smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name Cc1[nH]n(-c2ccc(Br)cc2C)c(=O)c1C=Nc1ccc([N+](=O)[O-])cc1O ZINC000408536279 555759802 /nfs/dbraw/zinc/75/98/02/555759802.db2.gz VSRNUXMJTNBOAU-ZROIWOOFSA-N 0 2 431.246 4.090 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)ccc1OCc1ccccc1 ZINC000408739552 556210551 /nfs/dbraw/zinc/21/05/51/556210551.db2.gz COUAPGPJQSYKGK-RCCKNPSSSA-N 0 2 442.471 4.331 40 10 IICBLN Cc1nn(-c2ccc(C)cc2C)c(C)c1/C=C1/C(=O)NC(=O)N(c2cccc(C)c2C)C1=O ZINC000408755321 556238238 /nfs/dbraw/zinc/23/82/38/556238238.db2.gz DMSUXJROCTVFKZ-BKUYFWCQSA-N 0 2 442.519 4.389 40 10 IICBLN Cc1nn(-c2ccc(C)cc2C)c(C)c1/C=C1\C(=O)NC(=O)N(c2ccccc2C)C1=O ZINC000408755999 556239182 /nfs/dbraw/zinc/23/91/82/556239182.db2.gz GUZSXVNWFGKQHO-DEDYPNTBSA-N 0 2 428.492 4.081 40 10 IICBLN Cc1cc(N2C(=O)NC(=O)C(=Cc3c(F)cccc3Cl)C2=O)ccc1Br ZINC000408767292 556830065 /nfs/dbraw/zinc/83/00/65/556830065.db2.gz ZADRGYMHSRCLQV-XYOKQWHBSA-N 0 2 437.652 4.216 40 10 IICBLN CCOc1ccc2ccc(OCC)c(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)c2c1 ZINC000408774454 556848160 /nfs/dbraw/zinc/84/81/60/556848160.db2.gz LLGLJHWHJSCWNU-RCCKNPSSSA-N 0 2 430.460 4.304 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OC(C)C)c(Br)c3)C2=O)cc1 ZINC000408799815 556857794 /nfs/dbraw/zinc/85/77/94/556857794.db2.gz LMXUKMIETHWTHM-MHWRWJLKSA-N 0 2 443.297 4.211 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(CC)cc3)C2=O)cc1OC ZINC000408800217 556858077 /nfs/dbraw/zinc/85/80/77/556858077.db2.gz NVZABRQLYUWJKZ-GZTJUZNOSA-N 0 2 442.899 4.366 40 10 IICBLN CCCOc1ccc(Br)cc1/C=C1\C(=O)NC(=O)N(c2cccc(C)c2)C1=O ZINC000408802321 556859399 /nfs/dbraw/zinc/85/93/99/556859399.db2.gz ZAZQQDIOZNSSQG-SFQUDFHCSA-N 0 2 443.297 4.213 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)ccc1OCc1cccc(C)c1 ZINC000408804452 556860134 /nfs/dbraw/zinc/86/01/34/556860134.db2.gz GFHGRWJBXDFUGR-KGENOOAVSA-N 0 2 442.471 4.249 40 10 IICBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3cc(Br)ccc3OC(C)C)C2=O)c1 ZINC000408806085 556861065 /nfs/dbraw/zinc/86/10/65/556861065.db2.gz AEMDFNCSBOZCNP-GZTJUZNOSA-N 0 2 443.297 4.211 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc(Cl)c1OCC ZINC000408808474 556861517 /nfs/dbraw/zinc/86/15/17/556861517.db2.gz PTFNWOZDIKZUIW-OVCLIPMQSA-N 0 2 449.290 4.457 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cccc(C)c3)C2=O)cc1 ZINC000408812342 556863007 /nfs/dbraw/zinc/86/30/07/556863007.db2.gz LPFFJBZJXQRSTK-PXLXIMEGSA-N 0 2 442.471 4.249 40 10 IICBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1OC ZINC000408812625 556863036 /nfs/dbraw/zinc/86/30/36/556863036.db2.gz MEUIDNLDVATLKZ-RVDMUPIBSA-N 0 2 428.872 4.112 40 10 IICBLN COc1cc(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)c1 ZINC000408865154 556873300 /nfs/dbraw/zinc/87/33/00/556873300.db2.gz BIWMXJHMGSRZNX-AWNIVKPZSA-N 0 2 425.655 4.322 40 10 IICBLN COc1cc(/C=C2/C(=O)NC(=O)N(c3ccccc3C)C2=O)ccc1Cc1ccccc1F ZINC000408865046 556873311 /nfs/dbraw/zinc/87/33/11/556873311.db2.gz AURJGUNPYGQRPH-DEDYPNTBSA-N 0 2 444.462 4.400 40 10 IICBLN CCOc1ccc(Br)cc1/C=C1/C(=O)NC(=O)N(c2ccccc2CC)C1=O ZINC000408865938 556873320 /nfs/dbraw/zinc/87/33/20/556873320.db2.gz CRNXQSVFOCTVME-VBKFSLOCSA-N 0 2 443.297 4.077 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4cccc(F)c4)cc3)C2=O)cc1 ZINC000408877438 556877213 /nfs/dbraw/zinc/87/72/13/556877213.db2.gz RONXOGSGOKKMDO-XQNSMLJCSA-N 0 2 444.462 4.482 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc(Cl)c1OC(C)C ZINC000408902587 556885202 /nfs/dbraw/zinc/88/52/02/556885202.db2.gz KQQNDWQCYPATSG-CXUHLZMHSA-N 0 2 446.862 4.331 40 10 IICBLN O=C1NC(=O)N(c2ccc(O)cc2)C(=O)/C1=C\c1cccc(OCc2ccccc2Cl)c1 ZINC000408936496 556895972 /nfs/dbraw/zinc/89/59/72/556895972.db2.gz KNLJRWNONDLTDY-MOSHPQCFSA-N 0 2 448.862 4.291 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c(C)n1-c1ccc(C)cn1 ZINC000408959982 556900044 /nfs/dbraw/zinc/90/00/44/556900044.db2.gz BKXXEOYOAKVOPA-CIAFOILYSA-N 0 2 428.492 4.081 40 10 IICBLN COc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc1Br ZINC000408990608 556911345 /nfs/dbraw/zinc/91/13/45/556911345.db2.gz XPHOOAULYLIHMQ-QPEQYQDCSA-N 0 2 449.688 4.086 40 10 IICBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2cc(Cl)c(O)c(Cl)c2)C1=O ZINC000409045155 556930290 /nfs/dbraw/zinc/93/02/90/556930290.db2.gz FKFUBQIGKZLEBK-BJMVGYQFSA-N 0 2 425.655 4.327 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2cccn2-c2ccc(C)c(C)c2)C1=O ZINC000409239125 557020402 /nfs/dbraw/zinc/02/04/02/557020402.db2.gz CAELYWMTVYSNNU-HMMYKYKNSA-N 0 2 429.476 4.159 40 10 IICBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c(C)n1-c1cccnc1 ZINC000409244520 557026439 /nfs/dbraw/zinc/02/64/39/557026439.db2.gz DXQDORSEQDCZLZ-WOJGMQOQSA-N 0 2 434.883 4.117 40 10 IICBLN COC(=O)c1ccc(Cl)c(S(=O)(=O)Nc2ccccc2C(=O)c2ccccc2)c1 ZINC000223843698 557519817 /nfs/dbraw/zinc/51/98/17/557519817.db2.gz ZSIPGSBPULTEQC-UHFFFAOYSA-N 0 2 429.881 4.158 40 10 IICBLN COc1cc(C=C2C(=O)NC(=O)N(c3ccccc3C)C2=O)cc(Br)c1OC ZINC000059861142 557827901 /nfs/dbraw/zinc/82/79/01/557827901.db2.gz HXWNSYGHGLLJQG-MDWZMJQESA-N 0 2 445.269 4.281 40 10 IICBLN Cc1ccc(C(=O)Oc2ccccc2/C=C2/C(=O)NC(=O)N(c3cccc(C)c3)C2=O)cc1 ZINC000408532543 555732778 /nfs/dbraw/zinc/73/27/78/555732778.db2.gz IIIXLEWEWGJHBA-QNGOZBTKSA-N 0 2 440.455 4.189 40 10 IICBLN Cc1cc(C)c(N2C(=O)NC(=O)C(=CNc3ccc(Br)c(C)c3)C2=O)c(C)c1 ZINC000408536050 555758365 /nfs/dbraw/zinc/75/83/65/555758365.db2.gz VLOISXIOUQUKDC-MHWRWJLKSA-N 0 2 442.313 4.262 40 10 IICBLN CN(C)c1ccc(/C=C2\C(=O)NC(=O)N(c3cc(C(F)(F)F)ccc3Cl)C2=O)cc1 ZINC000408771606 556846926 /nfs/dbraw/zinc/84/69/26/556846926.db2.gz JROSGQDAQDYCBG-NTEUORMPSA-N 0 2 437.805 4.091 40 10 IICBLN COc1cc(N2C(=O)NC(=O)C(=Cc3ccc(C(C)C)cc3)C2=O)c(OC)cc1Cl ZINC000408774983 556848392 /nfs/dbraw/zinc/84/83/92/556848392.db2.gz DXTRJHQSCKLNAP-OQLLNIDSSA-N 0 2 428.872 4.147 40 10 IICBLN O=C1NC(=O)N(c2ccc(O)cc2)C(=O)/C1=C/c1ccc(OCc2ccccc2)c(Cl)c1 ZINC000408805703 556860856 /nfs/dbraw/zinc/86/08/56/556860856.db2.gz CBYOSUZROYVZPG-XDHOZWIPSA-N 0 2 448.862 4.291 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(OCc4ccccc4)cc3)C2=O)cc1 ZINC000408816495 556863695 /nfs/dbraw/zinc/86/36/95/556863695.db2.gz UVZCWTVADOSSJL-XQNSMLJCSA-N 0 2 442.471 4.331 40 10 IICBLN CCOc1ccc(Br)cc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O ZINC000408816812 556863894 /nfs/dbraw/zinc/86/38/94/556863894.db2.gz ZGIQSABUZGQVGE-OQLLNIDSSA-N 0 2 449.688 4.168 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(C)cc4)cc3)C2=O)cc1 ZINC000408819868 556865777 /nfs/dbraw/zinc/86/57/77/556865777.db2.gz YLABNGFUBXLXLZ-HZHRSRAPSA-N 0 2 442.471 4.249 40 10 IICBLN CCOc1cc(Cl)c(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc1OCC ZINC000408850532 556870644 /nfs/dbraw/zinc/87/06/44/556870644.db2.gz BLZGUNOVYKUYBP-LICLKQGHSA-N 0 2 442.899 4.421 40 10 IICBLN COc1cc(/C=C2/C(=O)NC(=O)N(c3ccccc3)C2=O)ccc1Cc1ccccc1F ZINC000408873020 556875559 /nfs/dbraw/zinc/87/55/59/556875559.db2.gz QUGDALAKUCVJPM-DEDYPNTBSA-N 0 2 430.435 4.092 40 10 IICBLN O=C1NC(=O)N(c2ccccc2F)C(=O)/C1=C\c1ccc(OCc2cccc(F)c2)cc1 ZINC000408880418 556876301 /nfs/dbraw/zinc/87/63/01/556876301.db2.gz JSRHVKFYAQKPES-UYRXBGFRSA-N 0 2 434.398 4.210 40 10 IICBLN CCCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(Br)c(C)c3)C2=O)cc1 ZINC000408895704 556880924 /nfs/dbraw/zinc/88/09/24/556880924.db2.gz FFTTTZCIBFVMFW-ATVHPVEESA-N 0 2 443.297 4.213 40 10 IICBLN O=C1NC(=O)N(c2ccc(OCc3ccc(Cl)cc3)cc2)C(=O)/C1=C/c1ccccc1O ZINC000408935035 556895559 /nfs/dbraw/zinc/89/55/59/556895559.db2.gz GBVLJVMHGYGMII-DEDYPNTBSA-N 0 2 448.862 