated Anodyne in-vitro biogenic C[C@@]12CCC[C@@](O)(C1)[C@@H]1C[C@@]3(CCC[C@H]3CNC3CCCCC3)[C@@H]1[C@H](O)C2 ZINC000085547581 GI Annotated Anodyne in-vitro biogenic CC(C)CC[C@@H]1CC[C@H](NC[C@@H]2C[C@H]([C@H](C)c3ccc(C=O)cc3)N3C[C@]23O)C1 ZINC000085547876 GI Annotated Anodyne in-vitro biogenic CC[C@H](C)/C=C(C)/C=C/C1=CC2=CC3=C(C(C)=O)C(=O)O[C@]3(C)C(=O)C2=CO1 ZINC000085553559 GI Annotated Mild CNCc1ccc(CCc2c(/C=C/c3ccc(O)c(O)c3)ccc(O)c2O)cc1 ZINC000085569239 GI Annotated Clean in-vitro biogenic CCC/C=C1\OC(=O)C2=C1CC[C@@H]1[C@H]2[C@]23CC[C@H]1C=C2C(=O)O/C3=C\CCCO ZINC000085571578 GI Annotated Anodyne in-vitro biogenic CCCCCCCCCCCCCC[C@H](O)[C@@]1(O)C(=O)C=C[C@H]1OC(C)=O ZINC000085584170 GI Annotated Mild CCCCCCCCCCCCCC[C@@H](O)[C@@]1(O)C(=O)C=C[C@H]1OC(C)=O ZINC000085584173 GI Annotated Mild in-vitro biogenic CCCCCCCCCCCCCCC(=O)[C@@]1(O)C(=O)C=C[C@H]1OC(C)=O ZINC000085584217 GI Annotated Mild in-vitro biogenic CCCCCCCCCCCCCCC(=O)[C@]1(O)C(=O)C=C[C@@H]1OC(C)=O ZINC000085584230 GI Annotated Mild CCCCCC(=O)CC(=O)/C=C/c1cc(OC)c(O)cc1Cc1ccc(N)nc1 ZINC000085596502 GI Annotated Mild in-vitro biogenic COc1c(O)ccc(CCC(=O)C[C@H]2C[C@H](C)CCO2)c1-c1ccc(CN)cc1 ZINC000085597469 GI Annotated Anodyne in-vitro biogenic C[C@]1(C(=O)O)CCC[C@]2(C)[C@H]3CC[C@](C)(CCOS(=O)(=O)O)C=C3C=C[C@@H]12 ZINC000085599959 GI Annotated Anodyne COc1cc(CCC(=O)C[C@@H](CC[C@H]2C=CC=C[C@@H]2C)OC(C)=O)ccc1O ZINC000085624730 GI Annotated Anodyne in-vitro biogenic COc1cc(CC[C@]2(OC(C)=O)CC[C@@H](C3CCCCC3)[C@H](O)C2)ccc1O ZINC000085627686 GI Annotated Anodyne in-vitro biogenic CCCC[C@@H]1CC[C@](CCc2ccc(O)c3c2CCCO3)(OC(C)=O)C[C@H]1O ZINC000085627710 GI Annotated Anodyne in-vitro biogenic CNC[C@H](C)CCCCCC(=O)CC(=O)C1=Cc2cc(OC)c(O)cc2CC1 ZINC000085630781 GI Annotated Mild in-vitro biogenic COc1cc(/C=C/C(=O)CC(=O)CCCCCCC2CCNCC2)ccc1O ZINC000085630817 GI Annotated Mild in-vitro biogenic CO[C@H]1C[C@@H](CC[C@@]2(C)[C@H](C)[C@H](O)C[C@@]3(C)C(COC(C)=O)=CCC[C@@H]32)CO1 ZINC000085671113 GI Annotated Anodyne biogenic COc1cc(/C=C\CO)cc(OC)c1OC/C=C(\C)C/C=C/C(C)(C)OO ZINC000085799236 GI Annotated Reactive C=C(C)[C@@H](CC/C(C)=C/COc1c(OC)cc(/C=C\CO)cc1OC)OO ZINC000085799238 GI Annotated Reactive C/C=C/C1=CC2=C(CO1)C(=O)[C@]1(C)OC(=O)[C@@H](C(=O)CCCCCCC)[C@@H]1C2 ZINC000085897799 GI Annotated Mild Cc1cc(O)cc(O)c1C(=O)O[C@@H]1C[C@@]2(C)[C@H]3CC(C)(C)C[C@@H]3C=C(C=O)[C@H]12 ZINC000085911684 GI Annotated Reactive in-man Cc1cc(O)cc(O)c1C(=O)O[C@H]1C[C@@]2(C)[C@H]3CC(C)(C)C[C@@H]3C=C(C=O)[C@H]12 ZINC000085911686 GI Annotated Reactive in-man Cc1cc(O)cc(O)c1C(=O)O[C@@H]1C[C@]2(C)[C@H]3CC(C)(C)C[C@@H]3C=C(C=O)[C@H]12 ZINC000085911687 GI Annotated Reactive in-man Cc1cc(O)cc(O)c1C(=O)O[C@H]1C[C@]2(C)[C@H]3CC(C)(C)C[C@@H]3C=C(C=O)[C@H]12 ZINC000085911689 GI Annotated Reactive in-man CCC/C=C1\OC(=O)C2=C1CC[C@H]1[C@H]2[C@@]23C=CCC[C@@H]2[C@]1(C(=O)CCC)OC3=O ZINC000085923598 GI Annotated Anodyne CC(=O)OC/C(=C\CC/C(C)=C\CO)CCC[C@H](C)C(=O)/C=C/C(C)(C)OO ZINC000085944893 GI Annotated Reactive C=C(C)[C@@H]1Oc2ccc3oc4cc5c(c(O)c4c(=O)c3c2[C@@H]1O)C=CC(C)(C)O5 ZINC000085947447 GI Annotated Mild COc1cc2c3c(c4ccc(OC)c(O)c4c2cc1OC)C[C@H]1CCCN1C3 ZINC000085949692 GI Annotated Bother CC(=O)O[C@H]1C[C@@H](Br)C(C)(C)[C@H](Cl)/C1=C\CBr ZINC000085951749 GI Annotated Reactive CC(=O)O[C@@H]1C[C@H](Br)C(C)(C)C=C1[C@H](Br)CCl ZINC000085951768 GI Annotated Reactive CC(C)(Br)[C@H](Cl)C[C@H](Br)[C@](C)(Cl)[C@@H]1CO1 ZINC000085951845 GI Annotated Reactive COC(=O)[C@@]1(OC(C)=O)C[C@@]23CC[C@@H]4[C@@](C)(C=O)CCC[C@]4(C)[C@@H]2CC[C@@H]1C3 ZINC000085957149 GI Annotated Mild in-man COC(=O)[C@]1(OC(C)=O)C[C@@]23CC[C@@H]4[C@@](C)(C=O)CCC[C@]4(C)[C@@H]2CC[C@@H]1C3 ZINC000085957152 GI Annotated Mild in-man COc1ccc(Cl)cc1N1C(=O)[C@@H]2CCCN2[C@H]1c1ccc(F)c(F)c1 ZINC000085988184 GI Annotated Anodyne O=C1[C@@H]2CCCN2[C@@H](c2ccc(Br)cc2)N1c1ccc(F)cc1 ZINC000085988267 GI Annotated Anodyne O=C1[C@@H]2CCCN2[C@@H](c2cccc(Br)c2)N1c1ccc(F)cc1 ZINC000085988276 GI Annotated Anodyne CCOc1ccc([C@H]2N(c3ccc(Cl)cc3)C(=O)[C@@H]3CCCN32)cc1OC ZINC000085988292 GI Annotated Anodyne COc1cc2c(cc1OC)C(=O)C[C@](C)(c1cc3cc(OC)c(OC)cc3o1)O2 ZINC000085996879 GI Annotated Anodyne CC1(C)CCC[C@@]2(C)[C@H]1C[C@H](O)[C@H]1C[C@@H](OC(=O)CC(=O)O)[C@@]3(C)CC[C@]12C3 ZINC000085998960 GI Annotated Anodyne CC1(C)[C@@H](Br)CC[C@]2(C)O[C@@H](CBr)C(CO)=CC[C@H]12 ZINC000086033609 GI Annotated Reactive CC1=CC[C@H]([C@](C)(Cl)CCl)O[C@@H]1C(Br)Br ZINC000086036145 GI Annotated Reactive CC1=CC[C@H]([C@](C)(Cl)CCl)O[C@H]1C(Br)Br ZINC000086036153 GI Annotated Reactive CCN1CCN(Cc2ccc3c(c2)[C@H]2N=NC(c4cccc(OC)c4)=C2C3)CC1 ZINC000087612892 GI Annotated Anodyne CCN1CCN(Cc2ccc3c(c2)[C@@H]2N=NC(c4cccc(OC)c4)=C2C3)CC1 ZINC000087612893 GI Annotated Anodyne C=CCN1CCc2c(cc(O)c(O)c2Br)[C@H](c2ccccc2C)C1 ZINC000087723285 GI Annotated Mild C=CCN1CCc2c(cc(O)c(O)c2Br)[C@@H](c2ccccc2C)C1 ZINC000087723288 GI Annotated Mild CO/N=C/c1c(-c2cccc3c2NCC3)cc(C)c2c1[C@H](C)[C@@H](O)C(C)(C)N2 ZINC000089210612 GI Annotated Mild CCC(=O)Oc1ccc(-c2csc3c2-n2cccc2C3=O)cc1OC(=O)CC ZINC000089456654 GI Annotated Anodyne Oc1ccc(C2=C3Cc4cc(CNC5CCC(O)CC5)ccc4[C@@H]3N=N2)cc1 ZINC000089469167 GI Annotated Anodyne Oc1ccc(C2=C3Cc4cc(CNC5CCC(O)CC5)ccc4[C@H]3N=N2)cc1 ZINC000089469169 GI Annotated Anodyne CCCN1CCN(C(=O)c2oc3ccccc3c2NC(=O)C2CCCCC2)CC1 ZINC000009265307 GI Annotated Anodyne CNC(=O)/C(=N/OC)c1ccccc1Oc1cccc(Oc2ccccc2)c1 ZINC000090162401 GI Annotated Mild Oc1nc2ccc(N3CCc4ccccc4C3)nc2nc1Cc1ccc(F)cc1 ZINC000009635983 GI Annotated Anodyne COc1ccc(N2C(=O)c3ccccc3N[C@H]2c2cnn(-c3ccccc3)n2)cc1 ZINC000009883479 GI Annotated Anodyne COc1ccc(N2C(=O)c3ccccc3N[C@@H]2c2cnn(-c3ccccc3)n2)cc1 ZINC000009883481 GI Annotated Anodyne COC/C=C/c1ccc2c(c1)[C@H](COC(C)=O)[C@H](c1ccc(OC)c(OC)c1)O2 ZINC000095486004 GI Annotated Anodyne in-vitro biogenic COc1ccc2c(=O)oc3c4c(ccc3c3ccc(O)c1c23)C[C@@H](C)N[C@@H]4C ZINC000095486320 GI Annotated Bother in-vitro biogenic CCSc1cccc(-c2ccc([C@@H]3C[C@@H]3c3cc(=O)n(C)c(N)n3)cc2)c1 ZINC000095552333 GI Annotated Anodyne Cc1ccccc1N1CCN([C@@H](C)c2ccc(Cl)cc2Cl)C(=O)C1=O ZINC000095552378 GI Annotated Anodyne Cc1ccccc1N1CCN([C@H](C)c2ccc(Cl)cc2Cl)C(=O)C1=O ZINC000095552379 GI Annotated Anodyne CN1c2ccc(Br)cc2C(=O)N2CCc3c([nH]c4ccccc34)[C@@H]21 ZINC000095552683 GI Annotated Clean CN1c2ccc(Br)cc2C(=O)N2CCc3c([nH]c4ccccc34)[C@H]21 ZINC000095552684 GI Annotated Clean CC1(C)C=Cc2cc(CN(C3CCC3)S(=O)(=O)c3ccccn3)ccc2O1 ZINC000095552822 GI Annotated Anodyne CC(C)CN(Cc1ccc2c(c1)C=CC(C)(C)O2)S(=O)(=O)c1ccncc1 ZINC000095552835 GI Annotated Anodyne COc1ccc(Cn2[nH]c(COc3cc(Cl)cc(Cl)c3)cc2=O)cc1 ZINC000095552938 GI Annotated Anodyne CC1(C)C=Cc2cc(CN(C3CCCC3)S(=O)(=O)c3ccccn3)ccc2O1 ZINC000095552943 GI Annotated Anodyne CCS(=O)(=O)Nc1ccc2[nH]c3cnc(NCc4ccccc4)cc3c2c1 ZINC000095553045 GI Annotated Anodyne CC(C)CN(Cc1ccc2c(c1)C=CC(C)(C)O2)S(=O)(=O)c1ccccn1 ZINC000095553129 GI Annotated Anodyne O=C(NC1CCCCC1)c1cn2c3c(cccc3c1=O)OC[C@H]2c1ccccc1 ZINC000095553132 GI Annotated Anodyne O=C(NC1CCCCC1)c1cn2c3c(cccc3c1=O)OC[C@@H]2c1ccccc1 ZINC000095553133 GI Annotated Anodyne Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@@H](C)CNCc3ccc(C=O)cc3)C[C@@H]1O2 ZINC000095553385 GI Annotated Anodyne Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@H](C)CNCc3ccc(C=O)cc3)C[C@@H]1O2 ZINC000095553386 GI Annotated Anodyne Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@@H](C)CNCc3ccc(O)cc3)C[C@@H]1O2 ZINC000095553451 GI Annotated Anodyne Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@H](C)CNCc3ccc(O)cc3)C[C@@H]1O2 ZINC000095553452 GI Annotated Anodyne Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@@H](C)CNCc3ccc(O)c(F)c3)C[C@@H]1O2 ZINC000095553750 GI Annotated Anodyne Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@H](C)CNCc3ccc(O)c(F)c3)C[C@@H]1O2 ZINC000095553751 GI Annotated Anodyne COc1ccc(CNC[C@H](C)[C@H]2CCC3=Cc4c(cc(C)oc4=O)O[C@H]3C2)cc1 ZINC000095554111 GI Annotated Anodyne COc1ccc(CNC[C@@H](C)[C@H]2CCC3=Cc4c(cc(C)oc4=O)O[C@H]3C2)cc1 ZINC000095554112 GI Annotated Anodyne CCCOc1cccc(-c2ccc([C@@H]3C[C@@H]3c3cc(=O)n(C)c(N)n3)cc2)c1 ZINC000095554524 GI Annotated Anodyne Cc1ccc(NC(=O)[C@@H]2c3ccccc3C(=O)N2CCc2ccccn2)cc1C ZINC000095554692 GI Annotated Anodyne Cc1ccc(NC(=O)[C@H]2c3ccccc3C(=O)N2CCc2ccccn2)cc1C ZINC000095554693 GI Annotated Anodyne COC1=C[C@@H]2Cc3c(c4ccc(OC)cc4c4cc(OC)c(OC)cc34)CN2C1 ZINC000095555035 GI Annotated Bother COc1ccc2c3c(c4cc(OC)c(OC)cc4c2c1)C[C@H]1CCC(=O)CN1C3 ZINC000095555393 GI Annotated Bother Cn1c(N)nc([C@H]2C[C@H]2c2ccc(-c3cccc(OCC4CC4)c3)cc2)cc1=O ZINC000095555510 GI Annotated Anodyne