Oc1ccc2ccccc2c1Br ZINC000000001318 28/42/78/183284278 FQJZPYXGPYJJIH-UHFFFAOYSA-N -1 223.069 BG 3.308 1 Anodyne mid BGAAMM [O-]c1ccc2ccccc2c1Br Oc1ccc2ccccc2c1Br ZINC000000001318 28/42/75/183284275 FQJZPYXGPYJJIH-UHFFFAOYSA-N 0 223.069 BG 3.308 0 Anodyne ref BGAARN Oc1ccc2ccccc2c1Br O=C(Nc1ccc(F)cc1)c1ccccc1 ZINC000000029209 35/63/24/182356324 OMWWTMOLTFYGAK-UHFFFAOYSA-N 0 215.227 BG 3.078 0 Anodyne ref BGAARN O=C(Nc1ccc(F)cc1)c1ccccc1 Cc1cc(C)cc(NC(=O)c2ccco2)c1 ZINC000000029984 90/78/41/177907841 RIQTWSWKKBIZJQ-UHFFFAOYSA-N 0 215.252 BG 3.149 0 Anodyne ref BGAARN Cc1cc(C)cc(NC(=O)c2ccco2)c1 CCOc1ccc(NC(=O)CC(C)(C)C)cc1 ZINC000000030590 66/99/64/342669964 KBPKLZFBVOFRAA-UHFFFAOYSA-N 0 235.327 BG 3.46 0 Anodyne ref BGAARN CCOc1ccc(NC(=O)CC(C)(C)C)cc1 CC(C)(C)CC(=O)Nc1ccc(F)cc1 ZINC000000030640 66/99/29/342669929 DWGPXBYWJOBNHG-UHFFFAOYSA-N 0 209.264 BG 3.2 0 Anodyne ref BGAARN CC(C)(C)CC(=O)Nc1ccc(F)cc1 Cc1ccc(-c2csc(N)n2)c(C)c1 ZINC000000035820 33/07/15/178330715 OJXMEMYRDCFPHW-UHFFFAOYSA-N 0 204.298 BG 3.009 0 Anodyne ref BGAARN Cc1ccc(-c2csc(N)n2)c(C)c1 Cc1ccc(NC(=O)c2ccccc2)cc1F ZINC000000038651 67/06/67/342670667 JNADMABTRQLQPQ-UHFFFAOYSA-N 0 229.254 BG 3.386 0 Anodyne ref BGAARN Cc1ccc(NC(=O)c2ccccc2)cc1F Cc1ccccc1C(=O)Nc1cccc(C#N)c1 ZINC000000038855 25/29/30/179252930 OYKHWISHEYHDKB-UHFFFAOYSA-N 0 236.274 BG 3.119 0 Mild ref BGEARN Cc1ccccc1C(=O)Nc1cccc(C#N)c1 N#Cc1ccc(-c2cccs2)[nH]c1=S ZINC000000039962 09/57/17/181095717 ZFOUAZBWQSIIIA-UHFFFAOYSA-N 0 218.306 BG 3.344 0 Mild ref BGEARN N#Cc1ccc(-c2cccs2)[nH]c1=S O=C(O)C1CCC(c2ccccc2)CC1 ZINC000000041049 42/87/84/182428784 SYYSTPDYCASVSQ-UHFFFAOYSA-N -1 204.269 BG 3.045 0 Anodyne ref BGAARM O=C([O-])C1CCC(c2ccccc2)CC1 Cc1ccc(/N=C/c2ccc(O)c(O)c2)cc1 ZINC000000046056 35/97/02/178359702 YKQTYSAWAINHDQ-OQLLNIDSSA-N -1 227.263 BG 3.157 3 Mild high BGEAHM Cc1ccc(/N=C/c2ccc(O)c([O-])c2)cc1 Cc1ccc(/N=C/c2ccc(O)c(O)c2)cc1 ZINC000000046056 35/96/98/178359698 YKQTYSAWAINHDQ-OQLLNIDSSA-N 0 227.263 BG 3.157 0 Mild ref BGEARN