COc1ccc(C(=O)CCC(=O)O)c2ccccc12 ZINC000000000446 50/82/48/371508248 FHGJSJFIQNQBCK-UHFFFAOYSA-N -1 258.273 CF 2.896 0 Anodyne ref CFAARM COc1ccc(C(=O)CCC(=O)[O-])c2ccccc12 in-man O=C(O)c1ccc(-c2ccc3ccccc3c2)[nH]c1=O ZINC000000015410 23/03/90/304230390 QCYPQYOTSRVMBR-UHFFFAOYSA-N -1 265.268 CF 2.893 0 Anodyne ref CFABRM O=C([O-])c1ccc(-c2ccc3ccccc3c2)[nH]c1=O Cc1sc(NC(=O)/C=C/c2ccco2)c(C(N)=O)c1C ZINC000000027711 50/81/01/169508101 BWMNAZMXXCCUIV-AATRIKPKSA-N 0 290.344 CF 2.709 0 Anodyne ref CFAARN Cc1sc(NC(=O)/C=C/c2ccco2)c(C(N)=O)c1C COC(=O)c1ccc(NC(=O)Cc2ccc(OC)cc2)cc1 ZINC000000029645 50/98/29/371509829 FAWMCWSVEMOTEN-UHFFFAOYSA-N 0 299.326 CF 2.663 0 Anodyne ref CFAARN COC(=O)c1ccc(NC(=O)Cc2ccc(OC)cc2)cc1 Cc1sc(NC(=O)Cc2ccccc2)c(C(N)=O)c1C ZINC000000035368 51/17/40/371511740 TYECYBKXFAPQOG-UHFFFAOYSA-N 0 288.372 CF 2.645 0 Anodyne ref CFAARN Cc1sc(NC(=O)Cc2ccccc2)c(C(N)=O)c1C Cc1sc(NC(=O)c2cccs2)c(C(N)=O)c1C ZINC000000035583 51/26/74/371512674 OTIUGBVMROZGTK-UHFFFAOYSA-N 0 280.374 CF 2.778 0 Anodyne ref CFAARN Cc1sc(NC(=O)c2cccs2)c(C(N)=O)c1C Cc1ccc(OCC(=O)N2CCc3ccccc32)cc1 ZINC000000037566 51/37/38/371513738 REFCMCLQZRSZCO-UHFFFAOYSA-N 0 267.328 CF 2.963 0 Anodyne ref CFAARN Cc1ccc(OCC(=O)N2CCc3ccccc32)cc1 COc1ccccc1OC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000000038454 51/36/40/371513640 CLQKJZGDJMBLRU-UHFFFAOYSA-N 0 273.244 CF 2.823 0 Bother ref CFBARN COc1ccccc1OC(=O)c1ccc([N+](=O)[O-])cc1 COc1ccccc1OC(=O)c1ccccc1[N+](=O)[O-] ZINC000000038458 51/35/58/371513558 WWFNFBJSPNFCMW-UHFFFAOYSA-N 0 273.244 CF 2.823 0 Bother ref CFBARN COc1ccccc1OC(=O)c1ccccc1[N+](=O)[O-] Cc1ccccc1OC(=O)COc1ccc([N+](=O)[O-])cc1 ZINC000000038472 51/43/78/371514378 XPFWLIFFGQNERS-UHFFFAOYSA-N 0 287.271 CF 2.888 0 Bother ref CFBARN Cc1ccccc1OC(=O)COc1ccc([N+](=O)[O-])cc1 O=C(NCCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000000038503 51/32/16/169513216 KDOMUCROZLBGCX-UHFFFAOYSA-N 0 270.288 CF 2.567 0 Bother ref CFBARN O=C(NCCc1ccccc1)c1cccc([N+](=O)[O-])c1 COC(=O)c1c(NC(=O)C2CC2)sc2c1CCCC2 ZINC000000038513 51/37/50/371513750 HYUUOECEUSDWTC-UHFFFAOYSA-N 0 279.361 CF 2.762 0 Anodyne ref CFAARN COC(=O)c1c(NC(=O)C2CC2)sc2c1CCCC2 O=C(COc1ccc([N+](=O)[O-])cc1)N1CCc2ccccc21 