Cc1c(O)c(C)c2c(c1O)C(=O)C[C@H](c1ccc(O)cc1)O2 ZINC000000001419 25/05/91/280250591 DYHOLQACRGJEHX-CYBMUJFWSA-N -1 300.31 DG 3.127 3 Anodyne high DGAAHM Cc1c([O-])c(C)c2c(c1O)C(=O)C[C@H](c1ccc(O)cc1)O2 in-vitro biogenic Cc1c(O)c(C)c2c(c1O)C(=O)C[C@H](c1ccc(O)cc1)O2 ZINC000000001419 25/05/86/280250586 DYHOLQACRGJEHX-CYBMUJFWSA-N 0 300.31 DG 3.127 0 Anodyne ref DGAARN Cc1c(O)c(C)c2c(c1O)C(=O)C[C@H](c1ccc(O)cc1)O2 in-vitro biogenic O=C(OCC1c2ccccc2-c2ccccc21)N1CCC[C@H]1CO ZINC000000057599 11/67/54/431116754 HJUXXCOVGMCKQL-AWEZNQCLSA-N 0 323.392 DG 3.392 0 Anodyne ref DGAARN O=C(OCC1c2ccccc2-c2ccccc21)N1CCC[C@H]1CO O=C(OCC1c2ccccc2-c2ccccc21)N1CCC[C@@H]1CO ZINC000000057600 11/77/18/431117718 HJUXXCOVGMCKQL-CQSZACIVSA-N 0 323.392 DG 3.392 0 Anodyne ref DGAARN O=C(OCC1c2ccccc2-c2ccccc21)N1CCC[C@@H]1CO COc1ccc(-c2coc3cc(OC)c(OC)cc3c2=O)cc1 ZINC000000057640 11/72/59/431117259 YHXIOAVHEXKZCQ-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1ccc(-c2coc3cc(OC)c(OC)cc3c2=O)cc1 in-vitro biogenic O=c1c(Br)coc2ccc(Br)cc12 ZINC000000057728 38/93/09/280389309 XJSJGLRPSYOZLW-UHFFFAOYSA-N 0 303.937 DG 3.318 0 Anodyne ref DGAARN O=c1c(Br)coc2ccc(Br)cc12 COc1ccc2c(c1)O[C@@H](c1cccc(OC)c1OC)CC2=O ZINC000000057760 11/75/14/431117514 NNKKJSANGUCFHH-QGZVFWFLSA-N 0 314.337 DG 3.419 0 Anodyne ref DGABRN COc1ccc2c(c1)O[C@@H](c1cccc(OC)c1OC)CC2=O COc1ccc2c(c1)O[C@H](c1cccc(OC)c1OC)CC2=O ZINC000000057761 11/64/36/431116436 NNKKJSANGUCFHH-KRWDZBQOSA-N 0 314.337 DG 3.419 0 Anodyne ref DGABRN COc1ccc2c(c1)O[C@H](c1cccc(OC)c1OC)CC2=O COc1ccc2c(c1)C(=O)C[C@@H](c1ccc(OC)c(OC)c1)O2 ZINC000000057762 68/00/26/180680026 KYRMOZFTJMQBFZ-KRWDZBQOSA-N 0 314.337 DG 3.419 0 Anodyne ref DGAARN COc1ccc2c(c1)C(=O)C[C@@H](c1ccc(OC)c(OC)c1)O2 COc1ccc2c(c1)C(=O)C[C@H](c1ccc(OC)c(OC)c1)O2 ZINC000000057763 11/72/35/431117235 KYRMOZFTJMQBFZ-QGZVFWFLSA-N 0 314.337 DG 3.419 0 Anodyne ref DGAARN COc1ccc2c(c1)C(=O)C[C@H](c1ccc(OC)c(OC)c1)O2 COc1ccc2c(c1)C(=O)C[C@@H](c1cccc(OC)c1OC)O2 ZINC000000057764 11/72/42/431117242 VCOXKEDHNTZBAP-KRWDZBQOSA-N 0 314.337 DG 3.419 0 Anodyne ref DGABRN COc1ccc2c(c1)C(=O)C[C@@H](c1cccc(OC)c1OC)O2 COc1ccc2c(c1)C(=O)C[C@H](c1cccc(OC)c1OC)O2 ZINC000000057765 38/60/38/286386038 VCOXKEDHNTZBAP-QGZVFWFLSA-N 0 314.337 DG 3.419 0 Anodyne ref DGABRN COc1ccc2c(c1)C(=O)C[C@H](c1cccc(OC)c1OC)O2 COc1ccc(-c2c(C)c3ccc(O)cc3oc2=O)cc1OC ZINC000000057795 11/63/28/431116328 