4.291 40 10 IICBLN O=C1NC(=O)N(c2ccc(O)cc2)C(=O)/C1=C\c1cccc(OCc2cccc(Cl)c2)c1 ZINC000408939369 556896350 /nfs/dbraw/zinc/89/63/50/556896350.db2.gz RXRPLKOVHZXKAL-BKUYFWCQSA-N 0 2 448.862 4.291 40 10 IICBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4C)o3)C2=O)cc1 ZINC000408989646 556910805 /nfs/dbraw/zinc/91/08/05/556910805.db2.gz UUGMLUJTUOLTFR-DEDYPNTBSA-N 0 2 445.431 4.392 40 10 IICBLN COc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000409045202 556930275 /nfs/dbraw/zinc/93/02/75/556930275.db2.gz FVXWQIQUUYOZGX-NTUHNPAUSA-N 0 2 425.655 4.322 40 10 IICBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(OC)cc3)C2=O)cc1Cl ZINC000409046735 556931328 /nfs/dbraw/zinc/93/13/28/556931328.db2.gz LNJZUQGRTSJCRQ-RIYZIHGNSA-N 0 2 435.263 4.067 40 10 IICBLN O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1ccc(Br)o1 ZINC000409208040 556996918 /nfs/dbraw/zinc/99/69/18/556996918.db2.gz FCGZJMRZUUJUHN-RMKNXTFCSA-N 0 2 430.041 4.015 40 10 IICBLN Cc1ccc(Cn2cc(/C=C3\C(=O)NC(=O)N(c4ccncc4)C3=O)c3ccccc32)cc1 ZINC000409389419 557100785 /nfs/dbraw/zinc/10/07/85/557100785.db2.gz AZHSICUPGCKGMU-HYARGMPZSA-N 0 2 436.471 4.059 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccncc3)C2=O)c(C)n1-c1ccc(C(C)(C)C)cc1 ZINC000409389922 557101058 /nfs/dbraw/zinc/10/10/58/557101058.db2.gz CXFKTJPKBMPSQG-PXLXIMEGSA-N 0 2 442.519 4.453 40 10 IICBLN O=C(NCc1ccc(N2CCCC2)cc1)c1ccc(NS(=O)(=O)c2cccs2)cc1 ZINC000106158422 557333238 /nfs/dbraw/zinc/33/32/38/557333238.db2.gz PJFIVFZCJGSHRC-UHFFFAOYSA-N 0 2 441.578 4.079 40 10 IICBLN Cc1cc(N2CCCC2)c(F)cc1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000107632817 569260554 /nfs/dbraw/zinc/26/05/54/569260554.db2.gz QLQLXXMDWJZMMY-GZTJUZNOSA-N 0 2 427.863 4.054 40 10 IICBLN CC(C)COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)cc1 ZINC000408741961 556215623 /nfs/dbraw/zinc/21/56/23/556215623.db2.gz SZAPURIJYYHXGN-WOJGMQOQSA-N 0 2 443.297 4.150 40 10 IICBLN O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C\c1cccn1-c1ccc(O)cc1 ZINC000032127488 556536641 /nfs/dbraw/zinc/53/66/41/556536641.db2.gz KWMDLLOGCDWQMF-YBEGLDIGSA-N 0 2 442.258 4.156 40 10 IICBLN O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)C1=Cc1cc(Br)c(O)cc1O ZINC000083330494 556663856 /nfs/dbraw/zinc/66/38/56/556663856.db2.gz XSFIDHRRLQNVCP-VZUCSPMQSA-N 0 2 437.633 4.020 40 10 IICBLN COC(=O)c1ccc(-c2ccc(/C=C3\C(=O)NC(=O)N(c4cc(C)cc(C)c4)C3=O)o2)cc1 ZINC000408782165 556854808 /nfs/dbraw/zinc/85/48/08/556854808.db2.gz IEQUJXJCWHRGDF-DEDYPNTBSA-N 0 2 444.443 4.016 40 10 IICBLN COc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)c2C)cc1 ZINC000408789455 556855929 /nfs/dbraw/zinc/85/59/29/556855929.db2.gz KXCVDLMNTULSMM-HYARGMPZSA-N 0 2 429.476 4.078 40 10 IICBLN COc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(Br)cc3C)C2=O)cc1Cl ZINC000408790865 556856312 /nfs/dbraw/zinc/85/63/12/556856312.db2.gz TZZXIGLABJDFGP-JYRVWZFOSA-N 0 2 449.688 4.086 40 10 IICBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc1OC ZINC000408813561 556865037 /nfs/dbraw/zinc/86/50/37/556865037.db2.gz XXKLELVPKZFRNL-CXUHLZMHSA-N 0 2 428.872 4.031 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3F)C2=O)ccc1Cc1ccccc1F ZINC000408869318 556874491 /nfs/dbraw/zinc/87/44/91/556874491.db2.gz QWXYJMKCIYPPAV-PDGQHHTCSA-N 0 2 448.425 4.231 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)cc(Cl)c1O ZINC000408891594 556879264 /nfs/dbraw/zinc/87/92/64/556879264.db2.gz SYFBLWGNUJSJNB-AWNIVKPZSA-N 0 2 435.263 4.073 40 10 IICBLN Cc1cc(Br)ccc1N1C(=O)NC(=O)C(=Cc2ccccc2OC(C)C)C1=O ZINC000408895277 556880551 /nfs/dbraw/zinc/88/05/51/556880551.db2.gz DMQUNQLQUYJSGH-WJDWOHSUSA-N 0 2 443.297 4.211 40 10 IICBLN O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)/C1=C/c1ccc(C(F)(F)F)cc1 ZINC000408902309 556885049 /nfs/dbraw/zinc/88/50/49/556885049.db2.gz HHFPVQHVNQWLAW-NTEUORMPSA-N 0 2 439.187 4.134 40 10 IICBLN CC[C@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)cc1 ZINC000408903773 556886124 /nfs/dbraw/zinc/88/61/24/556886124.db2.gz YVFXJQYVFOUXAS-HTMJNSLASA-N 0 2 443.297 4.293 40 10 IICBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4cccc(F)c4)c3C)C2=O)cc1 ZINC000408983351 556908236 /nfs/dbraw/zinc/90/82/36/556908236.db2.gz LOAAJMQIYNHVRP-XKZIYDEJSA-N 0 2 431.467 4.462 40 10 IICBLN O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1ccc(Br)cc1 ZINC000409211242 557005806 /nfs/dbraw/zinc/00/58/06/557005806.db2.gz NDDYILGOMLLDDM-KPKJPENVSA-N 0 2 440.080 4.422 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)c(C)n1-c1cccc2ccccc21 ZINC000409229062 557015629 /nfs/dbraw/zinc/01/56/29/557015629.db2.gz JEZYLIJLXBYQIJ-HYARGMPZSA-N 0 2 436.471 4.309 40 10 IICBLN COC(=O)Cc1[nH]n(-c2ccccc2)c(=O)c1C(C)=Nc1cc(OC)c(Cl)cc1OC ZINC000019639339 557503735 /nfs/dbraw/zinc/50/37/35/557503735.db2.gz ZDCGOCYIGRQOEL-BKUYFWCQSA-N 0 2 443.887 4.009 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)cc1C ZINC000059336725 557822324 /nfs/dbraw/zinc/82/23/24/557822324.db2.gz SODUMINUODOQPL-UNOMPAQXSA-N 0 2 431.404 4.138 40 10 IICBLN CCc1ccccc1N1C(=O)NC(=O)C(=CNc2ccc(Br)cc2Cl)C1=O ZINC000408526975 555716342 /nfs/dbraw/zinc/71/63/42/555716342.db2.gz DORLGRSIDLGSNF-JLHYYAGUSA-N 0 2 448.704 4.244 40 10 IICBLN Cc1ccc(S(=O)(=O)Nc2cc(Br)c(O)c(Br)c2C)cc1 ZINC000016779902 556641365 /nfs/dbraw/zinc/64/13/65/556641365.db2.gz NQIPOTRBMNFVTL-UHFFFAOYSA-N 0 2 435.137 4.335 40 10 IICBLN Cc1nn(-c2ccc(C)c(C)c2)c(C)c1C=C1C(=O)NC(=O)N(c2cccc(C)c2)C1=O ZINC000408758156 556843019 /nfs/dbraw/zinc/84/30/19/556843019.db2.gz WDHXXFVFICSTAO-LPYMAVHISA-N 0 2 428.492 4.081 40 10 IICBLN Cc1nn(-c2ccc([N+](=O)[O-])cc2)c(C)c1N=CC1C(=O)N(c2cccc(C)c2)N=C1C ZINC000408758162 556846037 /nfs/dbraw/zinc/84/60/37/556846037.db2.gz WGHQFGAUABYNRL-FYJGNVAPSA-N 0 2 430.468 4.424 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc(Cl)c1OC ZINC000408797088 556857149 /nfs/dbraw/zinc/85/71/49/556857149.db2.gz FVDKMLOWBPIWTG-CXUHLZMHSA-N 0 2 428.872 4.031 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccc(F)cc3)C2=O)cc1 ZINC000408801097 556858519 /nfs/dbraw/zinc/85/85/19/556858519.db2.gz SSVIMYBXQHAIGA-KGENOOAVSA-N 0 2 446.434 4.080 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)c(OCc2ccccc2)c1 ZINC000408812687 556862932 /nfs/dbraw/zinc/86/29/32/556862932.db2.gz NHXALUPSUROMOZ-HYARGMPZSA-N 0 2 442.471 4.249 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c(OCc2cccc(C)c2)c1 ZINC000408813523 556865120 /nfs/dbraw/zinc/86/51/20/556865120.db2.gz UMHSDCGBCJPTPO-HYARGMPZSA-N 0 2 442.471 4.249 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)c(C)n1C1CCCCC1 ZINC000408853301 556870276 /nfs/dbraw/zinc/87/02/76/556870276.db2.gz NEGSBCPJASGEPB-YBFXNURJSA-N 0 2 435.480 4.005 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3cccc(F)c3)C2=O)cc1 ZINC000408867213 556873959 /nfs/dbraw/zinc/87/39/59/556873959.db2.gz JKVJLJIBGUKRSQ-PXLXIMEGSA-N 0 2 430.435 4.092 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2/C(=O)NC(=O)N(c3ccccc3F)C2=O)cc1OCC ZINC000408871249 556875041 /nfs/dbraw/zinc/87/50/41/556875041.db2.gz XJMCQSMAGHKUFE-UVTDQMKNSA-N 0 2 446.862 4.333 40 10 IICBLN CCOc1cc(Br)cc(/C=C2\C(=O)NC(=O)N(c3ccc(CC)cc3)C2=O)c1 ZINC000408872084 556875230 /nfs/dbraw/zinc/87/52/30/556875230.db2.gz KDXSYTRXRIAFAJ-WOJGMQOQSA-N 0 2 443.297 4.077 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)ccc1OCc1cccc(F)c1 ZINC000408880465 556876337 /nfs/dbraw/zinc/87/63/37/556876337.db2.gz HWZNJGRZWRTMHY-DEDYPNTBSA-N 0 2 446.434 4.080 40 10 IICBLN CCCCOc1ccc(N2C(=O)NC(=O)C(=Cc3c(O)ccc4ccccc43)C2=O)cc1 ZINC000408895171 556880418 /nfs/dbraw/zinc/88/04/18/556880418.db2.gz CSQYDUASCVWCLZ-QNGOZBTKSA-N 0 2 430.460 