ZINC000000038525 51/33/23/371513323 PYDWFXVLNWXBEL-UHFFFAOYSA-N 0 298.298 CF 2.563 0 Bother ref CFBARN O=C(COc1ccc([N+](=O)[O-])cc1)N1CCc2ccccc21 Cc1ccc(OC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 ZINC000000038529 51/40/34/371514034 TWIVUQZDLPCRJZ-UHFFFAOYSA-N 0 287.271 CF 2.888 0 Bother ref CFBARN Cc1ccc(OC(=O)COc2ccc([N+](=O)[O-])cc2)cc1 Cc1cccc(OC(=O)COc2ccc([N+](=O)[O-])cc2)c1 ZINC000000038530 51/37/10/371513710 AQSPRSJZUSKDPQ-UHFFFAOYSA-N 0 287.271 CF 2.888 0 Bother ref CFBARN Cc1cccc(OC(=O)COc2ccc([N+](=O)[O-])cc2)c1 Cc1cc(C)n(C(=O)c2ccc(NC(=O)C3CC3)cc2)n1 ZINC000000038580 51/35/92/371513592 AJYNZXMQANAJHO-UHFFFAOYSA-N 0 283.331 CF 2.537 0 Anodyne ref CFAARN Cc1cc(C)n(C(=O)c2ccc(NC(=O)C3CC3)cc2)n1 O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ccccc1 ZINC000000038683 51/39/48/371513948 BHZRTFDAJFZYBG-UHFFFAOYSA-N 0 260.224 CF 2.986 0 Bother ref CFBARN O=C(Nc1cc([N+](=O)[O-])ccc1F)c1ccccc1 O=C(c1ccccc1[N+](=O)[O-])N1CCc2ccccc21 ZINC000000038741 26/32/85/296263285 SRVUVPFZFSKXHU-UHFFFAOYSA-N 0 268.272 CF 2.798 0 Bother ref CFBARN O=C(c1ccccc1[N+](=O)[O-])N1CCc2ccccc21 Cc1sc(NC(=O)c2ccccc2)c(C(N)=O)c1C ZINC000000038744 51/35/15/169513515 DFXDLTKPEXDEQC-UHFFFAOYSA-N 0 274.345 CF 2.716 0 Anodyne ref CFAARN Cc1sc(NC(=O)c2ccccc2)c(C(N)=O)c1C O=C(O)CCC(=O)Nc1ccc(Cl)c(Cl)c1 ZINC000000038761 51/40/83/371514083 WFQJCNSEYTZNFO-UHFFFAOYSA-N -1 262.092 CF 2.797 0 Anodyne ref CFAARM O=C([O-])CCC(=O)Nc1ccc(Cl)c(Cl)c1 N#Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000000038777 51/34/84/169513484 FLZXFSVFNRKBNP-UHFFFAOYSA-N 0 267.244 CF 2.719 0 Mild ref CFEARN N#Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1 N#Cc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000000038778 51/41/53/371514153 GUTSPDJJXFMPBK-UHFFFAOYSA-N 0 267.244 CF 2.719 0 Mild ref CFEARN N#Cc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1 Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(N)ccc32)cc1 ZINC000000038801 61/03/97/263610397 WCZDODNEUXVJGQ-MRXNPFEDSA-N 0 277.327 CF 2.795 0 Reactive ref CFGARN Cc1ccc([C@H]2C(C#N)=C(N)Oc3cc(N)ccc32)cc1 O=C(O)c1ccccc1C(=O)N1CCc2ccccc21 ZINC000000038810 51/39/60/371513960 MKCDWVZVPUZDRZ-UHFFFAOYSA-N -1 267.284 CF 2.588 0 Anodyne