Nc1ccccc1Nc1ccccc1 ZINC000000058285 29/87/78/169298778 NFCPRRWCTNLGSN-UHFFFAOYSA-N 0 184.242 AG 3.012 0 Anodyne ref AGAARN Nc1ccccc1Nc1ccccc1 Cc1nc(-c2ccccc2)cs1 ZINC000000076753 92/58/08/342925808 XROORURTAQOYLW-UHFFFAOYSA-N 0 175.256 AG 3.119 0 Anodyne ref AGAARN Cc1nc(-c2ccccc2)cs1 in-vitro Clc1cnc(Cl)c(Cl)c1 ZINC000000084933 02/65/35/169026535 CNLIIAKAAMFCJG-UHFFFAOYSA-N 0 182.437 AG 3.042 0 Anodyne ref AGAARN Clc1cnc(Cl)c(Cl)c1 O=C1CCSc2ccc(Cl)cc21 ZINC000000106039 92/68/96/342926896 OKHUUKHZUNKSQA-UHFFFAOYSA-N 0 198.674 AG 3.019 0 Anodyne ref AGAARN O=C1CCSc2ccc(Cl)cc21 O=C(O)c1ccc(-c2ccccc2)cc1 ZINC000000157472 35/74/38/169357438 NNJMFJSKMRYHSR-UHFFFAOYSA-N -1 198.221 AG 3.052 0 Anodyne ref AGAARM O=C([O-])c1ccc(-c2ccccc2)cc1 Oc1ccc(Oc2ccccc2)cc1 ZINC000000158246 27/16/17/351271617 ZSBDGXGICLIJGD-UHFFFAOYSA-N 0 186.21 AG 3.185 0 Anodyne ref AGAARN Oc1ccc(Oc2ccccc2)cc1 in-vitro CC(C)(C)OC(=O)Nc1cccs1 ZINC000000158463 37/08/97/166370897 QTXXTRMGTVEBIN-UHFFFAOYSA-N 0 199.275 AG 3.095 0 Anodyne ref AGAARN CC(C)(C)OC(=O)Nc1cccs1 CC(C)(C)OC(=O)Nc1ccsc1 ZINC000000158474 37/12/26/166371226 PRWYQCYSADTIBZ-UHFFFAOYSA-N 0 199.275 AG 3.095 0 Anodyne ref AGAARN CC(C)(C)OC(=O)Nc1ccsc1 CC(=O)c1sc2ccccc2c1C ZINC000000162006 33/58/47/166335847 HBTQKSGOEOVCBN-UHFFFAOYSA-N 0 190.267 AG 3.412 0 Anodyne ref AGAARN CC(=O)c1sc2ccccc2c1C Nc1c(Cl)cc(Cl)cc1Cl ZINC000000164529 28/26/92/169282692 NATVSFWWYVJTAZ-UHFFFAOYSA-N 0 196.464 AG 3.229 0 Anodyne ref AGAARN Nc1c(Cl)cc(Cl)cc1Cl Cc1ccc2scc(CC#N)c2c1 ZINC000000172250 93/11/65/342931165 RRLULFXAPBEUDL-UHFFFAOYSA-N 0 187.267 AG 3.276 0 Mild ref AGEARN Cc1ccc2scc(CC#N)c2c1 Cc1nc2cccc3cccc([nH]1)c32 ZINC000000198687 93/16/79/342931679 HJXMORWPPSSVMF-UHFFFAOYSA-N 1 182.226 AG 3.025 2 Anodyne low AGAALO Cc1[nH]c2cccc3cccc([nH+]1)c32 Cc1nc2cccc3cccc([nH]1)c32 ZINC000000198687 93/16/78/342931678 HJXMORWPPSSVMF-UHFFFAOYSA-N 0 182.226 AG 3.025 0 Anodyne ref AGAARN Cc1nc2cccc3cccc([nH]1)c32 Oc1ccc(-c2ccc(F)cc2)cc1 ZINC000000329991 27/51/06/351275106 