Cn1c(=O)[nH]c(=O)c2c1nc(SCC(=O)O)n2Cc1ccccc1 ZINC000000041885 55/58/63/208555863 MHJUMJCNYDJSNW-UHFFFAOYSA-N -1 346.368 EC 0.648 0 Anodyne ref ECAARM Cn1c(=O)[nH]c(=O)c2c1nc(SCC(=O)[O-])n2Cc1ccccc1 CCOC(=O)N1CCN(c2nc3ccccn3c(=O)c2C=O)CC1 ZINC000000619093 95/81/58/435958158 HHKXRGZMFJZKGH-UHFFFAOYSA-N 0 330.344 EC 0.785 0 Anodyne ref ECAARN CCOC(=O)N1CCN(c2nc3ccccn3c(=O)c2C=O)CC1 COCCNC(=O)c1c(N)n(CCCN)c2nc3ccccc3nc12 ZINC000002335055 96/44/77/435964477 YHVASHMNQAHXJW-UHFFFAOYSA-N 1 342.403 EC 0.892 0 Anodyne ref ECAARO COCCNC(=O)c1c(N)n(CCC[NH3+])c2nc3ccccc3nc12 COCCNC(=O)c1c(N)n(CCCO)c2nc3ccccc3nc12 ZINC000002349832 96/45/39/435964539 GQMVRGYPWTXIIH-UHFFFAOYSA-N 0 343.387 EC 0.925 0 Anodyne ref ECAARN COCCNC(=O)c1c(N)n(CCCO)c2nc3ccccc3nc12 CC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)Cc3ccccc3)[C@H]2SC1 ZINC000002856907 97/21/45/435972145 CIPQGGYPCPIDBB-IUODEOHRSA-N -1 332.381 EC 0.988 0 Anodyne ref ECAARM CC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)Cc3ccccc3)[C@H]2SC1 CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O ZINC000003830218 07/91/19/210079119 AVKUERGKIZMTKX-NJBDSQKTSA-N 0 349.412 EC 0.318 1 Anodyne mid ECAAMN CC1(C)S[C@@H]2[C@H](NC(=O)[C@H]([NH3+])c3ccccc3)C(=O)N2[C@H]1C(=O)[O-] fda endogenous CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)O ZINC000003830218 07/91/15/210079115 AVKUERGKIZMTKX-NJBDSQKTSA-N -1 349.412 EC 0.318 0 Anodyne ref ECAARM CC1(C)S[C@@H]2[C@H](NC(=O)[C@H](N)c3ccccc3)C(=O)N2[C@H]1C(=O)[O-] fda endogenous CC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)[C@H](N)c3ccccc3)[C@H]2SC1 ZINC000003830500 07/80/08/210078008 ZAIPMKNFIOOWCQ-UEKVPHQBSA-N 0 347.396 EC 0.445 1 Anodyne mid ECAAMN CC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)[C@H]([NH3+])c3ccccc3)[C@H]2SC1 fda metabolite CC1=C(C(=O)O)N2C(=O)[C@@H](NC(=O)[C@H](N)c3ccccc3)[C@H]2SC1 ZINC000003830500 07/80/03/210078003 ZAIPMKNFIOOWCQ-UEKVPHQBSA-N -1 347.396 EC 0.445 0 Anodyne ref ECAARM CC1=C(C(=O)[O-])N2C(=O)[C@@H](NC(=O)[C@H](N)c3ccccc3)[C@H]2SC1 fda metabolite Nc1c(S(=O)(=O)O)cc2c3c(cccc13)C(=O)N(CCO)C2=O ZINC000003882157 08/35/45/210083545 HLUJFGIDURYWPV-UHFFFAOYSA-N -1 336.325 EC 0.257 0 Anodyne ref ECAARM Nc1c(S(=O)(=O)[O-])cc2c3c(cccc13)C(=O)N(CCO)C2=O O=C(O)[C@@H]1[C@@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C[C@]23C=C[C@H]1O3 ZINC000003882706 97/70/14/435977014 QSJZCTAJPCPMKQ-ABYLEIOUSA-N -1 329.308 EC 0.782 0 Anodyne ref ECAARM O=C([O-])[C@@H]1[C@@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C[C@]23C=C[C@H]1O3 O=C(O)[C@H]1[C@@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C[C@]23C=C[C@H]1O3 ZINC000003882707 08/35/35/210083535 QSJZCTAJPCPMKQ-LSCFUAHRSA-N -1 329.308 EC 0.782 0 Anodyne ref ECAARM O=C([O-])[C@H]1[C@@H]2C(=O)N(Cc3ccc4c(c3)OCO4)C[C@]23C=C[C@H]1O3 O=C(O)[C@H]1[C@H]2C=C[C@]3(CN(Cc4ccc5c(c4)OCO5)C(=O)[C@H]13)O2 ZINC000003882708 08/35/50/210083550 QSJZCTAJPCPMKQ-LRCAOYNASA-N -1 329.308 EC 0.782 0 Anodyne ref ECAARM