ref CFAARM O=C([O-])c1ccccc1C(=O)N1CCc2ccccc21 COC(=O)CCC(=O)Nc1nc(-c2ccccc2)cs1 ZINC000000038860 51/32/99/371513299 MQPQAWLQTQMQLD-UHFFFAOYSA-N 0 290.344 CF 2.702 0 Anodyne ref CFAARN COC(=O)CCC(=O)Nc1nc(-c2ccccc2)cs1 N#Cc1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000000038867 51/31/94/169513194 VSAWIOIBVHRRKX-UHFFFAOYSA-N 0 267.244 CF 2.719 0 Mild ref CFEARN N#Cc1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1 N#Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000000038868 51/32/27/169513227 YWCQLKFTKGNJPQ-UHFFFAOYSA-N 0 267.244 CF 2.719 0 Mild ref CFEARN N#Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 COc1cccc(NC(=O)COc2ccccc2OC)c1 ZINC000000039139 51/34/51/371513451 AXEUUOQSCAZABI-UHFFFAOYSA-N 0 287.315 CF 2.721 0 Anodyne ref CFAARN COc1cccc(NC(=O)COc2ccccc2OC)c1 COc1ccc(NC(=O)COc2ccccc2OC)cc1 ZINC000000039140 51/41/02/371514102 BDKMQEFKBJWDOZ-UHFFFAOYSA-N 0 287.315 CF 2.721 0 Anodyne ref CFAARN COc1ccc(NC(=O)COc2ccccc2OC)cc1 COc1ccccc1OCC(=O)NC1CCCCC1 ZINC000000039255 51/38/05/371513805 ULLJWQDVOVZFJK-UHFFFAOYSA-N 0 263.337 CF 2.523 0 Anodyne ref CFAARN COc1ccccc1OCC(=O)NC1CCCCC1 COc1ccc(OCC(=O)Nc2ccccc2F)cc1 ZINC000000041849 51/55/77/371515577 WMHGHMSBUPZPOQ-UHFFFAOYSA-N 0 275.279 CF 2.852 0 Anodyne ref CFAARN COc1ccc(OCC(=O)Nc2ccccc2F)cc1 COc1ccc(OCC(=O)Nc2ccc(F)cc2)cc1 ZINC000000041850 51/55/35/371515535 QOJFXLQDXCCMIG-UHFFFAOYSA-N 0 275.279 CF 2.852 0 Anodyne ref CFAARN COc1ccc(OCC(=O)Nc2ccc(F)cc2)cc1 COc1ccc(OCC(=O)Nc2cccc(F)c2)cc1 ZINC000000041851 51/60/17/371516017 HAJNLOFGRQHVJJ-UHFFFAOYSA-N 0 275.279 CF 2.852 0 Anodyne ref CFAARN COc1ccc(OCC(=O)Nc2cccc(F)c2)cc1 CCOC(=O)c1ccc(NC(=O)COc2ccccc2)cc1 ZINC000000043937 51/56/37/371515637 ZPIBNJSEYKTXBJ-UHFFFAOYSA-N 0 299.326 CF 2.881 0 Anodyne ref CFAARN CCOC(=O)c1ccc(NC(=O)COc2ccccc2)cc1 CCOC(=O)c1ccc(NC(=O)c2cccnc2)cc1 ZINC000000045243 51/58/76/371515876 IGNYCWGRAJGNKX-UHFFFAOYSA-N 0 270.288 CF 2.511 0 Anodyne ref CFAARN CCOC(=O)c1ccc(NC(=O)c2cccnc2)cc1 COc1ccc([N+](=O)[O-])cc1NC(=O)/C=C/c1ccco1 ZINC000000045888 51/64/65/169516465 KVOVXBWJNVYNDC-FNORWQNLSA-N 0 288.259 CF 2.848 0 Bother ref CFBARN COc1ccc([N+](=O)[O-])cc1NC(=O)/C=C/c1ccco1 NC(=O)c1ccccc1/N=C/c1ccc([N+](=O)[O-])s1 