Clc1ccc(-n2ccc(OCCCCN3CCSCC3)n2)cc1Cl ZINC000095555647 GI Annotated Anodyne CCCc1ccc(N2CCCN(C(=O)c3noc4c3CCCCC4)CC2)cc1 ZINC000095555718 GI Annotated Anodyne CCOC(=O)c1c(-c2cccc(Cl)c2)[nH]c2cc(OC)c(F)cc2c1=O ZINC000095555953 GI Annotated Anodyne Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@@H](C)CNCc3cccc(O)c3)C[C@@H]1O2 ZINC000095555979 GI Annotated Anodyne Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@H](C)CNCc3cccc(O)c3)C[C@@H]1O2 ZINC000095555980 GI Annotated Anodyne CN1c2ccccc2C(=O)N2CCc3c([nH]c4ccc(Br)cc34)[C@@H]21 ZINC000095556137 GI Annotated Clean CN1c2ccccc2C(=O)N2CCc3c([nH]c4ccc(Br)cc34)[C@H]21 ZINC000095556138 GI Annotated Clean CSc1cccc(-c2nc(N3CCC(C(=O)O)CC3)cc3cccnc23)c1 ZINC000095556173 GI Annotated Anodyne Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@@H](C)CNCc3ccc(C#N)cc3)C[C@@H]1O2 ZINC000095556713 GI Annotated Mild Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@H](C)CNCc3ccc(C#N)cc3)C[C@@H]1O2 ZINC000095556714 GI Annotated Mild CC(C)CN(Cc1ccc2c(c1)C=CC(C)(C)O2)S(=O)(=O)c1nccs1 ZINC000095556739 GI Annotated Anodyne Nc1nc(-c2ccccc2)c2c(n1)-c1cc(Cc3cncc(F)c3)ccc1C2=O ZINC000095556770 GI Annotated Anodyne Cc1c(C(=O)OCCc2ccccc2)oc2cccc(OC3CCNCC3)c12 ZINC000095556870 GI Annotated Anodyne COc1ccc(COc2cc(C3=NN(C(C)C)C(=O)C3(C)C)ccc2OC)cc1 ZINC000095557654 GI Annotated Anodyne COc1ccc(C2=NN(C(C)C)C(=O)C2(C)C)cc1OCc1ccc(C#N)cc1 ZINC000095557722 GI Annotated Mild Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@@H](C)CNCc3ccccc3O)C[C@@H]1O2 ZINC000095557755 GI Annotated Clean Cc1cc2c(c(=O)o1)C=C1CC[C@H]([C@H](C)CNCc3ccccc3O)C[C@@H]1O2 ZINC000095557756 GI Annotated Clean Cc1ccc2c(c1)C(=O)C(=O)N2Cc1ccc(/C=C2/C(=O)Nc3ccc(C)cc32)o1 ZINC000095557871 GI Annotated Anodyne CCCCN(CCO)Cc1coc2cccc(OCC3CCCCC3)c2c1=O ZINC000095558320 GI Annotated Anodyne COc1ccc(-n2cc(-c3ccccn3)cc(-c3ccccc3C#N)c2=O)cc1 ZINC000095558564 GI Annotated Mild CC1CCC2(CC1)S[C@@H](C)C(=O)N2NC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000095559551 GI Annotated Anodyne CC1CCC2(CC1)S[C@H](C)C(=O)N2NC(=O)C12CC3CC(CC(C3)C1)C2 ZINC000095559552 GI Annotated Anodyne O=C(/C=C/c1cc[n+](Cc2ccccc2F)cc1)c1cc2ccccc2oc1=O ZINC000095559827 GI Annotated Mild O=C(O)c1c(O)cc(O)cc1CCc1ccc(Cc2nc3ccccc3o2)cc1 ZINC000095559864 GI Annotated Anodyne O=C1NC2=Nc3ccccc3N(Cc3nc4ccccc4[nH]3)C2=Nc2ccccc21 ZINC000095559997 GI Annotated Anodyne Cc1nn(C(=O)c2ccc(Cl)cc2)c2c1nnc1cc(Cl)c(F)cc12 ZINC000095560256 GI Annotated Anodyne O=C(CSc1nccnc1-c1ccccc1Cl)N1CCc2ccccc2C1 ZINC000095560269 GI Annotated Anodyne CC(=O)Oc1c(C(=O)Nc2ncc([N+](=O)[O-])s2)cc(C(C)C)cc1C(C)C ZINC000095561020 GI Annotated Bother O=C(Nc1ncc([N+](=O)[O-])s1)c1ccc(-c2ccc(Br)cc2)o1 ZINC000095561445 GI Annotated Bother Ic1ccc(CNCC2C3CC4CC(C3)CC2C4)cc1 ZINC000095561851 GI Annotated Anodyne Cc1ccc(-c2c(C)nn3c(NCCN(C)C)cc(C(F)(F)F)nc23)cc1 ZINC000095562100 GI Annotated Anodyne CCCOC(=O)[C@]12CC[C@@]3(C)C[C@H]4O[C@@]4(C)[C@H]4O[C@H]4[C@H]3[C@@H]1CC[C@@H]2C(C)C ZINC000095562143 GI Annotated Anodyne Cn1c(-c2ccc(OCCO)cc2)[n+](C)c2c3ccccc3c3ccccc3c21 ZINC000095562435 GI Annotated Bother CCOC(=O)NCc1nc(-c2nc(C)cs2)c(-c2ccc3ncsc3c2)[nH]1 ZINC000095562927 GI Annotated Anodyne COc1ccc(Oc2c(Cl)cnn(-c3ccc(OC(C)C)cc3)c2=O)cc1 ZINC000095564141 GI Annotated Anodyne COc1cc2c(C[C@@H]3CCC[C@H](C)C3)c(C(=O)Nc3nn[nH]n3)sc2cc1C ZINC000095565941 GI Annotated Anodyne COc1cc2c(C[C@H]3CCC[C@H](C)C3)c(C(=O)Nc3nn[nH]n3)sc2cc1C ZINC000095565942 GI Annotated Anodyne COc1cc2c(C[C@@H]3CCC[C@@H](C)C3)c(C(=O)Nc3nn[nH]n3)sc2cc1C ZINC000095565943 GI Annotated Anodyne COc1cc2c(C[C@H]3CCC[C@@H](C)C3)c(C(=O)Nc3nn[nH]n3)sc2cc1C ZINC000095565944 GI Annotated Anodyne CCCCNC(=O)c1nc(C2CCNCC2)[nH]c1-c1cccc(C(F)(F)F)c1 ZINC000095566394 GI Annotated Anodyne Cc1ccnc(NC(=S)N2CCN(c3cccc(C(F)(F)F)c3)C[C@@H]2C)c1 ZINC000095566792 GI Annotated Anodyne c1ccc(-c2nnc(-c3ccccn3)nc2Nc2cnc3ccccc3n2)cc1 ZINC000095566853 GI Annotated Anodyne C=C1C[C@@H]2C[C@@H]2CN(S(=O)(=O)c2ccc(C)cc2)[C@@H]1COCc1ccccc1 ZINC000095567065 GI Annotated Mild COc1ccc([C@H]2O[C@@H](CCc3ccccc3)Cc3[nH]c(=S)[nH]c(=O)c32)cc1 ZINC000095567221 GI Annotated Anodyne COc1ccc([C@@H]2O[C@@H](CCc3ccccc3)Cc3[nH]c(=S)[nH]c(=O)c32)cc1 ZINC000095567222 GI Annotated Anodyne COc1ccc([C@H]2O[C@H](CCc3ccccc3)Cc3[nH]c(=S)[nH]c(=O)c32)cc1 ZINC000095567223 GI Annotated Anodyne COc1ccc([C@@H]2O[C@H](CCc3ccccc3)Cc3[nH]c(=S)[nH]c(=O)c32)cc1 ZINC000095567224 GI Annotated Anodyne CN(Cc1ccccc1)[C@H](c1cc2ccccc2o1)c1nnnn1C(C)(C)C ZINC000095567343 GI Annotated Anodyne CN(Cc1ccccc1)[C@@H](c1cc2ccccc2o1)c1nnnn1C(C)(C)C ZINC000095567344 GI Annotated Anodyne OCCO[C@H]1CCCc2oc(-c3ccccc3)c(C#CC3(O)CCCCC3)c21 ZINC000095567856 GI Annotated Mild OCCO[C@@H]1CCCc2oc(-c3ccccc3)c(C#CC3(O)CCCCC3)c21 ZINC000095567857 GI Annotated Mild Cc1cc(C)nc(NC(=S)N2CCN(c3ccc(Cl)cc3F)CC2)c1 ZINC000095568279 GI Annotated Anodyne CC(=O)C1=CC[C@@H](c2ccc(C)cc2)N(S(=O)(=O)c2ccc(Cl)cc2)C1 ZINC000095568423 GI Annotated Mild CC(=O)C1=CC[C@H](c2ccc(C)cc2)N(S(=O)(=O)c2ccc(Cl)cc2)C1 ZINC000095568424 GI Annotated Mild CCCCn1nnnc1[C@@H](c1cc2ccccc2o1)N(C)CCc1ccccc1 ZINC000095568551 GI Annotated Anodyne CCCCn1nnnc1[C@H](c1cc2ccccc2o1)N(C)CCc1ccccc1 ZINC000095568552 GI Annotated Anodyne Cc1cnc(-c2nc3ccccc3n2[C@H](C(=O)NC(C)(C)C)c2ccccc2)cn1 ZINC000095568582 GI Annotated Anodyne Cc1cnc(-c2nc3ccccc3n2[C@@H](C(=O)NC(C)(C)C)c2ccccc2)cn1 ZINC000095568583 GI Annotated Anodyne CCOC(=O)[C@]12Cc3cc(Cl)ccc3[C@H]1N(C(C)C)C(=O)c1ccccc12 ZINC000095568608 GI Annotated Anodyne Cc1ccnc(NC(=S)N2CCCN(c3cccc(C(F)(F)F)c3)CC2)c1 ZINC000095568697 GI Annotated Anodyne CCN(C[C@@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@@H](CO)N1CC1CC1)C(C)=O ZINC000095568714 GI Annotated Anodyne Cc1cc(C)nc(NC(=S)N2CCN(c3ccc(F)c(Cl)c3)CC2)c1 ZINC000095569208 GI Annotated Anodyne COC(=O)c1ccc2nc(-c3ccc(C#N)cc3)c(Cc3cccc(F)c3)n2c1 ZINC000095569340 GI Annotated Mild COC(=O)C1=CN(c2c(C)cc(C)cc2C)C(N)=C(C#N)[C@H]1c1cccc(F)c1 ZINC000095569344 GI Annotated Reactive COC(=O)C1=CN(c2c(C)cc(C)cc2C)C(N)=C(C#N)[C@@H]1c1cccc(F)c1 ZINC000095569345 GI Annotated Reactive Cc1ccnc(NC(=S)N2CCN(c3ccc(Cl)cc3Cl)CC2)c1 ZINC000095569587 GI Annotated Anodyne Cc1cc(C)nc(NC(=S)N2CCN(Cc3cccc4ccccc34)CC2)c1 ZINC000095569620 GI Annotated Anodyne Cc1ccnc(NC(=S)N[C@@H]2CCCN(c3cccc(C(F)(F)F)c3)C2)c1 ZINC000095569869 GI Annotated Anodyne Cc1ccnc(NC(=S)N[C@H]2CCCN(c3cccc(C(F)(F)F)c3)C2)c1 ZINC000095569870 GI Annotated Anodyne CN(CCc1ccccc1)[C@H](c1cc2ccccc2o1)c1nnnn1C(C)(C)C ZINC000095569928 GI Annotated Anodyne CN(CCc1ccccc1)[C@@H](c1cc2ccccc2o1)c1nnnn1C(C)(C)C ZINC000095569929 GI Annotated Anodyne Cc1ccnc(NC(=S)NC2CCN(c3cccc(C(F)(F)F)c3)CC2)c1 ZINC000095570437 GI Annotated Anodyne CCCCNC(=O)c1nc(C2CCNCC2)oc1-c1cccc(C(F)(F)F)c1 ZINC000095570777 GI Annotated Anodyne CCCCn1nnnc1[C@@H](c1cc2ccccc2o1)N(C)Cc1ccccc1 ZINC000095570800 GI Annotated Anodyne CCCCn1nnnc1[C@H](c1cc2ccccc2o1)N(C)Cc1ccccc1 ZINC000095570801 GI Annotated Anodyne CCOC(=O)[C@@H](c1nc2ccccc2[nH]1)n1c(-c2ccccn2)nc2ccccc21 ZINC000095570927 GI Annotated Anodyne CCOC(=O)[C@H](c1nc2ccccc2[nH]1)n1c(-c2ccccn2)nc2ccccc21 ZINC000095570928 GI Annotated Anodyne C[C@]1(C(=O)Nc2ccc3ccccc3c2)CCC(=O)N1CCOc1ccccc1 ZINC000095571028 GI Annotated Anodyne C[C@@]1(C(=O)Nc2ccc3ccccc3c2)CCC(=O)N1CCOc1ccccc1 ZINC000095571029 GI Annotated Anodyne COC(=O)c1c(N)[nH]c(C(=O)c2ccccc2)c1-c1ccccc1Br ZINC000095571189 GI Annotated Anodyne Cc1cc(C)nc(NC(=S)N2CCN(c3cccc(C(F)(F)F)c3)CC2)c1 ZINC000095571284 GI Annotated Anodyne O=c1[nH]c(=S)[nH]c2c1[C@H](c1ccc(F)cc1)O[C@H](CCc1ccccc1)C2 ZINC000095571465 GI Annotated Anodyne O=c1[nH]c(=S)[nH]c2c1[C@H](c1ccc(F)cc1)O[C@@H](CCc1ccccc1)C2 ZINC000095571466 GI Annotated Anodyne O=c1[nH]c(=S)[nH]c2c1[C@@H](c1ccc(F)cc1)O[C@H](CCc1ccccc1)C2 ZINC000095571467 GI Annotated Anodyne O=c1[nH]c(=S)[nH]c2c1[C@@H](c1ccc(F)cc1)O[C@@H](CCc1ccccc1)C2 ZINC000095571468 GI Annotated Anodyne Cc1ccnc(CC(=S)N2CCN(c3cccc(C(F)(F)F)c3)CC2)c1 ZINC000095571527 GI Annotated Anodyne c1cc(-c2nc(OCc3ccncc3)c3ccncc3n2)cc(-c2ncco2)c1 ZINC000095572228 GI Annotated Anodyne CCCN1Cc2c(c3ccc(OC)cc3c3cc(OC)c(OC)cc23)[C@H](O)C1 ZINC000095572237 GI Annotated Bother CCCN1Cc2c(c3ccc(OC)cc3c3cc(OC)c(OC)cc23)[C@@H](O)C1 ZINC000095572238 GI Annotated Bother O=C(O)C[C@H](CC(=O)c1ccc(I)cc1)c1ccccc1 ZINC000095572806 GI Annotated Anodyne O=C(O)C[C@@H](CC(=O)c1ccc(I)cc1)c1ccccc1 ZINC000095572807 GI Annotated Anodyne O=C1c2ccc(Nc3ccc(F)cc3F)cc2CCc2cc(OCCO)ccc21 ZINC000095572962 GI Annotated Anodyne COc1cc(/C=C2\CCCN3C2=NOC[C@@H]3CC(C)C)ccc1-n1cnc(C)c1 ZINC000095574005 GI Annotated Anodyne