CCOc1cc(C=O)ccc1OC(=O)c1ccco1 ZINC000000033990 51/23/48/371512348 MKLYKPSRZZUUDT-UHFFFAOYSA-N 0 260.245 CF 2.71 0 Anodyne ref CFAARN CCOc1cc(C=O)ccc1OC(=O)c1ccco1 COc1ccc(C=O)cc1COc1ccccc1[N+](=O)[O-] ZINC000000035787 51/20/20/371512020 OJLZETGPULWKBY-UHFFFAOYSA-N 0 287.271 CF 2.995 0 Bother ref CFBARN COc1ccc(C=O)cc1COc1ccccc1[N+](=O)[O-] O=C(O)c1cc(-c2cccnc2)nc2ccccc12 ZINC000000035836 51/19/18/169511918 XQNXXNNXRWYNAS-UHFFFAOYSA-N -1 250.257 CF 2.995 0 Anodyne ref CFAARM O=C([O-])c1cc(-c2cccnc2)nc2ccccc12 CC(=O)c1ccc(NC(=O)COc2ccccc2)cc1 ZINC000000046938 51/69/78/371516978 DBWULBWIOTWXON-UHFFFAOYSA-N 0 269.3 CF 2.907 0 Anodyne ref CFAARN CC(=O)c1ccc(NC(=O)COc2ccccc2)cc1 O=C(O)COc1ccc(Br)cc1Cl ZINC000000064970 52/37/04/169523704 VCDBRFZHSIYFRO-UHFFFAOYSA-N -1 265.49 CF 2.566 0 Anodyne ref CFAARM O=C([O-])COc1ccc(Br)cc1Cl O=C(O)c1cc(-c2ccncc2)nc2ccccc12 ZINC000000065268 52/22/56/371522256 IBXRRNLSWGROLA-UHFFFAOYSA-N -1 250.257 CF 2.995 0 Anodyne ref CFAARM O=C([O-])c1cc(-c2ccncc2)nc2ccccc12 in-vitro COC(=O)c1c(-c2ccc(F)cc2)csc1N ZINC000000105287 53/78/87/169537887 DZCBSOKWTGUFCJ-UHFFFAOYSA-N 0 251.282 CF 2.923 0 Anodyne ref CFAARN COC(=O)c1c(-c2ccc(F)cc2)csc1N COC(=O)c1c(-c2ccc(OC)cc2)csc1N ZINC000000105315 53/09/80/371530980 ZGOUZQMMKJXNQQ-UHFFFAOYSA-N 0 263.318 CF 2.793 0 Anodyne ref CFAARN COC(=O)c1c(-c2ccc(OC)cc2)csc1N CC(=O)c1cccc(NC(=O)COc2ccccc2)c1 ZINC000000123726 53/53/70/371535370 ZBUHFJKYBCCWAC-UHFFFAOYSA-N 0 269.3 CF 2.907 0 Anodyne ref CFAARN CC(=O)c1cccc(NC(=O)COc2ccccc2)c1 CC(C)(Oc1ccc(Br)cc1)C(=O)O ZINC000000133874 53/80/47/371538047 NRDUHXQTTOHIJX-UHFFFAOYSA-N -1 259.099 CF 2.691 0 Anodyne ref CFAARM CC(C)(Oc1ccc(Br)cc1)C(=O)[O-] CCOc1c(Br)cc(C=O)cc1OC ZINC000000147911 55/42/80/169554280 UYORHVZNGJVQCF-UHFFFAOYSA-N 0 259.099 CF 2.669 0 Anodyne ref CFAARN CCOc1c(Br)cc(C=O)cc1OC Cc1nn(Cc2ccc(C(=O)O)o2)c(C)c1Br ZINC000000161364 54/48/30/371544830 TXZIGOBIIZTCGA-UHFFFAOYSA-N -1 299.124 CF 2.602 0 Anodyne ref CFAARM Cc1nn(Cc2ccc(C(=O)[O-])o2)c(C)c1Br CC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1 ZINC000000172385 54/98/72/371549872 ACNVYECYPGKMHB-UHFFFAOYSA-N -1 275.329 CF 2.69 1 Anodyne mid CFAAMM