ZINC000000046017 51/52/77/371515277 XOURRBPIQHMSHP-VGOFMYFVSA-N 0 275.289 CF 2.506 0 Mild ref CFEARN NC(=O)c1ccccc1/N=C/c1ccc([N+](=O)[O-])s1 COc1ccc([C@H](O)c2cccs2)cc1OC ZINC000000046519 51/55/62/371515562 KWKXKUWOQVBCGP-ZDUSSCGKSA-N 0 250.319 CF 2.847 0 Anodyne ref CFAARN COc1ccc([C@H](O)c2cccs2)cc1OC COc1ccc([C@@H](O)c2cccs2)cc1OC ZINC000000046520 51/65/19/169516519 KWKXKUWOQVBCGP-CYBMUJFWSA-N 0 250.319 CF 2.847 0 Anodyne ref CFAARN COc1ccc([C@@H](O)c2cccs2)cc1OC Cc1ccc(N2C(=O)c3ccccc3C2=O)cc1F ZINC000000049340 86/24/14/280862414 WTSLOUCNAJODMM-UHFFFAOYSA-N 0 255.248 CF 2.935 0 Anodyne ref CFAARN Cc1ccc(N2C(=O)c3ccccc3C2=O)cc1F CCOC(=O)c1sc2nc(C)cc(C)c2c1N ZINC000000051809 51/68/93/371516893 NUXMTIQMQARQAV-UHFFFAOYSA-N 0 250.323 CF 2.672 0 Clean ref CFCARN CCOC(=O)c1sc2nc(C)cc(C)c2c1N aggregator CCOC(=O)/C(C#N)=N/Nc1cccc(Cl)c1C ZINC000000054660 51/83/72/371518372 JLTKZFXEXVXEDJ-LFIBNONCSA-N 0 265.7 CF 2.503 0 Mild ref CFEARN CCOC(=O)C(C#N)=NNc1cccc(Cl)c1C COc1ccc(C(=O)NC(C)(C)C)cc1Br ZINC000000054707 51/88/03/371518803 WFJKTBWZNWXGTQ-UHFFFAOYSA-N 0 286.169 CF 2.986 0 Anodyne ref CFAARN COc1ccc(C(=O)NC(C)(C)C)cc1Br O=C(COc1ccccc1)Nc1cccc([N+](=O)[O-])c1 ZINC000000059853 51/98/33/371519833 MDKUIXGMWVKQCH-UHFFFAOYSA-N 0 272.26 CF 2.612 0 Bother ref CFBARN O=C(COc1ccccc1)Nc1cccc([N+](=O)[O-])c1 COc1ccc(NC(=O)c2ccccc2OC)cc1 ZINC000000060233 52/01/46/371520146 GCIDTLGMBNRXFD-UHFFFAOYSA-N 0 257.289 CF 2.956 0 Anodyne ref CFAARN COc1ccc(NC(=O)c2ccccc2OC)cc1 N#Cc1c(NC(=O)C(F)(F)F)sc2c1CCC2 ZINC000000060922 52/06/34/371520634 QWZHTJXNBFZNCN-UHFFFAOYSA-N -1 260.24 CF 2.609 3 Mild high CFEAHM N#Cc1c([N-]C(=O)C(F)(F)F)sc2c1CCC2 N#Cc1c(NC(=O)C(F)(F)F)sc2c1CCC2 ZINC000000060922 52/06/22/371520622 QWZHTJXNBFZNCN-UHFFFAOYSA-N 0 260.24 CF 2.609 0 Mild ref CFEARN N#Cc1c(NC(=O)C(F)(F)F)sc2c1CCC2 O=C1c2ccccc2C(=O)N1/N=C/c1cccc(Cl)c1 ZINC000000062632 52/06/60/371520660 SXMXENXKEMLOIW-RQZCQDPDSA-N 0 284.702 CF 2.97 0 Mild ref CFEARN O=C1c2ccccc2C(=O)N1/N=C/c1cccc(Cl)c1 COc1ccc(NC(=S)NC(=O)c2ccccc2)cc1 ZINC000000063546 52/06/99/371520699 HLHLMJSGJJRCRH-UHFFFAOYSA-N 0 286.356 CF 2.822 0 Anodyne ref CFAARN COc1ccc(NC(=S)NC(=O)c2ccccc2)cc1 CN(C(=O)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000000063689 