COc1ccccc1Cn1c(-c2ccncc2)nc2cc(Br)cnc21 ZINC000095575300 GI Annotated Anodyne CCCn1cc(C(=O)N[C@@H]2C(C)(C)[C@H]3CC[C@]2(C)C3)c(=O)c2ccc(F)cc21 ZINC000095575321 GI Annotated Anodyne O=C1c2ccc(Nc3ccc(F)cc3F)cc2CCc2ccc(OCCO)cc21 ZINC000095575327 GI Annotated Anodyne Fc1ccc(CSc2nnc(-c3cnccn3)n2-c2ccccc2)c(F)c1 ZINC000095575605 GI Annotated Anodyne O=c1cc2n(-c3ccccc3)nc(-c3ccccc3)nc-2cc1N1CCCCC1 ZINC000095576012 GI Annotated Anodyne COc1ccc(-c2nnc(-c3cc(Br)c(Br)[nH]3)o2)cc1 ZINC000095576062 GI Annotated Anodyne Cc1ccc(CNc2nc(=O)c3cc(C(F)(F)F)cc([N+](=O)[O-])c3s2)o1 ZINC000095577527 GI Annotated Bother CCN(Cc1ccccc1)C(=S)Sc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000095577903 GI Annotated Bother CC(C)Nc1cc(-c2csc(N(C)C(=O)c3ccc(Cl)cc3)n2)ncn1 ZINC000095577976 GI Annotated Anodyne COc1cc(/C=C2\CCCN3C2=NOC[C@@H]3C(C)C)ccc1-n1cnc(C)c1 ZINC000095578150 GI Annotated Anodyne CC[C@H]1S/C(=N/N=C(\C)COc2ccccc2)N(c2ccc(OC)cc2)C1=O ZINC000095578201 GI Annotated Mild CC[C@@H]1S/C(=N/N=C(\C)COc2ccccc2)N(c2ccc(OC)cc2)C1=O ZINC000095578202 GI Annotated Mild COc1cc(Nc2ncn(Cc3cccc(Cl)c3)n2)ccc1-n1cnc(C)c1 ZINC000095578243 GI Annotated Anodyne COc1cc(/C=C2\CCCN3C2=NOC[C@@H]3C(C)(C)C)ccc1-n1cnc(C)c1 ZINC000095578604 GI Annotated Anodyne CCN1CCc2c(c3cc(OC)c(OC)cc3c3cc(OC)c(OC)cc23)C1 ZINC000095579889 GI Annotated Bother Cc1cn(-c2ccc(Nc3ncn(Cc4cccc(Cl)c4)n3)cc2C#N)cn1 ZINC000095580023 GI Annotated Mild C[C@H](NC1=NS(=O)(=O)c2cc(C(F)(F)F)ccc2S1)c1ccccc1 ZINC000095581414 GI Annotated Anodyne C[C@@H](NC1=NS(=O)(=O)c2cc(C(F)(F)F)ccc2S1)c1ccccc1 ZINC000095581415 GI Annotated Anodyne COc1ccccc1-c1nnn(-c2cccc(C)n2)c1-c1ccc2nccnc2c1 ZINC000095581702 GI Annotated Anodyne Cc1ccc(OCC#Cc2cc(N)cc(C#CCOc3ccc(C)cc3)n2)cc1 ZINC000095581724 GI Annotated Mild C=C(C)[C@@H]1CC=C(C)/C(=N/NC(=O)Nc2nnc(-c3ccc(OC)cc3)o2)C1 ZINC000095581786 GI Annotated Reactive COc1ccc2nc3cc(I)ccc3c(N(C)C)c2c1 ZINC000095582791 GI Annotated Clean CC(C)=CC/C=C(/C)C/C=N/NC(=O)Nc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000095583019 GI Annotated Reactive CCOC(=O)c1cc(-c2ccc(Cl)s2)nc2c1cnn2Cc1ccncc1 ZINC000095584707 GI Annotated Anodyne COc1c2ccc(I)cc2nc2ccc(N(C)C)cc12 ZINC000095585268 GI Annotated Bother O=C(O)c1cc(-c2cc3ccccc3s2)nc2c1cnn2Cc1ccncc1 ZINC000095585339 GI Annotated Anodyne C=C(C)[C@@H]1CC=C(C)/C(=N/NC(=O)Nc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000095585891 GI Annotated Reactive CCOC(=O)C1=C(C)N/C(=C/c2cc(C)n(-c3ccc(SC)cc3)c2C)C1=O ZINC000095586139 GI Annotated Mild CCOC(=O)c1c(O[C@@H]2CCCC[C@@H]2C)cc(CCc2ccccc2)[nH]c1=O ZINC000095586510 GI Annotated Anodyne CCOC(=O)c1c(O[C@H]2CCCC[C@@H]2C)cc(CCc2ccccc2)[nH]c1=O ZINC000095586511 GI Annotated Anodyne CCOC(=O)c1c(O[C@@H]2CCCC[C@H]2C)cc(CCc2ccccc2)[nH]c1=O ZINC000095586512 GI Annotated Anodyne CCOC(=O)c1c(O[C@H]2CCCC[C@H]2C)cc(CCc2ccccc2)[nH]c1=O ZINC000095586513 GI Annotated Anodyne CCOC(=O)C1=C(C)N/C(=C/c2ccc(-c3ccccc3C(F)(F)F)o2)C1=O ZINC000095586617 GI Annotated Mild CCCCCCCCC[S@@](=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O ZINC000095586922 GI Annotated Mild CCCCCCCCC[S@](=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O ZINC000095586923 GI Annotated Mild NS(=O)(=O)c1cc2nc(-c3ccccc3Cl)n3c4ccccc4oc(c1)c23 ZINC000095587386 GI Annotated Bother CN(C(=O)Cn1c(=O)n2c3c(cc(-c4ccccc4)cc31)CCC2)c1ccccc1 ZINC000095587472 GI Annotated Anodyne CCCCCCCC[S@@](=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O ZINC000095587512 GI Annotated Mild CCCCCCCC[S@](=O)C1=CC(=O)c2c(OC)ccc(OC)c2C1=O ZINC000095587513 GI Annotated Mild CCOC(=O)c1c(OC2C[C@@H](C)C[C@H](C)C2)cc(Cc2ccccc2)[nH]c1=O ZINC000095587574 GI Annotated Anodyne CCOC(=O)c1c(OC2C[C@H](C)C[C@@H](C)C2)cc(Cc2ccccc2)[nH]c1=O ZINC000095587575 GI Annotated Anodyne Cc1ccccc1NC[C@H](O)COc1ccc2c(c1)OC1(CCCC1)CC2=O ZINC000095588129 GI Annotated Anodyne Cc1ccccc1NC[C@@H](O)COc1ccc2c(c1)OC1(CCCC1)CC2=O ZINC000095588130 GI Annotated Anodyne CN(C)CCNCc1ccc(Nc2ncc3cc(-c4ccncc4)ccc3n2)cc1 ZINC000095589010 GI Annotated Anodyne CCCCOC(=O)N[C@H](C(=O)N[C@H](C)c1nc2ccc(F)cc2s1)C(C)C ZINC000095589027 GI Annotated Anodyne O=c1ccn(C/C=C/c2ccccc2)c(=O)n1Cc1cc(Cl)cc(Cl)c1 ZINC000095589111 GI Annotated Anodyne CC(=O)OC[C@@]1(C)CCC[C@]2(C)[C@@H]1CC[C@]13CC(=O)[C@H](C[C@H](OC(C)=O)[C@H]12)C3 ZINC000095589367 GI Annotated Anodyne NS(=O)(=O)c1cc2nc(-c3ccc(Cl)cc3)n3c4ccccc4oc(c1)c23 ZINC000095589409 GI Annotated Bother CC(C)[C@@]12C=C3[C@H](O)C[C@H]4[C@](C)(C(=O)O)CCC[C@]4(C)[C@H]3C[C@@H]1OC(C)(C)O2 ZINC000095589835 GI Annotated Anodyne Cc1ccc(-c2nc3cc4c5c(cccc5c3o2)C(=O)N(CCN(C)C)C4=O)cc1 ZINC000095590037 GI Annotated Anodyne COCCNCc1ccc(Nc2ncc3cc(-c4ccncc4)ccc3n2)cc1 ZINC000095590529 GI Annotated Anodyne CC1(C)CC[C@@H](OC(=O)/C=C/c2ccc(O)cc2)[C@]2(C)[C@@H]3C(=CC[C@@H]12)CO[C@@H]3O ZINC000095591268 GI Annotated Anodyne O=C1CC2(CCCCC2)Oc2cc(OC[C@@H](O)CNc3ccccc3)ccc21 ZINC000095591296 GI Annotated Anodyne O=C1CC2(CCCCC2)Oc2cc(OC[C@H](O)CNc3ccccc3)ccc21 ZINC000095591297 GI Annotated Anodyne COc1ccc(/C(=N/NC(=S)Nc2ccccc2)c2cccc(C)n2)cc1 ZINC000095591807 GI Annotated Mild CCOC(=O)c1c(O[C@@H]2CCCC[C@@H]2Cl)cc(Cc2ccccc2)[nH]c1=O ZINC000095591839 GI Annotated Reactive CCOC(=O)c1c(O[C@H]2CCCC[C@@H]2Cl)cc(Cc2ccccc2)[nH]c1=O ZINC000095591840 GI Annotated Reactive CCOC(=O)c1c(O[C@@H]2CCCC[C@H]2Cl)cc(Cc2ccccc2)[nH]c1=O ZINC000095591841 GI Annotated Reactive CCOC(=O)c1c(O[C@H]2CCCC[C@H]2Cl)cc(Cc2ccccc2)[nH]c1=O ZINC000095591842 GI Annotated Reactive CCOC(=O)c1c(OC2[C@@H](C)CCC[C@@H]2C)cc(Cc2ccccc2)[nH]c1=O ZINC000095591971 GI Annotated Anodyne CCOC(=O)c1c(OC2[C@H](C)CCC[C@H]2C)cc(Cc2ccccc2)[nH]c1=O ZINC000095591972 GI Annotated Anodyne Nc1nc(Nc2cccc(C(F)(F)F)c2)c2cc(CCc3ccccn3)[nH]c2n1 ZINC000095592487 GI Annotated Anodyne COc1ccc(C(=O)c2c[nH]c3c(OC)c(OC)c(OC)cc23)cc1Cl ZINC000095592717 GI Annotated Anodyne O=P(Nc1cc(F)ccc1-n1cccn1)(c1ccccc1)c1ccccc1 ZINC000095593577 GI Annotated Reactive CCCCNc1c2c3ccc(N4CCSCC4)c4cccc(c-2nc1=O)c43 ZINC000095593728 GI Annotated Bother COc1cc(Sc2c(C3=NCCO3)[nH]c3ccccc23)cc(OC)c1OC ZINC000095594019 GI Annotated Anodyne COc1cc([C@H](O)c2c(-c3cc[nH]c3)[nH]c3ccccc23)cc(OC)c1OC ZINC000095594624 GI Annotated Anodyne COc1cc([C@@H](O)c2c(-c3cc[nH]c3)[nH]c3ccccc23)cc(OC)c1OC ZINC000095594625 GI Annotated Anodyne COc1cc(C(F)(F)F)ccc1-c1cccc2c(CCN=C(N)N)cccc12 ZINC000095594994 GI Annotated Mild CCN1C(=O)S/C(=C\C2=Cc3cc(Br)ccc3O[C@@H]2C)C1=O ZINC000095595037 GI Annotated Anodyne CCN1C(=O)S/C(=C\C2=Cc3cc(Br)ccc3O[C@H]2C)C1=O ZINC000095595038 GI Annotated Anodyne CC(C)(C)NC(=O)[C@@H](c1cccnc1)N(C(=O)c1ccco1)c1ccc(F)cc1 ZINC000095595410 GI Annotated Anodyne CC(C)(C)NC(=O)[C@H](c1cccnc1)N(C(=O)c1ccco1)c1ccc(F)cc1 ZINC000095595411 GI Annotated Anodyne Cc1nc2sc(C(=O)NCc3cccc(F)c3F)c(N)c2c(C)c1Cl ZINC000095595769 GI Annotated Anodyne COc1ccc(C(=O)[C@@H](C)Oc2ccc(Br)cc2OC)cc1OC ZINC000095597004 GI Annotated Anodyne COc1ccc2c(c1)Oc1ncn3nc(C)nc3c1[C@H]2c1ccc(Cl)cc1 ZINC000095597444 GI Annotated Anodyne COc1ccc2c(c1)Oc1ncn3nc(C)nc3c1[C@@H]2c1ccc(Cl)cc1 ZINC000095597445 GI Annotated Anodyne COc1cc(CCc2cccc3c(=O)c4ccccc4[nH]c23)cc(OC)c1OC ZINC000095598182 GI Annotated Bother NC(=O)c1ccc2c(c1)C(=O)c1ccc(Nc3ccc(F)cc3F)cc1CC2 ZINC000095598229 GI Annotated Anodyne CCn1cc(CN2CCOc3ccc([C@H](O)C4CCCCC4)cc3C2)c(C)n1 ZINC000095598917 GI Annotated Anodyne CCn1cc(CN2CCOc3ccc([C@@H](O)C4CCCCC4)cc3C2)c(C)n1 ZINC000095598918 GI Annotated Anodyne O=C(NCCc1ccccc1F)c1[nH]c(C(F)(F)F)nc1-c1ccccc1 ZINC000095599035 GI Annotated Anodyne CCCCN1C(=O)C2=C(c3ccc(OC)cc3)Nc3ccccc3CN2C1=O ZINC000095599487 GI Annotated Anodyne COc1ccc(C(=O)[C@H](OP(=O)(OC)OC)c2ccccc2OC)cc1 ZINC000095600614 GI Annotated Anodyne COc1ccc(C(=O)[C@@H](OP(=O)(OC)OC)c2ccccc2OC)cc1 ZINC000095600615 GI Annotated Anodyne O=C1C(c2ccccc2)=NCCN1[C@@H](c1ccc(F)cc1)c1nc2ccccc2[nH]1 ZINC000095600617 GI Annotated Anodyne O=C1C(c2ccccc2)=NCCN1[C@H](c1ccc(F)cc1)c1nc2ccccc2[nH]1 ZINC000095600618 GI Annotated Anodyne Cn1oc2cc3c(c4cccc(c1=O)c24)[C@@H](CCl)CN3C(=O)OC(C)(C)C ZINC000095601195 GI Annotated Reactive CN1C(=O)[C@@]2(CC(C)(C)Cc3ccc(-c4cc(F)cc(Cl)c4)cc32)N=C1N ZINC000095601413 GI Annotated Anodyne CN1C(=O)[C@]2(CC(C)(C)Cc3ccc(-c4cc(F)cc(Cl)c4)cc32)N=C1N ZINC000095601414 GI Annotated Anodyne FC(F)(F)c1cccc(Sc2ccc3nnc(-c4nccs4)n3n2)c1 ZINC000095601480 GI Annotated Anodyne O=C1C2=C(c3ccccc3)Nc3ccccc3CN2C(=O)N1Cc1ccccc1 ZINC000095602399 GI Annotated Anodyne COc1cccc(CNc2ccc(C(F)(F)F)c(O[C@H]3CCN(C)C3)c2)c1 ZINC000095602605 GI Annotated Anodyne FC(F)(F)c1cccc(Sc2ccc3nnc(-c4cncs4)n3n2)c1 ZINC000095602876 GI Annotated Anodyne