4.391 40 10 IICBLN Cc1cccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)cc2)c1 ZINC000408914594 556889824 /nfs/dbraw/zinc/88/98/24/556889824.db2.gz QZXZEIYXNPMCBT-LPYMAVHISA-N 0 2 430.435 4.380 40 10 IICBLN CCOc1ccc(Br)cc1/C=C1/C(=O)NC(=O)N(c2ccc(CC)cc2)C1=O ZINC000408987577 556910182 /nfs/dbraw/zinc/91/01/82/556910182.db2.gz FUBRXRAMHSFNDB-ATVHPVEESA-N 0 2 443.297 4.077 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(O)cc3)C2=O)cc1Cl ZINC000409049073 556932180 /nfs/dbraw/zinc/93/21/80/556932180.db2.gz VWXWJAWGVHPPIS-RIYZIHGNSA-N 0 2 435.263 4.154 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)cc(Cl)c3O)C2=O)cc1Cl ZINC000409049234 556932186 /nfs/dbraw/zinc/93/21/86/556932186.db2.gz VTYCELBNTYFEML-LFYBBSHMSA-N 0 2 425.655 4.327 40 10 IICBLN COc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1Cl ZINC000409056903 556934378 /nfs/dbraw/zinc/93/43/78/556934378.db2.gz NJJBMLLIQXKXAH-LFYBBSHMSA-N 0 2 425.655 4.322 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c(C)n1-c1cc(C)ccn1 ZINC000409235702 557026508 /nfs/dbraw/zinc/02/65/08/557026508.db2.gz DAKCYIATKGDPCC-LDADJPATSA-N 0 2 448.910 4.426 40 10 IICBLN O=C1NC(=O)N(c2cccnc2)C(=O)/C1=C/c1ccc(-c2cc(Cl)ccc2Cl)o1 ZINC000409245435 557027221 /nfs/dbraw/zinc/02/72/21/557027221.db2.gz SWROVODVGODORO-OQLLNIDSSA-N 0 2 428.231 4.315 40 10 IICBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2ccc(N3CCCC3)c(F)c2)C1=O ZINC000409247420 557028505 /nfs/dbraw/zinc/02/85/05/557028505.db2.gz HEJRXPZVQYDXKD-RVDMUPIBSA-N 0 2 427.863 4.054 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccncc3)C2=O)c(C)n1-c1cccc(Cl)c1C ZINC000409391204 557095727 /nfs/dbraw/zinc/09/57/27/557095727.db2.gz HYRWMNGBYAYUEY-LDADJPATSA-N 0 2 434.883 4.117 40 10 IICBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OC(C)C)c(Br)c2)C1=O ZINC000014133149 557421782 /nfs/dbraw/zinc/42/17/82/557421782.db2.gz MLEUPKPKRHKXLC-XNTDXEJSSA-N 0 2 443.297 4.211 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(C)c(C)c4)c3C)C2=O)cc1 ZINC000408739784 556210940 /nfs/dbraw/zinc/21/09/40/556210940.db2.gz FQGWISNOTZZDRS-OEAKJJBVSA-N 0 2 443.503 4.386 40 10 IICBLN CCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)cc1Cl ZINC000016692354 556627616 /nfs/dbraw/zinc/62/76/16/556627616.db2.gz QZFAHVUDPAIYKF-ZROIWOOFSA-N 0 2 449.688 4.168 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc(Cl)c1OCC ZINC000408799721 556857857 /nfs/dbraw/zinc/85/78/57/556857857.db2.gz HXDQFHOFYGWABA-LICLKQGHSA-N 0 2 442.899 4.421 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)ccc1OC(C)C ZINC000408800325 556858086 /nfs/dbraw/zinc/85/80/86/556858086.db2.gz LZKNREADDCKFMI-LICLKQGHSA-N 0 2 428.872 4.192 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)ccc1OC ZINC000408802456 556859363 /nfs/dbraw/zinc/85/93/63/556859363.db2.gz FGMPLLXJEMZSML-MDWZMJQESA-N 0 2 435.263 4.067 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)cc1Br ZINC000408802228 556859407 /nfs/dbraw/zinc/85/94/07/556859407.db2.gz XTJYGJLXLSPVIF-NTUHNPAUSA-N 0 2 449.688 4.086 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)cc1Br ZINC000408819900 556866036 /nfs/dbraw/zinc/86/60/36/556866036.db2.gz YYBLPHUPBBHILE-XNTDXEJSSA-N 0 2 443.297 4.131 40 10 IICBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c(C)n1-c1ccc(O)cc1 ZINC000408848129 556869509 /nfs/dbraw/zinc/86/95/09/556869509.db2.gz PJBCMERFYBYIPZ-LPYMAVHISA-N 0 2 429.476 4.083 40 10 IICBLN CC(=O)c1cccc(-c2ccc(C=C3C(=O)NC(=O)N(c4ccc(C)c(C)c4)C3=O)o2)c1 ZINC000408856294 556872229 /nfs/dbraw/zinc/87/22/29/556872229.db2.gz JVGWOKOEPSQQHF-FYJGNVAPSA-N 0 2 428.444 4.432 40 10 IICBLN CCCOc1ccccc1/C=C1/C(=O)NC(=O)N(c2ccc(Br)c(C)c2)C1=O ZINC000408894330 556880363 /nfs/dbraw/zinc/88/03/63/556880363.db2.gz CBLWCIKXFHIOOI-VBKFSLOCSA-N 0 2 443.297 4.213 40 10 IICBLN O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1ccc(N2CCCC2)c(F)c1 ZINC000409103235 556956822 /nfs/dbraw/zinc/95/68/22/556956822.db2.gz VNHBLBRNBOLOJR-NTEUORMPSA-N 0 2 448.281 4.399 40 10 IICBLN O=C1NC(=O)N(c2cccnc2)C(=O)/C1=C\c1ccc(-c2cccc(Cl)c2Cl)o1 ZINC000409231093 557022712 /nfs/dbraw/zinc/02/27/12/557022712.db2.gz BJEILKUMOUJARJ-ZROIWOOFSA-N 0 2 428.231 4.315 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)c(C)n1-c1ccc(C(C)(C)C)cc1 ZINC000409242151 557032272 /nfs/dbraw/zinc/03/22/72/557032272.db2.gz MYBXNINSNAPZSZ-HYARGMPZSA-N 0 2 442.519 4.453 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)[C@@H](C)CC(C)(C)N4C)C2=O)cc1 ZINC000208198388 557079326 /nfs/dbraw/zinc/07/93/26/557079326.db2.gz XNPTUJRMXISKMP-NPRIEWAGSA-N 0 2 433.508 4.084 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccncc3)C2=O)c(C)n1-c1cccc2ccccc21 ZINC000409394084 557098166 /nfs/dbraw/zinc/09/81/66/557098166.db2.gz VJPQIICNEWZOCT-PXLXIMEGSA-N 0 2 436.471 4.309 40 10 IICBLN COc1ccc(-c2[nH]n(-c3ccc([N+](=O)[O-])cc3)c(=O)c2C(C)=Nc2ncccc2C)cc1 ZINC000103922152 557141361 /nfs/dbraw/zinc/14/13/61/557141361.db2.gz SSGFISQIIDZYIR-PGMHBOJBSA-N 0 2 443.463 4.444 40 10 IICBLN CCOC(=O)c1ccc(-c2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(C)c4)C3=O)o2)cc1 ZINC000113836391 557307596 /nfs/dbraw/zinc/30/75/96/557307596.db2.gz UGYNMCMDWNUTRT-XSFVSMFZSA-N 0 2 444.443 4.098 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)cc(Cl)c1OCC ZINC000014133028 557421464 /nfs/dbraw/zinc/42/14/64/557421464.db2.gz LTIKDTLQSCTJHQ-XNTDXEJSSA-N 0 2 428.872 4.112 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)ccc1OCc1ccccc1 ZINC000014132657 557421541 /nfs/dbraw/zinc/42/15/41/557421541.db2.gz QSAOGHVPMLQDOS-XSFVSMFZSA-N 0 2 442.471 4.249 40 10 IICBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2OCc2cccc(F)c2)C1=O ZINC000014133098 557421738 /nfs/dbraw/zinc/42/17/38/557421738.db2.gz GGFOWYPMXPPSPS-XSFVSMFZSA-N 0 2 430.435 4.380 40 10 IICBLN O=c1[nH]c2cc(Cl)c(S(=O)(=O)Nc3nc(-c4ccc(Cl)cc4)cs3)cc2o1 ZINC000223331682 557460036 /nfs/dbraw/zinc/46/00/36/557460036.db2.gz ABZLUQNLESGXPU-UHFFFAOYSA-N 0 2 442.305 4.352 40 10 IICBLN COc1ccc(C=C2C(=O)NC(=O)N(c3ccc(Br)c(C)c3)C2=O)cc1OC ZINC000059860857 557827849 /nfs/dbraw/zinc/82/78/49/557827849.db2.gz JAESJNURPHWXMV-NTEUORMPSA-N 0 2 445.269 4.281 40 10 IICBLN COc1ccc(OC)c(S(=O)(=O)Nc2ccc(Cl)cc2C(=O)c2ccccc2)c1 ZINC000137615971 569261113 /nfs/dbraw/zinc/26/11/13/569261113.db2.gz SSTLTKMMSXUQJD-UHFFFAOYSA-N 0 2 431.897 4.389 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3c[nH]c4ccc(Br)cc34)C2=O)cc1C ZINC000009259873 132311419 /nfs/dbraw/zinc/31/14/19/132311419.db2.gz BCQVDFWLIVLGLG-IUXPMGMMSA-N 0 2 438.281 4.214 40 10 IICBLN COc1cccc(C(=O)Oc2ccc(Cl)cc2/C=C2/C(=O)NN(c3ccccc3)C2=O)c1 ZINC000035127314 555831735 /nfs/dbraw/zinc/83/17/35/555831735.db2.gz KSXHIPIZXPJCPX-ZHZULCJRSA-N 0 2 448.862 4.029 40 10 IICBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3c[nH]c4ccc(Br)cc34)C2=O)cc1 ZINC000017101889 556666286 /nfs/dbraw/zinc/66/62/86/556666286.db2.gz OPPUREUZQIWBHR-MFOYZWKCSA-N 0 2 438.281 4.159 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4cccc(C)c4)c3C)C2=O)cc1 ZINC000408760202 556687296 /nfs/dbraw/zinc/68/72/96/556687296.db2.gz UJTDACWWRAHIAS-HYARGMPZSA-N 0 2 429.476 4.078 40 10 IICBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc1OC ZINC000408807567 556858924 /nfs/dbraw/zinc/85/89/24/556858924.db2.gz DDLNIKSKMCGOBW-MHWRWJLKSA-N 0 2 428.872 4.112 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)ccc1OC(C)C ZINC000408803671 556859969 /nfs/dbraw/zinc/85/99/69/556859969.db2.gz RVQSALBXKQIJKL-RIYZIHGNSA-N 0 2 449.290 4.456 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)cc(Cl)c1OCC ZINC000408808445 556861525 /nfs/dbraw/zinc/86/15/25/556861525.db2.gz PQVBDAIRVULDOB-MHWRWJLKSA-N 0 2 442.899 