Cc1ccc(/N=C/c2ccc(O)c(O)c2)cc1 Cc1cccc(NC(=S)NN=C2CCCC2)c1 ZINC000000046110 24/45/68/187244568 HQVXOPIUEDYSHB-UHFFFAOYSA-N 0 247.367 BG 3.211 0 Mild ref BGEARN Cc1cccc(NC(=S)NN=C2CCCC2)c1 C=C(C)CSc1nc2c(cc1C#N)CCC2 ZINC000000046225 94/27/91/191942791 GJLLNFYGBNBLCR-UHFFFAOYSA-N 0 230.336 BG 3.11 0 Mild ref BGEARN C=C(C)CSc1nc2c(cc1C#N)CCC2 O=C(Nc1cccc2ccccc12)C(F)(F)F ZINC000000046261 37/36/55/182373655 DASQPWURVZDKPV-UHFFFAOYSA-N 0 239.196 BG 3.341 0 Anodyne ref BGAARN O=C(Nc1cccc2ccccc12)C(F)(F)F O=[N+]([O-])c1ccc(/C=N/c2ccccc2O)s1 ZINC000000046317 67/12/10/342671210 WGJVLYHOLSVWBQ-KPKJPENVSA-N -1 248.263 BG 3.113 3 Mild high BGEAHM O=[N+]([O-])c1ccc(/C=N/c2ccccc2[O-])s1 O=[N+]([O-])c1ccc(/C=N/c2ccccc2O)s1 ZINC000000046317 67/12/09/342671209 WGJVLYHOLSVWBQ-KPKJPENVSA-N 0 248.263 BG 3.113 0 Mild ref BGEARN O=[N+]([O-])c1ccc(/C=N/c2ccccc2O)s1 N#Cc1cccc(/N=C/c2ccccc2O)c1 ZINC000000046334 13/44/86/181134486 MNEKPPWOMPRBIN-MHWRWJLKSA-N -1 222.247 BG 3.014 3 Mild high BGEAHM N#Cc1cccc(/N=C/c2ccccc2[O-])c1 N#Cc1cccc(/N=C/c2ccccc2O)c1 ZINC000000046334 13/44/84/181134484 MNEKPPWOMPRBIN-MHWRWJLKSA-N 0 222.247 BG 3.014 0 Mild ref BGEARN N#Cc1cccc(/N=C/c2ccccc2O)c1 N#Cc1ccccc1/N=C/c1ccc(F)cc1 ZINC000000046380 14/41/53/181144153 URIXJMQQDKKJKX-LICLKQGHSA-N 0 224.238 BG 3.448 0 Mild ref BGEARN N#Cc1ccccc1/N=C/c1ccc(F)cc1 COc1ccc(/N=C/c2ccc(C)o2)cc1 ZINC000000046385 04/94/33/175049433 QVEPAXZWXQSIRS-NTEUORMPSA-N 0 215.252 BG 3.347 0 Mild ref BGEARN COc1ccc(/N=C/c2ccc(C)o2)cc1 N#Cc1ccccc1/N=C/c1ccccc1O ZINC000000046397 14/42/13/181144213 IEWFISGZEVZDRK-MHWRWJLKSA-N -1 222.247 BG 3.014 1 Mild mid BGEAMM N#Cc1ccccc1/N=C/c1ccccc1[O-] N#Cc1ccccc1/N=C/c1ccccc1O ZINC000000046397 14/42/12/181144212 IEWFISGZEVZDRK-MHWRWJLKSA-N 0 222.247 BG 3.014 0 Mild ref BGEARN N#Cc1ccccc1/N=C/c1ccccc1O COC(=O)c1ccc(/N=C/c2cccs2)cc1 ZINC000000046425 81/98/19/383819819 GJOVIKHZUABMQE-NTEUORMPSA-N 0 245.303 BG 3.285 0 Mild ref BGEARN COC(=O)c1ccc(/N=C/c2cccs2)cc1 Cc1ccccc1C(=O)N[C@@H](C)c1ccccc1 ZINC000000046452 