52/02/51/371520251 ZGDQZPUGCAXWLR-UHFFFAOYSA-N 0 262.309 CF 3.0 0 Bother ref CFBARN CN(C(=O)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 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 Cc1cccc(NC(=S)N/N=C/c2ccco2)c1 ZINC000000065214 52/13/73/371521373 KXLGFSQJDTYOEJ-NTEUORMPSA-N 0 259.334 CF 2.909 0 Mild ref CFEARN Cc1cccc(NC(=S)N/N=C/c2ccco2)c1 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 Cc1ccccc1/C=N/N1C(=O)c2ccccc2C1=O ZINC000000065386 52/23/59/371522359 ASFFCTSTKPKLHK-LICLKQGHSA-N 0 264.284 CF 2.625 0 Mild ref CFEARN Cc1ccccc1/C=N/N1C(=O)c2ccccc2C1=O CC1(C)CC(=O)C(=NNc2ccc(F)cc2)C(=O)C1 ZINC000000068712 52/14/74/371521474 NPPANXDWWSDVKI-UHFFFAOYSA-N 0 262.284 CF 2.552 0 Mild ref CFEARN CC1(C)CC(=O)C(=NNc2ccc(F)cc2)C(=O)C1 CCOC(=O)/C(C#N)=N/Nc1ccc(Cl)c(Cl)c1 ZINC000000068744 52/10/71/371521071 WMSCINGRVJZMPS-MHWRWJLKSA-N 0 286.118 CF 2.848 0 Mild ref CFEARN CCOC(=O)C(C#N)=NNc1ccc(Cl)c(Cl)c1 CCOC(=O)/C(=N/Nc1cccc(Cl)c1C)C(C)=O ZINC000000068780 52/23/13/371522313 RSKORAMMPICAJD-FOWTUZBSSA-N 0 282.727 CF 2.568 0 Mild ref CFEARN CCOC(=O)C(=NNc1cccc(Cl)c1C)C(C)=O Cc1ccc(OCC(=O)Nc2ccccc2C#N)cc1 ZINC000000068975 52/54/28/169525428 OINLRPQHEINQFG-UHFFFAOYSA-N 0 266.3 CF 2.884 0 Mild ref CFEARN Cc1ccc(OCC(=O)Nc2ccccc2C#N)cc1 Cc1ccc(OCC(=O)Nc2cccc(C#N)c2)cc1 ZINC000000068981 52/10/29/371521029 BREKTRHCQZXRJI-UHFFFAOYSA-N 0 266.3 CF 2.884 0 Mild ref CFEARN Cc1ccc(OCC(=O)Nc2cccc(C#N)c2)cc1 COc1ccc(OC)c(NC(=O)/C=C/c2ccco2)c1 ZINC000000070519 52/22/99/371522299 FUECEMUHDWAETD-SOFGYWHQSA-N 0 273.288 CF 2.949 0 Anodyne ref CFAARN COc1ccc(OC)c(NC(=O)/C=C/c2ccco2)c1 Cc1ccc(C(=O)NC[C@H]2CCCO2)cc1Br ZINC000000070616 52/31/82/371523182 WEHGXHAEMRDSAH-LLVKDONJSA-N 0 298.18 CF 2.666 0 Anodyne ref CFAARN Cc1ccc(C(=O)NC[C@H]2CCCO2)cc1Br Cc1ccc(C(=O)NC[C@@H]2CCCO2)cc1Br ZINC000000070620 52/38/16/371523816 WEHGXHAEMRDSAH-NSHDSACASA-N 0 298.18 CF 2.666 0 Anodyne ref CFAARN Cc1ccc(C(=O)NC[C@@H]2CCCO2)cc1Br COc1ccc(C(=O)Oc2ccccc2[N+](=O)[O-])cc1 ZINC000000070838 52/40/16/371524016 UYVDUQWRYPWKGD-UHFFFAOYSA-N 0 273.244 CF 2.823 0 Bother ref CFBARN COc1ccc(C(=O)Oc2ccccc2[N+](=O)[O-])cc1 O=C(/C=C/c1ccco1)Oc1ccccc1[N+](=O)[O-] ZINC000000070843 52/40/94/371524094 