CC(=O)c1cccc([N-]S(=O)(=O)c2ccccc2)c1 CC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1 ZINC000000172385 54/98/65/371549865 ACNVYECYPGKMHB-UHFFFAOYSA-N 0 275.329 CF 2.69 0 Anodyne ref CFAARN CC(=O)c1cccc(NS(=O)(=O)c2ccccc2)c1 NC(=O)c1c(-c2ccc(Cl)cc2)csc1N ZINC000000179868 55/12/91/371551291 LCFOOVGQEWZAJK-UHFFFAOYSA-N 0 252.726 CF 2.75 0 Anodyne ref CFAARN NC(=O)c1c(-c2ccc(Cl)cc2)csc1N CC(C)(C)[C@H]1CCc2c(sc(N)c2C(N)=O)C1 ZINC000000191629 25/90/86/277259086 LBXIAHFWOUNFCV-ZETCQYMHSA-N 0 252.383 CF 2.58 0 Anodyne ref CFAARN CC(C)(C)[C@H]1CCc2c(sc(N)c2C(N)=O)C1 CC(C)(C)[C@@H]1CCc2c(sc(N)c2C(N)=O)C1 ZINC000000191631 23/84/69/277238469 LBXIAHFWOUNFCV-SSDOTTSWSA-N 0 252.383 CF 2.58 0 Anodyne ref CFAARN CC(C)(C)[C@@H]1CCc2c(sc(N)c2C(N)=O)C1 CCC(C)(C)[C@H]1CCc2c(sc(N)c2C(N)=O)C1 ZINC000000218451 58/28/03/278582803 GFSZVGGFYXGNQA-QMMMGPOBSA-N 0 266.41 CF 2.97 0 Anodyne ref CFAARN CCC(C)(C)[C@H]1CCc2c(sc(N)c2C(N)=O)C1 aggregator CCC(C)(C)[C@@H]1CCc2c(sc(N)c2C(N)=O)C1 ZINC000000218454 44/92/65/393449265 GFSZVGGFYXGNQA-MRVPVSSYSA-N 0 266.41 CF 2.97 0 Anodyne ref CFAARN CCC(C)(C)[C@@H]1CCc2c(sc(N)c2C(N)=O)C1 aggregator CCn1c(-c2ccc(OC)c(OC)c2)n[nH]c1=S ZINC000000244820 56/74/89/371567489 VNNWZCWDOJBXTQ-UHFFFAOYSA-N -1 265.338 CF 2.645 1 Anodyne mid CFAAMM CCn1c(-c2ccc(OC)c(OC)c2)n[n-]c1=S CCn1c(-c2ccc(OC)c(OC)c2)n[nH]c1=S ZINC000000244820 56/74/80/371567480 VNNWZCWDOJBXTQ-UHFFFAOYSA-N 0 265.338 CF 2.645 0 Anodyne ref CFAARN CCn1c(-c2ccc(OC)c(OC)c2)n[nH]c1=S C=CCn1c(-c2ccc(OC)c(OC)c2)n[nH]c1=S ZINC000000245347 56/82/33/371568233 JCRDSESGVZXDSC-UHFFFAOYSA-N -1 277.349 CF 2.811 1 Mild mid CFEAMM C=CCn1c(-c2ccc(OC)c(OC)c2)n[n-]c1=S C=CCn1c(-c2ccc(OC)c(OC)c2)n[nH]c1=S ZINC000000245347 56/82/16/371568216 JCRDSESGVZXDSC-UHFFFAOYSA-N 0 277.349 CF 2.811 0 Mild ref CFEARN C=CCn1c(-c2ccc(OC)c(OC)c2)n[nH]c1=S COc1cc(C=O)ccc1OC(=O)c1cccs1 ZINC000000266787 59/19/87/169591987 ZOLFWKYWRIZFDP-UHFFFAOYSA-N 0 262.286 CF 2.788 0 Anodyne ref CFAARN COc1cc(C=O)ccc1OC(=O)c1cccs1 COc1ccc(OC)c(-n2cnc3cc(C(=O)O)ccc32)c1 ZINC000000266897 57/34/93/371573493 QMADMVRXHYGRER-UHFFFAOYSA-N -1 298.298 CF 2.741 0 Anodyne ref CFAARM COc1ccc(OC)c(-n2cnc3cc(C(=O)[O-])ccc32)c1 