25/16/24/179251624 FGJJSSFDJWWUNG-ZDUSSCGKSA-N 0 239.318 BG 3.486 0 Anodyne ref BGAARN Cc1ccccc1C(=O)N[C@@H](C)c1ccccc1 Cc1ccccc1C(=O)N[C@H](C)c1ccccc1 ZINC000000046453 25/23/79/179252379 FGJJSSFDJWWUNG-CYBMUJFWSA-N 0 239.318 BG 3.486 0 Anodyne ref BGAARN Cc1ccccc1C(=O)N[C@H](C)c1ccccc1 Cc1ccc(NC(=O)c2cccs2)cc1F ZINC000000046478 67/12/31/342671231 VGWJDRSVUDADLG-UHFFFAOYSA-N 0 235.283 BG 3.448 0 Anodyne ref BGAARN Cc1ccc(NC(=O)c2cccs2)cc1F Cc1cc(C)cc(NCc2ccccc2CO)c1 ZINC000000046499 67/12/21/342671221 ROBZCQISTSCRDW-UHFFFAOYSA-N 0 241.334 BG 3.408 0 Anodyne ref BGAARN Cc1cc(C)cc(NCc2ccccc2CO)c1 Cc1cc(C)cc(/N=C/c2cccc(O)c2O)c1 ZINC000000047894 81/92/47/383819247 NNDPCBXVVWJLIC-CXUHLZMHSA-N -1 241.29 BG 3.465 3 Mild high BGEAHM Cc1cc(C)cc(/N=C/c2cccc([O-])c2O)c1 Cc1cc(C)cc(/N=C/c2cccc(O)c2O)c1 ZINC000000047894 81/92/42/383819242 NNDPCBXVVWJLIC-CXUHLZMHSA-N 0 241.29 BG 3.465 0 Mild ref BGEARN Cc1cc(C)cc(/N=C/c2cccc(O)c2O)c1 Cc1ccc(/N=C/c2ccccc2O)c(O)c1 ZINC000000054685 35/96/18/178359618 ZZQXHPKLKQFUOP-OQLLNIDSSA-N -1 227.263 BG 3.157 3 Mild high BGEAHM Cc1ccc(/N=C/c2ccccc2O)c([O-])c1 Cc1ccc(/N=C/c2ccccc2O)c(O)c1 ZINC000000054685 35/96/15/178359615 ZZQXHPKLKQFUOP-OQLLNIDSSA-N 0 227.263 BG 3.157 0 Mild ref BGEARN Cc1ccc(/N=C/c2ccccc2O)c(O)c1 Cc1ccc(C)c(NCc2ccccc2CO)c1 ZINC000000054757 82/19/37/383821937 YTXWAHSYKSUPAU-UHFFFAOYSA-N 0 241.334 BG 3.408 0 Anodyne ref BGAARN Cc1ccc(C)c(NCc2ccccc2CO)c1 Cc1ccc(CCNc2ccccc2)cn1 ZINC000000054763 67/15/06/342671506 NYZHDBKVHXVXBL-UHFFFAOYSA-N 1 212.296 BG 3.045 2 Anodyne low BGAALO Cc1ccc(CCNc2ccccc2)c[nH+]1 Cc1ccc(CCNc2ccccc2)cn1 ZINC000000054763 67/15/05/342671505 NYZHDBKVHXVXBL-UHFFFAOYSA-N 0 212.296 BG 3.045 0 Anodyne ref BGAARN Cc1ccc(CCNc2ccccc2)cn1 CC(=O)Nc1ccc(OCc2ccccc2)cc1 ZINC000000054899 09/90/72/188099072 QLCLKEPRVBUJHX-UHFFFAOYSA-N 0 241.29 BG 3.224 0 Anodyne ref BGAARN CC(=O)Nc1ccc(OCc2ccccc2)cc1 Cc1ccc2nc(Cl)c(C=O)cc2c1 ZINC000000058232 67/21/28/342672128 FSLNYYZJXMGKHK-UHFFFAOYSA-N 0 205.644 BG 3.009 0 Anodyne ref BGAARN