UPTBNXDZMZCUFQ-BQYQJAHWSA-N 0 259.217 CF 2.807 0 Bother ref CFBARN O=C(/C=C/c1ccco1)Oc1ccccc1[N+](=O)[O-] O=C(NCCC1=CCCCC1)[C@H]1CCCC[C@H]1C(=O)O ZINC000000072409 52/40/36/371524036 RGSAKBVUFAWDKJ-UONOGXRCSA-N -1 279.38 CF 2.884 0 Anodyne ref CFAARM O=C(NCCC1=CCCCC1)[C@H]1CCCC[C@H]1C(=O)[O-] Cc1cccc(C)c1NS(=O)(=O)c1ccc(N)cc1 ZINC000000073807 52/41/09/371524109 QFJZPNSHJNCXMO-UHFFFAOYSA-N -1 276.361 CF 2.686 3 Anodyne high CFAAHM Cc1cccc(C)c1[N-]S(=O)(=O)c1ccc(N)cc1 Cc1cccc(C)c1NS(=O)(=O)c1ccc(N)cc1 ZINC000000073807 52/41/03/371524103 QFJZPNSHJNCXMO-UHFFFAOYSA-N 0 276.361 CF 2.686 0 Anodyne ref CFAARN Cc1cccc(C)c1NS(=O)(=O)c1ccc(N)cc1 CCOc1ccccc1/C=N/n1c(C)cc(C)c(C#N)c1=O ZINC000000075907 52/31/20/371523120 QWTCBSSKVRETJQ-YBFXNURJSA-N 0 295.342 CF 2.618 0 Mild ref CFEARN CCOc1ccccc1/C=N/n1c(C)cc(C)c(C#N)c1=O C/C(=N\n1c(C)cc(C)c(C#N)c1=O)c1ccc(C)cc1 ZINC000000075934 52/30/14/371523014 DXQIOCYRQQXHLL-XMHGGMMESA-N 0 279.343 CF 2.918 0 Mild ref CFEARN C/C(=N\n1c(C)cc(C)c(C#N)c1=O)c1ccc(C)cc1 Cc1ccc(/C=N/n2c(C)cc(C)c(C#N)c2=O)cc1 ZINC000000075979 75/51/74/280755174 UFWOSOSCNQXBCY-VCHYOVAHSA-N 0 265.316 CF 2.527 0 Mild ref CFEARN Cc1ccc(/C=N/n2c(C)cc(C)c(C#N)c2=O)cc1 O=C(O)c1ccccc1C(=O)Nc1ccc(F)cc1 ZINC000000083322 52/54/38/371525438 FZGQSGHYCVVQEA-UHFFFAOYSA-N -1 259.236 CF 2.776 0 Anodyne ref CFAARM O=C([O-])c1ccccc1C(=O)Nc1ccc(F)cc1 CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccco1 ZINC000000084600 61/11/91/263611191 BCWJDLZORIVLIJ-CYBMUJFWSA-N 0 284.315 CF 2.73 0 Reactive ref CFGARN CC1(C)CC(=O)C2=C(C1)OC(N)=C(C#N)[C@@H]2c1ccco1 Cc1cc(C)n(C(=O)CNc2ccccc2Cl)n1 ZINC000000087021 52/73/74/371527374 WUKYUWPYLSXVEL-UHFFFAOYSA-N 0 263.728 CF 2.906 0 Anodyne ref CFAARN Cc1cc(C)n(C(=O)CNc2ccccc2Cl)n1 O=C(NC[C@H]1CCCO1)Nc1cccc(Cl)c1 ZINC000000095146 52/94/95/371529495 MWGYULMZHLTTJI-LLVKDONJSA-N 0 254.717 CF 2.641 0 Anodyne ref CFAARN O=C(NC[C@H]1CCCO1)Nc1cccc(Cl)c1 O=C(NC[C@@H]1CCCO1)Nc1cccc(Cl)c1 ZINC000000095152 53/00/37/371530037 MWGYULMZHLTTJI-NSHDSACASA-N 0 254.717 CF 2.641 0 Anodyne ref CFAARN O=C(NC[C@@H]1CCCO1)Nc1cccc(Cl)c1 O=C(Nc1ccc(Br)cc1)C(F)(F)F ZINC000000095890 93/28/18/295932818 VVFVNAMWSGDFCX-UHFFFAOYSA-N 0 268.032 CF 2.95 0 Anodyne ref CFAARN