O=C([O-])[C@H]1[C@H]2C=C[C@]3(CN(Cc4ccc5c(c4)OCO5)C(=O)[C@H]13)O2 O=C(O)[C@@H]1[C@H]2C=C[C@]3(CN(Cc4ccc5c(c4)OCO5)C(=O)[C@H]13)O2 ZINC000003882709 08/41/40/210084140 QSJZCTAJPCPMKQ-MBMVNNNZSA-N -1 329.308 EC 0.782 0 Anodyne ref ECAARM O=C([O-])[C@@H]1[C@H]2C=C[C@]3(CN(Cc4ccc5c(c4)OCO5)C(=O)[C@H]13)O2 C[C@H](NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1)C(=O)O ZINC000006645542 00/20/55/436002055 LTEKJHJBEVIQQC-NWDGAFQWSA-N -1 340.401 EC 0.677 0 Anodyne ref ECAARM C[C@H](NC(=O)[C@@H]1CCCN(S(=O)(=O)c2ccccc2)C1)C(=O)[O-] C[C@H](NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1)C(=O)O ZINC000006645543 00/40/87/436004087 LTEKJHJBEVIQQC-RYUDHWBXSA-N -1 340.401 EC 0.677 0 Anodyne ref ECAARM C[C@H](NC(=O)[C@H]1CCCN(S(=O)(=O)c2ccccc2)C1)C(=O)[O-] CCn1cc(C(=O)N[C@@H](C)C(=O)O)c(=O)c2cc3c(cc21)OCO3 ZINC000006645557 00/29/10/436002910 QVLZAVLZSWYWGD-QMMMGPOBSA-N -1 332.312 EC 0.953 0 Anodyne ref ECAARM CCn1cc(C(=O)N[C@@H](C)C(=O)[O-])c(=O)c2cc3c(cc21)OCO3 CCn1cc(C(=O)NCCC(=O)O)c(=O)c2cc3c(cc21)OCO3 ZINC000006645563 00/30/98/436003098 YNEPUNBYKXNTIS-UHFFFAOYSA-N -1 332.312 EC 0.955 0 Anodyne ref ECAARM CCn1cc(C(=O)NCCC(=O)[O-])c(=O)c2cc3c(cc21)OCO3 COc1ccc(OC)c(N2C(=S)N[C@H]3CS(=O)(=O)C[C@H]32)c1 ZINC000006719021 17/67/61/295176761 RUOWZPYDIBDWQA-GXSJLCMTSA-N 0 328.415 EC 0.564 0 Anodyne ref ECAARN COc1ccc(OC)c(N2C(=S)N[C@H]3CS(=O)(=O)C[C@H]32)c1 COc1ccc(OC)c(N2C(=S)N[C@H]3CS(=O)(=O)C[C@@H]32)c1 ZINC000006719022 00/36/17/436003617 RUOWZPYDIBDWQA-ONGXEEELSA-N 0 328.415 EC 0.564 0 Anodyne ref ECAARN COc1ccc(OC)c(N2C(=S)N[C@H]3CS(=O)(=O)C[C@@H]32)c1 COc1ccc(OC)c(N2C(=S)N[C@@H]3CS(=O)(=O)C[C@H]32)c1 ZINC000006719023 00/36/33/436003633 RUOWZPYDIBDWQA-MWLCHTKSSA-N 0 328.415 EC 0.564 0 Anodyne ref ECAARN COc1ccc(OC)c(N2C(=S)N[C@@H]3CS(=O)(=O)C[C@H]32)c1 COc1ccc(OC)c(N2C(=S)N[C@@H]3CS(=O)(=O)C[C@@H]32)c1 ZINC000006719024 00/35/58/436003558 RUOWZPYDIBDWQA-KOLCDFICSA-N 0 328.415 EC 0.564 0 Anodyne ref ECAARN COc1ccc(OC)c(N2C(=S)N[C@@H]3CS(=O)(=O)C[C@@H]32)c1 COc1ccc(CCn2c(=O)[nH]c(=O)c3sc(N)nc32)cc1OC ZINC000008733323 03/22/39/436032239 NWBGUZPNAXSKQD-UHFFFAOYSA-N -1 348.384 EC 0.988 3 Anodyne high ECAAHM COc1ccc(CCn2c(=O)[n-]c(=O)c3sc(N)nc32)cc1OC COc1ccc(CCn2c(=O)[nH]c(=O)c3sc(N)nc32)cc1OC ZINC000008733323 03/22/28/436032228 NWBGUZPNAXSKQD-UHFFFAOYSA-N 0 348.384 EC 0.988 0 Anodyne ref ECAARN COc1ccc(CCn2c(=O)[nH]c(=O)c3sc(N)nc32)cc1OC COc1cc2c(cc1OC)CN1C(=O)N(CCC(=O)O)C(=O)[C@@H]1C2 ZINC000012902525 05/59/49/436055949 PCVHDVXANQFIOQ-NSHDSACASA-N -1 334.328 EC 0.867 0 Anodyne ref ECAARM COc1cc2c(cc1OC)CN1C(=O)N(CCC(=O)[O-])C(=O)[C@@H]1C2 CC(=O)C1=C(O)C(=O)N(CCN2CCNCC2)[C@@H]1c1ccccc1 ZINC000019702492 05/54/60/212055460 HANYVJWQPZBKGC-MRXNPFEDSA-N 1 329.4 EC 0.876 0 Mild ref ECEARO CC(=O)C1=C(O)C(=O)N(CCN2CC[NH2+]CC2)[C@@H]1c1ccccc1 CC(=O)C1=C(O)C(=O)N(CCN2CCNCC2)[C@H]1c1ccccc1 ZINC000019702494 05/52/95/212055295 HANYVJWQPZBKGC-INIZCTEOSA-N 1 329.4 EC 0.876 0 Mild ref ECEARO CC(=O)C1=C(O)C(=O)N(CCN2CC[NH2+]CC2)[C@H]1c1ccccc1