4.421 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)c(OC(C)C)c1 ZINC000408810813 556862549 /nfs/dbraw/zinc/86/25/49/556862549.db2.gz UWNCUPMZAPENQQ-RQZCQDPDSA-N 0 2 428.872 4.111 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)cc1OC ZINC000408816251 556863615 /nfs/dbraw/zinc/86/36/15/556863615.db2.gz YCYVNUCAEHLMKX-XNTDXEJSSA-N 0 2 428.872 4.112 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3cccc(F)c3)C2=O)cc1 ZINC000408884362 556877670 /nfs/dbraw/zinc/87/76/70/556877670.db2.gz UGEHBVDMUPRFDV-XQNSMLJCSA-N 0 2 444.462 4.482 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1OCc1ccccc1 ZINC000408900152 556882113 /nfs/dbraw/zinc/88/21/13/556882113.db2.gz RSWBQITXYOVSGF-KGENOOAVSA-N 0 2 442.471 4.249 40 10 IICBLN O=C1NC(=O)N(c2cc(C(F)(F)F)ccc2Cl)C(=O)/C1=C\c1ccc(O)c(Cl)c1 ZINC000408934183 556895203 /nfs/dbraw/zinc/89/52/03/556895203.db2.gz CTHWZYDNQCNQEG-YHYXMXQVSA-N 0 2 445.180 4.384 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4F)c3)C2=O)cc1 ZINC000408935479 556895491 /nfs/dbraw/zinc/89/54/91/556895491.db2.gz HHGRFZMHYUNRCC-STZFKDTASA-N 0 2 430.435 4.380 40 10 IICBLN CCOc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccccc4F)C3=O)c2C)cc1 ZINC000409187651 556988277 /nfs/dbraw/zinc/98/82/77/556988277.db2.gz SWDVCCPRSVTACE-XSFVSMFZSA-N 0 2 447.466 4.298 40 10 IICBLN CCCOc1ccc(N2C(=O)NC(=O)C(=Cc3c(Cl)cccc3Cl)C2=O)cc1OC ZINC000409216239 557011209 /nfs/dbraw/zinc/01/12/09/557011209.db2.gz GLXMKKNAKSLDSN-SDNWHVSQSA-N 0 2 449.290 4.457 40 10 IICBLN O=C1NC(=O)N(c2ccncc2)C(=O)/C1=C/c1ccc(Sc2ccc(Cl)cc2)o1 ZINC000409394238 557098524 /nfs/dbraw/zinc/09/85/24/557098524.db2.gz XLPDWFJFUDZCBW-LFIBNONCSA-N 0 2 425.853 4.146 40 10 IICBLN CCCc1[nH]n(-c2ccc(F)cc2)c(=O)c1C=Nc1cc(OC)c(OC)cc1C(=O)OC ZINC000102881698 557309594 /nfs/dbraw/zinc/30/95/94/557309594.db2.gz UBLVHNMNKQOCOW-GHRIWEEISA-N 0 2 441.459 4.128 40 10 IICBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(OC)cc4)C3=O)cc2[C@@H](C)CC1(C)C ZINC000223533256 557482875 /nfs/dbraw/zinc/48/28/75/557482875.db2.gz JGIKVJFWQSNCFR-YIRPMMGJSA-N 0 2 447.535 4.474 40 10 IICBLN O=C1NC(=O)N(c2cccnc2)C(=O)C1=Cc1cccn1-c1ccc(Br)cc1 ZINC000096504871 569250139 /nfs/dbraw/zinc/25/01/39/569250139.db2.gz JLCKJEUBZHJWQO-GZTJUZNOSA-N 0 2 437.253 4.142 40 10 IICBLN COc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)c(Br)cc1OC(C)(C)C ZINC000033740407 569259733 /nfs/dbraw/zinc/25/97/33/569259733.db2.gz RZVDIHGVCJCEPF-GDNBJRDFSA-N 0 2 445.313 4.096 40 10 IICBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2=O)cc1 ZINC000002221182 536184288 /nfs/dbraw/zinc/18/42/88/536184288.db2.gz YHQBNCJKHSSODT-CPNJWEJPSA-N 0 2 431.404 4.084 40 10 IICBLN Cc1nn(-c2ccc(C)c(C)c2)c(C)c1/C=C1\C(=O)NC(=O)N(c2ccccc2C)C1=O ZINC000408755707 556238360 /nfs/dbraw/zinc/23/83/60/556238360.db2.gz DTDQTXOUXANZAO-FYJGNVAPSA-N 0 2 428.492 4.081 40 10 IICBLN CCc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccccc4F)C3=O)c2C)cc1 ZINC000408762762 556828959 /nfs/dbraw/zinc/82/89/59/556828959.db2.gz LCTLVTWMAAXFAH-XSFVSMFZSA-N 0 2 431.467 4.462 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Sc4nc5ccccc5[nH]4)o3)C2=O)cc1 ZINC000408781378 556855830 /nfs/dbraw/zinc/85/58/30/556855830.db2.gz CSAZPTOBVVBKIM-FOWTUZBSSA-N 0 2 444.472 4.282 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc(Cl)c1OC(C)C ZINC000408806656 556859214 /nfs/dbraw/zinc/85/92/14/556859214.db2.gz GDPLQRIRJIBTRU-OVCLIPMQSA-N 0 2 449.290 4.456 40 10 IICBLN CCOc1cc(OC)ccc1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O ZINC000408803520 556860009 /nfs/dbraw/zinc/86/00/09/556860009.db2.gz PZRLMIRUUKECOZ-RIYZIHGNSA-N 0 2 435.263 4.067 40 10 IICBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(O)cc4)C3=O)cc2)cc1C ZINC000408809603 556861847 /nfs/dbraw/zinc/86/18/47/556861847.db2.gz HNDFXCGLHHZADA-OEAKJJBVSA-N 0 2 442.471 4.254 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3c(OC(C)C)ccc4ccccc43)C2=O)cc1 ZINC000408819475 556865231 /nfs/dbraw/zinc/86/52/31/556865231.db2.gz XHJBHTODNCAQNK-KGENOOAVSA-N 0 2 430.460 4.302 40 10 IICBLN Cc1cccc(COc2ccc(/C=C3/C(=O)NC(=O)N(c4ccccc4F)C3=O)cc2)c1 ZINC000408868789 556874113 /nfs/dbraw/zinc/87/41/13/556874113.db2.gz BIXFDOKBKIRATO-ZHZULCJRSA-N 0 2 430.435 4.380 40 10 IICBLN CCOc1cc(Br)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c1 ZINC000408869390 556874532 /nfs/dbraw/zinc/87/45/32/556874532.db2.gz CRSQHHBYDJQTKL-VCHYOVAHSA-N 0 2 443.297 4.131 40 10 IICBLN CCOc1cc(Br)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)c1 ZINC000408870972 556875022 /nfs/dbraw/zinc/87/50/22/556875022.db2.gz WJSJYQLQSRUCLU-NTEUORMPSA-N 0 2 449.688 4.168 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3ccccc3F)C2=O)cc1 ZINC000408881457 556878291 /nfs/dbraw/zinc/87/82/91/556878291.db2.gz MILJTUFNPKOPIU-CJLVFECKSA-N 0 2 444.462 4.482 40 10 IICBLN CC(C)(C)c1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)cc1 ZINC000408900501 556882322 /nfs/dbraw/zinc/88/23/22/556882322.db2.gz TWMPJUIZSULVNT-SFQUDFHCSA-N 0 2 427.298 4.413 40 10 IICBLN O=C1NC(=O)N(c2ccc(OCc3ccc(Cl)cc3)cc2)C(=O)/C1=C\c1cccc(O)c1 ZINC000408936536 556895984 /nfs/dbraw/zinc/89/59/84/556895984.db2.gz KWSOYRMABQWUJO-BKUYFWCQSA-N 0 2 448.862 4.291 40 10 IICBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4)c3)C2=O)cc1 ZINC000408937830 556896896 /nfs/dbraw/zinc/89/68/96/556896896.db2.gz PFANETNAHKKUFD-KQWNVCNZSA-N 0 2 426.472 4.494 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(OC)cc3)C2=O)cc1Cl ZINC000409056233 556933824 /nfs/dbraw/zinc/93/38/24/556933824.db2.gz LFSWNKDIXZGQSH-OQLLNIDSSA-N 0 2 449.290 4.457 40 10 IICBLN COc1cc(N2CCCCC2)ccc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O ZINC000409239851 557020967 /nfs/dbraw/zinc/02/09/67/557020967.db2.gz QYGGLUJSHGGBGT-XDHOZWIPSA-N 0 2 439.899 4.005 40 10 IICBLN COc1cccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c1OC(C)C ZINC000409243465 557033408 /nfs/dbraw/zinc/03/34/08/557033408.db2.gz WOLLZXYFMMFMDZ-RVDMUPIBSA-N 0 2 428.872 4.111 40 10 IICBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2OCc2ccc(F)cc2)C1=O ZINC000014133099 557421795 /nfs/dbraw/zinc/42/17/95/557421795.db2.gz CJUUHHCCZHOIOC-XSFVSMFZSA-N 0 2 430.435 4.380 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1Cc1ccccc1 ZINC000059336662 557822185 /nfs/dbraw/zinc/82/21/85/557822185.db2.gz OVFBFKYEKQAQKN-RCCKNPSSSA-N 0 2 430.435 4.092 40 10 IICBLN COC(=O)c1ccc(-c2ccc(C=C3C(=O)NC(=O)N(c4ccc(F)cc4)C3=O)o2)cc1 ZINC000033331155 521925270 /nfs/dbraw/zinc/92/52/70/521925270.db2.gz CKWWCAAABKDMNQ-PDGQHHTCSA-N 0 2 434.379 4.379 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=CNc3c(C)cc(Br)cc3C)C2=O)cc1C ZINC000408537184 555769297 /nfs/dbraw/zinc/76/92/97/555769297.db2.gz ZKQJYPHJSFMNNK-LICLKQGHSA-N 0 2 442.313 4.262 40 10 IICBLN O=C1NC(=S)N(c2cccc(Cl)c2)C(=O)/C1=C/c1cc(Cl)cc(Cl)c1O ZINC000408723665 556151002 /nfs/dbraw/zinc/15/10/02/556151002.db2.gz ZIDOLAGLXVRUNJ-LFYBBSHMSA-N 0 2 427.696 4.184 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccc(F)cc3)C2=O)cc1 ZINC000408786360 556856513 /nfs/dbraw/zinc/85/65/13/556856513.db2.gz IHIJDEGYAYOMCK-KGENOOAVSA-N 0 2 430.435 4.380 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cccc(C)c4)cc3)C2=O)cc1 ZINC000408815342 556863194 /nfs/dbraw/zinc/86/31/94/556863194.db2.gz QCYAITYCFQYEPT-HZHRSRAPSA-N 0 2 442.471 4.249 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4ccccc4F)cc3)C2=O)cc1 ZINC000408885366 556877946 /nfs/dbraw/zinc/87/79/46/556877946.db2.gz ZZDRNELPXAVXPM-CJLVFECKSA-N 0 2 444.462 4.482 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)ccc1OCc1ccccc1F ZINC000408893014 556881744 /nfs/dbraw/zinc/88/17/44/556881744.db2.gz