O=C(O)CCC(=O)Nc1ccc(N2CCCCCC2)cc1 ZINC000000266951 57/36/28/371573628 QIQXSDGBZBAACD-UHFFFAOYSA-N -1 290.363 CF 2.87 0 Anodyne ref CFAARM O=C([O-])CCC(=O)Nc1ccc(N2CCCCCC2)cc1 CCn1c(-c2cc(OC)c(OC)c(OC)c2)n[nH]c1=S ZINC000000277145 57/63/53/371576353 GSWUODWZESJTSQ-UHFFFAOYSA-N -1 295.364 CF 2.653 1 Anodyne mid CFAAMM CCn1c(-c2cc(OC)c(OC)c(OC)c2)n[n-]c1=S CCn1c(-c2cc(OC)c(OC)c(OC)c2)n[nH]c1=S ZINC000000277145 57/63/42/371576342 GSWUODWZESJTSQ-UHFFFAOYSA-N 0 295.364 CF 2.653 0 Anodyne ref CFAARN CCn1c(-c2cc(OC)c(OC)c(OC)c2)n[nH]c1=S Nc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1 ZINC000000286765 57/84/80/371578480 RBJGYDGKXTYSSL-UHFFFAOYSA-N -1 282.752 CF 2.723 3 Anodyne high CFAAHM Nc1ccc(S(=O)(=O)[N-]c2ccc(Cl)cc2)cc1 in-vivo Nc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1 ZINC000000286765 57/84/74/371578474 RBJGYDGKXTYSSL-UHFFFAOYSA-N 0 282.752 CF 2.723 0 Anodyne ref CFAARN Nc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2)cc1 in-vivo Cc1cc(C)c(NS(=O)(=O)c2ccc(N)cc2)c(C)c1 ZINC000000286799 57/79/43/371577943 XBMADYXUVVGVFF-UHFFFAOYSA-N -1 290.388 CF 2.995 3 Anodyne high CFAAHM Cc1cc(C)c([N-]S(=O)(=O)c2ccc(N)cc2)c(C)c1 Cc1cc(C)c(NS(=O)(=O)c2ccc(N)cc2)c(C)c1 ZINC000000286799 57/79/38/371577938 XBMADYXUVVGVFF-UHFFFAOYSA-N 0 290.388 CF 2.995 0 Anodyne ref CFAARN Cc1cc(C)c(NS(=O)(=O)c2ccc(N)cc2)c(C)c1 COc1ccc(C(=O)Oc2ccc(C=O)cc2)cc1 ZINC000000303226 58/25/50/371582550 VYORLHNCZWLOHJ-UHFFFAOYSA-N 0 256.257 CF 2.727 0 Anodyne ref CFAARN COc1ccc(C(=O)Oc2ccc(C=O)cc2)cc1 O=C(O)c1cc(-c2ccccn2)nc2ccccc12 ZINC000000312247 21/97/45/304219745 WSYCFYURDIXHNT-UHFFFAOYSA-N -1 250.257 CF 2.995 0 Anodyne ref CFAARM O=C([O-])c1cc(-c2ccccn2)nc2ccccc12 Nc1sc2c(c1C(=O)N1CCCCC1)CCCC2 ZINC000000316022 50/68/46/303506846 NSQDUMFSCVOMPZ-UHFFFAOYSA-N 0 264.394 CF 2.835 0 Anodyne ref CFAARN Nc1sc2c(c1C(=O)N1CCCCC1)CCCC2 COc1ccc(C=O)cc1COc1ccc(C#N)cc1 ZINC000000335391 58/92/99/371589299 CPIXHAGRFHZALO-UHFFFAOYSA-N 0 267.284 CF 2.958 0 Mild ref CFEARN COc1ccc(C=O)cc1COc1ccc(C#N)cc1 CCOc1cc(C=O)c(Br)cc1OC ZINC000000335429 58/90/10/371589010 YUXVFHKEALFFSX-UHFFFAOYSA-N 0 259.099 CF 2.669 0 Anodyne ref CFAARN CCOc1cc(C=O)c(Br)cc1OC