Cc1ccc2nc(Cl)c(C=O)cc2c1 COc1ccc(/C=N/c2ccccc2)cc1O ZINC000000065202 04/92/92/175049292 WEBGNOFPKPMJDB-XNTDXEJSSA-N -1 227.263 BG 3.151 3 Mild high BGEAHM COc1ccc(/C=N/c2ccccc2)cc1[O-] COc1ccc(/C=N/c2ccccc2)cc1O ZINC000000065202 04/92/91/175049291 WEBGNOFPKPMJDB-XNTDXEJSSA-N 0 227.263 BG 3.151 0 Mild ref BGEARN COc1ccc(/C=N/c2ccccc2)cc1O Cc1ccc(/N=C/c2cccc(O)c2O)cc1C ZINC000000065569 35/95/11/178359511 BRRRJEDOMQFETE-CXUHLZMHSA-N -1 241.29 BG 3.465 3 Mild high BGEAHM Cc1ccc(/N=C/c2cccc([O-])c2O)cc1C Cc1ccc(/N=C/c2cccc(O)c2O)cc1C ZINC000000065569 35/95/09/178359509 BRRRJEDOMQFETE-CXUHLZMHSA-N 0 241.29 BG 3.465 0 Mild ref BGEARN Cc1ccc(/N=C/c2cccc(O)c2O)cc1C Cc1ccccc1/C=N/c1ccc(O)cc1 ZINC000000065647 24/50/14/179245014 UOBLBEDCLBTNGC-XNTDXEJSSA-N -1 211.264 BG 3.451 3 Mild high BGEAHM Cc1ccccc1/C=N/c1ccc([O-])cc1 Cc1ccccc1/C=N/c1ccc(O)cc1 ZINC000000065647 24/50/09/179245009 UOBLBEDCLBTNGC-XNTDXEJSSA-N 0 211.264 BG 3.451 0 Mild ref BGEARN Cc1ccccc1/C=N/c1ccc(O)cc1 N#Cc1ccc(/C=N/c2cccc(C#N)c2)cc1 ZINC000000065788 82/18/90/383821890 WEBZGRKSDMLPJO-WOJGMQOQSA-N 0 231.258 BG 3.181 0 Mild ref BGEARN N#Cc1ccc(/C=N/c2cccc(C#N)c2)cc1 COc1ccc(/C=N/c2cccc(C#N)c2)cc1 ZINC000000065852 04/91/81/175049181 QSMLMKHMCNXWTP-GZTJUZNOSA-N 0 236.274 BG 3.317 0 Mild ref BGEARN COc1ccc(/C=N/c2cccc(C#N)c2)cc1 Cc1cccc(C(=O)Nc2cccc(C#N)c2)c1 ZINC000000066189 60/51/00/388605100 VTPGIUMSTZHXMS-UHFFFAOYSA-N 0 236.274 BG 3.119 0 Mild ref BGEARN Cc1cccc(C(=O)Nc2cccc(C#N)c2)c1 COC(=O)c1sc2ccccc2c1Cl ZINC000000066852 67/24/13/342672413 VAPMGETZRJYSLW-UHFFFAOYSA-N 0 226.684 BG 3.341 0 Anodyne ref BGAARN COC(=O)c1sc2ccccc2c1Cl O=C(NCCC1=CCCCC1)c1ccc(F)cc1 ZINC000000068703 15/32/95/182153295 FLUJDWNFMMMLFN-UHFFFAOYSA-N 0 247.313 BG 3.446 0 Anodyne ref BGAARN O=C(NCCC1=CCCCC1)c1ccc(F)cc1 O=C(/C=C/c1ccco1)Nc1ccc(F)cc1 ZINC000000070493 82/12/01/383821201 ZRPVRTIPVIEWRZ-BQYQJAHWSA-N 0 231.226 BG 3.071 0 Anodyne ref BGAARN O=C(/C=C/c1ccco1)Nc1ccc(F)cc1 O=C(/C=C/c1ccco1)NCCC1=CCCCC1 ZINC000000070529 82/18/74/383821874 