DRTJAVCFSXGGTH-CPNJWEJPSA-N 0 2 446.434 4.080 40 10 IICBLN Cc1cc(N2C(=O)NC(=O)C(=Cc3ccccc3OC(C)C)C2=O)ccc1Br ZINC000408900810 556882231 /nfs/dbraw/zinc/88/22/31/556882231.db2.gz VHAFKVFEZFYWGP-WJDWOHSUSA-N 0 2 443.297 4.211 40 10 IICBLN CC[C@@H](C)Oc1c(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cccc1OC ZINC000408897908 556883279 /nfs/dbraw/zinc/88/32/79/556883279.db2.gz JOESTPAUZSUQBC-LVLBFHFTSA-N 0 2 428.872 4.192 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)cc(Cl)c1OC(C)C ZINC000408915500 556890324 /nfs/dbraw/zinc/89/03/24/556890324.db2.gz WLSOWSWRICZSBU-LZYBPNLTSA-N 0 2 446.862 4.331 40 10 IICBLN CCOc1c(Cl)cc(/C=C2/C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc1OC ZINC000408983112 556908321 /nfs/dbraw/zinc/90/83/21/556908321.db2.gz KPSYNLZAGMQZBS-AUWJEWJLSA-N 0 2 449.290 4.376 40 10 IICBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2=O)cc1 ZINC000408990241 556911216 /nfs/dbraw/zinc/91/12/16/556911216.db2.gz WKJBUVBQCGXEMU-QGOAFFKASA-N 0 2 431.404 4.084 40 10 IICBLN CC1=NN(c2c(F)c(F)c(F)c(F)c2F)C(=O)/C1=C/c1cc(Cl)cc([N+](=O)[O-])c1O ZINC000409046876 556931481 /nfs/dbraw/zinc/93/14/81/556931481.db2.gz SDDOAZPSAMHPKD-FPYGCLRLSA-N 0 2 447.703 4.455 40 10 IICBLN COc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccccc2Cl)C1=O ZINC000409050224 556932394 /nfs/dbraw/zinc/93/23/94/556932394.db2.gz SOYNZKKTABHHJZ-YRNVUSSQSA-N 0 2 425.655 4.322 40 10 IICBLN CCCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cl)cc3Cl)C2=O)cc1OC ZINC000409215379 557010177 /nfs/dbraw/zinc/01/01/77/557010177.db2.gz ZYRMTOJWMWHWAC-OQLLNIDSSA-N 0 2 449.290 4.457 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(-c3ccccc3C)c2C)C1=O ZINC000409222458 557017466 /nfs/dbraw/zinc/01/74/66/557017466.db2.gz XGCPESOSKZNOGF-HMMYKYKNSA-N 0 2 443.503 4.468 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccncc3)C2=O)c(C)n1-c1cc(Cl)ccc1C ZINC000409393259 557097477 /nfs/dbraw/zinc/09/74/77/557097477.db2.gz PKQDIJFVZIDNBO-YBFXNURJSA-N 0 2 434.883 4.117 40 10 IICBLN CCCC1=NN(c2ccccc2)C(=O)C1C(C)=Nc1cc(C(=O)OC)cc(C(=O)OC)c1 ZINC000103919223 557140717 /nfs/dbraw/zinc/14/07/17/557140717.db2.gz RZTVDNYXOCTHHW-QNGOZBTKSA-N 0 2 435.480 4.149 40 10 IICBLN CCCc1[nH]n(-c2ccccc2)c(=O)c1C(C)=Nc1cc(C(=O)OC)cc(C(=O)OC)c1 ZINC000103919223 557140721 /nfs/dbraw/zinc/14/07/21/557140721.db2.gz RZTVDNYXOCTHHW-QNGOZBTKSA-N 0 2 435.480 4.149 40 10 IICBLN CCCC1=NN(c2ccccc2)C(=O)C1=C(C)Nc1cc(C(=O)OC)cc(C(=O)OC)c1 ZINC000103919223 557140724 /nfs/dbraw/zinc/14/07/24/557140724.db2.gz RZTVDNYXOCTHHW-QNGOZBTKSA-N 0 2 435.480 4.149 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc(Cl)c1OC(C)C ZINC000111507823 557228811 /nfs/dbraw/zinc/22/88/11/557228811.db2.gz MLLQCEBKSAVFOG-RQZCQDPDSA-N 0 2 442.899 4.419 40 10 IICBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3ccc(F)cc3)cc2)C1=O ZINC000014132717 557421596 /nfs/dbraw/zinc/42/15/96/557421596.db2.gz MXVQDDHOJNRUSG-KGENOOAVSA-N 0 2 430.435 4.380 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)cc(Cl)c1OC(C)C ZINC000014133164 557421838 /nfs/dbraw/zinc/42/18/38/557421838.db2.gz DKDVHZKUTJGCCW-OQLLNIDSSA-N 0 2 428.872 4.111 40 10 IICBLN O=C1C(=Cc2ccc(O)c([N+](=O)[O-])c2)C(=O)N(c2ccccc2)C(=S)N1c1ccccc1 ZINC000059426375 557823581 /nfs/dbraw/zinc/82/35/81/557823581.db2.gz WXSXKVJHRZLYSF-UHFFFAOYSA-N 0 2 445.456 4.049 40 10 IICBLN CCCCCCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(O)cc3)C2=O)cc1OC ZINC000408537674 555781740 /nfs/dbraw/zinc/78/17/40/555781740.db2.gz GTQMTXQGOIWLNN-RGEXLXHISA-N 0 2 438.480 4.026 40 10 IICBLN CC(=C\c1ccccc1)/C=C1\C(=O)NC(=O)N(c2ccc(Br)c(C)c2)C1=O ZINC000408756871 556236874 /nfs/dbraw/zinc/23/68/74/556236874.db2.gz XWYWUBAJTJBEQX-YAXRHUFXSA-N 0 2 425.282 4.370 40 10 IICBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c(C)n1-c1ccc(O)cc1 ZINC000408772987 556848051 /nfs/dbraw/zinc/84/80/51/556848051.db2.gz ODKSIPZKRLSDCC-LPYMAVHISA-N 0 2 429.476 4.083 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)cc(Cl)c1OCC ZINC000408779710 556854063 /nfs/dbraw/zinc/85/40/63/556854063.db2.gz IOIKNQMOAPYGGM-LICLKQGHSA-N 0 2 442.899 4.421 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc(Cl)c1OC ZINC000408782575 556855101 /nfs/dbraw/zinc/85/51/01/556855101.db2.gz IRAZJHIQKANJPN-RIYZIHGNSA-N 0 2 435.263 4.067 40 10 IICBLN COc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O ZINC000408805588 556860809 /nfs/dbraw/zinc/86/08/09/556860809.db2.gz HBHTWFAYNOZQAM-KPKJPENVSA-N 0 2 425.655 4.322 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)cc1OC ZINC000408810792 556862447 /nfs/dbraw/zinc/86/24/47/556862447.db2.gz QAIYWLLGSQTRPL-MHWRWJLKSA-N 0 2 428.872 4.112 40 10 IICBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccc(F)cc3)C2=O)c1 ZINC000408817176 556864042 /nfs/dbraw/zinc/86/40/42/556864042.db2.gz ZWAITESQQJIJCH-KGENOOAVSA-N 0 2 430.435 4.380 40 10 IICBLN CCCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2ccc(OC)cc2)C1=O ZINC000408813728 556864954 /nfs/dbraw/zinc/86/49/54/556864954.db2.gz YKKOKZFMDNCRSI-RCCKNPSSSA-N 0 2 430.460 4.304 40 10 IICBLN COc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccc(C)c(C)c4)C3=O)c2C)cc1 ZINC000408855180 556871974 /nfs/dbraw/zinc/87/19/74/556871974.db2.gz DDNLMSUWIWSSDR-OEAKJJBVSA-N 0 2 443.503 4.386 40 10 IICBLN CC[C@@H](C)Oc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(Br)cc2)C1=O ZINC000408902809 556885470 /nfs/dbraw/zinc/88/54/70/556885470.db2.gz LNUJZROMTNGITR-LVLBFHFTSA-N 0 2 443.297 4.293 40 10 IICBLN Cc1ccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)cc1 ZINC000408913833 556889352 /nfs/dbraw/zinc/88/93/52/556889352.db2.gz OAMQFSYTOPAFGK-FYJGNVAPSA-N 0 2 430.435 4.380 40 10 IICBLN CCOc1cccc(/C=C2\C(=O)NC(=O)N(c3cc(C(F)(F)F)ccc3Cl)C2=O)c1 ZINC000408934502 556895504 /nfs/dbraw/zinc/89/55/04/556895504.db2.gz DVFSMZWLYSAFGY-NTEUORMPSA-N 0 2 438.789 4.424 40 10 IICBLN CCN(CC)c1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)c(OC)c1 ZINC000408986923 556909829 /nfs/dbraw/zinc/90/98/29/556909829.db2.gz NTNOXBZORSCBAK-WQRHYEAKSA-N 0 2 441.915 4.170 40 10 IICBLN CCOc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)c2C)cc1 ZINC000409186840 556991142 /nfs/dbraw/zinc/99/11/42/556991142.db2.gz IMYFJUDTFHRBEY-PXLXIMEGSA-N 0 2 429.476 4.159 40 10 IICBLN O=C1NC(=O)N(c2cccnc2)C(=O)/C1=C\c1ccc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000409231282 557022948 /nfs/dbraw/zinc/02/29/48/557022948.db2.gz JNWAYUGCGSAZMY-ZROIWOOFSA-N 0 2 428.231 4.315 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)[C@@H](C)CC(C)(C)N4C)C2=O)cc1 ZINC000208198051 557079509 /nfs/dbraw/zinc/07/95/09/557079509.db2.gz ILTWAXCSAXVDPP-YIRPMMGJSA-N 0 2 447.535 4.474 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)C(C)=CC(C)(C)N4C)C2=O)cc1 ZINC000208445167 557087404 /nfs/dbraw/zinc/08/74/04/557087404.db2.gz GTUJDBYRGPGMFF-KGENOOAVSA-N 0 2 445.519 4.383 40 10 IICBLN Cc1cc2c(cc1/C=C1\C(=O)NC(=O)N(c3cccc(F)c3)C1=O)C(C)=CC(C)(C)N2C ZINC000208454821 557088383 /nfs/dbraw/zinc/08/83/83/557088383.db2.gz HYZYECXLWWSWEH-RGVLZGJSSA-N 0 2 433.483 4.432 40 10 IICBLN Cc1cc(N2CCCCC2)ccc1C=C1C(=O)NC(=O)N(c2ccc3c(c2)OCO3)C1=O ZINC000059104486 557814290 /nfs/dbraw/zinc/81/42/90/557814290.db2.gz RTHOSIAPKQDCTI-XDHOZWIPSA-N 0 2 433.464 4.221 40 10 IICBLN COc1c(Cl)cc(C=C2C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)cc1Cl ZINC000059105193 557814564 /nfs/dbraw/zinc/81/45/64/557814564.db2.gz PRDPFVPKXNXQGJ-NYYWCZLTSA-N 0 2 435.219 4.237 40 10 IICBLN CCc1cc(Br)ccc1N1C(=O)NC(=O)C(=CNc2cc(C)ccc2C)C1=O ZINC000408526157 555715305 /nfs/dbraw/zinc/71/53/05/555715305.db2.gz AALJCJWOJOYRNJ-LFIBNONCSA-N 0 2 442.313 4.207 40 10 IICBLN