CC(=O)c1ccc(NC(=O)[C@H]2CCCC[C@H]2C(=O)O)cc1 ZINC000000341417 59/12/27/371591227 ZUQGGJINTUPOSO-UONOGXRCSA-N -1 289.331 CF 2.719 0 Anodyne ref CFAARM CC(=O)c1ccc(NC(=O)[C@H]2CCCC[C@H]2C(=O)[O-])cc1 CC(=O)c1ccc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)O)cc1 ZINC000000341418 59/07/78/371590778 ZUQGGJINTUPOSO-ZIAGYGMSSA-N -1 289.331 CF 2.719 0 Anodyne ref CFAARM CC(=O)c1ccc(NC(=O)[C@@H]2CCCC[C@H]2C(=O)[O-])cc1 CC(=O)c1ccc(NC(=O)[C@H]2CCCC[C@@H]2C(=O)O)cc1 ZINC000000341419 59/09/77/371590977 ZUQGGJINTUPOSO-KBPBESRZSA-N -1 289.331 CF 2.719 0 Anodyne ref CFAARM CC(=O)c1ccc(NC(=O)[C@H]2CCCC[C@@H]2C(=O)[O-])cc1 CC(=O)c1ccc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)O)cc1 ZINC000000341421 59/13/28/371591328 ZUQGGJINTUPOSO-KGLIPLIRSA-N -1 289.331 CF 2.719 0 Anodyne ref CFAARM CC(=O)c1ccc(NC(=O)[C@@H]2CCCC[C@@H]2C(=O)[O-])cc1 CCN(CC)C(=O)c1sc(N)c(C(=O)OC(C)C)c1C ZINC000000368994 59/69/01/371596901 DTTKSMRPORHRTD-UHFFFAOYSA-N 0 298.408 CF 2.686 0 Anodyne ref CFAARN CCN(CC)C(=O)c1sc(N)c(C(=O)OC(C)C)c1C Nc1sc2c(c1C(=O)NCc1cccnc1)CCCC2 ZINC000000374472 59/90/79/371599079 UAXNGJFJZHAKCY-UHFFFAOYSA-N 0 287.388 CF 2.534 0 Anodyne ref CFAARN Nc1sc2c(c1C(=O)NCc1cccnc1)CCCC2 CCc1c(C)sc(N)c1C(=O)NCc1cccnc1 ZINC000000374521 62/21/31/169622131 JTVIASQDTMEDAY-UHFFFAOYSA-N 0 275.377 CF 2.526 0 Anodyne ref CFAARN CCc1c(C)sc(N)c1C(=O)NCc1cccnc1 Cc1nc2sc3c(c2c(=O)n1N)CC[C@H](C(C)(C)C)C3 ZINC000000390119 60/41/84/371604184 IZMZLEDEZDKPJV-VIFPVBQESA-N 0 291.42 CF 2.631 0 Anodyne ref CFAARN Cc1nc2sc3c(c2c(=O)n1N)CC[C@H](C(C)(C)C)C3 Cc1nc2sc3c(c2c(=O)n1N)CC[C@@H](C(C)(C)C)C3 ZINC000000390120 14/55/51/279145551 IZMZLEDEZDKPJV-SECBINFHSA-N 0 291.42 CF 2.631 0 Anodyne ref CFAARN Cc1nc2sc3c(c2c(=O)n1N)CC[C@@H](C(C)(C)C)C3 COC(=O)c1c(-c2ccc(OC)c(OC)c2)csc1N ZINC000000442718 64/18/83/169641883 ZUSQWNRHCGOMKZ-UHFFFAOYSA-N 0 293.344 CF 2.801 0 Anodyne ref CFAARN COC(=O)c1c(-c2ccc(OC)c(OC)c2)csc1N COC(=O)c1c(-c2ccc(OC)cc2OC)csc1N ZINC000000442730 61/68/36/371616836 CITRNEKIFXSLSJ-UHFFFAOYSA-N 0 293.344 CF 2.801 0 Anodyne ref CFAARN COC(=O)c1c(-c2ccc(OC)cc2OC)csc1N COC(=O)c1ccc(COc2ccc(C=O)cc2)cc1 ZINC000000447268 61/66/72/371616672 QCMBUFDXULESGG-UHFFFAOYSA-N 