OFQKQEQONJVUGV-CMDGGOBGSA-N 0 245.322 BG 3.3 0 Anodyne ref BGAARN O=C(/C=C/c1ccco1)NCCC1=CCCCC1 CCc1ccc(OC(=O)/C=C/c2ccco2)cc1 ZINC000000070797 82/32/65/171823265 ZTQWZOJVPMWZQC-MDZDMXLPSA-N 0 242.274 BG 3.461 0 Anodyne ref BGAARN CCc1ccc(OC(=O)/C=C/c2ccco2)cc1 O=C(Oc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000000070841 20/26/04/344202604 JHTMKRHSWHPMNK-UHFFFAOYSA-N 0 249.266 BG 3.081 0 Bother ref BGBARN O=C(Oc1ccccc1[N+](=O)[O-])C1CCCCC1 Cc1ccccc1C(=O)Nc1ccccc1F ZINC000000073197 25/23/67/179252367 GUHKGNBWSKJZPY-UHFFFAOYSA-N 0 229.254 BG 3.386 0 Anodyne ref BGAARN Cc1ccccc1C(=O)Nc1ccccc1F Cc1cccc(C(=O)NC2CCCCC2)c1 ZINC000000073772 01/47/72/179014772 FNTGEXAHADFYNU-UHFFFAOYSA-N 0 217.312 BG 3.058 0 Anodyne ref BGAARN Cc1cccc(C(=O)NC2CCCCC2)c1 O=Cc1ccc(Sc2nc3ccccc3[nH]2)o1 ZINC000000075657 82/41/67/383824167 CATAEVIKQDVMNF-UHFFFAOYSA-N 0 244.275 BG 3.12 0 Anodyne ref BGAARN O=Cc1ccc(Sc2nc3ccccc3[nH]2)o1 COC(=O)c1ccc(-c2ccccc2)cc1 ZINC000000086788 82/39/67/383823967 GATUGNVDXMYTJX-UHFFFAOYSA-N 0 212.248 BG 3.14 0 Anodyne ref BGAARN COC(=O)c1ccc(-c2ccccc2)cc1 CC1CCN(C(=S)Nc2ccccc2)CC1 ZINC000000086916 17/73/66/168177366 WXYKAMQINZQPRT-UHFFFAOYSA-N 0 234.368 BG 3.115 0 Anodyne ref BGAARN CC1CCN(C(=S)Nc2ccccc2)CC1 Oc1ccccc1NC(=S)Nc1ccccc1 ZINC000000086930 30/34/18/183303418 CQOHACLBKAAZBM-UHFFFAOYSA-N -1 244.319 BG 3.201 3 Anodyne high BGAAHM [O-]c1ccccc1NC(=S)Nc1ccccc1 Oc1ccccc1NC(=S)Nc1ccccc1 ZINC000000086930 30/34/16/183303416 CQOHACLBKAAZBM-UHFFFAOYSA-N 0 244.319 BG 3.201 0 Anodyne ref BGAARN Oc1ccccc1NC(=S)Nc1ccccc1 O=C(NC1CCCCC1)N1CCc2ccccc21 ZINC000000094210 11/26/99/182112699 OSIPNWACISSEHG-UHFFFAOYSA-N 0 244.338 BG 3.091 0 Anodyne ref BGAARN O=C(NC1CCCCC1)N1CCc2ccccc21 CCc1cccc(C)c1NC(=O)c1ccncc1 ZINC000000119462 85/36/97/171853697 NRRMYFSCWAQAFU-UHFFFAOYSA-N 0 240.306 BG 3.205 0 Anodyne ref BGAARN CCc1cccc(C)c1NC(=O)c1ccncc1 Nc1cccc(-c2nc3ccccc3o2)c1 ZINC000000122894 67/57/30/342675730 WHVJDKRJPAKQIO-UHFFFAOYSA-N 0 210.236 BG 3.077 0 Anodyne ref BGAARN