Cc1c(C)c(NC=C2C(=O)NC(=O)N(c3ccccc3Cl)C2=O)ccc1Br ZINC000408526170 555715330 /nfs/dbraw/zinc/71/53/30/555715330.db2.gz ATNSRRHAGQARGO-FMIVXFBMSA-N 0 2 448.704 4.298 40 10 IICBLN CCc1cc(Br)ccc1N1C(=O)NC(=O)C(=CNc2ccc(C)cc2C)C1=O ZINC000408535202 555760819 /nfs/dbraw/zinc/76/08/19/555760819.db2.gz XXDPRXINAZYBQL-LFIBNONCSA-N 0 2 442.313 4.207 40 10 IICBLN Cc1nn(-c2ccc(C)cc2C)c(C)c1/C=C1/C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O ZINC000408756909 556236863 /nfs/dbraw/zinc/23/68/63/556236863.db2.gz KEUAYQNTGJNEQZ-NDENLUEZSA-N 0 2 448.910 4.426 40 10 IICBLN CCn1cc(/C=C2/C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)c2ccccc21 ZINC000015013075 556484086 /nfs/dbraw/zinc/48/40/86/556484086.db2.gz MGPKIZIOCYHJDC-BOPFTXTBSA-N 0 2 438.281 4.090 40 10 IICBLN Cc1nnc(NS(=O)(=O)c2ccc(NN=C3C=CC(=O)c4ncccc43)cc2)s1 ZINC000017824707 556679664 /nfs/dbraw/zinc/67/96/64/556679664.db2.gz SFILKVPTXQDZEH-QURGRASLSA-N 0 2 426.483 4.317 40 10 IICBLN Cc1nn(-c2ccc(C)c(C)c2)c(C)c1C=C1C(=O)NC(=O)N(c2ccc(C)c(C)c2)C1=O ZINC000408758121 556807079 /nfs/dbraw/zinc/80/70/79/556807079.db2.gz VOVWATXNGJDGCT-YDZHTSKRSA-N 0 2 442.519 4.389 40 10 IICBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(Sc3nc4ccccc4[nH]3)o2)C1=O ZINC000408790361 556856294 /nfs/dbraw/zinc/85/62/94/556856294.db2.gz QSCJJLVTCBUUAP-NTCAYCPXSA-N 0 2 444.472 4.282 40 10 IICBLN CCCOc1ccc(Br)cc1/C=C1\C(=O)NC(=O)N(c2ccc(C)cc2)C1=O ZINC000408800984 556858386 /nfs/dbraw/zinc/85/83/86/556858386.db2.gz QVMPNTUSJJRSBS-SFQUDFHCSA-N 0 2 443.297 4.213 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)cc(Cl)c1OC(C)C ZINC000408801310 556858672 /nfs/dbraw/zinc/85/86/72/556858672.db2.gz VBOCRUWPNQIISZ-MHWRWJLKSA-N 0 2 428.872 4.192 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1OC ZINC000408802029 556858827 /nfs/dbraw/zinc/85/88/27/556858827.db2.gz YCYRJOCUTIIPEB-OVCLIPMQSA-N 0 2 449.290 4.457 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)cc1Br ZINC000408807982 556861240 /nfs/dbraw/zinc/86/12/40/556861240.db2.gz LVVBESCDTOEYDQ-XNTDXEJSSA-N 0 2 443.297 4.131 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c(OCc2ccc(F)cc2)c1 ZINC000408808906 556861613 /nfs/dbraw/zinc/86/16/13/556861613.db2.gz GVAFVNWZRIKBTG-FYJGNVAPSA-N 0 2 446.434 4.080 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)cc(Cl)c1OC ZINC000408811623 556862683 /nfs/dbraw/zinc/86/26/83/556862683.db2.gz VYQSFRTWSQNNAJ-XYOKQWHBSA-N 0 2 435.263 4.067 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)c(OC(C)C)c1 ZINC000408819069 556864859 /nfs/dbraw/zinc/86/48/59/556864859.db2.gz YAYURVAVROPSKR-OVCLIPMQSA-N 0 2 449.290 4.456 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c(Cc2ccccc2F)c1 ZINC000408869896 556873062 /nfs/dbraw/zinc/87/30/62/556873062.db2.gz SNXCSTZCZVWHPT-RCCKNPSSSA-N 0 2 430.435 4.092 40 10 IICBLN CCCOc1ccc(Br)cc1/C=C1/C(=O)NC(=O)N(c2ccccc2F)C1=O ZINC000408870999 556875033 /nfs/dbraw/zinc/87/50/33/556875033.db2.gz WSUSMBNYMZGTBZ-KAMYIIQDSA-N 0 2 447.260 4.043 40 10 IICBLN CCOc1cc(Br)cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)c1 ZINC000408876514 556876587 /nfs/dbraw/zinc/87/65/87/556876587.db2.gz LRPKKZSYEUOSOZ-LZYBPNLTSA-N 0 2 449.688 4.168 40 10 IICBLN Cc1cc(C)cc(Cc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccc(O)cc3)C2=O)c1 ZINC000408885118 556877912 /nfs/dbraw/zinc/87/79/12/556877912.db2.gz WTLFGKARGAJGEZ-HZHRSRAPSA-N 0 2 426.472 4.266 40 10 IICBLN CCOc1cc(Cl)c(/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)cc1OCC ZINC000408900499 556882358 /nfs/dbraw/zinc/88/23/58/556882358.db2.gz TVWZSOPNCNAHBC-LICLKQGHSA-N 0 2 442.899 4.421 40 10 IICBLN Cc1cc(Br)ccc1N1C(=O)NC(=O)C(=Cc2ccc(OC(C)C)cc2)C1=O ZINC000408901384 556882587 /nfs/dbraw/zinc/88/25/87/556882587.db2.gz XPUSTFCEAOXEGL-BOPFTXTBSA-N 0 2 443.297 4.211 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccc(C)cc4)c3)C2=O)cc1 ZINC000408937178 556896932 /nfs/dbraw/zinc/89/69/32/556896932.db2.gz MXMMJJNXQZEITQ-HAHDFKILSA-N 0 2 442.471 4.249 40 10 IICBLN O=C1NC(=O)N(c2ccc3c(c2)OCO3)C(=O)/C1=C/c1c2ccccc2cc2ccccc21 ZINC000408956047 556900166 /nfs/dbraw/zinc/90/01/66/556900166.db2.gz VTKIMTXUBSPQQE-FYJGNVAPSA-N 0 2 436.423 4.388 40 10 IICBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c(C)n1Cc1ccccc1 ZINC000408967966 556903533 /nfs/dbraw/zinc/90/35/33/556903533.db2.gz YHIZMYIOESXIGP-OEAKJJBVSA-N 0 2 427.504 4.436 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c(C)n1-c1ccc2ncccc2c1 ZINC000408968490 556903949 /nfs/dbraw/zinc/90/39/49/556903949.db2.gz ZNXDGHOKAUUBAI-PXLXIMEGSA-N 0 2 436.471 4.309 40 10 IICBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cccc(C(C)=O)c4)o3)C2=O)cc1 ZINC000408985436 556909289 /nfs/dbraw/zinc/90/92/89/556909289.db2.gz WVMAHIOMEZFBGE-STZFKDTASA-N 0 2 428.444 4.378 40 10 IICBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2cc(Cl)cc(Cl)c2O)C1=O ZINC000409041644 556929490 /nfs/dbraw/zinc/92/94/90/556929490.db2.gz KIBNEZJALRSDRE-IZZDOVSWSA-N 0 2 425.655 4.327 40 10 IICBLN CCOc1cc(Cl)c(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1OC ZINC000409228516 557015380 /nfs/dbraw/zinc/01/53/80/557015380.db2.gz BBJGCBXMPWCGHF-MDWZMJQESA-N 0 2 449.290 4.376 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)c(C)n1-c1ccc(C(C)C)cc1 ZINC000409232324 557023921 /nfs/dbraw/zinc/02/39/21/557023921.db2.gz NXADUJPDNUZHRY-LPYMAVHISA-N 0 2 428.492 4.279 40 10 IICBLN O=C1NC(=O)N(c2ccncc2)C(=O)/C1=C/c1ccc(-c2cccc(C(F)(F)F)c2)o1 ZINC000409394454 557098443 /nfs/dbraw/zinc/09/84/43/557098443.db2.gz AQKZZNZPHUGAJL-LFIBNONCSA-N 0 2 427.338 4.027 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccncc3)C2=O)c(C)n1-c1ccc2ccccc2c1 ZINC000409390072 557101360 /nfs/dbraw/zinc/10/13/60/557101360.db2.gz DOZLWXRMAKAIFH-HZHRSRAPSA-N 0 2 436.471 4.309 40 10 IICBLN COC(=O)Cc1[nH]n(-c2ccccc2)c(=O)c1C(C)=Nc1ccccc1OC(F)(F)F ZINC000112293193 557239228 /nfs/dbraw/zinc/23/92/28/557239228.db2.gz MXYBFVPYXZTBLO-UYRXBGFRSA-N 0 2 433.386 4.237 40 10 IICBLN CCN(CC)c1ccc(CNC(=O)c2ccc(NS(=O)(=O)c3cccs3)cc2)cc1 ZINC000223348931 557461097 /nfs/dbraw/zinc/46/10/97/557461097.db2.gz ZXQCZQVFCHAJJK-UHFFFAOYSA-N 0 2 443.594 4.325 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4cc(C)cc(C)c4)c3C)C2=O)cc1 ZINC000000843371 555568436 /nfs/dbraw/zinc/56/84/36/555568436.db2.gz RPMZZHATNUBMQA-UCQKPKSFSA-N 0 2 443.503 4.386 40 10 IICBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=CNc3cc(C)c(Br)cc3C)C2=O)c1 ZINC000408533404 555746566 /nfs/dbraw/zinc/74/65/66/555746566.db2.gz SBEOHEQWHDOCSO-XNTDXEJSSA-N 0 2 442.313 4.262 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=CNc3ccc(Br)c(Cl)c3)C2=O)cc1C ZINC000408533732 555747929 /nfs/dbraw/zinc/74/79/29/555747929.db2.gz OWNKXKWQMHYRRK-NTEUORMPSA-N 0 2 448.704 4.298 40 10 IICBLN Cc1nn(-c2ccc(C)c(C)c2)c(C)c1C=C1C(=O)NC(=O)N(c2ccc(C)cc2)C1=O ZINC000408755288 556238309 /nfs/dbraw/zinc/23/83/09/556238309.db2.gz DCSJRMFMLOLWQQ-LPYMAVHISA-N 0 2 428.492 4.081 40 10 IICBLN Cc1nn(-c2ccc(C)cc2C)c(C)c1/C=C1/C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000408757967 556612050 /nfs/dbraw/zinc/61/20/50/556612050.db2.gz SUHYXIRDIALWDK-NDENLUEZSA-N 0 2 448.910 4.426 40 10 IICBLN COc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(Br)c(C)c2)C1=O ZINC000408765633 556829686 /nfs/dbraw/zinc/82/96/86/556829686.db2.gz MUCDZXLSFYEOCJ-NTEUORMPSA-N 0 2 449.688 4.086 40 10 IICBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(Sc4nc5ccccc5[nH]4)o3)C2=O)c1 ZINC000408776154 556847439 /nfs/dbraw/zinc/84/74/39/556847439.db2.gz MRHBXSQXKOLWHM-FOWTUZBSSA-N 0 2 444.472 4.282 40 10 IICBLN COC(=O)c1ccc(C)c(-c2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)o2)c1 ZINC000408786000 