0 270.284 CF 2.865 0 Anodyne ref CFAARN COC(=O)c1ccc(COc2ccc(C=O)cc2)cc1 CCOc1cc(C=O)cc(Br)c1OC ZINC000000453738 61/84/43/371618443 REGQXFPWCZJUGY-UHFFFAOYSA-N 0 259.099 CF 2.669 0 Anodyne ref CFAARN CCOc1cc(C=O)cc(Br)c1OC CCOc1cc(Br)c(C=O)cc1OC ZINC000000454191 64/46/74/169644674 WAOXYYVXSGMMFL-UHFFFAOYSA-N 0 259.099 CF 2.669 0 Anodyne ref CFAARN CCOc1cc(Br)c(C=O)cc1OC COc1ccc(C(=O)Oc2cccc(C=O)c2)cc1 ZINC000000565984 64/06/53/371640653 AZDDZTAYYQDDSA-UHFFFAOYSA-N 0 256.257 CF 2.727 0 Anodyne ref CFAARN COc1ccc(C(=O)Oc2cccc(C=O)c2)cc1 CC(=O)c1cccc(NC(=O)[C@H]2CCCC[C@H]2C(=O)O)c1 ZINC000000586786 64/32/88/371643288 MLPFDTLCMOBABK-UONOGXRCSA-N -1 289.331 CF 2.719 0 Anodyne ref CFAARM CC(=O)c1cccc(NC(=O)[C@H]2CCCC[C@H]2C(=O)[O-])c1 CCOc1ccc(-c2n[nH]cc2C=O)cc1Cl ZINC000000618040 67/60/01/169676001 RLCRFZUDXDARPS-UHFFFAOYSA-N 0 250.685 CF 2.941 0 Anodyne ref CFAARN CCOc1ccc(-c2n[nH]cc2C=O)cc1Cl CC(C)(C)C(=O)c1cn(CC(=O)O)c2ccccc12 ZINC000000817617 65/18/87/371651887 KWHJLJIDMPOHHZ-UHFFFAOYSA-N -1 259.305 CF 2.955 0 Anodyne ref CFAARM CC(C)(C)C(=O)c1cn(CC(=O)[O-])c2ccccc12 CCn1c(S)nnc1-c1cc(Cl)ccc1OC ZINC000001297054 79/41/00/326794100 JQCJLZNTDPXCNE-UHFFFAOYSA-N 0 269.757 CF 2.916 0 Anodyne ref CFAARN CCN1C(=S)N=NC1c1cc(Cl)ccc1OC COc1ccc(C(=O)Oc2ccc(C=O)cc2OC)cc1 ZINC000001438891 67/58/35/371675835 VEHXKUNAGOJDJB-UHFFFAOYSA-N 0 286.283 CF 2.736 0 Anodyne ref CFAARN COc1ccc(C(=O)Oc2ccc(C=O)cc2OC)cc1 COC(=O)c1c(N)sc(C(=O)Nc2ccccc2)c1C ZINC000001441472 70/61/94/169706194 BWKPWQXMESIWDK-UHFFFAOYSA-N 0 290.344 CF 2.678 0 Anodyne ref CFAARN COC(=O)c1c(N)sc(C(=O)Nc2ccccc2)c1C Cc1cc(Cl)ccc1OCc1nnc(S)n1C ZINC000002522210 20/71/75/346207175 ZFIDHFSYPWDWLK-UHFFFAOYSA-N 0 269.757 CF 2.645 0 Anodyne ref CFAARN Cc1cc(Cl)ccc1OCC1N=NC(=S)N1C Cn1c(S)nnc1COc1ccc(C(C)(C)C)cc1 ZINC000002522212 73/15/69/371731569 VFJHCIUJARGAOD-UHFFFAOYSA-N 0 277.393 CF 2.98 0 Anodyne ref CFAARN CN1C(=S)N=NC1COc1ccc(C(C)(C)C)cc1 CCn1c(S)nnc1COc1cc(C)ccc1C ZINC000002522220 73/15/77/371731577 DTCLFZJJHNANPH-UHFFFAOYSA-N 0 263.366 CF 2.783 0 Anodyne ref CFAARN CCN1C(=S)N=NC1COc1cc(C)ccc1C CCn1c(S)nnc1COc1ccc(C)c(C)c1 ZINC000002522227 73/20/08/371732008 CTXPCGMKEKORRJ-UHFFFAOYSA-N 