O=C(Nc1ccc(Br)cc1)C(F)(F)F Cc1cccc(OCC(=O)NCc2ccccc2)c1 ZINC000000097584 53/02/47/371530247 JLOZXVQJNBSKPI-UHFFFAOYSA-N 0 255.317 CF 2.69 0 Anodyne ref CFAARN Cc1cccc(OCC(=O)NCc2ccccc2)c1 COc1ccc(C(=O)n2cnc3ccccc32)cc1 ZINC000000101604 52/95/29/371529529 KRIWMLYYGXHCKE-UHFFFAOYSA-N 0 252.273 CF 2.733 0 Anodyne ref CFAARN COc1ccc(C(=O)n2cnc3ccccc32)cc1 Cc1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000000102604 53/14/71/371531471 CWUDNULMFSYIND-UHFFFAOYSA-N 0 292.316 CF 2.704 2 Bother low CFBALN Cc1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 Cc1ccc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 ZINC000000102604 53/14/64/371531464 CWUDNULMFSYIND-UHFFFAOYSA-N -1 292.316 CF 2.704 0 Bother ref CFBARM Cc1ccc([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1 CN(C(=O)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000000103176 53/71/88/169537188 XTFRUWLCKHHIIN-UHFFFAOYSA-N 0 256.261 CF 2.871 0 Bother ref CFBARN CN(C(=O)c1ccccc1[N+](=O)[O-])c1ccccc1 CN(C(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000000103269 53/11/03/371531103 LOAQBQYXMDUJKS-UHFFFAOYSA-N 0 256.261 CF 2.871 0 Bother ref CFBARN CN(C(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1 COC(=O)c1ccccc1NC(=O)Cc1ccccc1OC ZINC000000116318 53/39/99/371533999 IUIGJLDCWVNLRQ-UHFFFAOYSA-N 0 299.326 CF 2.663 0 Anodyne ref CFAARN COC(=O)c1ccccc1NC(=O)Cc1ccccc1OC Cc1ccc(/C=N/n2c(C)cc(C)c(C#N)c2=O)s1 ZINC000000116472 44/68/49/393446849 RGMUKOOFFHQVAR-LZYBPNLTSA-N 0 271.345 CF 2.589 0 Mild ref CFEARN Cc1ccc(/C=N/n2c(C)cc(C)c(C#N)c2=O)s1 CSc1ccc(/C=N/n2c(C)cc(C)c(C#N)c2=O)cc1 ZINC000000116516 53/42/10/371534210 FALVVWKMSBGGQL-VCHYOVAHSA-N 0 297.383 CF 2.941 0 Mild ref CFEARN CSc1ccc(/C=N/n2c(C)cc(C)c(C#N)c2=O)cc1 Cc1cc(C)n(/N=C/c2ccc(Cl)cc2)c(=O)c1C#N ZINC000000116524 44/19/46/280441946 FRGHETWNXAGILM-GIJQJNRQSA-N 0 285.734 CF 2.872 0 Mild ref CFEARN Cc1cc(C)n(/N=C/c2ccc(Cl)cc2)c(=O)c1C#N Cc1ccccc1/C=N/n1c(C)cc(C)c(C#N)c1=O ZINC000000116565 33/25/90/281332590 BIKDVAWGWYIOHR-VCHYOVAHSA-N 0 265.316 CF 2.527 0 Mild ref CFEARN Cc1ccccc1/C=N/n1c(C)cc(C)c(C#N)c1=O Cc1cccc(/C=N/n2c(C)cc(C)c(C#N)c2=O)c1 ZINC000000116572 53/35/86/371533586 IHNQESCMMAGPBS-VCHYOVAHSA-N 0 265.316 CF 2.527 0 Mild ref