Cn1oc2cc3c(c4cccc(c1=O)c24)[C@H](CCl)CN3C(=O)OC(C)(C)C ZINC000095602926 GI Annotated Reactive Nc1nnc(-c2cc(C(F)(F)F)nc(C(F)(F)F)c2)c(-c2ccccc2)n1 ZINC000095602969 GI Annotated Anodyne CC1(C)Cc2cc(Cl)ccc2C(N[C@@H](Cc2ccccc2)c2nnco2)=N1 ZINC000095603290 GI Annotated Anodyne CC1(C)Cc2cc(Cl)ccc2C(N[C@H](Cc2ccccc2)c2nnco2)=N1 ZINC000095603291 GI Annotated Anodyne O=C1c2ccccc2-n2nnc(-c3ccccc3)c2[C@H]2c3ccccc3CCN12 ZINC000095604084 GI Annotated Anodyne O=C1c2ccccc2-n2nnc(-c3ccccc3)c2[C@@H]2c3ccccc3CCN12 ZINC000095604085 GI Annotated Anodyne COc1ccc(CNc2ccc(C(F)(F)F)c(O[C@H]3CCN(C)C3)c2)cc1 ZINC000095604492 GI Annotated Anodyne CC(C)c1ccc(OCC(=O)N(Cc2nc(-c3cccnc3)no2)C(C)C)cc1 ZINC000095604695 GI Annotated Anodyne COC(=O)c1c(C)nc(C)c2c1C(=O)C=C(Sc1ccc(C)c(C)c1)C2=O ZINC000095605268 GI Annotated Mild Brc1cccc(Sc2ccc3nnc(-c4cncs4)n3n2)c1 ZINC000095605334 GI Annotated Anodyne COC(=O)c1c(N)[nH]c(C(=O)c2ccccc2)c1-c1ccc(Br)cc1 ZINC000095605700 GI Annotated Anodyne Cc1ccc(C(=O)N2CCc3cc4c(cc3[C@@H]2c2cccc(O)c2)OCO4)cc1 ZINC000095605811 GI Annotated Anodyne Cc1ccc(C(=O)N2CCc3cc4c(cc3[C@H]2c2cccc(O)c2)OCO4)cc1 ZINC000095605812 GI Annotated Anodyne CC1(C)Cc2cc(Cl)ccc2C(N[C@@H](Cc2ccccc2)c2noc(O)n2)=N1 ZINC000095605836 GI Annotated Anodyne O=C1CCC(=O)N[C@@H](c2ccc(F)cc2)C/C=C\C[C@H](c2ccc(F)cc2)N1 ZINC000095661190 GI Annotated Anodyne O=C1CCC(=O)N[C@H](c2ccc(F)cc2)C/C=C\C[C@@H](c2ccc(F)cc2)N1 ZINC000095662271 GI Annotated Anodyne CCCC#Cc1ccc2c(c1)[C@H]1[C@H](CCN1C(=O)C1CCCCC1)[C@@H](CO)N2 ZINC000095662731 GI Annotated Mild CCC(=O)N1[C@H](CO)[C@H](c2ccc(C3=CCCC3)cc2)[C@@H]1CNC1CCCCC1 ZINC000095663251 GI Annotated Anodyne CC(C)NC[C@@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@@H](CO)N1C(=O)CC1CC1 ZINC000095664002 GI Annotated Anodyne O=C(C1CCCC1)N1CC[C@@H]2[C@H]1c1cc(-c3cccc(F)c3)ccc1N[C@H]2CO ZINC000095665026 GI Annotated Anodyne OC[C@@H]1[C@@H](c2ccccc2)C2(CN(Cc3cccc(F)c3)C2)N1CC1CCCC1 ZINC000095665029 GI Annotated Anodyne CCOC(=O)C1(CCOc2ccccc2)CCN(C(=O)OC(C)(C)C)CC1 ZINC000095665443 GI Annotated Anodyne O=C1CC/C=C/CN(Cc2ccc(Cl)cc2)C(=O)OC[C@@H](c2ccccc2)N1 ZINC000095665498 GI Annotated Anodyne N#C[C@@H]1[C@@H](c2ccccc2-c2cccc(F)c2)[C@H](CO)N1C(=O)C1CCCCC1 ZINC000095666902 GI Annotated Mild N#C[C@@H]1[C@H](c2ccccc2-c2cccc(F)c2)[C@H](CO)N1C(=O)C1CCCCC1 ZINC000095666908 GI Annotated Mild N#C[C@H]1[C@H](c2ccccc2-c2cccc(F)c2)[C@@H](CO)N1C(=O)C1CCCCC1 ZINC000095666913 GI Annotated Mild N#C[C@H]1[C@@H](c2ccccc2-c2cccc(F)c2)[C@@H](CO)N1C(=O)C1CCCCC1 ZINC000095667015 GI Annotated Mild CCCNC[C@@H]1[C@@H](c2ccc(C3=CCCC3)cc2)[C@@H](CO)N1C(=O)C1CCCC1 ZINC000095667093 GI Annotated Anodyne CCCC#Cc1ccc2c(c1)[C@@H]1[C@@H](CCN1C(=O)C1CCCCC1)[C@@H](CO)N2 ZINC000095667146 GI Annotated Mild CCCNC[C@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@@H](CO)N1C(=O)C1CCC1 ZINC000095667186 GI Annotated Anodyne CCCC#Cc1ccc2c(c1)[C@H]1[C@H](CCN1Cc1ccccc1F)[C@@H](CO)N2 ZINC000095668569 GI Annotated Mild CCc1csc(N2[C@@H](C#N)[C@@H](c3ccccc3-c3cccc(F)c3)[C@@H]2CO)n1 ZINC000095668730 GI Annotated Mild O=C(N[C@@H](C(=O)O)c1ccccc1O)OCC1c2ccccc2-c2ccccc21 ZINC000095748936 GI Annotated Clean O=C(N[C@H](C(=O)O)c1ccccc1O)OCC1c2ccccc2-c2ccccc21 ZINC000095748937 GI Annotated Clean O=C(NC[C@H](Cc1ccco1)C(=O)O)OCC1c2ccccc2-c2ccccc21 ZINC000095750651 GI Annotated Anodyne O=C(NC[C@@H](Cc1ccco1)C(=O)O)OCC1c2ccccc2-c2ccccc21 ZINC000095750653 GI Annotated Anodyne COc1ccccc1NC1=NC(=O)/C(=C/c2ccc3c(c2)OC(F)(F)O3)S1 ZINC000095755392 GI Annotated Clean C=C/C=C/[C@@H]1C(=C)CN2[C@@H](Cc3ccccc3)C(=O)O[C@@H](Cc3ccccc3)[C@@H]12 ZINC000095783742 GI Annotated Mild O=C(C1=C[C@@H](C2CC2)C[C@@H](OCc2ccc(CO)cc2)O1)N1CCCCCCC1 ZINC000095783797 GI Annotated Anodyne C#CCN1[C@@H](Cc2ccccc2)C(=O)O[C@H](C2CCCCC2)[C@@H]1/C=C/C1CC1 ZINC000095784857 GI Annotated Mild C#CCN1[C@@H](/C=C/C2CC2)[C@@H](C2CCCCC2)OC(=O)[C@H]1Cc1ccccc1 ZINC000095784860 GI Annotated Mild CCCNC[C@@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@@H](CO)N1C(=O)C1CCC1 ZINC000095794447 GI Annotated Anodyne OC[C@@H]1Nc2ccc(C3=CCCCC3)cc2[C@@H]2[C@H]1CCN2Cc1nccs1 ZINC000095794543 GI Annotated Anodyne O=C(c1cccnc1)N1CC[C@@H]2[C@H](CO)Nc3ccc(C4=CCCCC4)cc3[C@@H]21 ZINC000095794795 GI Annotated Anodyne N#C[C@H]1[C@@H](c2ccccc2-c2ccccc2)[C@H](CO)N1C(=O)NC1CCCCC1 ZINC000095795554 GI Annotated Mild O=C(C1CCCC1)N1CC[C@@H]2[C@H](CO)Nc3ccc(-c4cccc(F)c4)cc3[C@@H]21 ZINC000095796902 GI Annotated Anodyne CN1c2ccc(C3=CCCCC3)cc2[C@H]2[C@H](CCN2C(=O)C2CCC2)[C@@H]1CO ZINC000095797648 GI Annotated Clean O=C(C1=C[C@H](C2CCCCC2)C[C@H](OCc2ccc(CO)cc2)O1)N1CCCC1 ZINC000095798310 GI Annotated Anodyne O=C(C1=C[C@H](C2CC2)C[C@H](OCc2ccc(CO)cc2)O1)N1CCCCCCC1 ZINC000095798311 GI Annotated Anodyne C#CCN1[C@@H](Cc2ccccc2)C(=O)O[C@@H](Cc2ccccc2)[C@H]1/C=C/C1CC1 ZINC000095798342 GI Annotated Mild N#C[C@@H]1[C@@H](c2ccccc2C2=CCCCC2)[C@@H](CO)N1C(=O)NC1CCCCC1 ZINC000095798433 GI Annotated Mild N#C[C@@H]1[C@H](c2ccccc2C2=CCCCC2)[C@H](CO)N1C(=O)NC1CCCCC1 ZINC000095798456 GI Annotated Mild N#C[C@H]1[C@@H](c2ccccc2-c2ccccc2)[C@@H](CO)N1C(=O)NC1CCCCC1 ZINC000095798470 GI Annotated Mild Cc1ccsc1/C=N/NC(=O)CCCCCCC(=O)Nc1ccccc1O ZINC000095808882 GI Annotated Reactive O=C(O)CCCCCCC(=O)N/N=C/c1ccc(-c2cccc(Cl)c2)o1 ZINC000095809004 GI Annotated Reactive CC1(C)[C@H]2CC=C(/C=N\NC(=O)CCCCCC(=O)Nc3ccccc3O)[C@@H]1C2 ZINC000095809771 GI Annotated Reactive N#C[C@@H]1[C@@H](c2ccccc2-c2ccccc2)[C@H](CO)N1C(=O)NC1CCCCC1 ZINC000095864467 GI Annotated Mild N#C[C@@H]1[C@H](c2ccccc2-c2ccccc2)[C@H](CO)N1C(=O)NC1CCCCC1 ZINC000095864477 GI Annotated Mild N#C[C@H]1[C@@H](c2ccccc2C2=CCCCC2)[C@@H](CO)N1C(=O)NC1CCCCC1 ZINC000095864491 GI Annotated Mild N#C[C@H]1[C@H](c2ccccc2-c2ccccc2)[C@@H](CO)N1C(=O)NC1CCCCC1 ZINC000095864516 GI Annotated Mild N#C[C@@H]1[C@H](c2ccccc2C2=CCCCC2)[C@@H](CO)N1C(=O)NC1CCCCC1 ZINC000095864559 GI Annotated Mild O=C(C1CCCC1)N1CC[C@H]2[C@@H](CO)Nc3ccc(-c4cccc(F)c4)cc3[C@H]21 ZINC000095866641 GI Annotated Anodyne O=C(C1CCCC1)N1CC[C@@H]2[C@@H](CO)Nc3ccc(-c4cccc(F)c4)cc3[C@@H]21 ZINC000095866813 GI Annotated Anodyne N#C[C@H]1[C@H](c2ccccc2C2=CCCCC2)[C@H](CO)N1C(=O)NC1CCCCC1 ZINC000095866864 GI Annotated Mild N#C[C@@H]1[C@@H](c2ccccc2C2=CCCCC2)[C@H](CO)N1C(=O)NC1CCCCC1 ZINC000095866867 GI Annotated Mild N#C[C@H]1[C@H](c2ccccc2C2=CCCCC2)[C@@H](CO)N1C(=O)NC1CCCCC1 ZINC000095866906 GI Annotated Mild N#C[C@H]1[C@H](c2ccccc2-c2ccccc2)[C@H](CO)N1C(=O)NC1CCCCC1 ZINC000095867907 GI Annotated Mild N#C[C@@H]1[C@H](c2ccccc2-c2ccccc2)[C@@H](CO)N1C(=O)NC1CCCCC1 ZINC000095867909 GI Annotated Mild OC[C@@H]1Nc2ccc(-c3cccc(F)c3)cc2[C@@H]2[C@H]1CCN2Cc1ccncc1 ZINC000095867931 GI Annotated Anodyne N#C[C@@H]1[C@@H](c2ccccc2-c2ccccc2)[C@@H](CO)N1C(=O)NC1CCCCC1 ZINC000095869241 GI Annotated Mild CN1c2ccc(C3=CCCCC3)cc2[C@@H]2[C@@H](CCN2C(=O)C2CCC2)[C@@H]1CO ZINC000095869271 GI Annotated Clean CN1c2ccc(C3=CCCCC3)cc2[C@@H]2[C@@H](CCN2C(=O)C2CCC2)[C@H]1CO ZINC000095869293 GI Annotated Clean C/C=C/c1ccc([C@H]2[C@@H](CO)N(c3nc(C)c(C)s3)[C@@H]2CNCC(C)C)cc1 ZINC000095871721 GI Annotated Anodyne OC[C@@H]1[C@H](c2ccc(C3=CCCC3)cc2)[C@@H](CNC2CCCC2)N1CC1CC1 ZINC000095871745 GI Annotated Anodyne CCC(=O)N1[C@H](CO)[C@H](c2ccc(C3=CCCCC3)cc2)[C@H]1CNCC1CCC1 ZINC000095871746 GI Annotated Anodyne CCC(=O)N1[C@H](CO)[C@H](c2ccc(C3=CCCCC3)cc2)[C@@H]1CNC1CCCC1 ZINC000095871834 GI Annotated Anodyne CCc1csc(N2[C@H](C#N)[C@H](c3ccccc3-c3ccc(F)cc3)[C@H]2CO)n1 ZINC000095871847 GI Annotated Mild CCc1csc(N2[C@@H](C#N)[C@@H](c3ccccc3-c3ccc(F)cc3)[C@@H]2CO)n1 ZINC000095871849 GI Annotated Mild N#C[C@@H]1[C@@H](c2ccccc2C2=CCCCC2)[C@@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095871851 GI Annotated Mild N#C[C@@H]1[C@H](c2ccccc2C2=CCCCC2)[C@@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095871852 GI Annotated Mild N#C[C@H]1[C@@H](c2ccccc2C2=CCCCC2)[C@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095871854 GI Annotated Mild N#C[C@H]1[C@H](c2ccccc2C2=CCCCC2)[C@@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095871856 GI Annotated Mild N#C[C@H]1[C@H](c2ccccc2C2=CCCCC2)[C@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095871858 GI Annotated Mild N#C[C@H]1[C@@H](c2ccccc2C2=CCCCC2)[C@@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095871860 GI Annotated Mild N#C[C@@H]1[C@H](c2ccccc2C2=CCCCC2)[C@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095871862 GI Annotated Mild N#C[C@@H]1[C@@H](c2ccccc2C2=CCCCC2)[C@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095871863 GI Annotated Mild CC(=O)N(C[C@@H]1[C@@H](c2ccc(C3=CCCC3)cc2)[C@@H](CO)N1CC1CC1)C(C)C ZINC000095871871 GI Annotated Anodyne