COC(=O)C1=C(C)NC(C)=C(C(=O)OCC(C)C)[C@H]1c1ccccc1[N+](=O)[O-] ZINC000000591993 16/39/04/212163904 VKQFCGNPDRICFG-SFHVURJKSA-N 0 388.42 GG 3.202 0 Bother ref GGBARN COC(=O)C1=C(C)NC(C)=C(C(=O)OCC(C)C)[C@H]1c1ccccc1[N+](=O)[O-] fda CC[C@@H](C)n1ncn(-c2ccc(N3CCN(c4ccc(O)cc4)CC3)cc2)c1=O ZINC000000644683 16/89/48/212168948 FFAQILVGBAELHN-QGZVFWFLSA-N 0 393.491 GG 3.037 0 Anodyne ref GGAARN CC[C@@H](C)n1ncn(-c2ccc(N3CCN(c4ccc(O)cc4)CC3)cc2)c1=O in-vitro CC[C@H](C)n1ncn(-c2ccc(N3CCN(c4ccc(O)cc4)CC3)cc2)c1=O ZINC000000644684 25/44/51/209254451 FFAQILVGBAELHN-KRWDZBQOSA-N 0 393.491 GG 3.037 0 Anodyne ref GGAARN CC[C@H](C)n1ncn(-c2ccc(N3CCN(c4ccc(O)cc4)CC3)cc2)c1=O in-vitro C#Cc1cccc(Nc2ncnc3cc(OCCOC)c(OCCOC)cc23)c1 ZINC000001546066 16/89/55/209168955 AAKJLRGGTJKAMG-UHFFFAOYSA-N 0 393.443 GG 3.405 0 Mild ref GGEARN C#Cc1cccc(Nc2ncnc3cc(OCCOC)c(OCCOC)cc23)c1 fda CCN(CC)CCNC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1C ZINC000003964325 49/70/79/206497079 WINHZLLDWRZWRT-ATVHPVEESA-N 1 398.482 GG 3.335 0 Anodyne ref GGAARO CC[NH+](CC)CCNC(=O)c1c(C)[nH]c(/C=C2\C(=O)Nc3ccc(F)cc32)c1C fda CCN(CC)CCNC(=O)c1c(C)[nH]c(/C=C2/C(=O)Nc3ccc(F)cc32)c1C ZINC000013673696 22/01/37/560220137 WINHZLLDWRZWRT-SFQUDFHCSA-N 1 398.482 GG 3.335 0 Anodyne ref GGAARO CC[NH+](CC)CCNC(=O)c1c(C)[nH]c(/C=C2/C(=O)Nc3ccc(F)cc32)c1C in-vitro O=C(O)COCCN1CCN([C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000019364229 11/82/23/207118223 ZKLPARSLTMPFCP-NRFANRHFSA-N 0 388.895 GG 3.148 2 Anodyne low GGAALN O=C([O-])COCCN1CC[NH+]([C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 fda O=C(O)COCCN1CCN([C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000019364229 11/82/21/207118221 ZKLPARSLTMPFCP-NRFANRHFSA-N 0 388.895 GG 3.148 1 Anodyne mid GGAAMN O=C([O-])COCC[NH+]1CCN([C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 fda O=C(O)COCCN1CCN([C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000019364229 11/82/17/207118217 ZKLPARSLTMPFCP-NRFANRHFSA-N -1 388.895 GG 3.148 0 Anodyne ref GGAARM O=C([O-])COCCN1CCN([C@@H](c2ccccc2)c2ccc(Cl)cc2)CC1 fda O=C(O)COCCN1CCN([C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000019364230 11/80/01/207118001 ZKLPARSLTMPFCP-OAQYLSRUSA-N 0 388.895 GG 3.148 2 Anodyne low GGAALN O=C([O-])COCCN1CC[NH+]([C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 fda O=C(O)COCCN1CCN([C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000019364230 11/80/00/207118000 ZKLPARSLTMPFCP-OAQYLSRUSA-N 0 388.895 GG 3.148 1 Anodyne mid GGAAMN O=C([O-])COCC[NH+]1CCN([C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 fda O=C(O)COCCN1CCN([C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 ZINC000019364230 11/79/96/207117996 ZKLPARSLTMPFCP-OAQYLSRUSA-N -1 388.895 GG 3.148 0 Anodyne ref GGAARM O=C([O-])COCCN1CCN([C@H](c2ccccc2)c2ccc(Cl)cc2)CC1 fda CCN1C[C@@H](CCN2CCOCC2)C(c2ccccc2)(c2ccccc2)C1=O ZINC000019632668 27/79/85/210277985 XFDJYSQDBULQSI-JOCHJYFZSA-N 1 378.516 GG 3.173 1 Anodyne mid GGAAMO CCN1C[C@@H](CC[NH+]2CCOCC2)C(c2ccccc2)(c2ccccc2)C1=O fda CCN1C[C@@H](CCN2CCOCC2)C(c2ccccc2)(c2ccccc2)C1=O ZINC000019632668 27/79/78/210277978 