AQGVQGLSKSEDGI-UHFFFAOYSA-N 0 312.321 DG 3.491 1 Anodyne mid DGAAMN COc1ccc(-c2c(C)c3ccc(O)cc3oc2=O)cc1OC COc1ccc(-c2c(C)c3ccc(O)cc3oc2=O)cc1OC ZINC000000057795 11/63/18/431116318 AQGVQGLSKSEDGI-UHFFFAOYSA-N -1 312.321 DG 3.491 0 Anodyne ref DGAARM COc1ccc(-c2c(C)c3ccc([O-])cc3oc2=O)cc1OC COc1ccc(-c2c(C)c3cc(O)ccc3oc2=O)cc1OC ZINC000000057810 11/61/99/431116199 XVUGUSLJPOBMDX-UHFFFAOYSA-N -1 312.321 DG 3.491 3 Anodyne high DGAAHM COc1ccc(-c2c(C)c3cc([O-])ccc3oc2=O)cc1OC in-vitro biogenic COc1ccc(-c2c(C)c3cc(O)ccc3oc2=O)cc1OC ZINC000000057810 11/61/86/431116186 XVUGUSLJPOBMDX-UHFFFAOYSA-N 0 312.321 DG 3.491 0 Anodyne ref DGAARN COc1ccc(-c2c(C)c3cc(O)ccc3oc2=O)cc1OC in-vitro biogenic COc1ccc2cc(-c3ccc(OC)c(OC)c3)c(=O)oc2c1 ZINC000000057815 11/62/22/431116222 XJMBKKMQJONPPZ-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1ccc2cc(-c3ccc(OC)c(OC)c3)c(=O)oc2c1 COc1cccc(-c2oc3cc(OC)ccc3c(=O)c2OC)c1 ZINC000000057842 11/76/29/431117629 YUSMIUGOOGKMJN-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1cccc(-c2oc3cc(OC)ccc3c(=O)c2OC)c1 COc1ccc2oc(-c3cccc(OC)c3OC)cc(=O)c2c1 ZINC000000057847 11/71/32/431117132 JAJRYQVSBTWNTH-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1ccc2oc(-c3cccc(OC)c3OC)cc(=O)c2c1 COc1ccc(-c2cc(=O)c3cc(OC)ccc3o2)c(OC)c1 ZINC000000057848 67/99/35/180679935 WUWFDVDASNSUKP-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1ccc(-c2cc(=O)c3cc(OC)ccc3o2)c(OC)c1 in-vitro COc1ccc([C@@H]2CC(=O)c3cc(OC)ccc3O2)c(OC)c1 ZINC000000057856 11/58/81/431115881 GLQDUOUZVYGIDH-SFHVURJKSA-N 0 314.337 DG 3.419 0 Anodyne ref DGAARN COc1ccc([C@@H]2CC(=O)c3cc(OC)ccc3O2)c(OC)c1 COc1ccc([C@H]2CC(=O)c3cc(OC)ccc3O2)c(OC)c1 ZINC000000057857 11/72/69/431117269 GLQDUOUZVYGIDH-GOSISDBHSA-N 0 314.337 DG 3.419 0 Anodyne ref DGAARN COc1ccc([C@H]2CC(=O)c3cc(OC)ccc3O2)c(OC)c1 COc1cccc(-c2oc3ccc(OC)cc3c(=O)c2OC)c1 ZINC000000057864 11/76/99/431117699 PRWZDYJHEPXPGA-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1cccc(-c2oc3ccc(OC)cc3c(=O)c2OC)c1 COc1ccc(-c2cc(=O)c3ccc(OC)cc3o2)c(OC)c1 ZINC000000057884 11/73/07/431117307 YPQZGQIOLDZFBE-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1ccc(-c2cc(=O)c3ccc(OC)cc3o2)c(OC)c1 COc1ccc2c(=O)cc(-c3cccc(OC)c3OC)oc2c1 ZINC000000057888 11/74/89/431117489 PVWALMCXZUMCBB-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1ccc2c(=O)cc(-c3cccc(OC)c3OC)oc2c1 COc1ccc(-c2oc3ccc(C)cc3c(=O)c2O)c(OC)c1 