QSJNKJGPJVOGPK-UHFFFAOYSA-N 0 188.201 AG 3.198 0 Anodyne ref AGAARN Oc1ccc(-c2ccc(F)cc2)cc1 c1ccc(Sc2ccccn2)cc1 ZINC000000331984 27/54/16/351275416 DWBYVHWWZMMIOT-UHFFFAOYSA-N 0 187.267 AG 3.233 0 Anodyne ref AGAARN c1ccc(Sc2ccccn2)cc1 CC[C@@H](C)n1cccc(C=O)c1=S ZINC000000332228 50/08/76/167500876 CUGRTMPRQOQUAR-MRVPVSSYSA-N 0 195.287 AG 3.001 0 Anodyne ref AGAARN CC[C@@H](C)n1cccc(C=O)c1=S CC[C@H](C)n1cccc(C=O)c1=S ZINC000000332229 63/59/76/167635976 CUGRTMPRQOQUAR-QMMMGPOBSA-N 0 195.287 AG 3.001 0 Anodyne ref AGAARN CC[C@H](C)n1cccc(C=O)c1=S O=Cc1sc2ccccc2c1Cl ZINC000000332747 27/52/68/351275268 UFTPKLPCVLXBQY-UHFFFAOYSA-N 0 196.658 AG 3.367 0 Anodyne ref AGAARN O=Cc1sc2ccccc2c1Cl Cc1cc(Cl)nc2ccc(F)cc12 ZINC000000333000 93/37/04/342933704 NWUZTEJFFHETQP-UHFFFAOYSA-N 0 195.624 AG 3.336 0 Anodyne ref AGAARN Cc1cc(Cl)nc2ccc(F)cc12 c1cc(-c2ccsc2)cs1 ZINC000000334271 20/37/48/518203748 IAAQEGBHNXAHBF-UHFFFAOYSA-N 0 166.27 AG 3.477 0 Anodyne ref AGAARN c1cc(-c2ccsc2)cs1 N#CCc1cccc(Cl)c1Cl ZINC000000334880 10/46/29/169104629 CZLINJDTCHACEH-UHFFFAOYSA-N 0 186.041 AG 3.059 0 Mild ref AGEARN N#CCc1cccc(Cl)c1Cl Cc1cc(Cl)c(Cl)nc1Cl ZINC000000334917 93/39/94/342933994 DBOPDFFTUIMICA-UHFFFAOYSA-N 0 196.464 AG 3.35 0 Anodyne ref AGAARN Cc1cc(Cl)c(Cl)nc1Cl Cc1cccc(Oc2ccc(N)cc2)c1 ZINC000000335309 93/39/79/342933979 GYVLOVTVJKXIGZ-UHFFFAOYSA-N 0 199.253 AG 3.37 0 Clean ref AGCARN Cc1cccc(Oc2ccc(N)cc2)c1 Cc1ccccc1Oc1ccc(N)cc1 ZINC000000335312 93/40/62/342934062 JPCCVWJJMUIBJR-UHFFFAOYSA-N 0 199.253 AG 3.37 0 Clean ref AGCARN Cc1ccccc1Oc1ccc(N)cc1 Cc1ccc(-n2cccc2)cc1Cl ZINC000000336032 93/40/16/342934016 CGNNQGOLXHUUHO-UHFFFAOYSA-N 0 191.661 AG 3.439 0 Anodyne ref AGAARN Cc1ccc(-n2cccc2)cc1Cl CCCn1c(=S)oc2ccccc21 ZINC000000336583 11/59/17/167115917 CAVOYOJEBKCAMU-UHFFFAOYSA-N 0 193.271 AG 3.374 0 Anodyne ref AGAARN CCCn1c(=S)oc2ccccc21 CC(=O)Nc1c(C)ccc2ccccc12 ZINC000000337290 93/42/40/342934240 SGRWRTKJEQTSCK-UHFFFAOYSA-N 0 199.253 AG 3.107 0 Anodyne ref AGAARN CC(=O)Nc1c(C)ccc2ccccc12 