0 263.366 CF 2.783 0 Anodyne ref CFAARN CCN1C(=S)N=NC1COc1ccc(C)c(C)c1 Cn1c(S)nnc1COc1cc(Cl)ccc1Cl ZINC000002522231 73/10/13/371731013 VYPDUEVSZKQUSS-UHFFFAOYSA-N 0 290.175 CF 2.99 0 Anodyne ref CFAARN CN1C(=S)N=NC1COc1cc(Cl)ccc1Cl Cc1cc(OCc2nnc(S)n2C)cc(C)c1Cl ZINC000002522232 80/20/55/169802055 XFFALXBKATXVSL-UHFFFAOYSA-N 0 283.784 CF 2.953 0 Anodyne ref CFAARN Cc1cc(OCC2N=NC(=S)N2C)cc(C)c1Cl C[C@@H](Oc1ccc(Br)cc1Cl)C(=O)O ZINC000002526125 73/34/65/371733465 OINRZNVTDBJWDL-RXMQYKEDSA-N -1 279.517 CF 2.954 0 Anodyne ref CFAARM C[C@@H](Oc1ccc(Br)cc1Cl)C(=O)[O-] C=CCn1c(S)nnc1COc1cc(C)cc(C)c1 ZINC000002526640 73/36/38/371733638 CFZKYSQSJFABLU-UHFFFAOYSA-N 0 275.377 CF 2.949 0 Mild ref CFEARN C=CCN1C(=S)N=NC1COc1cc(C)cc(C)c1 CCn1c(S)nnc1COc1cc(C)cc(C)c1 ZINC000002526641 80/28/52/169802852 KLWQAJFLTRDFOU-UHFFFAOYSA-N 0 263.366 CF 2.783 0 Anodyne ref CFAARN CCN1C(=S)N=NC1COc1cc(C)cc(C)c1 CCn1c(S)nnc1COc1ccc(F)cc1Cl ZINC000002526646 73/33/24/371733324 OIZMNXGLWAGLHD-UHFFFAOYSA-N 0 287.747 CF 2.958 0 Anodyne ref CFAARN CCN1C(=S)N=NC1COc1ccc(F)cc1Cl C[C@H](Oc1cccc(Cl)c1)c1nnc(S)n1C ZINC000002526647 73/31/21/371733121 DCOBIQZXJGKIRZ-ZETCQYMHSA-N 0 269.757 CF 2.897 0 Anodyne ref CFAARN C[C@H](Oc1cccc(Cl)c1)C1N=NC(=S)N1C Cc1cccc(O[C@@H](C)c2nnc(S)n2C)c1C ZINC000002526650 73/32/63/371733263 KGUXMBAOVJIPHT-JTQLQIEISA-N 0 263.366 CF 2.861 0 Anodyne ref CFAARN Cc1cccc(O[C@@H](C)C2N=NC(=S)N2C)c1C C=CCn1c(S)nnc1[C@H](C)Oc1ccc(OC)cc1 ZINC000002526655 80/28/08/169802808 IVMYIAUJRKKCNH-JTQLQIEISA-N 0 291.376 CF 2.901 0 Mild ref CFEARN C=CCN1C(=S)N=NC1[C@H](C)Oc1ccc(OC)cc1 C=CCn1c(S)nnc1COc1ccc(C)c(C)c1 ZINC000002526659 80/31/00/169803100 NLAXDVPFTGDESH-UHFFFAOYSA-N 0 275.377 CF 2.949 0 Mild ref CFEARN C=CCN1C(=S)N=NC1COc1ccc(C)c(C)c1 Cn1c(S)nnc1COc1cccc(C(F)(F)F)c1 ZINC000002526671 80/29/34/169802934 JAZIJYVOLZZRKK-UHFFFAOYSA-N 0 289.282 CF 2.702 0 Anodyne ref CFAARN CN1C(=S)N=NC1COc1cccc(C(F)(F)F)c1 C=CCn1c(-c2ccc(N(C)C)cc2)n[nH]c1=S ZINC000002526675 73/37/17/371733717 STLICZRBJOVEPW-UHFFFAOYSA-N -1 260.366 CF 2.86 1 Mild mid CFEAMM C=CCn1c(-c2ccc(N(C)C)cc2)n[n-]c1=S C=CCn1c(-c2ccc(N(C)C)cc2)n[nH]c1=S ZINC000002526675 73/37/08/371733708 