Cc1ccccc1-c1ccccc1[C@H]1[C@@H](C#N)N(C(=O)c2ccccc2)[C@@H]1CO ZINC000095871898 GI Annotated Mild Cc1ccccc1-c1ccccc1[C@@H]1[C@@H](C#N)N(C(=O)c2ccccc2)[C@H]1CO ZINC000095871900 GI Annotated Mild Cc1ccccc1-c1ccccc1[C@H]1[C@@H](C#N)N(C(=O)c2ccccc2)[C@H]1CO ZINC000095871902 GI Annotated Mild Cc1ccccc1-c1ccccc1[C@@H]1[C@H](C#N)N(C(=O)c2ccccc2)[C@H]1CO ZINC000095871904 GI Annotated Mild Cc1nc(N2[C@H](CO)[C@H](c3ccccc3)[C@H]2CNCC2CCCCC2)sc1C ZINC000095871906 GI Annotated Anodyne CCC(=O)N1[C@H](CO)[C@H](c2ccc(C3=CCCCC3)cc2)[C@H]1CNC1CCCC1 ZINC000095871911 GI Annotated Anodyne CCC(=O)NC[C@@H]1[C@@H](c2ccc(C3=CCCC3)cc2)[C@@H](CO)N1CC1CCCC1 ZINC000095871916 GI Annotated Anodyne Cc1ccccc1-c1ccccc1[C@H]1[C@@H](CO)N(C(=O)c2ccccc2)[C@H]1C#N ZINC000095871918 GI Annotated Mild CCC(=O)N1[C@H](CO)[C@H](c2ccc(C3=CCCC3)cc2)[C@H]1CNCC1CCCC1 ZINC000095871984 GI Annotated Anodyne Cc1[nH]nc2c1[C@@H](c1ccc(Br)cn1)C1=C(CC(C)(C)CC1=O)N2 ZINC000095872414 GI Annotated Mild Cc1[nH]nc2c1[C@H](c1ccc(Br)cn1)C1=C(CC(C)(C)CC1=O)N2 ZINC000095872415 GI Annotated Mild Cc1ccccc1-c1ccc([C@@H]2[C@@H](CO)N3CCCCN(CC4CC4)C[C@H]23)cc1 ZINC000095876971 GI Annotated Anodyne Cc1ccccc1-c1ccc([C@H]2[C@@H](CO)N3CCCCN(CC4CC4)C[C@H]23)cc1 ZINC000095876972 GI Annotated Anodyne Cc1ccccc1-c1ccc([C@H]2[C@H](CO)N3CCCCN(CC4CC4)C[C@@H]23)cc1 ZINC000095876973 GI Annotated Anodyne Cc1ccccc1-c1ccc([C@@H]2[C@H](CO)N3CCCCN(CC4CC4)C[C@@H]23)cc1 ZINC000095876974 GI Annotated Anodyne Cc1ccccc1-c1ccc([C@H]2[C@@H](CO)N3CCCCN(CC4CC4)C[C@@H]23)cc1 ZINC000095876975 GI Annotated Anodyne O=C(Cc1ccccc1)N1CC[C@H]2[C@@H](CO)Nc3ccc(-c4ccccc4)cc3[C@H]21 ZINC000095877502 GI Annotated Anodyne O=C(Cc1ccccc1)N1CC[C@@H]2[C@H](CO)Nc3ccc(-c4ccccc4)cc3[C@@H]21 ZINC000095877503 GI Annotated Anodyne O=C(Cc1ccccc1)N1CC[C@@H]2[C@@H](CO)Nc3ccc(-c4ccccc4)cc3[C@@H]21 ZINC000095877504 GI Annotated Anodyne O=C(Cc1ccccc1)N1CC[C@@H]2[C@H]1c1cc(-c3ccccc3)ccc1N[C@H]2CO ZINC000095877505 GI Annotated Anodyne O=C(c1ccncc1)N1CC[C@@H]2[C@@H](CO)Nc3ccc(C4=CCCCC4)cc3[C@@H]21 ZINC000095878124 GI Annotated Anodyne O=C(c1cccnc1)N1CC[C@@H]2[C@@H](CO)Nc3ccc(C4=CCCCC4)cc3[C@@H]21 ZINC000095878828 GI Annotated Anodyne OC[C@H]1Nc2ccc(-c3cccc(F)c3)cc2[C@H]2[C@@H]1CCN2Cc1ccncc1 ZINC000095878852 GI Annotated Anodyne OC[C@H]1Nc2ccc(-c3cccc(F)c3)cc2[C@@H]2[C@H]1CCN2Cc1ccncc1 ZINC000095878853 GI Annotated Anodyne OC[C@@H]1Nc2ccc(-c3cccc(F)c3)cc2[C@H]2[C@@H]1CCN2Cc1ccncc1 ZINC000095878854 GI Annotated Anodyne CN1c2ccc(-c3ccccc3)cc2[C@H]2[C@H](CCN2C(=O)c2ccccc2)[C@H]1CO ZINC000095878891 GI Annotated Anodyne CN1c2ccc(-c3ccccc3)cc2[C@H]2[C@H](CCN2C(=O)c2ccccc2)[C@@H]1CO ZINC000095878892 GI Annotated Anodyne CN1c2ccc(-c3ccccc3)cc2[C@@H]2[C@@H](CCN2C(=O)c2ccccc2)[C@@H]1CO ZINC000095878893 GI Annotated Anodyne CN1c2ccc(-c3ccccc3)cc2[C@@H]2[C@@H](CCN2C(=O)c2ccccc2)[C@H]1CO ZINC000095878894 GI Annotated Anodyne O=C(Nc1ccccc1)N1C[C@H]2[C@@H](c3ccccc31)[C@@H](CO)N2CC1CCCC1 ZINC000095893760 GI Annotated Anodyne O=C(Nc1ccccc1)N1C[C@@H]2[C@H](c3ccccc31)[C@H](CO)N2CC1CCCC1 ZINC000095893761 GI Annotated Anodyne O=C(Nc1ccccc1)N1C[C@H]2[C@@H](c3ccccc31)[C@H](CO)N2CC1CCCC1 ZINC000095893762 GI Annotated Anodyne O=C(Nc1ccccc1)N1C[C@@H]2[C@H](c3ccccc31)[C@@H](CO)N2CC1CCCC1 ZINC000095893763 GI Annotated Anodyne O=C(Nc1ccccc1)N1C[C@@H]2[C@H](c3ccccc31)[C@@H](CO)N2Cc1ccccc1 ZINC000095894129 GI Annotated Anodyne O=C(Nc1ccccc1)N1C[C@H]2[C@@H](c3ccccc31)[C@H](CO)N2Cc1ccccc1 ZINC000095894130 GI Annotated Anodyne C/C=C/c1ccc([C@H]2[C@@H](CNC(C)C)N(c3nc(CC)cs3)[C@H]2CO)cc1 ZINC000095894957 GI Annotated Anodyne CC(C)NC[C@H]1[C@@H](c2ccc(-c3cccc(F)c3)cc2)[C@@H](CO)N1CC1CC1 ZINC000095895612 GI Annotated Anodyne CCNC[C@@H]1[C@H](c2ccc(C3=CCCC3)cc2)[C@H](CO)N1c1nc(C)c(C)s1 ZINC000095895721 GI Annotated Anodyne CCN(C[C@H]1[C@H](c2ccc(C3=CCCCC3)cc2)[C@H](CO)N1CC1CC1)C(C)=O ZINC000095895911 GI Annotated Anodyne C/C=C/c1ccc([C@@H]2[C@@H](CO)N(c3nc(CC)cs3)[C@@H]2CNC(C)C)cc1 ZINC000095895996 GI Annotated Anodyne C/C=C/c1ccc([C@H]2[C@@H](CO)N(c3nc(CC)cs3)[C@H]2CNC(C)C)cc1 ZINC000095895997 GI Annotated Anodyne C/C=C/c1ccc([C@H]2[C@H](CO)N(c3nc(CC)cs3)[C@H]2CNC(C)C)cc1 ZINC000095895998 GI Annotated Anodyne N#C[C@@H]1[C@@H](c2ccc(/C=C/c3ccccc3)cc2)[C@@H](CO)N1C(=O)C1CCCC1 ZINC000095896050 GI Annotated Mild N#C[C@H]1[C@@H](c2ccc(/C=C/c3ccccc3)cc2)[C@@H](CO)N1C(=O)C1CCCC1 ZINC000095896051 GI Annotated Mild N#C[C@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@H](CO)N1C(=O)NC1CCCCC1 ZINC000095896207 GI Annotated Mild N#C[C@@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@H](CO)N1C(=O)NC1CCCCC1 ZINC000095896208 GI Annotated Mild N#C[C@@H]1[C@H](c2ccc(C3=CCCCC3)cc2)[C@H](CO)N1C(=O)NC1CCCCC1 ZINC000095896209 GI Annotated Mild N#C[C@@H]1[C@H](c2ccc(C3=CCCCC3)cc2)[C@@H](CO)N1C(=O)NC1CCCCC1 ZINC000095896210 GI Annotated Mild N#C[C@H]1[C@H](c2ccc(C3=CCCCC3)cc2)[C@@H](CO)N1C(=O)NC1CCCCC1 ZINC000095896211 GI Annotated Mild N#C[C@H]1[C@H](c2ccc(C3=CCCCC3)cc2)[C@H](CO)N1C(=O)NC1CCCCC1 ZINC000095896212 GI Annotated Mild N#C[C@@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@@H](CO)N1C(=O)NC1CCCCC1 ZINC000095896213 GI Annotated Mild N#C[C@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@@H](CO)N1C(=O)NC1CCCCC1 ZINC000095896214 GI Annotated Mild CCc1csc(N2[C@@H](C#N)[C@H](c3ccc(-c4ccc(F)cc4)cc3)[C@@H]2CO)n1 ZINC000095897503 GI Annotated Mild CCc1csc(N2[C@H](CO)[C@@H](c3ccc(-c4ccc(F)cc4)cc3)[C@@H]2C#N)n1 ZINC000095897504 GI Annotated Mild CCc1csc(N2[C@H](C#N)[C@H](c3ccc(-c4ccc(F)cc4)cc3)[C@H]2CO)n1 ZINC000095897505 GI Annotated Mild CCc1csc(N2[C@H](C#N)[C@@H](c3ccc(-c4ccc(F)cc4)cc3)[C@@H]2CO)n1 ZINC000095897506 GI Annotated Mild CCc1csc(N2[C@H](C#N)[C@H](c3ccc(-c4ccc(F)cc4)cc3)[C@@H]2CO)n1 ZINC000095897507 GI Annotated Mild CCc1csc(N2[C@@H](C#N)[C@@H](c3ccc(-c4ccc(F)cc4)cc3)[C@@H]2CO)n1 ZINC000095897508 GI Annotated Mild CCc1csc(N2[C@H](C#N)[C@@H](c3ccc(-c4ccc(F)cc4)cc3)[C@H]2CO)n1 ZINC000095897509 GI Annotated Mild CCc1csc(N2[C@H](CO)[C@H](c3ccc(-c4ccc(F)cc4)cc3)[C@@H]2C#N)n1 ZINC000095897510 GI Annotated Mild N#C[C@@H]1[C@H](c2ccc(C3=CCCC3)cc2)[C@H](CO)N1C(=O)Nc1ccccc1F ZINC000095897856 GI Annotated Mild N#C[C@H]1[C@@H](c2ccc(C3=CCCC3)cc2)[C@@H](CO)N1C(=O)Nc1ccccc1F ZINC000095897857 GI Annotated Mild CCc1csc(N2[C@H](C#N)[C@H](c3ccc(-c4cccc(F)c4)cc3)[C@H]2CO)n1 ZINC000095898012 GI Annotated Mild CCc1csc(N2[C@H](C#N)[C@H](c3ccc(-c4cccc(F)c4)cc3)[C@@H]2CO)n1 ZINC000095898013 GI Annotated Mild CCc1csc(N2[C@@H](C#N)[C@@H](c3ccc(-c4cccc(F)c4)cc3)[C@@H]2CO)n1 ZINC000095898014 GI Annotated Mild CCc1csc(N2[C@H](CO)[C@@H](c3ccc(-c4cccc(F)c4)cc3)[C@@H]2C#N)n1 ZINC000095898015 GI Annotated Mild CCc1csc(N2[C@H](C#N)[C@@H](c3ccc(-c4cccc(F)c4)cc3)[C@@H]2CO)n1 ZINC000095898016 GI Annotated Mild CCc1csc(N2[C@@H](C#N)[C@H](c3ccc(-c4cccc(F)c4)cc3)[C@@H]2CO)n1 ZINC000095898017 GI Annotated Mild CCc1csc(N2[C@H](C#N)[C@@H](c3ccc(-c4cccc(F)c4)cc3)[C@H]2CO)n1 ZINC000095898018 GI Annotated Mild CCc1csc(N2[C@H](CO)[C@H](c3ccc(-c4cccc(F)c4)cc3)[C@@H]2C#N)n1 ZINC000095898019 GI Annotated Mild CCc1cnc(N2[C@@H](C#N)[C@H](c3ccc(-c4cccc(F)c4)cc3)[C@@H]2CO)s1 ZINC000095898033 GI Annotated Mild CCc1cnc(N2[C@H](C#N)[C@@H](c3ccc(-c4cccc(F)c4)cc3)[C@@H]2CO)s1 ZINC000095898034 GI Annotated Mild CCc1cnc(N2[C@H](C#N)[C@H](c3ccc(-c4cccc(F)c4)cc3)[C@@H]2CO)s1 ZINC000095898035 GI Annotated Mild CCc1cnc(N2[C@H](CO)[C@@H](c3ccc(-c4cccc(F)c4)cc3)[C@@H]2C#N)s1 ZINC000095898036 GI Annotated Mild CCc1cnc(N2[C@H](C#N)[C@H](c3ccc(-c4cccc(F)c4)cc3)[C@H]2CO)s1 ZINC000095898037 GI Annotated Mild CCc1cnc(N2[C@@H](C#N)[C@@H](c3ccc(-c4cccc(F)c4)cc3)[C@@H]2CO)s1 ZINC000095898038 GI Annotated Mild CCc1cnc(N2[C@H](C#N)[C@@H](c3ccc(-c4cccc(F)c4)cc3)[C@H]2CO)s1 ZINC000095898039 GI Annotated Mild N#C[C@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095898279 GI Annotated Mild N#C[C@@H]1[C@H](c2ccc(C3=CCCCC3)cc2)[C@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095898280 GI Annotated Mild N#C[C@H]1[C@H](c2ccc(C3=CCCCC3)cc2)[C@@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095898281 GI Annotated Mild N#C[C@@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095898282 GI Annotated Mild N#C[C@@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095898283 GI Annotated Mild N#C[C@H]1[C@@H](c2ccc(C3=CCCCC3)cc2)[C@@H](CO)N1C(=O)c1cccc(F)c1 ZINC000095898284 GI Annotated Mild C/C=C(/C)C(=O)O[C@@H]1C[C@H](C)[C@H](O)C[C@H]1[C@@H](C)C[C@@H](C=C(C)C)OC(C)=O ZINC000095909194 GI Annotated Anodyne in-vitro biogenic COC(=O)/C=C(\C)CC[C@@]1(C)[C@H](C)[C@H](OC(C)=O)C[C@@]2(C)C(C)=C(C=O)C[C@@H]21 ZINC000095909213 GI Annotated Reactive in-vitro biogenic