ZINC000000057889 11/75/59/431117559 FHCLYGAQOAONOZ-UHFFFAOYSA-N 0 312.321 DG 3.491 0 Anodyne ref DGAARN COc1ccc(-c2oc3ccc(C)cc3c(=O)c2O)c(OC)c1 COc1ccc2c(=O)cc(-c3ccc(OC)c(OC)c3)oc2c1 ZINC000000057905 67/98/14/180679814 VSFZYCDPDWSYSS-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1ccc2c(=O)cc(-c3ccc(OC)c(OC)c3)oc2c1 in-vitro biogenic COc1cc2oc(-c3ccccc3)cc(=O)c2c(OC)c1OC ZINC000000058118 11/75/24/431117524 HJNJAUYFFFOFBW-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1cc2oc(-c3ccccc3)cc(=O)c2c(OC)c1OC in-vitro biogenic COc1ccc(-c2coc3cc(OC)cc(OC)c3c2=O)cc1 ZINC000000058170 26/61/93/257266193 PVVORTURQPBPEQ-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1ccc(-c2coc3cc(OC)cc(OC)c3c2=O)cc1 in-vitro COc1ccc2c(=O)c(-c3ccc(OC)c(OC)c3)coc2c1 ZINC000000058171 11/70/78/431117078 UKWLNMIPRJLYGH-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1ccc2c(=O)c(-c3ccc(OC)c(OC)c3)coc2c1 in-man endogenous O=C(O)c1ccccc1C(=O)c1ccc(Br)cc1 ZINC000000058211 45/86/10/331458610 NONNFIAFWRSPPY-UHFFFAOYSA-N -1 305.127 DG 3.378 0 Anodyne ref DGAARM O=C([O-])c1ccccc1C(=O)c1ccc(Br)cc1 O=c1[nH]nc(-c2ccc(Br)cc2)c2ccccc12 ZINC000000058219 45/86/33/331458633 ZISOEGMOUGUEMP-UHFFFAOYSA-N 0 301.143 DG 3.353 0 Anodyne ref DGAARN O=c1[nH]nc(-c2ccc(Br)cc2)c2ccccc12 O=C(NC1(C(=O)O)CC1)OCC1c2ccccc2-c2ccccc21 ZINC000000105368 12/43/69/431124369 OPPOISJKHBLNPD-UHFFFAOYSA-N -1 323.348 DG 3.142 0 Anodyne ref DGAARM O=C(NC1(C(=O)[O-])CC1)OCC1c2ccccc2-c2ccccc21 CCOC(=O)c1cnn(-c2ccc(F)cc2)c1C(F)(F)F ZINC000000160026 71/17/59/180711759 WTDWKMYSOQGLIX-UHFFFAOYSA-N 0 302.227 DG 3.207 0 Anodyne ref DGAARN CCOC(=O)c1cnn(-c2ccc(F)cc2)c1C(F)(F)F COc1ccc([C@H]2CC(=O)c3c(OC)cc(OC)cc3O2)cc1 ZINC000000161951 13/59/17/431135917 MQFSCAHSIUPLSB-OAHLLOKOSA-N 0 314.337 DG 3.419 0 Anodyne ref DGAARN COc1ccc([C@H]2CC(=O)c3c(OC)cc(OC)cc3O2)cc1 in-vitro biogenic COc1ccc([C@@H]2CC(=O)c3c(OC)cc(OC)cc3O2)cc1 ZINC000000161953 13/59/97/431135997 MQFSCAHSIUPLSB-HNNXBMFYSA-N 0 314.337 DG 3.419 0 Anodyne ref DGAARN COc1ccc([C@@H]2CC(=O)c3c(OC)cc(OC)cc3O2)cc1 in-vitro biogenic O=C(O)c1nnsc1Sc1ccc(C(F)(F)F)cc1 ZINC000000166260 13/69/68/431136968 DOSWLXUTUFNTRD-UHFFFAOYSA-N -1 306.29 DG 3.406 0 Anodyne ref DGAARM O=C([O-])c1nnsc1Sc1ccc(C(F)(F)F)cc1 Fc1cc(F)c(I)c(Br)c1 ZINC000000167274 13/73/58/431137358 KJJGFGWQNCPZBG-UHFFFAOYSA-N 0 318.886 DG 3.332 0 Anodyne ref DGAARN