CCC(=O)c1ccc(SC)cc1 ZINC000000337871 93/44/66/342934466 FTJGECIARDVRJC-UHFFFAOYSA-N 0 180.272 AG 3.001 0 Anodyne ref AGAARN CCC(=O)c1ccc(SC)cc1 COc1ccc(C(C)(C)C)cc1OC ZINC000000348140 24/67/24/168246724 FSWSUKGIUZLXKK-UHFFFAOYSA-N 0 194.274 AG 3.001 0 Anodyne ref AGAARN COc1ccc(C(C)(C)C)cc1OC CC1(C)Nc2cccc3cccc(c23)N1 ZINC000000392955 93/66/59/342936659 DETLTZYXZWIXIB-UHFFFAOYSA-N 0 198.269 AG 3.413 0 Clean ref AGCARN CC1(C)Nc2cccc3cccc(c23)N1 Cc1cc(Cl)nc2ccccc12 ZINC000000404326 93/84/51/342938451 PFEIMKNQOIFKSW-UHFFFAOYSA-N 0 177.634 AG 3.197 0 Anodyne ref AGAARN Cc1cc(Cl)nc2ccccc12 Oc1cccc(Nc2ccccc2)c1 ZINC000000404423 99/52/32/170995232 NDACNGSDAFKTGE-UHFFFAOYSA-N 0 185.226 AG 3.136 0 Anodyne ref AGAARN Oc1cccc(Nc2ccccc2)c1 CC(C)CCCc1ccncc1 ZINC000000967175 28/29/28/351282928 ZPLJAHIMDRYVIX-UHFFFAOYSA-N 0 163.264 AG 3.06 0 Anodyne ref AGABRN CC(C)CCCc1ccncc1 Cc1ccnc(-c2ccccc2)c1 ZINC000000967177 94/23/97/342942397 WWMRJCUZPJJWBC-UHFFFAOYSA-N 0 169.227 AG 3.057 0 Anodyne ref AGAARN Cc1ccnc(-c2ccccc2)c1 c1ccc2c3c([nH]c2c1)CCCC3 ZINC000000967256 48/01/86/169480186 XKLNOVWDVMWTOB-UHFFFAOYSA-N 0 171.243 AG 3.047 0 Anodyne ref AGAARN c1ccc2c3c([nH]c2c1)CCCC3 CC(=O)c1ccc2ccccc2c1 ZINC000000967335 41/11/11/574411111 XSAYZAUNJMRRIR-UHFFFAOYSA-N 0 170.211 AG 3.042 0 Anodyne ref AGAARN CC(=O)c1ccc2ccccc2c1 in-man endogenous c1ccc([C@H]2O[C@@H]2c2ccccc2)cc1 ZINC000000967371 28/34/33/351283433 ARCJQKUWGAZPFX-ZIAGYGMSSA-N 0 196.249 AG 3.499 0 Anodyne ref AGAARN c1ccc([C@H]2O[C@@H]2c2ccccc2)cc1 in-vitro c1ccc([C@@H]2O[C@H]2c2ccccc2)cc1 ZINC000000967372 28/34/70/351283470 ARCJQKUWGAZPFX-KBPBESRZSA-N 0 196.249 AG 3.499 0 Anodyne ref AGAARN c1ccc([C@@H]2O[C@H]2c2ccccc2)cc1 in-vitro CC(=O)CCC=C1CCCCC1 ZINC000000967418 94/24/27/342942427 PQIXRYBSJBIXHN-UHFFFAOYSA-N 0 166.264 AG 3.246 0 Anodyne ref AGAARN CC(=O)CCC=C1CCCCC1 c1ccc(-c2ccsc2)cc1 ZINC000000967487 28/34/41/351283441 ZDQZVKVIYAPRON-UHFFFAOYSA-N 0 160.241 AG 3.415 0 Anodyne ref AGAARN c1ccc(-c2ccsc2)cc1 