COC(=O)/C=C(\C)CC[C@@]1(C)[C@H](C)[C@H](OC(C)=O)C[C@@]2(C)C(C)=CC(=O)C[C@@H]21 ZINC000095909214 GI Annotated Mild in-vitro biogenic CCCCCCCCCCCCCC[C@@H](O)[C@@]1(O)C(=O)C=C[C@@H]1OC(C)=O ZINC000095909277 GI Annotated Mild in-vitro biogenic C=C1C(=O)O[C@@H]2[C@H]1CC[C@](C)(O)[C@@]1(/C=C\C)C[C@@]3(C[C@H]21)C(=O)C[C@@]1(C(C)C)C[C@@H]31 ZINC000095909665 GI Annotated Mild in-vitro biogenic C=C1COC(=O)[C@@]12C[C@]1(C)[C@@H]([C@@H](OC(C)=O)CC[C@H]1C)[C@@H]2CC(=O)CC(C)C ZINC000095909720 GI Annotated Mild in-vitro biogenic CC(C)=CCc1c2c(c(O)c3cc(C(C)(C)O)oc13)C(=O)[C@@H]1C=CC=C(O)[C@@H]1N2 ZINC000095909931 GI Annotated Anodyne in-vitro biogenic COC(=O)/C=C(\C)CC[C@@]1(C)[C@H](C)[C@H](OC(C)=O)C[C@@]2(C)C(C)=C[C@@H](O)C[C@@H]21 ZINC000095911944 GI Annotated Anodyne in-vitro biogenic C=C1[C@H](O)CC[C@H]2[C@@]1(C)C[C@@H](OC(C)=O)[C@@H](C)[C@]2(C)CC/C(C)=C/C(=O)OC ZINC000095911946 GI Annotated Mild in-vitro biogenic COC(=O)[C@@]1(C)CCC[C@@]2(C)[C@@H]1CC[C@]13C=C(C(C)(C)OO)[C@H](C[C@H]21)OO3 ZINC000095913662 GI Annotated Reactive in-vitro biogenic CC1(C)C(=O)CC[C@]2(C)[C@@H]1CC[C@](C)(O)[C@H]2OCc1ccc2ccc(=O)oc2c1 ZINC000095913878 GI Annotated Anodyne in-vitro biogenic CCC/C=C1/OC(=O)C2=C1CC[C@H]1[C@H]2[C@@]23C=CCC[C@@H]2[C@]1(C(=O)CCC)OC3=O ZINC000095918969 GI Annotated Anodyne in-vitro biogenic COc1ccc(C(=O)O[C@@H]2C[C@H]3[C@H](C=C2C)C(C)(C)CCC[C@]3(C)O)cc1O ZINC000095919431 GI Annotated Anodyne in-vitro biogenic CC1=C2C=CNC(=O)[C@@H]2C(C)=C2C1=Nc1ccc(OC(=O)c3ccccc3)cc12 ZINC000095921055 GI Annotated Anodyne CC1=C2C=CNC(=O)[C@H]2C(C)=C2C1=Nc1ccc(OC(=O)c3ccccc3)cc12 ZINC000095921056 GI Annotated Anodyne CN1CC/C=C/CCCCCCC(=O)Cc2c(Cl)c(O)cc(O)c2C1=O ZINC000095921284 GI Annotated Anodyne CN(C)c1cccc(/C=C2\C[C@@]3(OC(=O)c4cccc(F)c4)CCCN2C3)c1 ZINC000096018830 GI Annotated Anodyne CN(C)c1cccc(/C=C2\C[C@@]3(OC(=O)c4ccc(F)cc4)CCCN2C3)c1 ZINC000096018832 GI Annotated Anodyne COc1ccccc1CN1Cc2ccccc2Oc2ccccc2S1(=O)=O ZINC000096021185 GI Annotated Anodyne CSc1ccc(S[C@H]2CN(Cc3ccc(C)cc3)S(=O)(=O)C2)cc1 ZINC000096021207 GI Annotated Anodyne CSc1ccc(S[C@@H]2CN(Cc3ccc(C)cc3)S(=O)(=O)C2)cc1 ZINC000096021208 GI Annotated Anodyne C=C1[C@H](OC(=O)/C=C(/C)CC)C[C@@H](C(C)C)[C@@H]2[C@@H]([C@@H](C)OC(C)=O)C(=O)C[C@@H]12 ZINC000096054714 GI Annotated Mild C[C@@]12C=CC(=O)[C@H]1C1=C(CC2)[C@]2(CCl)C(=CC1=O)C=C[C@H](Cl)[C@H]2Cl ZINC000096085376 GI Annotated Anodyne in-vitro CCN(CC)C(=O)[C@H](Oc1ccccc1-n1cccc1)c1ccc(OC)cc1 ZINC000096168031 GI Annotated Anodyne CCN(CC)C(=O)[C@@H](Oc1ccccc1-n1cccc1)c1ccc(OC)cc1 ZINC000096168032 GI Annotated Anodyne CC(C)Oc1nc(-c2cccnc2)nc2c1CN(c1nc3ccccc3o1)CC2 ZINC000096168392 GI Annotated Anodyne COc1ccc([C@H](Cc2cccc(Br)c2)c2cn(C)c(N)n2)cc1 ZINC000096168395 GI Annotated Anodyne COc1ccc([C@@H](Cc2cccc(Br)c2)c2cn(C)c(N)n2)cc1 ZINC000096168396 GI Annotated Anodyne CC(C)CCO[C@H]1C[C@@H]2CN(c3ccc(OCC(F)(F)F)cc3)C(=O)N2C1 ZINC000096168555 GI Annotated Anodyne CC(C)CCO[C@@H]1C[C@@H]2CN(c3ccc(OCC(F)(F)F)cc3)C(=O)N2C1 ZINC000096168558 GI Annotated Anodyne CCOc1ccccc1-c1cccn2nc(Nc3ccc4c(c3)CCNCC4)nc12 ZINC000096169751 GI Annotated Anodyne COc1cc(C(F)(F)F)cc(C)c1C(=O)C[C@@H]1COCC[C@H]1N1CCCC1 ZINC000096170651 GI Annotated Anodyne CCc1cc(C(F)(F)F)cc(OC)c1C(=O)C[C@@H]1COCC[C@H]1N1CCCC1 ZINC000096170653 GI Annotated Anodyne COc1cc(C(F)(F)F)cc(C)c1C(=O)C[C@H]1COCC[C@@H]1N1CCCC1 ZINC000096170677 GI Annotated Anodyne CCc1cc(C(F)(F)F)cc(OC)c1C(=O)C[C@H]1COCC[C@@H]1N1CCCC1 ZINC000096172020 GI Annotated Anodyne C/C=C/COc1ccc(C(=O)Cc2cccc([C@]3(C)CCSC(N)=N3)c2)nc1 ZINC000096172032 GI Annotated Anodyne CC(=O)C[C@@H](C)c1ccc(OC2CN(c3cnc(CC4CCC4)nc3)C2)cc1 ZINC000096172849 GI Annotated Anodyne CC(=O)C[C@@H](C)c1ccc(OC2CN(c3ccc4c(c3)OCCCO4)C2)cc1 ZINC000096172850 GI Annotated Clean CC(=O)C[C@@H](C)c1ccc(OC2CN(c3ccc4c(c3)OC(F)(F)O4)C2)cc1 ZINC000096172858 GI Annotated Clean CCCOc1ccc(N2CC(Oc3ccc([C@H](C)CC(=O)N(C)C)cc3)C2)cc1 ZINC000096172863 GI Annotated Clean C[C@H](CC(=O)N(C)C)c1ccc(OC2CN(c3ccc(OC4CC4)cc3)C2)cc1 ZINC000096172864 GI Annotated Clean C[C@H](CC(=O)C1CC1)c1ccc(OC2CN(c3ccc4c(c3)OCCO4)C2)cc1 ZINC000096172874 GI Annotated Clean CCCOc1cccc(N2CC(Oc3ccc([C@H](C)CC(=O)N(C)C)cc3)C2)c1 ZINC000096172875 GI Annotated Anodyne CC(=O)C[C@@H](C)c1ccc(OC2CN(c3cc4c(cc3F)OCCCO4)C2)cc1 ZINC000096172886 GI Annotated Clean CCCOc1ccc(N2CC(Oc3ccc([C@H](C)CC(C)=O)cc3)C2)c(C#N)n1 ZINC000096172893 GI Annotated Mild C[C@H](CC(=O)C1CC1)c1ccc(OC2CN(c3ncc(C4CC4)cn3)C2)cc1 ZINC000096172915 GI Annotated Anodyne CC(=O)C[C@@H](C)c1ccc(OC2CN(c3ccc(Br)cn3)C2)cc1 ZINC000096172936 GI Annotated Anodyne CC(=O)C[C@@H](C)c1ccc(OC2CN(c3cc(Br)ccn3)C2)cc1 ZINC000096172937 GI Annotated Anodyne CC(=O)C[C@@H](C)c1ccc(OC2CN(c3cccc(C(F)(F)F)n3)C2)cc1 ZINC000096172940 GI Annotated Anodyne CC(=O)C[C@@H](C)c1ccc(OC2CN(c3ccnc(C(F)(F)F)c3)C2)cc1 ZINC000096172947 GI Annotated Anodyne CC(=O)C[C@@H](C)c1ccc(OC2CN(c3nc4ccccc4nc3C)C2)cc1 ZINC000096172956 GI Annotated Anodyne CCOc1ccc(N2CC(Oc3ccc([C@H](C)CC(=O)CC#N)cc3)C2)cc1 ZINC000096172979 GI Annotated Mild CCOc1ccc(N2CC(Oc3ccc([C@H](C)CC(=O)CCOC)cc3)C2)cc1 ZINC000096172997 GI Annotated Clean CCOc1ccc(N2CC(Oc3ccc([C@H](C)CC(=O)COC)cc3)C2)cc1 ZINC000096173019 GI Annotated Clean CC(=O)C[C@@H](C)c1ccc(OC2CN(c3ccc(OCC4CC4)cc3)C2)cn1 ZINC000096173038 GI Annotated Clean O=C1CCCC2(CCN(c3cnc4ccccc4n3)CC2)N1Cc1ccccc1 ZINC000096173172 GI Annotated Anodyne O=C(O)c1cc(C2CC2)ccc1Cc1cnc(-c2c(F)cc(O)cc2F)nc1 ZINC000096173333 GI Annotated Anodyne Cc1ccc(Cc2cnc(-c3cccc(C(=O)N(C)C)c3)c(C)c2)c(C(=O)O)c1 ZINC000096173359 GI Annotated Anodyne NC1(c2ccc(-c3nnc4n3-c3cccnc3Nc3ccccc3-4)cc2)CCC1 ZINC000096174059 GI Annotated Anodyne c1ccc2c(c1)Nc1ncccc1-n1c(-c3ccc([C@@H]4CCCN4)cc3)nnc1-2 ZINC000096174130 GI Annotated Anodyne c1ccc2c(c1)Nc1ncccc1-n1c(-c3ccc([C@H]4CCCN4)cc3)nnc1-2 ZINC000096174131 GI Annotated Anodyne NC1(c2ccc(-c3nnc4n3-c3cnccc3Nc3ccccc3-4)cc2)CCC1 ZINC000096174155 GI Annotated Anodyne CCN(C)Cc1ccc2c(c1)C[C@H](N(C)C(=O)c1ccc(OCC3CC3)cc1)C2 ZINC000096174221 GI Annotated Anodyne C[C@]1(c2cc(Br)cc(CC(=O)c3ccco3)c2)CCSC(N)=N1 ZINC000096174335 GI Annotated Anodyne C[C@@]1(c2cc(Br)cc(CC(=O)c3ccco3)c2)CCSC(N)=N1 ZINC000096174336 GI Annotated Anodyne C[C@]1(c2cccc(CC(=O)c3nc4ccccc4s3)c2)CCSC(N)=N1 ZINC000096174349 GI Annotated Anodyne C[C@@]1(c2cccc(CC(=O)c3nc4ccccc4s3)c2)CCSC(N)=N1 ZINC000096174350 GI Annotated Anodyne CCc1ccc(-c2ccc(CNCCP(=O)(O)O)nc2-c2ccccc2)cc1 ZINC000096174494 GI Annotated Anodyne CN1CCN(C2=NC(=O)/C(=C/c3cc(C(C)(C)C)cc(C(C)(C)C)c3)S2)CC1 ZINC000096174737 GI Annotated Clean CC(C)CCN(CCCN)c1cccc2ccc(-c3nnc4ccccn34)nc12 ZINC000096174952 GI Annotated Anodyne CCC[C@H](Oc1cccc2ccc(-c3nnc4ccccn34)nc12)[C@@H](CC)CN ZINC000096174985 GI Annotated Anodyne CCC[C@@H](Oc1cccc2ccc(-c3nnc4ccccn34)nc12)[C@@H](CC)CN ZINC000096174986 GI Annotated Anodyne CCC[C@H](Oc1cccc2ccc(-c3nnc4ccccn34)nc12)[C@H](CC)CN ZINC000096174987 GI Annotated Anodyne CCC[C@@H](Oc1cccc2ccc(-c3nnc4ccccn34)nc12)[C@H](CC)CN ZINC000096174988 GI Annotated Anodyne CC(=O)[C@H]1CCC[C@H](Oc2cccc3ccc(-c4nnc5ccccn45)nc23)C1 ZINC000096175010 GI Annotated Anodyne CC(=O)[C@H]1CCC[C@@H](Oc2cccc3ccc(-c4nnc5ccccn45)nc23)C1 ZINC000096175011 GI Annotated Anodyne CC(C)(CN)COc1cccc2ccc(-c3nnc4ccc(C5CC5)cn34)nc12 ZINC000096175031 GI Annotated Anodyne OC1(COc2cccc3ccc(-c4nnc5ccccn45)nc23)CCCCCC1 ZINC000096175109 GI Annotated Anodyne CCC(CC)(CO)COc1cccc2ccc(-c3nnc4ccccn34)nc12 ZINC000096175122 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4)cc(Cl)c31)[C@H]1CC[C@@H](C2)N1 ZINC000096175202 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccccc4)cc(Cl)c31)[C@@H]1CC[C@H](C2)N1 ZINC000096175203 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc5occc5c4)ccc31)[C@@H]1CC[C@H](C2)N1 ZINC000096175256 GI Annotated Anodyne Cn1c2c(c3cc(S(=O)(=O)c4ccc5occc5c4)ccc31)[C@H]1CC[C@@H](C2)N1 ZINC000096175257 GI Annotated Anodyne CCN(CC)C(=O)c1ccc(-c2ccccc2C(F)(F)F)cc1OC1CNC1 ZINC000096175904 GI Annotated Anodyne CC(C)Oc1nccc2c1C(c1cc(C(=O)N3CCCCC3)n(C(C)C)c1)=NC2 ZINC000096175977 GI Annotated Anodyne Fc1ccccc1-c1cc(NCc2cccnc2)n2ncc(Br)c2n1 ZINC000096176121 GI Annotated Anodyne O=Cc1ccc(N2CCN(c3cc(-c4ccccn4)nc4ccccc34)CC2)cc1 ZINC000096269560 GI Annotated Anodyne O=C(O)C[C@@H]1COc2cc3c(cc21)OC[C@@H](c1cc(F)cc(C(F)(F)F)c1)O3 ZINC000096269837 GI Annotated Anodyne O=C(O)C[C@@H]1COc2cc3c(cc21)OC[C@H](c1cc(F)cc(C(F)(F)F)c1)O3 ZINC000096269838 GI Annotated Anodyne O=C(O)C[C@@H]1COc2cc3c(cc21)OC[C@H](c1cccc(C(F)(F)F)c1)O3 ZINC000096269843 GI Annotated Anodyne O=C(O)C[C@@H]1COc2cc3c(cc21)OC[C@@H](c1cccc(C(F)(F)F)c1)O3 ZINC000096269844 GI Annotated Anodyne