Fc1cc(F)c(I)c(Br)c1 Cc1nn(C)c(Oc2cccc(C(F)(F)F)c2)c1C(=O)O ZINC000000167574 13/62/19/431136219 PXLDNTZHJFLCCC-UHFFFAOYSA-N -1 300.236 DG 3.238 0 Anodyne ref DGAARM Cc1nn(C)c(Oc2cccc(C(F)(F)F)c2)c1C(=O)[O-] Cn1nc(C(F)(F)F)c(CO)c1Sc1ccc(F)cc1 ZINC000000169002 13/75/28/431137528 UWASPYXTSSUGBZ-UHFFFAOYSA-N 0 306.284 DG 3.222 0 Anodyne ref DGAARN Cn1nc(C(F)(F)F)c(CO)c1Sc1ccc(F)cc1 Cn1nc(C(F)(F)F)c(CO)c1Oc1ccc(Cl)cc1 ZINC000000169008 14/04/04/431140404 DIVFCQKXUCIGKZ-UHFFFAOYSA-N 0 306.671 DG 3.377 0 Anodyne ref DGAARN Cn1nc(C(F)(F)F)c(CO)c1Oc1ccc(Cl)cc1 Fc1ccc(Br)c(I)c1 ZINC000000403475 17/66/30/431176630 QDCBSSUCEUMLGC-UHFFFAOYSA-N 0 300.896 DG 3.193 0 Anodyne ref DGAARN Fc1ccc(Br)c(I)c1 Fc1cc(Br)ccc1I ZINC000000409261 17/70/87/431177087 XRMZKCQCINEBEI-UHFFFAOYSA-N 0 300.896 DG 3.193 0 Anodyne ref DGAARN Fc1cc(Br)ccc1I Cc1ccc(S(=O)(=O)OC(C(F)(F)F)C(F)(F)F)cc1 ZINC000001730139 46/76/59/331467659 QGSVBFAODCJVIZ-UHFFFAOYSA-N 0 322.226 DG 3.194 0 Mild ref DGEARN Cc1ccc(S(=O)(=O)OC(C(F)(F)F)C(F)(F)F)cc1 COc1ccc(-c2oc3ccccc3c(=O)c2OC)cc1OC ZINC000001978642 24/13/52/431241352 BSKMLHOVEORMSF-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1ccc(-c2oc3ccccc3c(=O)c2OC)cc1OC in-vitro biogenic FC(F)(F)c1cc(N2CCNCC2)c2cc(Cl)ccc2n1 ZINC000002243380 24/82/56/431248256 GIFXTASSJARHPP-UHFFFAOYSA-N 0 315.726 DG 3.317 3 Anodyne high DGAAHN FC(F)(F)c1cc(N2CCNCC2)c2cc(Cl)ccc2n1 FC(F)(F)c1cc(N2CCNCC2)c2cc(Cl)ccc2n1 ZINC000002243380 24/82/51/431248251 GIFXTASSJARHPP-UHFFFAOYSA-N 1 315.726 DG 3.317 0 Anodyne ref DGAARO FC(F)(F)c1cc(N2CC[NH2+]CC2)c2cc(Cl)ccc2n1 FC(F)(F)c1cc(N2CCNCC2)c2cccc(Cl)c2n1 ZINC000002243385 24/73/31/431247331 GYLMHFWBDILTEA-UHFFFAOYSA-N 0 315.726 DG 3.317 3 Anodyne high DGAAHN FC(F)(F)c1cc(N2CCNCC2)c2cccc(Cl)c2n1 FC(F)(F)c1cc(N2CCNCC2)c2cccc(Cl)c2n1 ZINC000002243385 24/73/22/431247322 GYLMHFWBDILTEA-UHFFFAOYSA-N 1 315.726 DG 3.317 0 Anodyne ref DGAARO FC(F)(F)c1cc(N2CC[NH2+]CC2)c2cccc(Cl)c2n1 NCCCCNC(=O)OCC1c2ccccc2-c2ccccc21 ZINC000002244335 24/72/04/431247204 GUERCAXBAHLNFO-UHFFFAOYSA-N 1 310.397 DG 3.264 0 Anodyne ref DGAARO [NH3+]CCCCNC(=O)OCC1c2ccccc2-c2ccccc21 COc1cc(OC)c(C(=O)/C=C/Cc2ccco2)c(OC)c1 ZINC000002510902 25/56/21/431255621 MYADXDSCPPEEPU-XBXARRHUSA-N 0 302.326 DG 3.287 0 Mild ref DGEARN COc1cc(OC)c(C(=O)/C=C/Cc2ccco2)c(OC)c1 Fc1ccc(I)c(Br)c1 ZINC000002512339 74/47/10/294744710 GKGPZAZTXZCUMU-UHFFFAOYSA-N 0 300.896 DG 3.193 