C(=C/c1ccncc1)\c1ccccc1 ZINC000001036714 04/50/28/166045028 QKHRGPYNTXRMSL-VOTSOKGWSA-N 0 181.238 AG 3.252 0 Anodyne ref AGAARN C(=C/c1ccncc1)\c1ccccc1 Cc1ccnc2c(Cl)cccc12 ZINC000001507359 89/17/49/168891749 GSPZRQVQAVVSTQ-UHFFFAOYSA-N 0 177.634 AG 3.197 0 Anodyne ref AGAARN Cc1ccnc2c(Cl)cccc12 Cc1c(C)c(C)c(C=O)c(C)c1C ZINC000001643306 95/36/75/342953675 RWOZGGOKRKSHKN-UHFFFAOYSA-N 0 176.259 AG 3.041 0 Anodyne ref AGAARN Cc1c(C)c(C)c(C=O)c(C)c1C C=C(c1ccccc1)c1ccccc1N ZINC000001643336 14/05/96/166140596 BYTLHHFRLLQLDH-UHFFFAOYSA-N 0 195.265 AG 3.33 0 Anodyne ref AGAARN C=C(c1ccccc1)c1ccccc1N CCN(CC)c1ccc(Cl)cc1 ZINC000001676322 17/26/02/167172602 LVIXJLIXKMZERD-UHFFFAOYSA-N 0 183.682 AG 3.186 0 Anodyne ref AGAARN CCN(CC)c1ccc(Cl)cc1 O=Cc1ccc(-c2ccccc2)cc1 ZINC000001677755 40/42/92/169404292 ISDBWOPVZKNQDW-UHFFFAOYSA-N 0 182.222 AG 3.166 0 Anodyne ref AGAARN O=Cc1ccc(-c2ccccc2)cc1 Cc1cc(C(C)(C)C)cc(C)c1O ZINC000001679614 95/76/14/342957614 MEPYMUOZRROULQ-UHFFFAOYSA-N 0 178.275 AG 3.307 0 Anodyne ref AGAARN Cc1cc(C(C)(C)C)cc(C)c1O Sc1ccc2ccccc2c1 ZINC000001680382 41/14/22/574411422 RFCQDOVPMUSZMN-UHFFFAOYSA-N 0 160.241 AG 3.129 2 Anodyne low AGAALN Sc1ccc2ccccc2c1 in-man endogenous Sc1ccc2ccccc2c1 ZINC000001680382 41/14/21/574411421 RFCQDOVPMUSZMN-UHFFFAOYSA-N -1 160.241 AG 3.129 0 Anodyne ref AGAARM [S-]c1ccc2ccccc2c1 in-man endogenous Cc1ccc(C(=O)c2ccccc2)cc1 ZINC000001680440 95/75/95/342957595 WXPWZZHELZEVPO-UHFFFAOYSA-N 0 196.249 AG 3.226 0 Anodyne ref AGAARN Cc1ccc(C(=O)c2ccccc2)cc1 in-vitro Cc1ccc([C@@H](O)c2ccccc2)cc1 ZINC000001680849 83/74/97/168837497 IHASOVONMUHDND-AWEZNQCLSA-N 0 198.265 AG 3.077 0 Anodyne ref AGAARN Cc1ccc([C@@H](O)c2ccccc2)cc1 Cc1ccc2ccccc2c1C#N ZINC000001707753 96/09/88/342960988 MSGUYMCVLYTSNE-UHFFFAOYSA-N 0 167.211 AG 3.02 0 Mild ref AGEARN Cc1ccc2ccccc2c1C#N CC(C)(C)c1ccc(C(C)(C)O)cc1 ZINC000001712092 38/42/35/166384235 NZOYROYEQWWFIB-UHFFFAOYSA-N 0 192.302 AG 3.212 0 Anodyne ref AGAARN CC(C)(C)c1ccc(C(C)(C)O)cc1 O=C(O)c1cccc(-c2ccccc2)c1 