Nc1cccc(-c2nc3ccccc3o2)c1 Nc1ccc(-c2nc3ccccc3o2)cc1 ZINC000000122960 67/57/96/342675796 XZYQBYQGHHGXBC-UHFFFAOYSA-N 0 210.236 BG 3.077 0 Anodyne ref BGAARN Nc1ccc(-c2nc3ccccc3o2)cc1 Cc1ccc(/N=C/c2ccc(C)o2)c(O)c1 ZINC000000125081 36/02/74/178360274 XGZODPVBKWSTTK-RIYZIHGNSA-N -1 215.252 BG 3.353 3 Mild high BGEAHM Cc1ccc(/N=C/c2ccc(C)o2)c([O-])c1 Cc1ccc(/N=C/c2ccc(C)o2)c(O)c1 ZINC000000125081 36/02/71/178360271 XGZODPVBKWSTTK-RIYZIHGNSA-N 0 215.252 BG 3.353 0 Mild ref BGEARN Cc1ccc(/N=C/c2ccc(C)o2)c(O)c1 Cc1ccc(/N=C/c2cccc(O)c2O)cc1F ZINC000000125166 36/04/12/178360412 DYLCDUHNMSDRHC-LZYBPNLTSA-N -1 245.253 BG 3.296 3 Mild high BGEAHM Cc1ccc(/N=C/c2cccc([O-])c2O)cc1F Cc1ccc(/N=C/c2cccc(O)c2O)cc1F ZINC000000125166 36/04/10/178360410 DYLCDUHNMSDRHC-LZYBPNLTSA-N 0 245.253 BG 3.296 0 Mild ref BGEARN Cc1ccc(/N=C/c2cccc(O)c2O)cc1F Cc1ccccc1C(=O)Nc1ccccc1C#N ZINC000000125380 25/21/60/179252160 PAVTYEMZZOGVEM-UHFFFAOYSA-N 0 236.274 BG 3.119 0 Mild ref BGEARN Cc1ccccc1C(=O)Nc1ccccc1C#N N#Cc1ccccc1NC(=O)/C=C/c1ccccc1 ZINC000000134212 14/82/92/181148292 KEZKCEUPWHCJOV-ZHACJKMWSA-N 0 248.285 BG 3.21 0 Mild ref BGEARN N#Cc1ccccc1NC(=O)/C=C/c1ccccc1 CCC(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000000142033 24/29/98/168242998 LHMVKQWXRUZZJG-UHFFFAOYSA-N 0 218.083 BG 3.342 0 Anodyne ref BGAARN CCC(=O)Nc1cc(Cl)cc(Cl)c1 O=C(NCCC1=CCCCC1)c1ccccc1 ZINC000000142034 15/33/28/182153328 STZFSVDIZBFOTM-UHFFFAOYSA-N 0 229.323 BG 3.307 0 Anodyne ref BGAARN O=C(NCCC1=CCCCC1)c1ccccc1 Cc1cccc(OCC(=O)Nc2ccccc2)c1 ZINC000000142171 16/30/21/179163021 GPPURKNHFFZLAZ-UHFFFAOYSA-N 0 241.29 BG 3.013 0 Anodyne ref BGAARN Cc1cccc(OCC(=O)Nc2ccccc2)c1 CCCC(=O)Nc1ccccc1NC(=O)CCC ZINC000000142298 56/62/67/168566267 GEMDYKDBNGRQOI-UHFFFAOYSA-N 0 248.326 BG 3.164 0 Anodyne ref BGAARN CCCC(=O)Nc1ccccc1NC(=O)CCC Cc1ccc(C(=O)N[C@@H](C)c2ccccc2)cc1 ZINC000000142905 42/31/07/178423107 QYZVNRJWKFCVMG-ZDUSSCGKSA-N 0 239.318 BG 3.486 0 Anodyne ref BGAARN Cc1ccc(C(=O)N[C@@H](C)c2ccccc2)cc1 Cc1ccc(C(=O)N[C@H](C)c2ccccc2)cc1 