XFDJYSQDBULQSI-JOCHJYFZSA-N 0 378.516 GG 3.173 0 Anodyne ref GGAARN CCN1C[C@@H](CCN2CCOCC2)C(c2ccccc2)(c2ccccc2)C1=O fda CCN1C[C@H](CCN2CCOCC2)C(c2ccccc2)(c2ccccc2)C1=O ZINC000019632670 02/22/22/571022222 XFDJYSQDBULQSI-QFIPXVFZSA-N 1 378.516 GG 3.173 1 Anodyne mid GGAAMO CCN1C[C@H](CC[NH+]2CCOCC2)C(c2ccccc2)(c2ccccc2)C1=O fda CCN1C[C@H](CCN2CCOCC2)C(c2ccccc2)(c2ccccc2)C1=O ZINC000019632670 02/22/19/571022219 XFDJYSQDBULQSI-QFIPXVFZSA-N 0 378.516 GG 3.173 0 Anodyne ref GGAARN CCN1C[C@H](CCN2CCOCC2)C(c2ccccc2)(c2ccccc2)C1=O fda COc1ccccc1N1CCN(C[C@@H](O)COc2cccc3ccccc23)CC1 ZINC000019632696 14/30/52/207143052 HRRBJVNMSRJFHQ-HXUWFJFHSA-N 1 392.499 GG 3.41 1 Anodyne mid GGAAMO COc1ccccc1N1CC[NH+](C[C@@H](O)COc2cccc3ccccc23)CC1 world COc1ccccc1N1CCN(C[C@@H](O)COc2cccc3ccccc23)CC1 ZINC000019632696 14/30/46/207143046 HRRBJVNMSRJFHQ-HXUWFJFHSA-N 0 392.499 GG 3.41 0 Anodyne ref GGAARN COc1ccccc1N1CCN(C[C@@H](O)COc2cccc3ccccc23)CC1 world COc1ccccc1N1CCN(C[C@H](O)COc2cccc3ccccc23)CC1 ZINC000019632700 27/81/48/210278148 HRRBJVNMSRJFHQ-FQEVSTJZSA-N 1 392.499 GG 3.41 1 Anodyne mid GGAAMO COc1ccccc1N1CC[NH+](C[C@H](O)COc2cccc3ccccc23)CC1 world COc1ccccc1N1CCN(C[C@H](O)COc2cccc3ccccc23)CC1 ZINC000019632700 27/81/43/210278143 HRRBJVNMSRJFHQ-FQEVSTJZSA-N 0 392.499 GG 3.41 0 Anodyne ref GGAARN COc1ccccc1N1CCN(C[C@H](O)COc2cccc3ccccc23)CC1 world CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C[C@H](O)[C@@H](N)Cc1ccccc1 ZINC000021982299 30/08/22/570300822 UKFHOTNATOJBKZ-ACRUOGEOSA-N 1 384.52 GG 3.443 0 Anodyne ref GGAARO CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C[C@H](O)[C@@H]([NH3+])Cc1ccccc1 in-vitro O=C1c2ccccc2C(=O)N1C/C=C/COc1cc(CN2CCCCC2)ccn1 ZINC000021991878 24/52/77/207245277 XFHKPHXNYPOQDJ-VOTSOKGWSA-N 0 391.471 GG 3.299 1 Anodyne mid GGABMN O=C1c2ccccc2C(=O)N1C/C=C/COc1cc(CN2CCCCC2)ccn1 O=C1c2ccccc2C(=O)N1C/C=C/COc1cc(CN2CCCCC2)ccn1 ZINC000021991878 24/52/70/207245270 XFHKPHXNYPOQDJ-VOTSOKGWSA-N 1 391.471 GG 3.299 0 Anodyne ref GGABRO O=C1c2ccccc2C(=O)N1C/C=C/COc1cc(C[NH+]2CCCCC2)ccn1 CCN(CC)C(=O)[C@]1(c2ccccc2)C[C@@H]1CN1C(=O)c2ccccc2C1=O ZINC000022057497 30/36/56/570303656 JOTWZGIFEGRKFM-HXOBKFHXSA-N 0 376.456 GG 3.109 0 Anodyne ref GGAARN CCN(CC)C(=O)[C@]1(c2ccccc2)C[C@@H]1CN1C(=O)c2ccccc2C1=O CCN(CC)C(=O)[C@]1(c2ccccc2)C[C@H]1CN1C(=O)c2ccccc2C1=O ZINC000022057502 30/35/56/570303556 JOTWZGIFEGRKFM-SBUREZEXSA-N 0 376.456 GG 3.109 0 Anodyne ref GGABRN CCN(CC)C(=O)[C@]1(c2ccccc2)C[C@H]1CN1C(=O)c2ccccc2C1=O O=c1[nH]c2ccccc2n1CCN1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000052716421 67/31/89/570673189 PPRRDFIXUUSXRA-UHFFFAOYSA-N 1 390.409 GG 3.171 1 Anodyne mid GGAAMO O=c1[nH]c2ccccc2n1CC[NH+]1CCN(c2cccc(C(F)(F)F)c2)CC1 fda O=c1[nH]c2ccccc2n1CCN1CCN(c2cccc(C(F)(F)F)c2)CC1 ZINC000052716421 67/31/86/570673186 PPRRDFIXUUSXRA-UHFFFAOYSA-N 0 390.409 GG 3.171 0 Anodyne ref GGAARN O=c1[nH]c2ccccc2n1CCN1CCN(c2cccc(C(F)(F)F)c2)CC1 fda Nc1c(Br)cc(Br)cc1CN[C@@H]1CC[C@H](O)CC1 ZINC000100070274 38/17/40/211381740 JBDGDEWWOUBZPM-XYPYZODXSA-N 1 378.108 GG 3.187 0 Anodyne ref GGAARO Nc1c(Br)cc(Br)cc1C[NH2+][C@@H]1CC[C@H](O)CC1 world