ZINC000001729991 00/22/81/171002281 XNLWJFYYOIRPIO-UHFFFAOYSA-N -1 198.221 AG 3.052 0 Anodyne ref AGAARM O=C([O-])c1cccc(-c2ccccc2)c1 O=C1C=Cc2cccc3cccc1c23 ZINC000001744968 00/24/36/171002436 WWBGWPHHLRSTFI-UHFFFAOYSA-N 0 180.206 AG 3.049 0 Mild ref AGEARN O=C1C=Cc2cccc3cccc1c23 CC1(C)[C@H]2CC[C@]1(C)CC2=S ZINC000002023132 96/73/27/342967327 SKEQOMRGTLUDPW-OIBJUYFYSA-N 0 168.305 AG 3.203 0 Clean ref AGCARN CC1(C)[C@H]2CC[C@]1(C)CC2=S CC1(C)[C@@H]2CC[C@@]1(C)CC2=S ZINC000002023135 70/04/04/166700404 SKEQOMRGTLUDPW-XCBNKYQSSA-N 0 168.305 AG 3.203 0 Clean ref AGCARN CC1(C)[C@@H]2CC[C@@]1(C)CC2=S CCCCCCCCCC#CCO ZINC000002023235 00/36/92/171003692 SOUKGGXCKPWFMZ-UHFFFAOYSA-N 0 182.307 AG 3.123 0 Mild ref AGEARN CCCCCCCCCC#CCO CCCCCCN[C@@H](C)C(C)C ZINC000002027670 00/39/57/171003957 BKTNILPJQUOZES-NSHDSACASA-N 1 171.328 AG 3.201 0 Anodyne ref AGAARO CCCCCC[NH2+][C@@H](C)C(C)C CCCCCCN[C@H](C)C(C)C ZINC000002027673 00/38/77/171003877 BKTNILPJQUOZES-LLVKDONJSA-N 1 171.328 AG 3.201 0 Anodyne ref AGAARO CCCCCC[NH2+][C@H](C)C(C)C CC[C@@H](C)N[C@@H](C)c1ccccc1 ZINC000002027683 47/51/23/167475123 PXWVXIBJJNDWLW-MNOVXSKESA-N 1 177.291 AG 3.136 0 Anodyne ref AGAARO CC[C@@H](C)[NH2+][C@@H](C)c1ccccc1 CC[C@H](C)N[C@@H](C)c1ccccc1 ZINC000002027684 61/78/68/167617868 PXWVXIBJJNDWLW-QWRGUYRKSA-N 1 177.291 AG 3.136 0 Anodyne ref AGAARO CC[C@H](C)[NH2+][C@@H](C)c1ccccc1 CC[C@@H](C)N[C@H](C)c1ccccc1 ZINC000002027685 30/24/48/351302448 PXWVXIBJJNDWLW-GHMZBOCLSA-N 1 177.291 AG 3.136 0 Anodyne ref AGAARO CC[C@@H](C)[NH2+][C@H](C)c1ccccc1 CC[C@H](C)N[C@H](C)c1ccccc1 ZINC000002027688 96/70/82/342967082 PXWVXIBJJNDWLW-WDEREUQCSA-N 1 177.291 AG 3.136 0 Anodyne ref AGAARO CC[C@H](C)[NH2+][C@H](C)c1ccccc1 CC(C)N[C@H](c1ccccc1)C(C)C ZINC000002027705 96/72/88/342967288 CDBFDZDLTLIVIP-ZDUSSCGKSA-N 1 191.318 AG 3.382 0 Anodyne ref AGAARO CC(C)[NH2+][C@H](c1ccccc1)C(C)C CC(C)N[C@@H](c1ccccc1)C(C)C ZINC000002027707 96/71/15/342967115 CDBFDZDLTLIVIP-CYBMUJFWSA-N 1 191.318 AG 3.382 0 Anodyne ref AGAARO