STLICZRBJOVEPW-UHFFFAOYSA-N 0 260.366 CF 2.86 0 Mild ref CFEARN C=CCn1c(-c2ccc(N(C)C)cc2)n[nH]c1=S Cc1ccc(O[C@@H](C)c2nnc(S)n2C)c(C)c1 ZINC000002532701 80/40/88/169804088 LVZHKFDJIMXVJO-JTQLQIEISA-N 0 263.366 CF 2.861 0 Anodyne ref CFAARN Cc1ccc(O[C@@H](C)C2N=NC(=S)N2C)c(C)c1 Cc1nn(Cc2ccc(F)cc2Cl)c(C)c1N ZINC000002534302 73/30/59/371733059 PCYFSKARZNSSAM-UHFFFAOYSA-N 0 253.708 CF 2.923 0 Anodyne ref CFAARN Cc1nn(Cc2ccc(F)cc2Cl)c(C)c1N CCCCOc1ccc(-c2nnc(S)n2C)cc1 ZINC000002536715 73/44/65/371734465 MOEFMACKNTZORW-UHFFFAOYSA-N 0 263.366 CF 2.95 0 Anodyne ref CFAARN CCCCOc1ccc(C2N=NC(=S)N2C)cc1 CC(C)COc1ccc(-c2nnc(S)n2C)cc1 ZINC000002536718 73/48/23/371734823 OVTXCVOGUWTAKV-UHFFFAOYSA-N 0 263.366 CF 2.806 0 Anodyne ref CFAARN CC(C)COc1ccc(C2N=NC(=S)N2C)cc1 CCn1c(S)nnc1COc1ccc(F)c(Cl)c1 ZINC000002536735 80/46/91/169804691 PIPCJYHUOLPCNP-UHFFFAOYSA-N 0 287.747 CF 2.958 0 Anodyne ref CFAARN CCN1C(=S)N=NC1COc1ccc(F)c(Cl)c1 C[C@H](Oc1ccc(F)cc1F)c1n[nH]c(=S)n1C ZINC000002536745 73/50/79/371735079 FQQGIGOYRRRQNW-LURJTMIESA-N -1 271.292 CF 2.896 1 Anodyne mid CFAAMM C[C@H](Oc1ccc(F)cc1F)c1n[n-]c(=S)n1C C[C@H](Oc1ccc(F)cc1F)c1n[nH]c(=S)n1C ZINC000002536745 73/50/70/371735070 FQQGIGOYRRRQNW-LURJTMIESA-N 0 271.292 CF 2.896 0 Anodyne ref CFAARN C[C@H](Oc1ccc(F)cc1F)c1n[nH]c(=S)n1C Cc1c(-c2cc(C(=O)O)c3ccccc3n2)cnn1C ZINC000002537740 73/50/45/371735045 HIAGTHWYOVNDNJ-UHFFFAOYSA-N -1 267.288 CF 2.642 0 Anodyne ref CFAARM Cc1c(-c2cc(C(=O)[O-])c3ccccc3n2)cnn1C COc1ccc(C(=O)O)cc1Cn1nc(C)c(Cl)c1C ZINC000002545455 73/45/17/371734517 BLSYTCAUWBMMQT-UHFFFAOYSA-N -1 294.738 CF 2.908 0 Anodyne ref CFAARM COc1ccc(C(=O)[O-])cc1Cn1nc(C)c(Cl)c1C COc1cc(N)cc(S(=O)(=O)c2ccc(Cl)cc2)c1 ZINC000002549460 22/78/00/286227800 KEVFBGRKISZETC-UHFFFAOYSA-N 0 297.763 CF 2.764 0 Anodyne ref CFAARN COc1cc(N)cc(S(=O)(=O)c2ccc(Cl)cc2)c1 c1ccc(COc2ccc(N3CCNCC3)cc2)cc1 ZINC000002556736 73/65/28/371736528 BSYHPGDHIZWPSR-UHFFFAOYSA-N 0 268.36 CF 2.675 3 Clean high CFCAHN c1ccc(COc2ccc(N3CCNCC3)cc2)cc1 c1ccc(COc2ccc(N3CCNCC3)cc2)cc1 ZINC000002556736 73/65/19/371736519 BSYHPGDHIZWPSR-UHFFFAOYSA-N 1 268.36 CF 2.675 0 Clean ref CFCARO c1ccc(COc2ccc(N3CC[NH2+]CC3)cc2)cc1 COc1cc(C=O)ccc1OC(=O)C1CCCCC1 