CFEARN Cc1cccc(/C=N/n2c(C)cc(C)c(C#N)c2=O)c1 CCOc1ccc(/C=N/n2c(C)cc(C)c(C#N)c2=O)cc1 ZINC000000116585 53/40/45/371534045 GEYYRFLRELHAJK-YBFXNURJSA-N 0 295.342 CF 2.618 0 Mild ref CFEARN CCOc1ccc(/C=N/n2c(C)cc(C)c(C#N)c2=O)cc1 Cc1cc(C)n(/N=C/c2c[nH]c3ccccc23)c(=O)c1C#N ZINC000000116595 54/15/04/169541504 WYQJXICDHKGDMK-KEBDBYFISA-N 0 290.326 CF 2.7 0 Mild ref CFEARN Cc1cc(C)n(/N=C/c2c[nH]c3ccccc23)c(=O)c1C#N COc1ccc(OC(=O)COc2ccccc2)cc1 ZINC000000119106 54/26/47/169542647 NWFMYJOAVIEQRP-UHFFFAOYSA-N 0 258.273 CF 2.68 0 Anodyne ref CFAARN COc1ccc(OC(=O)COc2ccccc2)cc1 Cc1cc(C)n(/N=C/c2c[nH]c3ccccc23)c(=O)c1 ZINC000000121315 53/54/15/371535415 WVKBEHKIRXSRNC-VCHYOVAHSA-N 0 265.316 CF 2.829 0 Mild ref CFEARN Cc1cc(C)n(/N=C/c2c[nH]c3ccccc23)c(=O)c1 O=C(NCc1ccco1)c1ccccc1Br ZINC000000123559 53/50/44/371535044 SOBQMAPZTVNYBB-UHFFFAOYSA-N 0 280.121 CF 2.972 0 Anodyne ref CFAARN O=C(NCc1ccco1)c1ccccc1Br O=C(O)CCC(=O)Nc1ccc(C(=O)c2ccccc2)cc1 ZINC000000125169 53/69/48/371536948 VUMNTRNMHOFCKA-UHFFFAOYSA-N -1 297.31 CF 2.721 0 Anodyne ref CFAARM O=C([O-])CCC(=O)Nc1ccc(C(=O)c2ccccc2)cc1 COC(=O)CCC(=O)Nc1cc(Cl)cc(Cl)c1 ZINC000000125382 54/51/69/169545169 IMQPAVWAYIOQNF-UHFFFAOYSA-N 0 276.119 CF 2.885 0 Anodyne ref CFAARN COC(=O)CCC(=O)Nc1cc(Cl)cc(Cl)c1 CC(=O)c1cccc(NC(=O)c2ccccc2C(=O)O)c1 ZINC000000125450 54/51/78/169545178 FBFFSUCSLKYKLH-UHFFFAOYSA-N -1 283.283 CF 2.84 0 Anodyne ref CFAARM CC(=O)c1cccc(NC(=O)c2ccccc2C(=O)[O-])c1 CC(=O)Nc1sc(Cc2ccccc2)c(C)c1C(N)=O ZINC000000125584 53/71/06/371537106 QZKUWFMDDAMTMB-UHFFFAOYSA-N 0 288.372 CF 2.705 0 Anodyne ref CFAARN CC(=O)Nc1sc(Cc2ccccc2)c(C)c1C(N)=O COc1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1 ZINC000000127337 53/70/40/371537040 GFPBLDMXBCYORT-UHFFFAOYSA-N -1 277.345 CF 2.804 3 Anodyne high CFAAHM COc1ccc([N-]S(=O)(=O)c2ccc(C)cc2)cc1 COc1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1 ZINC000000127337 53/70/34/371537034 GFPBLDMXBCYORT-UHFFFAOYSA-N 0 277.345 CF 2.804 0 Anodyne ref CFAARN COc1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1 COC(=O)c1ccc(NC(=O)COc2ccccc2C)cc1 ZINC000000130103 53/82/04/371538204 NVJUBHVEKOQCAD-UHFFFAOYSA-N 0 299.326 CF 2.799 0 Anodyne ref CFAARN COC(=O)c1ccc(NC(=O)COc2ccccc2C)cc1