O=C(O)C[C@@H]1COc2cc3c(cc21)OC[C@H](c1ccc(Cl)c(Cl)c1)O3 ZINC000096269845 GI Annotated Anodyne O=C(O)C[C@@H]1COc2cc3c(cc21)OC[C@@H](c1ccc(Cl)c(Cl)c1)O3 ZINC000096269846 GI Annotated Anodyne O=c1cc(O)n(CCC(c2ccccc2)c2ccccc2)c(=O)n1C1CCCC1 ZINC000096270104 GI Annotated Anodyne CN(C)C(=O)[C@H]1C[C@@H]1c1ccc(-c2[nH]cnc2Sc2ccc(Cl)cn2)cc1 ZINC000096270411 GI Annotated Anodyne COC(=N)c1nc2ccc3ncnc(Nc4ccc(F)cc4OC)c3c2s1 ZINC000096270444 GI Annotated Anodyne N#Cc1ccc(-c2cc3c(o2)C(=O)Nc2ccc(C4CCNCC4)cc2C3)cc1 ZINC000096270552 GI Annotated Mild O=C1NC2=C(CNC/C2=C\c2ccccc2Cl)[C@@H](c2ccccc2Cl)N1 ZINC000096270602 GI Annotated Anodyne O=C1NC2=C(CNC/C2=C\c2ccccc2Cl)[C@H](c2ccccc2Cl)N1 ZINC000096270603 GI Annotated Anodyne COc1ccccc1COc1ccccc1/C=C/C=C1\SC(=S)NC1=O ZINC000096272368 GI Annotated Clean O=C(O)CSc1nnc(-c2ccccc2Cl)n1-c1cccc(Cl)c1 ZINC000096273179 GI Annotated Anodyne CC(C)Oc1cc(Oc2ccc(S(C)(=O)=O)cc2)cc(-c2cccc(=O)[nH]2)c1 ZINC000096273774 GI Annotated Anodyne COc1ccc(-c2csc(NC(=O)c3c(C)cc(=O)oc3C)c2)cc1OC ZINC000096282749 GI Annotated Anodyne CCN1CC2=C(NC(=S)N[C@H]2c2ccc(F)cc2)/C(=C/c2ccc(F)cc2)C1 ZINC000096282924 GI Annotated Anodyne CCN1CC2=C(NC(=S)N[C@@H]2c2ccc(F)cc2)/C(=C/c2ccc(F)cc2)C1 ZINC000096282925 GI Annotated Anodyne CCN1CC2=C(NC(=S)N[C@H]2c2ccccc2F)/C(=C/c2ccccc2F)C1 ZINC000096282930 GI Annotated Anodyne CCN1CC2=C(NC(=S)N[C@@H]2c2ccccc2F)/C(=C/c2ccccc2F)C1 ZINC000096282931 GI Annotated Anodyne CCN1CC2=C(NC(=S)N[C@H]2c2ccccc2C)/C(=C/c2ccccc2C)C1 ZINC000096282934 GI Annotated Anodyne CCN1CC2=C(NC(=S)N[C@@H]2c2ccccc2C)/C(=C/c2ccccc2C)C1 ZINC000096282935 GI Annotated Anodyne C[C@@H]1c2ccccc2CCN1C(=O)c1csc(Nc2ccc3c(c2)OCO3)n1 ZINC000096283023 GI Annotated Anodyne C[C@H]1c2ccccc2CCN1C(=O)c1csc(Nc2ccc3c(c2)OCO3)n1 ZINC000096283024 GI Annotated Anodyne Cc1sc(Nc2cc3c(cc2F)OCO3)nc1C(=O)N1CCC[C@H](C)[C@@H]1C ZINC000096283032 GI Annotated Anodyne Cc1sc(Nc2cc3c(cc2F)OCO3)nc1C(=O)N1CCC[C@@H](C)[C@@H]1C ZINC000096283033 GI Annotated Anodyne Cc1sc(Nc2cc3c(cc2F)OCO3)nc1C(=O)N1CCC[C@H](C)[C@H]1C ZINC000096283034 GI Annotated Anodyne Cc1sc(Nc2cc3c(cc2F)OCO3)nc1C(=O)N1CCC[C@@H](C)[C@H]1C ZINC000096283035 GI Annotated Anodyne CC(C)(C(=O)Nc1nncs1)[C@H](c1ccccc1)c1ccc2[nH]ncc2c1 ZINC000096283989 GI Annotated Anodyne CC(C)(C(=O)Nc1nncs1)[C@@H](c1ccccc1)c1ccc2[nH]ncc2c1 ZINC000096283990 GI Annotated Anodyne c1ccc(Cn2ccnc2C2(c3ccccc3)CCN(c3ncccn3)CC2)cc1 ZINC000096310709 GI Annotated Anodyne CCNC(=O)N1CCC(c2ccccc2)(c2nccn2Cc2ccccc2)CC1 ZINC000096310714 GI Annotated Anodyne O=C(C1=C(O)C(=O)N(c2nccs2)[C@@H]1c1ccccc1Cl)c1ccco1 ZINC000096336092 GI Annotated Mild O=C(C1=C(O)C(=O)N(c2nccs2)[C@H]1c1ccccc1Cl)c1ccco1 ZINC000096336093 GI Annotated Mild O=C(C1=C(O)C(=O)N(c2nccs2)[C@@H]1c1ccc(Cl)cc1)c1ccco1 ZINC000096336094 GI Annotated Mild O=C(C1=C(O)C(=O)N(c2nccs2)[C@H]1c1ccc(Cl)cc1)c1ccco1 ZINC000096336095 GI Annotated Mild C=C1[C@@H](N(C)C)CC[C@]23C[C@]24CC[C@]2(C)[C@@H](C(C)=O)[C@H](O)C[C@@]2(C)[C@@H]4CC[C@H]13 ZINC000096888348 GI Annotated Mild C=C=CCOc1cc2c(c3c1C[C@@H]1[C@@H](C)CO[C@]1(C)O3)C[C@@H]1[C@@H](C)CO[C@]1(C)O2 ZINC000096900505 GI Annotated Anodyne CC[C@@H](C)[C@H]1O[C@@H](c2c(O)c(-c3ccccc3)cn(OC)c2=O)[C@H](C)C[C@@H]1C ZINC000096900883 GI Annotated Anodyne CCCOc1cc2c(c3c1C[C@@H]1[C@@H](C)CO[C@]1(C)O3)C[C@@H]1[C@@H](C)CO[C@]1(C)O2 ZINC000096900982 GI Annotated Anodyne CN(C)c1ccc(/N=N/c2ccccc2C(=O)OCC(=O)NC2CCCC2)cc1 ZINC000096901176 GI Annotated Clean O=C(Cn1c(O)c(/N=N\C(=O)c2ccncc2)c2ccccc21)Nc1ccccc1 ZINC000096901472 GI Annotated Clean O=C(Cn1c(O)c(/N=N/C(=O)c2ccncc2)c2ccccc21)Nc1ccccc1 ZINC000096901473 GI Annotated Clean CCN1CCN(CCOc2ccccc2)[C@H]2CCn3c(c(C)c4ccccc43)[C@@H]21 ZINC000096902340 GI Annotated Anodyne CN1CCN(c2nc(-c3ccccn3)nc3sc4c(c23)CCCCCC4)CC1 ZINC000096903266 GI Annotated Anodyne c1ccc(-c2nc(N3CCOCC3)c3c4c(sc3n2)CCCCCC4)nc1 ZINC000096903269 GI Annotated Anodyne CC1(C)C[C@H](n2cc(C3CCCCC3)nn2)C2=C(O1)C(=O)c1ccccc1C2=O ZINC000096904264 GI Annotated Mild CC1(C)C[C@@H](n2cc(C3CCCCC3)nn2)C2=C(O1)C(=O)c1ccccc1C2=O ZINC000096904265 GI Annotated Mild CCCCCc1cn([C@@H]2CC(C)(C)OC3=C2C(=O)c2ccccc2C3=O)nn1 ZINC000096904266 GI Annotated Mild CCCCCc1cn([C@H]2CC(C)(C)OC3=C2C(=O)c2ccccc2C3=O)nn1 ZINC000096904267 GI Annotated Mild CCCCCCc1cn([C@@H]2C3=C(OC2(C)C)C(=O)c2ccccc2C3=O)nn1 ZINC000096904276 GI Annotated Mild CCCCCCc1cn([C@H]2C3=C(OC2(C)C)C(=O)c2ccccc2C3=O)nn1 ZINC000096904277 GI Annotated Mild CC1(C)OC2=C(C(=O)c3ccccc3C2=O)[C@H]1n1cc(C2CCCCC2)nn1 ZINC000096904726 GI Annotated Mild CC1(C)OC2=C(C(=O)c3ccccc3C2=O)[C@@H]1n1cc(C2CCCCC2)nn1 ZINC000096904727 GI Annotated Mild Cc1ccc2c(c1)Sc1cc3ccccc3nc1N2CCCNS(C)(=O)=O ZINC000096905907 GI Annotated Anodyne CS(=O)(=O)NCCCCN1c2ccccc2Sc2cc3ccccc3nc21 ZINC000096905908 GI Annotated Anodyne CC1=C2[C@H]3OC(=O)[C@]4(CC(c5ccccc5Cl)=NO4)[C@@H]3CC[C@@]2(C)C=CC1=O ZINC000096906653 GI Annotated Mild CC1=C2[C@H]3OC(=O)[C@@]4(CC(c5ccccc5Cl)=NO4)[C@@H]3CC[C@@]2(C)C=CC1=O ZINC000096906654 GI Annotated Mild CCOc1ccc2c(C#N)c(-c3ccc(NS(=O)(=O)CC)cc3)n(CC)c2c1 ZINC000096907004 GI Annotated Mild CCn1c(-c2ccc(NS(=O)(=O)CC)cc2)c(C#N)c2ccc(COC)cc21 ZINC000096907011 GI Annotated Mild COc1ccc2c(c1)C=C(C(=O)/C=C/C1=Cc3ccc(OC)cc3OC1)CO2 ZINC000096907870 GI Annotated Mild COc1ccc2c(c1)C=C(C(=O)/C=C/C1=Cc3cccc(OC)c3OC1)CO2 ZINC000096907871 GI Annotated Mild O=C(CCCCl)Nc1ccc(SCC(=O)Nc2ccc(Cl)cn2)cc1 ZINC000096908530 GI Annotated Reactive CCc1cscc1C[C@H](NC1=NC(C)(C)Cc2cc(Cl)ccc21)C(=O)O ZINC000096908800 GI Annotated Anodyne CCc1cscc1C[C@@H](NC1=NC(C)(C)Cc2cc(Cl)ccc21)C(=O)O ZINC000096908801 GI Annotated Anodyne O=C(OCCCO[N+](=O)[O-])c1onc(-c2ccc(Cl)o2)c1-c1ccccc1 ZINC000096909037 GI Annotated Anodyne C[C@@]1(Cc2ccccc2)OC(=O)c2c1ccn(CCc1ccc(Cl)cc1)c2=O ZINC000096909529 GI Annotated Anodyne C[C@]1(Cc2ccccc2)OC(=O)c2c1ccn(CCc1ccc(Cl)cc1)c2=O ZINC000096909530 GI Annotated Anodyne O=C1OCc2c1cc1ccc3c(c1c2-c1ccc2c(c1)OC(F)(F)O2)OCO3 ZINC000096909753 GI Annotated Anodyne Nc1nc(-c2ccccc2)cc(-c2ccc([C@H]3NC(=O)c4ccccc4N3)cc2)n1 ZINC000096909906 GI Annotated Anodyne Nc1nc(-c2ccccc2)cc(-c2ccc([C@@H]3NC(=O)c4ccccc4N3)cc2)n1 ZINC000096909907 GI Annotated Anodyne C=CCn1c(-c2cccs2)nn(CN2CCN(c3ccccc3)CC2)c1=S ZINC000096910239 GI Annotated Mild O=c1cc(SCn2cnc3c(Cl)cccc3c2=O)sc2ccccc12 ZINC000096910571 GI Annotated Anodyne O=C1/C(=N/Nc2cccc([N+](=O)[O-])c2)C(O)=Nc2c1ccc(Cl)c2Cl ZINC000096910598 GI Annotated Mild O=C1/C(=N/Nc2cccc(Cl)c2Cl)C(O)=Nc2cc([N+](=O)[O-])ccc21 ZINC000096910603 GI Annotated Mild CC(=O)c1ccc(N/N=C2/C(=O)c3ccc(Cl)c(Cl)c3N=C2O)cc1 ZINC000096910644 GI Annotated Mild On1cc(C2CCNCC2)c(-c2cn(Cc3ccccc3)c(-c3ccccc3)n2)n1 ZINC000096910962 GI Annotated Anodyne CCC(=O)Nc1cc(CNc2c(C#N)c(C)nn2-c2ccccc2)cc(C)c1O ZINC000096913610 GI Annotated Mild CCC(=O)Nc1cc(CNc2c(C#N)cnn2-c2ccccc2)cc(Cl)c1O ZINC000096913619 GI Annotated Mild CCOc1cc(/C=C/c2cc(SC)nc(N)n2)ccc1O[C@@H]1CCCCO1 ZINC000096914138 GI Annotated Anodyne CCOc1cc(/C=C/c2cc(SC)nc(N)n2)ccc1O[C@H]1CCCCO1 ZINC000096914139 GI Annotated Anodyne O=C1OCC(OCCOC(=O)c2ccc(Cl)cc2Cl)=C1c1ccccc1 ZINC000096914288 GI Annotated Anodyne O=C1OCC(OCCOC(=O)c2ccc(Cl)c(Cl)c2)=C1c1ccccc1 ZINC000096914290 GI Annotated Anodyne O=C1OCC(OCCOC(=O)c2cccc(Cl)c2)=C1c1ccc(Cl)cc1 ZINC000096914305 GI Annotated Anodyne CCOC(=O)c1c(C(F)(F)F)c2cccnn2c1C(=O)c1ccc(Cl)cc1 ZINC000096914605 GI Annotated Anodyne CCOC(=O)c1c(C(F)(F)F)c2cccnn2c1C(=O)c1ccc(C)cc1 ZINC000096914606 GI Annotated Anodyne CC(=O)O[C@@H]1C/C(C)=C/CC[C@@H](C)CC(=O)CC2=C[C@@H](OC2=O)[C@@H]1C(C)C ZINC000096915199 GI Annotated Anodyne CC(=O)O[C@@H]1C/C(C)=C/CC[C@H](C)CC(=O)CC2=C[C@@H](OC2=O)[C@@H]1C(C)C ZINC000096915200 GI Annotated Anodyne CO[C@H]1C=C[C@H]2C/C=C\C[C@H](c3ccc(Br)cc3)OC(=O)C[C@@H]1O2 ZINC000096915233 GI Annotated Anodyne Cn1c(S(=O)(=O)Cc2ccncc2)nc(-c2ccccc2)c1-c1ccccc1 ZINC000096915285 GI Annotated Anodyne Cn1c(S(=O)(=O)Cc2cccnc2)nc(-c2ccccc2)c1-c1ccccc1 ZINC000096915286 GI Annotated Anodyne Nc1nc(-c2cccc([N+](=O)[O-])c2)nc2nc3c(Cl)ccc(Cl)c3nc12 ZINC000096916338 GI Annotated Bother O/N=C1\c2ccccc2O[C@@H](c2ccc(Cl)cc2Cl)[C@@H]1n1cncn1 ZINC000096916662 GI Annotated Mild CCCOC(=O)c1cccc(-c2ccc([C@@H]3COC4(C=CC(=O)C=C4)O3)cc2)c1 ZINC000096916698 GI Annotated Mild CCCOC(=O)c1cccc(-c2ccc([C@H]3COC4(C=CC(=O)C=C4)O3)cc2)c1 ZINC000096916700 GI Annotated Mild CCCOC(=O)c1ccc(-c2ccc([C@@H]3COC4(C=CC(=O)C=C4)O3)cc2)cc1 ZINC000096916702 GI Annotated Mild CCCOC(=O)c1ccc(-c2ccc([C@H]3COC4(C=CC(=O)C=C4)O3)cc2)cc1 ZINC000096916704 GI Annotated Mild S=C(N/N=C/c1ccc(Oc2ccc3c(c2)OCO3)cc1)NC1CCCCC1 ZINC000096922609 GI Annotated Mild O=C(/C=C/c1ccc2c(c1)Cc1sc(Nc3ccc(F)cc3F)nc1-2)NO