556856242 /nfs/dbraw/zinc/85/62/42/556856242.db2.gz DNMVMNIQFSXISE-DEDYPNTBSA-N 0 2 444.443 4.016 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c(OC(C)C)c1 ZINC000408800507 556858345 /nfs/dbraw/zinc/85/83/45/556858345.db2.gz NESKQJVVBQQFFW-MHWRWJLKSA-N 0 2 428.872 4.111 40 10 IICBLN CCOc1ccc(Br)cc1/C=C1\C(=O)NC(=O)N(c2ccc(C)c(C)c2)C1=O ZINC000408803918 556859949 /nfs/dbraw/zinc/85/99/49/556859949.db2.gz USVPGXAKIQRSOQ-GZTJUZNOSA-N 0 2 443.297 4.131 40 10 IICBLN O=C1NC(=O)N(c2ccc(O)cc2)C(=O)/C1=C/c1cc(Cl)ccc1OCc1ccccc1 ZINC000408809672 556861913 /nfs/dbraw/zinc/86/19/13/556861913.db2.gz IGLGXSKJOYEFHA-DEDYPNTBSA-N 0 2 448.862 4.291 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc(Cl)c1OC(C)C ZINC000408810742 556862412 /nfs/dbraw/zinc/86/24/12/556862412.db2.gz JMSWRWCMLPMXCZ-CXUHLZMHSA-N 0 2 428.872 4.111 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)c(Cl)cc1OC ZINC000408852964 556870072 /nfs/dbraw/zinc/87/00/72/556870072.db2.gz KDNRNCNJLJXJPG-CXUHLZMHSA-N 0 2 428.872 4.031 40 10 IICBLN COc1ccc(/C=C2/C(=O)NC(=O)N(c3ccccc3F)C2=O)c(Cc2cccc(F)c2)c1 ZINC000408869692 556874483 /nfs/dbraw/zinc/87/44/83/556874483.db2.gz TUGLDGROWBGRPE-ZHZULCJRSA-N 0 2 448.425 4.231 40 10 IICBLN CC(C)Oc1ccc(Br)cc1/C=C1/C(=O)NC(=O)N(c2ccccc2F)C1=O ZINC000408875290 556874535 /nfs/dbraw/zinc/87/45/35/556874535.db2.gz ITMCESFNCLBCGV-UVTDQMKNSA-N 0 2 447.260 4.042 40 10 IICBLN CCOc1cc(Br)cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c1 ZINC000408873398 556875595 /nfs/dbraw/zinc/87/55/95/556875595.db2.gz QNHCYSBQFWOUAV-CXUHLZMHSA-N 0 2 449.688 4.168 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2/C(=O)NC(=O)N(c3ccccc3CC)C2=O)cc1OC ZINC000408875743 556876323 /nfs/dbraw/zinc/87/63/23/556876323.db2.gz HHFNHSAZCLRHLD-WJDWOHSUSA-N 0 2 442.899 4.366 40 10 IICBLN Cc1cc(C)cc(Cc2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(O)cc4)C3=O)cc2)c1 ZINC000408884975 556877995 /nfs/dbraw/zinc/87/79/95/556877995.db2.gz WJRCOCBDVAOUSE-HZHRSRAPSA-N 0 2 426.472 4.266 40 10 IICBLN O=C1NC(=O)N(c2ccc(O)cc2)C(=O)/C1=C\c1cccc(OCc2ccc(Cl)cc2)c1 ZINC000408935883 556895635 /nfs/dbraw/zinc/89/56/35/556895635.db2.gz IOCYOCLBLAANFN-BKUYFWCQSA-N 0 2 448.862 4.291 40 10 IICBLN CC(C)COc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(O)cc2)C1=O ZINC000409056533 556934177 /nfs/dbraw/zinc/93/41/77/556934177.db2.gz MQJVPKUJYYIFGO-LZYBPNLTSA-N 0 2 449.290 4.400 40 10 IICBLN COc1cccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)c1OC(C)C ZINC000409107417 556959421 /nfs/dbraw/zinc/95/94/21/556959421.db2.gz RTFDBBHMMGDHKG-JLHYYAGUSA-N 0 2 449.290 4.456 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(-c3ccc(C)cc3)c2C)C1=O ZINC000409228357 557014993 /nfs/dbraw/zinc/01/49/93/557014993.db2.gz XUCDWVUEJQPUGO-QNGOZBTKSA-N 0 2 443.503 4.468 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2cccn2-c2ccc(Cl)cc2)C1=O ZINC000409222216 557017144 /nfs/dbraw/zinc/01/71/44/557017144.db2.gz WCZRUTUFSHTXSS-NBVRZTHBSA-N 0 2 435.867 4.196 40 10 IICBLN O=C(NN1C(=O)/C(=C/c2cc(Cl)c(O)c(Cl)c2)SC1=S)c1cccs1 ZINC000409350860 557078518 /nfs/dbraw/zinc/07/85/18/557078518.db2.gz YXBABFCFFSFJKZ-WDZFZDKYSA-N 0 2 431.347 4.307 40 10 IICBLN CCCc1[nH]n(-c2ccccc2)c(=O)c1C(C)=Nc1cc(OC)c(OC)cc1C(=O)OC ZINC000103919276 557140260 /nfs/dbraw/zinc/14/02/60/557140260.db2.gz UXURQRSMQVZPEU-JCMHNJIXSA-N 0 2 437.496 4.379 40 10 IICBLN CCCC1=NN(c2ccccc2)C(=O)C1C(C)=Nc1cc(OC)c(OC)cc1C(=O)OC ZINC000103919276 557140264 /nfs/dbraw/zinc/14/02/64/557140264.db2.gz UXURQRSMQVZPEU-JCMHNJIXSA-N 0 2 437.496 4.379 40 10 IICBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2OCc2ccccc2F)C1=O ZINC000014133097 557421804 /nfs/dbraw/zinc/42/18/04/557421804.db2.gz SAFJSHPCWBPLIF-XMHGGMMESA-N 0 2 430.435 4.380 40 10 IICBLN Cc1c(/C=C2/C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)c2ccccc2n1C ZINC000059303087 557822218 /nfs/dbraw/zinc/82/22/18/557822218.db2.gz ZSNDMPIIWWJJAT-GDNBJRDFSA-N 0 2 428.275 4.460 40 10 IICBLN COc1ccc(Br)cc1/C=C1\C(=O)NC(=O)N(c2c(C)cc(C)cc2C)C1=O ZINC000059417342 557822875 /nfs/dbraw/zinc/82/28/75/557822875.db2.gz BJAIJBACYWKQFL-MHWRWJLKSA-N 0 2 443.297 4.049 40 10 IICBLN O=C1C=CC(=NNc2cccc(C(F)(F)F)c2)C=C1C=Cc1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-] ZINC000108929855 569260922 /nfs/dbraw/zinc/26/09/22/569260922.db2.gz DLQDIIPAPXIZQA-OMOHLZNYSA-N 0 2 447.329 4.282 40 10 IICBLN C=CCOc1c(Cl)cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1Br ZINC000108981449 569260980 /nfs/dbraw/zinc/26/09/80/569260980.db2.gz CGYAGTDRDNWQAU-ZROIWOOFSA-N 0 2 433.689 4.129 40 10 IICBLN O=C1NC(=O)N(c2ccc(O)cc2)C(=O)/C1=C\c1ccc(-c2ccc(F)c(Cl)c2)o1 ZINC000408600278 555958676 /nfs/dbraw/zinc/95/86/76/555958676.db2.gz BAFQFXOZKSZVQP-GDNBJRDFSA-N 0 2 426.787 4.111 40 10 IICBLN O=C1NC(=O)N(c2ccc(Cl)cc2Cl)C(=O)/C1=C\c1ccc(N2CCCC2)c(F)c1 ZINC000015013508 556484495 /nfs/dbraw/zinc/48/44/95/556484495.db2.gz GUFTZESLDUFUEB-ZROIWOOFSA-N 0 2 448.281 4.399 40 10 IICBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1Br ZINC000408800465 556858265 /nfs/dbraw/zinc/85/82/65/556858265.db2.gz MODCXEYXSYDDFH-LFIBNONCSA-N 0 2 443.297 4.213 40 10 IICBLN CCCOc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000408814749 556865274 /nfs/dbraw/zinc/86/52/74/556865274.db2.gz SCQLYDNUHNCZCU-XSFVSMFZSA-N 0 2 445.431 4.203 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1Br ZINC000408819610 556865751 /nfs/dbraw/zinc/86/57/51/556865751.db2.gz YABZFYIHNJNNDE-XYOKQWHBSA-N 0 2 449.688 4.086 40 10 IICBLN O=C1NC(=O)N(c2ccc(Cl)cc2)C(=O)/C1=C/c1cccn1-c1ccc(Cl)cc1 ZINC000408851863 556869716 /nfs/dbraw/zinc/86/97/16/556869716.db2.gz AWHYCUISUFJWDV-LDADJPATSA-N 0 2 426.259 4.451 40 10 IICBLN O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1cccn1-c1ccccc1 ZINC000408854239 556871753 /nfs/dbraw/zinc/87/17/53/556871753.db2.gz AQRIXVWVZDUFJJ-LFIBNONCSA-N 0 2 426.259 4.451 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccccc4)c3)C2=O)cc1 ZINC000408934222 556895361 /nfs/dbraw/zinc/89/53/61/556895361.db2.gz CZYORGQRCZYPPZ-KQWNVCNZSA-N 0 2 442.471 4.331 40 10 IICBLN COc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)cc1Cl ZINC000409056143 556933873 /nfs/dbraw/zinc/93/38/73/556933873.db2.gz KWRABFRPJCBUFZ-UXBLZVDNSA-N 0 2 425.655 4.322 40 10 IICBLN COc1cc(N=C(C)C2C(=O)N(c3ccc([N+](=O)[O-])cc3)N=C2C)c(OC)cc1Cl ZINC000112293573 557239766 /nfs/dbraw/zinc/23/97/66/557239766.db2.gz IDOVZWUOENJPTB-ODLFYWEKSA-N 0 2 430.848 4.374 40 10 IICBLN COc1cc(N=C(C)c2c(C)[nH]n(-c3ccc([N+](=O)[O-])cc3)c2=O)c(OC)cc1Cl ZINC000112293573 557239767 /nfs/dbraw/zinc/23/97/67/557239767.db2.gz IDOVZWUOENJPTB-ODLFYWEKSA-N 0 2 430.848 4.374 40 10 IICBLN CCN(CC)S(=O)(=O)c1ccc(N=Cc2c(C)[nH]n(-c3ccc(Cl)cc3)c2=O)cc1 ZINC000100191733 557246976 /nfs/dbraw/zinc/24/69/76/557246976.db2.gz OXPHCRNBOYHDLR-XSFVSMFZSA-N 0 2 446.960 4.089 40 10 IICBLN CCCCOc1ccc(Br)cc1/C=C1/C(=O)NC(=O)N(c2ccccc2)C1=O ZINC000408534332 555750836 /nfs/dbraw/zinc/75/08/36/555750836.db2.gz VEPLDHKTBXONGN-LGMDPLHJSA-N 0 2 443.297 4.294 40 10 IICBLN CCCCCCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc1 ZINC000408538293 555777646 /nfs/dbraw/zinc/77/76/46/555777646.db2.gz KKXVPHIBCHYBIN-HKWRFOASSA-N 0 2 437.452 4.220 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cccc(F)c4)cc3)C2=O)cc1 ZINC000408785376 556855827 /nfs/dbraw/zinc/85/58/27/556855827.db2.gz WTXYJDBPAYOTPH-HYARGMPZSA-N 0 2 430.435 4.380 40 10 IICBLN CCCOc1cc(OC)ccc1/C=C1\C(=O)NC(=O)N(c2ccc(C)c(Cl)c2)C1=O ZINC000408804429 556860259 /nfs/dbraw/zinc/86/02/59/556860259.db2.gz FXGMCYTXYJCFHF-LICLKQGHSA-N 0 2 428.872 4.112 40 10 IICBLN CCCOc1cc(OC)ccc1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)c(Cl)c2)C1=O