0 Anodyne ref DGAARN Fc1ccc(I)c(Br)c1 COc1ccc2oc(-c3ccccc3OC)c(OC)c(=O)c2c1 ZINC000002553976 93/47/23/180934723 NRPVNJIMIFDLSF-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1ccc2oc(-c3ccccc3OC)c(OC)c(=O)c2c1 CC(C)(C)OC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)O ZINC000002554977 25/80/97/431258097 URKWHOVNPHQQTM-OAHLLOKOSA-N -1 315.369 DG 3.36 0 Anodyne ref DGAARM CC(C)(C)OC(=O)N[C@H](Cc1ccc2ccccc2c1)C(=O)[O-] FC1(F)C(F)(F)[C@](F)(Br)[C@@]1(F)Br ZINC000002560312 12/51/42/303125142 HLCPJMKKTKDOGB-LWMBPPNESA-N 0 321.84 DG 3.392 0 Anodyne ref DGAARN FC1(F)C(F)(F)[C@](F)(Br)[C@@]1(F)Br COc1ccc(-c2cc(=O)c3c(OC)cc(OC)cc3o2)cc1 ZINC000002566194 25/76/17/431257617 ZXJJBDHPUHUUHD-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1ccc(-c2cc(=O)c3c(OC)cc(OC)cc3o2)cc1 in-man endogenous COc1ccc(-c2coc3c(OC)c(OC)ccc3c2=O)cc1 ZINC000002566743 93/57/77/180935777 CRZCBRQLDFFZHO-UHFFFAOYSA-N 0 312.321 DG 3.486 0 Anodyne ref DGAARN COc1ccc(-c2coc3c(OC)c(OC)ccc3c2=O)cc1 in-vitro CC(C)(C)OC(=O)N[C@H](Cc1cccc2ccccc12)C(=O)O ZINC000002568075 25/85/63/431258563 KHHIGWRTNILXLL-OAHLLOKOSA-N -1 315.369 DG 3.36 0 Anodyne ref DGAARM CC(C)(C)OC(=O)N[C@H](Cc1cccc2ccccc12)C(=O)[O-] CC(C)(C)OC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)O ZINC000002568078 93/59/04/180935904 URKWHOVNPHQQTM-HNNXBMFYSA-N -1 315.369 DG 3.36 0 Anodyne ref DGAARM CC(C)(C)OC(=O)N[C@@H](Cc1ccc2ccccc2c1)C(=O)[O-] CSCC[C@H](NC(C)=O)C(=O)Oc1cccc2ccccc12 ZINC000002572076 93/65/99/180936599 FGHRSVXVKOEYHM-HNNXBMFYSA-N 0 317.41 DG 3.003 0 Anodyne ref DGABRN CSCC[C@H](NC(C)=O)C(=O)Oc1cccc2ccccc12 COc1cc(OC)c2c(C)c(-c3ccc(O)cc3)c(=O)oc2c1 ZINC000002573914 38/62/41/277386241 XCAIUEVJJRUZJU-UHFFFAOYSA-N -1 312.321 DG 3.491 3 Anodyne high DGABHM COc1cc(OC)c2c(C)c(-c3ccc([O-])cc3)c(=O)oc2c1 COc1cc(OC)c2c(C)c(-c3ccc(O)cc3)c(=O)oc2c1 ZINC000002573914 38/62/39/277386239 XCAIUEVJJRUZJU-UHFFFAOYSA-N 0 312.321 DG 3.491 0 Anodyne ref DGABRN COc1cc(OC)c2c(C)c(-c3ccc(O)cc3)c(=O)oc2c1 CC(C)(C)OC(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)O ZINC000002575217 93/66/85/180936685 KHHIGWRTNILXLL-HNNXBMFYSA-N -1 315.369 DG 3.36 0 Anodyne ref DGAARM CC(C)(C)OC(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)[O-] COc1cc(OC)c2c(c1)O[C@@H](c1ccc(O)cc1)CC2=O ZINC000002584591 25/74/50/431257450 REBBZOCNEVVAPX-CQSZACIVSA-N 0 300.31 DG 3.116 0 Anodyne ref DGAARN