ZINC000096923422 GI Annotated Bother CC(=O)O[C@@H]1C[C@@H](C)[C@]2(CC[C@]3(COC(=O)C3)O2)[C@@]2(C)CCCC(C)(C)[C@H]12 ZINC000096923692 GI Annotated Anodyne C=CCn1c(SC/C(=N/O)c2ccccc2)nnc1-c1ccc(OC)cc1 ZINC000096924048 GI Annotated Mild Cc1coc2c3c(ccc2c1=O)OC[C@H]1[C@@H]3N(Cc2ccccc2)OC1(C)C ZINC000096924228 GI Annotated Anodyne CC(C)(C)c1cc(N2CCC(O)=NC2=O)cc(C(=O)Nc2ccccc2)c1O ZINC000096926926 GI Annotated Anodyne O=[N+]([O-])c1ccc(O)c(CNc2ccc(/C=C/c3cc(O)cc(O)c3)cc2)c1 ZINC000096926962 GI Annotated Clean CC(C)=C[C@H]1C[C@H](C)[C@]2(CC[C@]3(C)C[C@@H]4C(C)=CC(=O)[C@]4(O)C(C=O)=CC[C@@H]23)O1 ZINC000096927592 GI Annotated Reactive CC1=CC2=C[C@H](C)C[C@@]23O[C@]2(CC(C)(C)C[C@@H]2[C@@]1(O)C(F)(F)F)[C@@H](C)C3=O ZINC000096928255 GI Annotated Anodyne O=c1c2c3c(sc2nc(/C=C/c2ccccc2)n1-c1conc1O)CCCC3 ZINC000096928943 GI Annotated Anodyne COc1cccc(COC(=O)c2c(-c3ccc(OC)c(OC)c3)csc2N)c1 ZINC000096929335 GI Annotated Anodyne COc1cc(-n2c(-c3cccc4cc[nH]c34)cccc2=O)cc(OC)c1OC ZINC000096929957 GI Annotated Anodyne N#CC(C(=O)c1ccco1)=P(c1ccccc1)(c1ccccc1)c1ccccc1 ZINC000096929996 GI Annotated Unstable CC(C)(C)C(=O)C(C#N)=P(c1ccccc1)(c1ccccc1)c1ccccc1 ZINC000096929997 GI Annotated Unstable CCc1n(Cc2cc3ccccc3o2)cc[n+]1CC(=O)c1ccc(OC)cc1 ZINC000096930233 GI Annotated Mild O=C(C[n+]1ccn(Cc2cc3ccccc3o2)c1)c1ccc(Br)cc1 ZINC000096930242 GI Annotated Mild O=C(C[n+]1cn(Cc2cc3ccccc3o2)c2ccccc21)c1ccc(O)cc1 ZINC000096930249 GI Annotated Mild CCOC(=O)c1c(-c2ccc(OC)cc2)cc(-c2ccc[nH]2)c([N+](=O)[O-])c1N ZINC000096931784 GI Annotated Bother CCOC(=O)c1c(-c2ccc(OC)cc2)cc(-c2ccco2)c([N+](=O)[O-])c1N ZINC000096931788 GI Annotated Bother CCN(CC)CCNc1nc2c(-c3ccc(OC)cc3)cnn2c2ccccc12 ZINC000096933163 GI Annotated Anodyne COc1ccc(-c2cnn3c2nc(NCCCc2ncc[nH]2)c2ccccc23)cc1 ZINC000096933166 GI Annotated Anodyne COc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2cc(C(F)F)nn12 ZINC000096933205 GI Annotated Anodyne CO[C@@H]1C[C@H](O)C(O)=C(C/C=C(\C)CC/C=C(\C)CCC[C@H](C)C(=O)O)C1=O ZINC000096933280 GI Annotated Mild CO[C@@H]1C[C@H](O)C(O)=C(C/C=C(\C)CC/C=C(\C)CCC[C@@H](C)C(=O)O)C1=O ZINC000096933281 GI Annotated Mild CO[C@@H]1C[C@H](O)C(O)=C(C/C=C(\C)CC/C=C(\C)CC/C=C(\C)C(=O)O)C1=O ZINC000096933282 GI Annotated Mild COc1ccc(O)c(C/C=C(\C)CC/C=C(\C)CC[C@@H](O)C(C)(C)O)c1O ZINC000096933295 GI Annotated Anodyne COc1ccc(C(=O)Nc2c(Cl)cncc2Cl)c2cc(C3CC3)nn12 ZINC000096933393 GI Annotated Anodyne O=c1[nH]nc2n1-c1ccc(OCc3c(Cl)cccc3Cl)cc1SC2 ZINC000096933885 GI Annotated Anodyne C[C@]12C=C3C(=O)C[C@H](c4ccccc4)C[C@@]3(OO1)O[C@@H]2c1ccc([N+](=O)[O-])cc1 ZINC000096933989 GI Annotated Reactive C[C@]12C=C3C(=O)C[C@@H](c4ccccc4)C[C@@]3(OO1)O[C@@H]2c1ccc([N+](=O)[O-])cc1 ZINC000096933990 GI Annotated Reactive C[C@]12C=C3C(=O)C[C@H](c4ccccc4)C[C@@]3(OO1)O[C@H]2c1ccc([N+](=O)[O-])cc1 ZINC000096933991 GI Annotated Reactive C[C@]12C=C3C(=O)C[C@@H](c4ccccc4)C[C@@]3(OO1)O[C@H]2c1ccc([N+](=O)[O-])cc1 ZINC000096933992 GI Annotated Reactive COc1ccc([C@H]2O[C@]34C[C@@H](c5ccccc5)CC(=O)C3=C[C@@]2(C)OO4)cc1 ZINC000096933993 GI Annotated Reactive COc1ccc([C@H]2O[C@]34C[C@H](c5ccccc5)CC(=O)C3=C[C@@]2(C)OO4)cc1 ZINC000096933994 GI Annotated Reactive COc1ccc([C@@H]2O[C@]34C[C@@H](c5ccccc5)CC(=O)C3=C[C@@]2(C)OO4)cc1 ZINC000096933995 GI Annotated Reactive COc1ccc([C@@H]2O[C@]34C[C@H](c5ccccc5)CC(=O)C3=C[C@@]2(C)OO4)cc1 ZINC000096933996 GI Annotated Reactive O=C(/C=C1\NC[C@H]2c3ccccc3CCN2C1=O)c1ccc(-c2ccccc2)cc1 ZINC000096934343 GI Annotated Mild O=C(/C=C1\NC[C@@H]2c3ccccc3CCN2C1=O)c1ccc(-c2ccccc2)cc1 ZINC000096934344 GI Annotated Mild CO[C@]12C(=O)c3ccccc3C(=O)[C@H]1C(C1CC1)=C2c1ccc(O)c2ncccc12 ZINC000096934548 GI Annotated Clean CO[C@@]12C(=O)c3ccccc3C(=O)[C@H]1C(C1CC1)=C2c1ccc(O)c2ncccc12 ZINC000096934549 GI Annotated Clean CO[C@@]12C(=O)c3ccccc3C(=O)[C@@H]1C(C1CC1)=C2c1ccc(O)c2ncccc12 ZINC000096934550 GI Annotated Clean CO[C@]12C(=O)c3ccccc3C(=O)[C@H]1C(C1CC1)=C2c1cnc2ccccc2c1 ZINC000096934683 GI Annotated Clean CO[C@@]12C(=O)c3ccccc3C(=O)[C@H]1C(C1CC1)=C2c1cnc2ccccc2c1 ZINC000096934684 GI Annotated Clean CO[C@@]12C(=O)c3ccccc3C(=O)[C@@H]1C(C1CC1)=C2c1cnc2ccccc2c1 ZINC000096934685 GI Annotated Clean CO[C@]12C(=O)c3ccccc3C(=O)[C@H]1C(C1CC1)=C2c1cncc2ccccc12 ZINC000096934686 GI Annotated Clean CO[C@@]12C(=O)c3ccccc3C(=O)[C@H]1C(C1CC1)=C2c1cncc2ccccc12 ZINC000096934687 GI Annotated Clean CO[C@@]12C(=O)c3ccccc3C(=O)[C@@H]1C(C1CC1)=C2c1cncc2ccccc12 ZINC000096934688 GI Annotated Clean COc1ccc(-c2cc3c(c(/C=C/N(C)C)n2)C(=O)c2ccccc2C3=O)cc1 ZINC000096934760 GI Annotated Clean Brc1ccc(COc2ccc([C@H](Nn3cnnc3)C3CC3)cc2)cc1 ZINC000096938144 GI Annotated Anodyne Brc1ccc(COc2ccc([C@@H](Nn3cnnc3)C3CC3)cc2)cc1 ZINC000096938145 GI Annotated Anodyne O=C1C=CN(C(=O)Oc2ccccc2)[C@H](c2cccc(-c3ccccc3)c2)[C@H]1O ZINC000096938198 GI Annotated Mild CCCNC(=O)/C(=C\Nc1ccc(OCC)cc1)C(=O)c1ccc(Cl)cc1 ZINC000096938324 GI Annotated Mild COc1ccc(-c2c3ncn(C)c3cc3cc(OC)c(OC)c(OC)c23)cc1 ZINC000096938726 GI Annotated Anodyne COc1ccc(-c2c3cc(OC)c(OC)c(OC)c3cc3c2nc(N)n3C)cc1 ZINC000096938729 GI Annotated Anodyne COc1ccc(-c2c3cc(OC)c(OC)c(OC)c3cc3c2ncn3C)cc1 ZINC000096938730 GI Annotated Anodyne O=C(Nc1ccc(F)c(CF)n1)c1cc(Cl)cc(Oc2cncnc2)c1 ZINC000096939144 GI Annotated Anodyne Cc1cc(=O)oc2c(-c3nn(-c4ccc(Cl)cc4)cc3C=O)c(O)ccc12 ZINC000096939312 GI Annotated Anodyne O[C@H](COc1ccc2c(c1)[nH]c1ccc(F)cc12)CN1CCOc2ccccc21 ZINC000096939747 GI Annotated Anodyne O[C@@H](COc1ccc2c(c1)[nH]c1ccc(F)cc12)CN1CCOc2ccccc21 ZINC000096939751 GI Annotated Anodyne COc1ccc(CSc2nc(O)c(C)c(C(=O)c3ccccc3F)n2)cc1 ZINC000096939924 GI Annotated Anodyne COc1ccc(CSc2nc(O)c(C)c(C(=O)c3ccc(F)cc3)n2)cc1 ZINC000096939928 GI Annotated Anodyne COc1ccc(S(=O)(=O)n2ccc3ccnc(-c4ccc(F)cc4)c32)cc1 ZINC000096940437 GI Annotated Anodyne Cc1ccc(C)c(N2CCN(C(=O)c3oc(C)nc3-c3ccccc3F)CC2)c1 ZINC000098067403 GI Annotated Anodyne CCn1cc(C(=O)N/N=C\C=C(/C)CCC=C(C)C)c(=O)c2ccc(C)nc21 ZINC000098081955 GI Annotated Reactive COc1ccc(Nc2nc3sc4cc(Cl)ccc4n3c(=N)c2C#N)cc1 ZINC000098081996 GI Annotated Mild O=C(c1n[nH]c(=S)o1)n1c(=O)c2ccccc2c2c3cc(Cl)ccc3[nH]c21 ZINC000098082245 GI Annotated Bother O=C1N/C(=N\c2nc3ccccc3s2)S/C1=C\c1ccc([N+](=O)[O-])s1 ZINC000098082400 GI Annotated Mild O=C1C(SCc2ccc(Cl)cc2)=C(N2CCOCC2)C(=O)c2ccccc21 ZINC000098082670 GI Annotated Mild Cc1cc(C2(c3cc(C)c(N)c(C)c3)C(=O)c3ccccc3C2=O)cc(C)c1N ZINC000098082694 GI Annotated Clean COc1cccc2cc(-c3ccc(C(=O)c4cc(C)ccc4O)cn3)c(=O)oc12 ZINC000098083601 GI Annotated Anodyne O=C1CS[C@H](c2ccccn2)N1c1nnc2c3cc(Cl)ccc3nc-2s1 ZINC000098083907 GI Annotated Anodyne O=C1CS[C@@H](c2ccccn2)N1c1nnc2c3cc(Cl)ccc3nc-2s1 ZINC000098083908 GI Annotated Anodyne Cc1cccc(N(C)C[C@@H]2CCC/C(=C\c3ccc(S(C)(=O)=O)cc3)C2=O)c1 ZINC000098084187 GI Annotated Mild Cc1cccc(N(C)C[C@H]2CCC/C(=C\c3ccc(S(C)(=O)=O)cc3)C2=O)c1 ZINC000098084188 GI Annotated Mild CCn1c[n+](Cc2ccc(C[n+]3cn(CC)c4ccccc43)cc2)c2ccccc21 ZINC000098084263 GI Annotated Anodyne CCOn1c(Sc2cc(Cl)cc(Cl)c2)c(CC)c(=O)[nH]c1=S ZINC000098084581 GI Annotated Anodyne Cc1ccc(N2C(c3ccccc3)=C(c3ccccc3)[C@H]3C(NN)=NC=N[C@@H]32)cc1 ZINC000098084645 GI Annotated Anodyne Cc1ccc(N2C(c3ccccc3)=C(c3ccccc3)[C@H]3C(NN)=NC=N[C@H]32)cc1 ZINC000098084646 GI Annotated Anodyne Cc1ccc(N2C(c3ccccc3)=C(c3ccccc3)[C@@H]3C(NN)=NC=N[C@@H]32)cc1 ZINC000098084647 GI Annotated Anodyne Cc1ccc(N2C(c3ccccc3)=C(c3ccccc3)[C@@H]3C(NN)=NC=N[C@H]32)cc1 ZINC000098084648 GI Annotated Anodyne Cc1cc(C2(c3cc(C)c(N)cc3F)C(=O)c3ccccc3C2=O)c(F)cc1N ZINC000098084685 GI Annotated Clean O=C1N/C(=N\c2nc(-c3ccccc3)cs2)S/C1=C\c1ccc([N+](=O)[O-])o1 ZINC000098084962 GI Annotated Mild COc1ccc(C2=NOC3=c4ccccc4=CSC3=C2c2ccc(C)cc2)cc1 ZINC000098085298 GI Annotated Anodyne COc1ccc(C2=C3SC=c4ccccc4=C3ON=C2c2ccc(C)cc2)cc1 ZINC000098085300 GI Annotated Anodyne O=C(c1ccc(-c2cc3ccccc3oc2=O)nc1)c1cc(Cl)ccc1O ZINC000098085364 GI Annotated Anodyne Cc1ccc(N(C)C[C@@H]2CCC/C(=C\c3ccc(S(C)(=O)=O)cc3)C2=O)cc1 ZINC000098085400 GI Annotated Mild Cc1ccc(N(C)C[C@H]2CCC/C(=C\c3ccc(S(C)(=O)=O)cc3)C2=O)cc1 ZINC000098085401 GI Annotated Mild COc1ccc(N2C=C(c3ccccc3)[C@@H]3C(n4nc(C)cc4C)=NC=N[C@H]32)cc1 ZINC000098085505 GI Annotated Anodyne COc1ccc(N2C=C(c3ccccc3)[C@@H]3C(n4nc(C)cc4C)=NC=N[C@@H]32)cc1 ZINC000098085506 GI Annotated Anodyne COc1ccc(N2C=C(c3ccccc3)[C@H]3C(n4nc(C)cc4C)=NC=N[C@H]32)cc1 ZINC000098085507 GI Annotated Anodyne COc1ccc(N2C=C(c3ccccc3)[C@H]3C(n4nc(C)cc4C)=NC=N[C@@H]32)cc1 ZINC000098085508 GI Annotated Anodyne O=S(=O)(F)c1cccc(-c2nnc(-c3cc(Cl)c(O)c(Cl)c3)o2)c1 ZINC000098207872 GI Annotated Unstable C=CCc1cc(Cl)cc(CNCCCNC(=O)Nc2ccsc2)c1O ZINC000098208146 GI Annotated Mild