CC(C)[NH2+][C@@H](c1ccccc1)C(C)C CC1(C)[C@@H]2CC[C@@]1(C)C(=S)C2 ZINC000002028342 69/96/51/166699651 AAADKYXUTOBAGS-XCBNKYQSSA-N 0 168.305 AG 3.203 0 Clean ref AGCARN CC1(C)[C@@H]2CC[C@@]1(C)C(=S)C2 in-vivo CC1(C)[C@H]2CC[C@]1(C)C(=S)C2 ZINC000002028345 96/76/44/342967644 AAADKYXUTOBAGS-OIBJUYFYSA-N 0 168.305 AG 3.203 0 Clean ref AGCARN CC1(C)[C@H]2CC[C@]1(C)C(=S)C2 Cc1ccc([C@H](O)c2ccccc2)cc1 ZINC000002140967 84/27/74/168842774 IHASOVONMUHDND-CQSZACIVSA-N 0 198.265 AG 3.077 0 Anodyne ref AGAARN Cc1ccc([C@H](O)c2ccccc2)cc1 Clc1cccc(-c2ccccc2)n1 ZINC000002382952 02/43/69/169024369 YTAGJMFBUAHVDP-UHFFFAOYSA-N 0 189.645 AG 3.402 0 Anodyne ref AGAARN Clc1cccc(-c2ccccc2)n1 Cc1cc(Cl)c2cc(F)ccc2n1 ZINC000002564315 97/73/77/342977377 GMMVVJJBQBYMNZ-UHFFFAOYSA-N 0 195.624 AG 3.336 0 Anodyne ref AGAARN Cc1cc(Cl)c2cc(F)ccc2n1 N#CC(c1ccccc1)c1ccccc1 ZINC000003860898 01/03/01/171010301 NEBPTMCRLHKPOB-UHFFFAOYSA-N 0 193.249 AG 3.342 0 Mild ref AGEARN N#CC(c1ccccc1)c1ccccc1 Cc1cc([N+](=O)[O-])c2ccccc2c1 ZINC000005046278 99/84/10/342998410 HKMFJWNUOWBRGF-UHFFFAOYSA-N 0 187.198 AG 3.056 0 Bother ref AGBARN Cc1cc([N+](=O)[O-])c2ccccc2c1 COc1ccc(C(C)(C)C)c(C)c1 ZINC000006070066 24/66/64/168246664 ZNQXIHJPCUGNJF-UHFFFAOYSA-N 0 178.275 AG 3.301 0 Anodyne ref AGAARN COc1ccc(C(C)(C)C)c(C)c1 Cc1cc2[nH]c3ccccc3c2cn1 ZINC000006070238 01/24/29/343012429 MNWHCHUSCPJCHV-UHFFFAOYSA-N 0 182.226 AG 3.025 3 Anodyne high AGAAHN Cc1cc2nc3ccccc3c-2c[nH]1 Cc1cc2[nH]c3ccccc3c2cn1 ZINC000006070238 01/24/28/343012428 MNWHCHUSCPJCHV-UHFFFAOYSA-N 1 182.226 AG 3.025 0 Anodyne ref AGAARO Cc1cc2[nH]c3ccccc3c2c[nH+]1 Cc1nccc2[nH]c3ccccc3c12 ZINC000006556497 01/50/53/343015053 LYLAKNJXZFOMHN-UHFFFAOYSA-N 0 182.226 AG 3.025 3 Anodyne high AGAAHN Cc1[nH]ccc2nc3ccccc3c1-2 Cc1nccc2[nH]c3ccccc3c12 ZINC000006556497 01/50/51/343015051 LYLAKNJXZFOMHN-UHFFFAOYSA-N 1 182.226 AG 3.025 0 Anodyne ref AGAARO Cc1[nH+]ccc2[nH]c3ccccc3c12 Cc1cc(=S)[nH]c2ccc(F)cc12 ZINC000006556550 01/51/90/343015190 VALXEXSRWIMJOG-UHFFFAOYSA-N -1 