ZINC000002558347 80/86/00/169808600 YCEBTYIAJWTZQH-UHFFFAOYSA-N 0 262.305 CF 2.993 0 Anodyne ref CFAARN COc1cc(C=O)ccc1OC(=O)C1CCCCC1 Cc1ccc(-c2c(C)sc3nc(C)n(N)c(=O)c23)cc1 ZINC000002558374 73/67/30/371736730 PUIJVCFPPSNXQA-UHFFFAOYSA-N 0 285.372 CF 2.764 0 Anodyne ref CFAARN Cc1ccc(-c2c(C)sc3nc(C)n(N)c(=O)c23)cc1 Nc1sc2c(c1C(=O)NC1CCCC1)CCCC2 ZINC000002558484 73/66/55/371736655 QAGLYPZARQJAHK-UHFFFAOYSA-N 0 264.394 CF 2.882 0 Anodyne ref CFAARN Nc1sc2c(c1C(=O)NC1CCCC1)CCCC2 CC[C@H]1CCc2c(sc(N)c2C(=O)NC2CC2)C1 ZINC000002558492 80/86/67/169808667 AXFSSFJVDOIFRQ-QMMMGPOBSA-N 0 264.394 CF 2.737 0 Anodyne ref CFAARN CC[C@H]1CCc2c(sc(N)c2C(=O)NC2CC2)C1 Nc1sc2c(c1C(=O)NCc1ccccc1)CCC2 ZINC000002558495 73/66/50/371736650 XSBLBHSBKQYFIY-UHFFFAOYSA-N 0 272.373 CF 2.749 0 Anodyne ref CFAARN Nc1sc2c(c1C(=O)NCc1ccccc1)CCC2 CCc1c(C)sc(N)c1C(=O)N1CCCCC1 ZINC000002558522 36/85/41/281368541 CCFJZLLSLUHEPL-UHFFFAOYSA-N 0 252.383 CF 2.827 0 Anodyne ref CFAARN CCc1c(C)sc(N)c1C(=O)N1CCCCC1 C[C@H]1CCc2c(sc(N)c2C(=O)NCc2ccco2)C1 ZINC000002558527 73/60/49/371736049 JRKAOXFJRBMVPB-VIFPVBQESA-N 0 290.388 CF 2.978 0 Anodyne ref CFAARN C[C@H]1CCc2c(sc(N)c2C(=O)NCc2ccco2)C1 CCCn1c(S)nnc1-c1ccc(Br)o1 ZINC000002569165 73/80/45/371738045 OWJYPMPAOHAKPB-UHFFFAOYSA-N 0 288.17 CF 2.999 0 Anodyne ref CFAARN CCCN1C(=S)N=NC1c1ccc(Br)o1 COc1ccc(C=O)cc1COc1ccc([N+](=O)[O-])cc1 ZINC000002573198 73/83/81/371738381 CEIJZCASKXSWHG-UHFFFAOYSA-N 0 287.271 CF 2.995 0 Bother ref CFBARN COc1ccc(C=O)cc1COc1ccc([N+](=O)[O-])cc1 COc1ccc(C=O)cc1Cn1cc(Br)cn1 ZINC000002573203 73/86/34/371738634 ISRSQWIEFFNTDG-UHFFFAOYSA-N 0 295.136 CF 2.515 0 Anodyne ref CFAARN COc1ccc(C=O)cc1Cn1cc(Br)cn1 CCOc1cc(C=O)c(Br)cc1OC(C)=O ZINC000002573238 73/78/45/371737845 OFOKVBIFOWJOJN-UHFFFAOYSA-N 0 287.109 CF 2.586 0 Anodyne ref CFAARN CCOc1cc(C=O)c(Br)cc1OC(C)=O Cc1nn(Cc2c(F)cccc2Cl)c(C)c1N ZINC000002576726 81/23/55/169812355 VIZPWFGIFXOESP-UHFFFAOYSA-N 0 253.708 CF 2.923 0 Anodyne ref CFAARN Cc1nn(Cc2c(F)cccc2Cl)c(C)c1N CC[C@@H](Oc1ccc(Br)cc1)C(=O)O ZINC000002581485 73/96/98/371739698 SOOHCBKDVIPIIJ-SECBINFHSA-N -1 259.099 CF 2.691 0 Anodyne ref CFAARM CC[C@@H](Oc1ccc(Br)cc1)C(=O)[O-]