COc1cc(OC)c2c(c1)O[C@@H](c1ccc(O)cc1)CC2=O COc1ccc(C(=O)/C=C/c2ccc(OC)c(OC)c2)c(O)c1 ZINC000004029960 06/41/65/181064165 SKTAHPCCLORHHM-XBXARRHUSA-N 0 314.337 DG 3.314 1 Mild mid DGEAMN COc1ccc(C(=O)/C=C/c2ccc(OC)c(OC)c2)c(O)c1 COc1ccc(C(=O)/C=C/c2ccc(OC)c(OC)c2)c(O)c1 ZINC000004029960 06/41/64/181064164 SKTAHPCCLORHHM-XBXARRHUSA-N -1 314.337 DG 3.314 0 Mild ref DGEARM COc1ccc(C(=O)/C=C/c2ccc(OC)c(OC)c2)c([O-])c1 COc1cc(/C=C/C(=O)c2ccccc2O)cc(OC)c1OC ZINC000004042476 06/60/29/181066029 SRSBUHVXNLHWHU-CMDGGOBGSA-N 0 314.337 DG 3.314 1 Mild mid DGEAMN COc1cc(/C=C/C(=O)c2ccccc2O)cc(OC)c1OC in-vivo COc1cc(/C=C/C(=O)c2ccccc2O)cc(OC)c1OC ZINC000004042476 06/60/26/181066026 SRSBUHVXNLHWHU-CMDGGOBGSA-N -1 314.337 DG 3.314 0 Mild ref DGEARM COc1cc(/C=C/C(=O)c2ccccc2[O-])cc(OC)c1OC in-vivo COc1ccc(C(=O)/C=C/c2ccc(OC)cc2OC)c(O)c1 ZINC000004045718 54/26/11/523542611 ZTIPWOFLPVWZDX-WEVVVXLNSA-N 0 314.337 DG 3.314 1 Mild mid DGEAMN COc1ccc(C(=O)/C=C/c2ccc(OC)cc2OC)c(O)c1 COc1ccc(C(=O)/C=C/c2ccc(OC)cc2OC)c(O)c1 ZINC000004045718 54/25/91/523542591 ZTIPWOFLPVWZDX-WEVVVXLNSA-N -1 314.337 DG 3.314 0 Mild ref DGEARM COc1ccc(C(=O)/C=C/c2ccc(OC)cc2OC)c([O-])c1 Cc1c(O)c(C)c2c(c1O)C(=O)C[C@@H](c1ccc(O)cc1)O2 ZINC000004098306 25/05/18/280250518 DYHOLQACRGJEHX-ZDUSSCGKSA-N -1 300.31 DG 3.127 3 Anodyne high DGAAHM Cc1c([O-])c(C)c2c(c1O)C(=O)C[C@@H](c1ccc(O)cc1)O2 in-vitro biogenic Cc1c(O)c(C)c2c(c1O)C(=O)C[C@@H](c1ccc(O)cc1)O2 ZINC000004098306 25/05/15/280250515 DYHOLQACRGJEHX-ZDUSSCGKSA-N 0 300.31 DG 3.127 0 Anodyne ref DGAARN Cc1c(O)c(C)c2c(c1O)C(=O)C[C@@H](c1ccc(O)cc1)O2 in-vitro biogenic COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1 ZINC000004100760 07/37/36/181073736 CGIBCVBDFUTMPT-RMKNXTFCSA-N 0 314.337 DG 3.314 1 Mild mid DGEAMN COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1 in-man endogenous COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2OC)cc1 ZINC000004100760 07/37/35/181073735 CGIBCVBDFUTMPT-RMKNXTFCSA-N -1 314.337 DG 3.314 0 Mild ref DGEARM COc1ccc(/C=C/C(=O)c2c([O-])cc(OC)cc2OC)cc1 in-man endogenous COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1 ZINC000004100761 07/33/49/181073349 UXUFMIJZNYXWDX-VMPITWQZSA-N 0 300.31 DG 3.011 1 Mild mid DGEAMN COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1 in-man endogenous COc1cc(O)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1 ZINC000004100761 07/33/48/181073348 