193.246 AG 3.345 3 Anodyne high AGAAHM Cc1cc(=S)[n-]c2ccc(F)cc12 Cc1cc(=S)[nH]c2ccc(F)cc12 ZINC000006556550 01/51/89/343015189 VALXEXSRWIMJOG-UHFFFAOYSA-N 0 193.246 AG 3.345 0 Anodyne ref AGAARN Cc1cc(=S)[nH]c2ccc(F)cc12 CC(C)(C)c1cccc(C(C)(C)O)c1 ZINC000007023239 38/60/74/166386074 JCMRQVLDMWYRHC-UHFFFAOYSA-N 0 192.302 AG 3.212 0 Anodyne ref AGAARN CC(C)(C)c1cccc(C(C)(C)O)c1 CC(=O)/C=C/c1sccc1N=[N+]=[N-] ZINC000008383148 02/10/73/171021073 SWRNNCSVKWAPKC-NSCUHMNNSA-N 0 193.231 AG 3.292 0 Mild ref AGEARN CC(=O)C=Cc1sccc1N=[N+]=[N-] c1ccc([C@@H]2O[C@@H]2c2ccccc2)cc1 ZINC000013523714 36/99/90/351369990 ARCJQKUWGAZPFX-OKILXGFUSA-N 0 196.249 AG 3.499 0 Mild ref AGEARN c1ccc([C@@H]2O[C@@H]2c2ccccc2)cc1 in-man Cc1ccc(C(C)(C)C)cc1[N+](=O)[O-] ZINC000019872718 06/27/19/343062719 HRVZKMAFMMNKGU-UHFFFAOYSA-N 0 193.246 AG 3.201 0 Bother ref AGBARN Cc1ccc(C(C)(C)C)cc1[N+](=O)[O-] CC(C)[C@@H](C)N[C@@H](C)c1ccccc1 ZINC000019878414 06/29/65/343062965 ZMZIQRWISWNDFB-NEPJUHHUSA-N 1 191.318 AG 3.382 0 Anodyne ref AGAARO CC(C)[C@@H](C)[NH2+][C@@H](C)c1ccccc1 CC(C)[C@H](C)N[C@@H](C)c1ccccc1 ZINC000019878416 60/24/46/166602446 ZMZIQRWISWNDFB-RYUDHWBXSA-N 1 191.318 AG 3.382 0 Anodyne ref AGAARO CC(C)[C@H](C)[NH2+][C@@H](C)c1ccccc1 CC(=O)c1oc2ccc(C)cc2c1C ZINC000034751474 33/51/18/166335118 WUJLHEYDSHCIIR-UHFFFAOYSA-N 0 188.226 AG 3.252 0 Anodyne ref AGAARN CC(=O)c1oc2ccc(C)cc2c1C N#C/C(Cl)=C1\CCc2ccccc21 ZINC000038973781 19/25/87/343192587 JIOKTJJUKXZRGS-KHPPLWFESA-N 0 189.645 AG 3.106 0 Reactive ref AGGARN N#C/C(Cl)=C1\CCc2ccccc21 CC(C)=C(C)c1ccc(C(=O)O)cc1 ZINC000039120446 07/61/25/171076125 ZELRASFYVOUIRY-UHFFFAOYSA-N -1 190.242 AG 3.198 0 Anodyne ref AGAARM CC(C)=C(C)c1ccc(C(=O)[O-])cc1 CC(C)=C(C)c1cccc(C(=O)O)c1 ZINC000060309235 10/23/40/171102340 ZIYWBEWMBVLFEP-UHFFFAOYSA-N -1 190.242 AG 3.198 0 Anodyne ref AGAARM CC(C)=C(C)c1cccc(C(=O)[O-])c1 Cc1c(O)cc2ccccc2c1C ZINC000168967091 34/13/70/344341370 DPQILBPFOYSPEV-UHFFFAOYSA-N 0 172.227 AG 3.162 0 Anodyne ref AGAARN Cc1c(O)cc2ccccc2c1C