ZINC000000142908 43/07/11/178430711 QYZVNRJWKFCVMG-CYBMUJFWSA-N 0 239.318 BG 3.486 0 Anodyne ref BGAARN Cc1ccc(C(=O)N[C@H](C)c2ccccc2)cc1 Cc1ccccc1C(=O)NC1CCCCC1 ZINC000000142909 25/01/89/179250189 MDXWMUYRRDYWKZ-UHFFFAOYSA-N 0 217.312 BG 3.058 0 Anodyne ref BGAARN Cc1ccccc1C(=O)NC1CCCCC1 Nc1cccc(C(=O)Nc2cccc(Cl)c2)c1 ZINC000000143001 67/69/93/342676993 PCTFHCZRFZZANY-UHFFFAOYSA-N 0 246.697 BG 3.175 0 Anodyne ref BGAARN Nc1cccc(C(=O)Nc2cccc(Cl)c2)c1 Cc1cccc(C(=O)Nc2ccc(C#N)cc2)c1 ZINC000000143161 02/53/27/179025327 SUGBEAJLPVSROX-UHFFFAOYSA-N 0 236.274 BG 3.119 0 Mild ref BGEARN Cc1cccc(C(=O)Nc2ccc(C#N)cc2)c1 Cc1ccccc1C(=O)N1CCc2ccccc21 ZINC000000143314 24/86/94/179248694 IIRMAUHQDXLCPP-UHFFFAOYSA-N 0 237.302 BG 3.198 0 Anodyne ref BGAARN Cc1ccccc1C(=O)N1CCc2ccccc21 Cc1ccc(C(=O)Nc2ccccc2)cc1 ZINC000000143382 42/65/59/387426559 PQEOPHYIUYAVDQ-UHFFFAOYSA-N 0 211.264 BG 3.247 0 Anodyne ref BGAARN Cc1ccc(C(=O)Nc2ccccc2)cc1 CC(=O)Nc1ccc(Oc2ccccc2)cc1 ZINC000000143410 67/70/54/342677054 JIHOMPVYRSEHKW-UHFFFAOYSA-N 0 227.263 BG 3.437 0 Anodyne ref BGAARN CC(=O)Nc1ccc(Oc2ccccc2)cc1 Cc1ccccc1C(=O)Nc1ccc(C#N)cc1 ZINC000000143438 25/27/15/179252715 OEWXOXDMFRGRLJ-UHFFFAOYSA-N 0 236.274 BG 3.119 0 Mild ref BGEARN Cc1ccccc1C(=O)Nc1ccc(C#N)cc1 O=C(c1ccccc1)N1CCCc2ccccc21 ZINC000000143451 31/28/96/132312896 CEBQABUYWIZVHQ-UHFFFAOYSA-N 0 237.302 BG 3.28 0 Anodyne ref BGAARN O=C(c1ccccc1)N1CCCc2ccccc21 Cc1ccc(NCc2ccccc2CO)c(C)c1 ZINC000000143610 67/70/77/342677077 MZOMKLHFMNWLFW-UHFFFAOYSA-N 0 241.334 BG 3.408 0 Anodyne ref BGAARN Cc1ccc(NCc2ccccc2CO)c(C)c1 O=C(O)c1ccccc1Nc1ccccc1 ZINC000000154642 67/77/81/342677781 ZWJINEZUASEZBH-UHFFFAOYSA-N -1 213.236 BG 3.128 0 Anodyne ref BGAARM O=C([O-])c1ccccc1Nc1ccccc1 in-vitro CN(C(=O)Nc1ccccc1)C1CCCCC1 ZINC000000154840 32/44/26/172324426 UETYSSIXKKSCFG-UHFFFAOYSA-N 0 232.327 BG 3.483 0 Anodyne ref BGAARN CN(C(=O)Nc1ccccc1)C1CCCCC1 COc1ccc(-c2nc3cc(N)ccc3o2)cc1 ZINC000000154944 04/03/84/175040384 CZSVPGARXVXXOX-UHFFFAOYSA-N 0 240.262 BG 3.086 