UXUFMIJZNYXWDX-VMPITWQZSA-N -1 300.31 DG 3.011 0 Mild ref DGEARM COc1cc([O-])c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1 in-man endogenous COc1cc(O)c(C(=O)/C=C/c2ccc(F)cc2)c(OC)c1 ZINC000004100771 07/33/45/181073345 WZCYSJXPWSPCHO-VMPITWQZSA-N 0 302.301 DG 3.445 1 Mild mid DGEAMN COc1cc(O)c(C(=O)/C=C/c2ccc(F)cc2)c(OC)c1 COc1cc(O)c(C(=O)/C=C/c2ccc(F)cc2)c(OC)c1 ZINC000004100771 07/33/43/181073343 WZCYSJXPWSPCHO-VMPITWQZSA-N -1 302.301 DG 3.445 0 Mild ref DGEARM COc1cc([O-])c(C(=O)/C=C/c2ccc(F)cc2)c(OC)c1 COc1cc(OC)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1 ZINC000004100777 07/33/72/181073372 ZWNLSRDFHQCTQW-RMKNXTFCSA-N 0 314.337 DG 3.314 0 Mild ref DGEARN COc1cc(OC)c(C(=O)/C=C/c2ccc(O)cc2)c(OC)c1 in-vitro biogenic COc1cc(O)c(C(=O)/C=C/c2ccccc2O)c(OC)c1 ZINC000004252555 08/83/82/181088382 ONIYXBSQSPCBOF-BQYQJAHWSA-N -2 300.31 DG 3.011 3 Mild high DGEAHL COc1cc([O-])c(C(=O)/C=C/c2ccccc2[O-])c(OC)c1 COc1cc(O)c(C(=O)/C=C/c2ccccc2O)c(OC)c1 ZINC000004252555 08/83/80/181088380 ONIYXBSQSPCBOF-BQYQJAHWSA-N 0 300.31 DG 3.011 1 Mild mid DGEAMN COc1cc(O)c(C(=O)/C=C/c2ccccc2O)c(OC)c1 COc1cc(O)c(C(=O)/C=C/c2ccccc2O)c(OC)c1 ZINC000004252555 08/83/76/181088376 ONIYXBSQSPCBOF-BQYQJAHWSA-N -1 300.31 DG 3.011 0 Mild ref DGEARM COc1cc([O-])c(C(=O)/C=C/c2ccccc2O)c(OC)c1 COc1cccc(/C=C/C(=O)c2ccc(O)cc2O)c1OC ZINC000004252556 08/86/11/181088611 JUCNRAJYHMZLOT-RMKNXTFCSA-N -2 300.31 DG 3.011 3 Mild high DGEAHL COc1cccc(/C=C/C(=O)c2ccc([O-])cc2[O-])c1OC COc1cccc(/C=C/C(=O)c2ccc(O)cc2O)c1OC ZINC000004252556 08/86/08/181088608 JUCNRAJYHMZLOT-RMKNXTFCSA-N 0 300.31 DG 3.011 1 Mild mid DGEAMN COc1cccc(/C=C/C(=O)c2ccc(O)cc2O)c1OC COc1cccc(/C=C/C(=O)c2ccc(O)cc2O)c1OC ZINC000004252556 08/86/07/181088607 JUCNRAJYHMZLOT-RMKNXTFCSA-N -1 300.31 DG 3.011 0 Mild ref DGEARM COc1cccc(/C=C/C(=O)c2ccc(O)cc2[O-])c1OC COc1ccc(/C=C/C(=O)c2ccc(O)cc2O)cc1OC ZINC000004252557 08/84/99/181088499 ZMMIEHPFMMRMMN-XVNBXDOJSA-N -2 300.31 DG 3.011 3 Mild high DGEAHL COc1ccc(/C=C/C(=O)c2ccc([O-])cc2[O-])cc1OC in-vitro biogenic COc1ccc(/C=C/C(=O)c2ccc(O)cc2O)cc1OC ZINC000004252557 08/84/95/181088495 ZMMIEHPFMMRMMN-XVNBXDOJSA-N 0 300.31 DG 3.011 1 Mild mid DGEAMN COc1ccc(/C=C/C(=O)c2ccc(O)cc2O)cc1OC in-vitro biogenic COc1ccc(/C=C/C(=O)c2ccc(O)cc2O)cc1OC ZINC000004252557 08/84/93/181088493 ZMMIEHPFMMRMMN-XVNBXDOJSA-N -1 300.31 DG 3.011 0 Mild ref DGEARM