0 Anodyne ref BGAARN COc1ccc(-c2nc3cc(N)ccc3o2)cc1 COC(=O)c1ccc(OCc2ccccc2)cc1 ZINC000000156676 83/52/75/383835275 ZLLQTDQOTFCCDF-UHFFFAOYSA-N 0 242.274 BG 3.052 0 Anodyne ref BGAARN COC(=O)c1ccc(OCc2ccccc2)cc1 O=Cc1ccc(-c2cccc(Cl)c2)o1 ZINC000000158143 83/55/68/383835568 FIGLPGGFAIZKFQ-UHFFFAOYSA-N 0 206.628 BG 3.413 0 Anodyne ref BGAARN O=Cc1ccc(-c2cccc(Cl)c2)o1 FC(F)(F)c1ccc(Br)cc1 ZINC000000164872 89/25/81/180892581 XLQSXGGDTHANLN-UHFFFAOYSA-N 0 225.007 BG 3.468 0 Anodyne ref BGAARN FC(F)(F)c1ccc(Br)cc1 C=CC[C@H]1Nc2ccccc2N[C@@H]1CC=C ZINC000000182678 89/26/29/355892629 MLKXLUABNFQTNB-VXGBXAGGSA-N 0 214.312 BG 3.413 0 Mild ref BGEARN C=CC[C@H]1Nc2ccccc2N[C@@H]1CC=C C=CC[C@@H]1Nc2ccccc2N[C@H]1CC=C ZINC000000182681 94/27/52/191942752 MLKXLUABNFQTNB-RYUDHWBXSA-N 0 214.312 BG 3.413 0 Mild ref BGEARN C=CC[C@@H]1Nc2ccccc2N[C@H]1CC=C Cc1ccc(C(=O)N2CCc3ccccc32)cc1 ZINC000000190916 84/07/26/383840726 HHQOFVLYUPEKNF-UHFFFAOYSA-N 0 237.302 BG 3.198 0 Anodyne ref BGAARN Cc1ccc(C(=O)N2CCc3ccccc32)cc1 CC(C)(C)NC(=O)Nc1cccc(Cl)c1 ZINC000000207848 62/44/41/166624441 YNEOHINYTJZRNL-UHFFFAOYSA-N 0 226.707 BG 3.26 0 Anodyne ref BGAARN CC(C)(C)NC(=O)Nc1cccc(Cl)c1 COc1cccc(NC(=O)c2cccc(F)c2)c1 ZINC000000235884 27/82/74/175278274 JVRLXRSVFNWGJR-UHFFFAOYSA-N 0 245.253 BG 3.087 0 Anodyne ref BGAARN COc1cccc(NC(=O)c2cccc(F)c2)c1 C[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)O ZINC000000241544 00/40/22/176004022 FUPGQEMJIGUBGO-LLVKDONJSA-N -1 242.274 BG 3.206 0 Anodyne ref BGAARM C[C@@H](Oc1ccc(-c2ccccc2)cc1)C(=O)[O-] CCCc1ccc(-c2ccc(C(=O)O)cc2)nc1 ZINC000000242076 82/36/49/345823649 MUUPNHJYELPKQX-UHFFFAOYSA-N -1 241.29 BG 3.399 0 Anodyne ref BGAARM CCCc1ccc(-c2ccc(C(=O)[O-])cc2)nc1 O=C(NC1CCCCC1)c1ccccc1Cl ZINC000000249033 11/46/59/182114659 QMRTZPNVQIUAHF-UHFFFAOYSA-N 0 237.73 BG 3.403 0 Anodyne ref BGAARN O=C(NC1CCCCC1)c1ccccc1Cl S=C(Nc1ccccc1)N1CCCCCC1 ZINC000000251337 31/13/62/183311362 ULNNAURUINOGHW-UHFFFAOYSA-N 0 234.368 BG 3.259 0 Anodyne ref BGAARN S=C(Nc1ccccc1)N1CCCCCC1