COc1ccc(/C=C/C(=O)c2ccc(O)cc2[O-])cc1OC in-vitro biogenic COc1cc(O)c(OC)c(O)c1C(=O)/C=C/c1ccccc1 ZINC000004252559 08/85/16/181088516 BXMWIRIMYNWIGQ-CMDGGOBGSA-N -1 300.31 DG 3.011 1 Mild mid DGEAMM COc1cc(O)c(OC)c([O-])c1C(=O)/C=C/c1ccccc1 COc1cc(O)c(OC)c(O)c1C(=O)/C=C/c1ccccc1 ZINC000004252559 08/85/14/181088514 BXMWIRIMYNWIGQ-CMDGGOBGSA-N 0 300.31 DG 3.011 0 Mild ref DGEARN COc1cc(O)c(OC)c(O)c1C(=O)/C=C/c1ccccc1 COc1cc(O)c(C(=O)/C=C/c2ccccc2)c(O)c1OC ZINC000004252560 08/85/90/181088590 KVDNSLPRNTZIKF-CMDGGOBGSA-N -2 300.31 DG 3.011 3 Mild high DGEAHL COc1cc([O-])c(C(=O)/C=C/c2ccccc2)c([O-])c1OC in-vitro biogenic COc1cc(O)c(C(=O)/C=C/c2ccccc2)c(O)c1OC ZINC000004252560 08/85/88/181088588 KVDNSLPRNTZIKF-CMDGGOBGSA-N -1 300.31 DG 3.011 1 Mild mid DGEAMM COc1cc(O)c(C(=O)/C=C/c2ccccc2)c([O-])c1OC in-vitro biogenic COc1cc(O)c(C(=O)/C=C/c2ccccc2)c(O)c1OC ZINC000004252560 08/85/86/181088586 KVDNSLPRNTZIKF-CMDGGOBGSA-N -1 300.31 DG 3.011 1 Mild mid DGEAMM COc1cc([O-])c(C(=O)/C=C/c2ccccc2)c(O)c1OC in-vitro biogenic COc1cc(O)c(C(=O)/C=C/c2ccccc2)c(O)c1OC ZINC000004252560 08/85/83/181088583 KVDNSLPRNTZIKF-CMDGGOBGSA-N 0 300.31 DG 3.011 0 Mild ref DGEARN COc1cc(O)c(C(=O)/C=C/c2ccccc2)c(O)c1OC in-vitro biogenic COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2O)cc1 ZINC000004252563 08/85/12/181088512 NXHNEWMDVUHUCV-VMPITWQZSA-N -2 300.31 DG 3.011 3 Mild high DGEBHL COc1ccc(/C=C/C(=O)c2c([O-])cc(OC)cc2[O-])cc1 COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2O)cc1 ZINC000004252563 08/85/10/181088510 NXHNEWMDVUHUCV-VMPITWQZSA-N 0 300.31 DG 3.011 1 Mild mid DGEBMN COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2O)cc1 COc1ccc(/C=C/C(=O)c2c(O)cc(OC)cc2O)cc1 ZINC000004252563 08/85/05/181088505 NXHNEWMDVUHUCV-VMPITWQZSA-N -1 300.31 DG 3.011 0 Mild ref DGEBRM COc1ccc(/C=C/C(=O)c2c([O-])cc(OC)cc2O)cc1 COc1ccc(C(=O)/C=C/c2cccc(OC)c2OC)c(O)c1 ZINC000004252619 38/50/37/337385037 ZPBDKGAFNCLNTD-JXMROGBWSA-N 0 314.337 DG 3.314 1 Mild mid DGEAMN COc1ccc(C(=O)/C=C/c2cccc(OC)c2OC)c(O)c1 COc1ccc(C(=O)/C=C/c2cccc(OC)c2OC)c(O)c1 ZINC000004252619 38/50/36/337385036 ZPBDKGAFNCLNTD-JXMROGBWSA-N -1 314.337 DG 3.314 0 Mild ref DGEARM COc1ccc(C(=O)/C=C/c2cccc(OC)c2OC)c([O-])c1 COc1ccc(O)c(C(=O)/C=C/c2cccc(OC)c2OC)c1 ZINC000004252620 08/83/66/181088366 NRAAGHLLAJEOAZ-VQHVLOKHSA-N -1 314.337 DG 3.314 1 Mild mid DGEAMM COc1ccc([O-])c(C(=O)/C=C/c2cccc(OC)c2OC)c1