ZINC000408805052 556860441 /nfs/dbraw/zinc/86/04/41/556860441.db2.gz CTQWEXCDJACNDD-OQLLNIDSSA-N 0 2 449.290 4.457 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cc(C)ccc3C)C2=O)cc1OC ZINC000408805804 556860797 /nfs/dbraw/zinc/86/07/97/556860797.db2.gz HRLJFDJPIXTWKD-MHWRWJLKSA-N 0 2 442.899 4.421 40 10 IICBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cc(C)ccc3C)C2=O)cc1OC ZINC000408809379 556861951 /nfs/dbraw/zinc/86/19/51/556861951.db2.gz NYGNEWAUASIOLF-OQLLNIDSSA-N 0 2 428.872 4.031 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)ccc3OC(C)C)C2=O)cc1 ZINC000408816725 556863957 /nfs/dbraw/zinc/86/39/57/556863957.db2.gz UJCQZRJBENBSKW-LDADJPATSA-N 0 2 428.872 4.192 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3Cc3ccccc3F)C2=O)cc1 ZINC000408878032 556877128 /nfs/dbraw/zinc/87/71/28/556877128.db2.gz ZAOJZCRURHXRCF-RCCKNPSSSA-N 0 2 430.435 4.092 40 10 IICBLN O=C1NC(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1ccccc1OCc1cccc(F)c1 ZINC000408913813 556889317 /nfs/dbraw/zinc/88/93/17/556889317.db2.gz NYOCPNIMSGRHHA-UDWIEESQSA-N 0 2 434.398 4.210 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)c(OCC)c1 ZINC000409075493 556943805 /nfs/dbraw/zinc/94/38/05/556943805.db2.gz WHSICNIVXVREEI-GXDHUFHOSA-N 0 2 449.290 4.457 40 10 IICBLN CCCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cl)cc3)C2=O)cc1OCC ZINC000409211160 557005610 /nfs/dbraw/zinc/00/56/10/557005610.db2.gz NACUWRDCZBWVKP-SFQUDFHCSA-N 0 2 428.872 4.194 40 10 IICBLN Cc1cccc(Cn2cc(/C=C3\C(=O)NC(=O)N(c4cccnc4)C3=O)c3ccccc32)c1 ZINC000409239111 557020296 /nfs/dbraw/zinc/02/02/96/557020296.db2.gz BYJDITSKJIMAMQ-LPYMAVHISA-N 0 2 436.471 4.059 40 10 IICBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C\c1ccc2c(ccn2Cc2cccc(F)c2)c1 ZINC000409248475 557029394 /nfs/dbraw/zinc/02/93/94/557029394.db2.gz KQKPJXJXCMTXSL-JCMHNJIXSA-N 0 2 439.446 4.495 40 10 IICBLN Cc1cc2c(cc1/C=C1\C(=O)NC(=O)N(c3ccccc3F)C1=O)C(C)=CC(C)(C)N2C ZINC000208454441 557087898 /nfs/dbraw/zinc/08/78/98/557087898.db2.gz IXRPSPSMPDDOJJ-LDADJPATSA-N 0 2 433.483 4.432 40 10 IICBLN Cc1cc(NS(=O)(=O)c2ccccc2)c(C(C)C)c(S(=O)(=O)c2ccccc2)c1O ZINC000026786843 557248804 /nfs/dbraw/zinc/24/88/04/557248804.db2.gz PNKUIVAXEOXWFJ-UHFFFAOYSA-N 0 2 445.562 4.458 40 10 IICBLN O=C1NN(c2ccccc2)C(=O)/C1=C\c1cccc([N+](=O)[O-])c1OCc1ccccc1Cl ZINC000033623211 569259504 /nfs/dbraw/zinc/25/95/04/569259504.db2.gz FSRHQVQCODITOQ-AQTBWJFISA-N 0 2 449.850 4.289 40 10 IICBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2ccc(N3CCCCC3)cc2F)C1=O ZINC000009264664 132311850 /nfs/dbraw/zinc/31/18/50/132311850.db2.gz BDYJMCAZZVILHX-ATVHPVEESA-N 0 2 441.890 4.444 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)cc(Cl)c3Cl)C2=O)cc1 ZINC000408739723 556210657 /nfs/dbraw/zinc/21/06/57/556210657.db2.gz DXXWELNAXVBAPE-QPEQYQDCSA-N 0 2 425.655 4.322 40 10 IICBLN Cc1nn(-c2cccc3ccccc32)c(C)c1/C=C1\C(=O)NC(=O)N(c2ccccc2)C1=O ZINC000408756720 556236363 /nfs/dbraw/zinc/23/63/63/556236363.db2.gz JDIZSXJXRROWNW-JCMHNJIXSA-N 0 2 436.471 4.309 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc1Br ZINC000408785342 556855837 /nfs/dbraw/zinc/85/58/37/556855837.db2.gz YOXQIZMRNAWLLW-MHWRWJLKSA-N 0 2 443.297 4.131 40 10 IICBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1OC ZINC000408803047 556859667 /nfs/dbraw/zinc/85/96/67/556859667.db2.gz KRGZBTOODFPXHF-MDWZMJQESA-N 0 2 449.290 4.376 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)cc(Cl)c1OCC ZINC000408803730 556859990 /nfs/dbraw/zinc/85/99/90/556859990.db2.gz STSWFSOBRNXDOB-MHWRWJLKSA-N 0 2 428.872 4.112 40 10 IICBLN CCCOc1cc(OC)ccc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2C)C1=O ZINC000408812853 556862936 /nfs/dbraw/zinc/86/29/36/556862936.db2.gz XJQWOCIDQPZWJN-LFIBNONCSA-N 0 2 428.872 4.112 40 10 IICBLN CCOc1ccc(OCC)c(N2C(=O)NC(=O)C(=Cc3c(O)ccc4ccccc43)C2=O)c1 ZINC000408854108 556871668 /nfs/dbraw/zinc/87/16/68/556871668.db2.gz XVEUQEMQJIEVGF-RGEXLXHISA-N 0 2 446.459 4.009 40 10 IICBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(Cl)c(OC(C)C)c(OC)c2)C1=O ZINC000408885380 556878054 /nfs/dbraw/zinc/87/80/54/556878054.db2.gz YXMLNODIBSCWHL-YBEGLDIGSA-N 0 2 442.899 4.365 40 10 IICBLN Cc1cc(C)cc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccc(O)cc3)C2=O)c1 ZINC000408887787 556879902 /nfs/dbraw/zinc/87/99/02/556879902.db2.gz UGVQUZOTFMJOPQ-HYARGMPZSA-N 0 2 442.471 4.254 40 10 IICBLN CC[C@@H](C)Oc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1OC ZINC000408902597 556885220 /nfs/dbraw/zinc/88/52/20/556885220.db2.gz KVTQSRSJKSBSNS-GFQQVXNGSA-N 0 2 446.862 4.331 40 10 IICBLN O=C1NC(=O)N(c2ccccc2F)C(=O)/C1=C/c1cccc(OCc2ccccc2F)c1 ZINC000408936516 556896032 /nfs/dbraw/zinc/89/60/32/556896032.db2.gz KSKMYDYVUXPJHW-QGOAFFKASA-N 0 2 434.398 4.210 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1cc(C)ccn1 ZINC000408960808 556899540 /nfs/dbraw/zinc/89/95/40/556899540.db2.gz JCAXXXYDUGUCBR-XDHOZWIPSA-N 0 2 434.883 4.117 40 10 IICBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)c(C)n1-c1ccc(O)cc1 ZINC000408981293 556907696 /nfs/dbraw/zinc/90/76/96/556907696.db2.gz ADIIZZCZEYOCLP-JAIQZWGSSA-N 0 2 449.894 4.428 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Oc4ccc(F)cc4)cc3)C2=O)cc1 ZINC000408739783 556210543 /nfs/dbraw/zinc/21/05/43/556210543.db2.gz FQDMCJOXUMEIRS-KGENOOAVSA-N 0 2 432.407 4.293 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)ccc1OCc1ccccc1 ZINC000408739604 556210620 /nfs/dbraw/zinc/21/06/20/556210620.db2.gz CWZILXMUCWPITP-KGENOOAVSA-N 0 2 442.471 4.249 40 10 IICBLN Cc1nn(-c2ccc(C)c(C)c2)c(C)c1/C=C1/C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O ZINC000408757987 556627045 /nfs/dbraw/zinc/62/70/45/556627045.db2.gz TVXHTMKJBSXZRW-MTJSOVHGSA-N 0 2 448.910 4.426 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4cccc(C)c4)c3C)C2=O)cc1 ZINC000408760415 556687270 /nfs/dbraw/zinc/68/72/70/556687270.db2.gz YIOGFJYGMYFWHJ-HZHRSRAPSA-N 0 2 443.503 4.468 40 10 IICBLN COc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1Br ZINC000408772516 556847917 /nfs/dbraw/zinc/84/79/17/556847917.db2.gz MJKAFPYZYCMZSV-NTUHNPAUSA-N 0 2 449.688 4.086 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4cc(C)c(C)c([N+](=O)[O-])c4)o3)C2=O)cc1 ZINC000408777014 556850519 /nfs/dbraw/zinc/85/05/19/556850519.db2.gz UPUKJFRIDZQYOE-XDHOZWIPSA-N 0 2 445.431 4.446 40 10 IICBLN COc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccc(Cl)cc4)C3=O)c2C)cc1 ZINC000408777906 556853736 /nfs/dbraw/zinc/85/37/36/556853736.db2.gz LNJUVHQFAUGZIW-FYJGNVAPSA-N 0 2 449.894 4.423 40 10 IICBLN CCOc1ccc(Br)cc1/C=C1\C(=O)NC(=O)N(c2cc(C)cc(C)c2)C1=O ZINC000408777965 556853822 /nfs/dbraw/zinc/85/38/22/556853822.db2.gz NEVYQKOXFPFUNO-GZTJUZNOSA-N 0 2 443.297 4.131 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cc(C)ccc3C)C2=O)cc(Cl)c1OCC ZINC000408803896 556859865 /nfs/dbraw/zinc/85/98/65/556859865.db2.gz UNPOPBICGIYBGB-MHWRWJLKSA-N 0 2 442.899 4.421 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)c(OC(C)C)c1 ZINC000408803732 556860024 /nfs/dbraw/zinc/86/00/24/556860024.db2.gz SUMWEKYLHJZAEP-RQZCQDPDSA-N 0 2 428.872 4.111 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1OC ZINC000408804616 556860298 /nfs/dbraw/zinc/86/02/98/556860298.db2.gz YXYWNZDHOLHVHI-MDWZMJQESA-N 0 2 435.263 4.067 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc1OC ZINC000408805971 556861023 /nfs/dbraw/zinc/86/10/23/556861023.db2.gz DERBLBBEVISLQX-LICLKQGHSA-N 0 2 442.899 4.421 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cccc(F)c4)cc3)C2=O)cc1 ZINC000408897129 556883082 /nfs/dbraw/zinc/88/30/82/556883082.db2.gz VYHFTBBOIZWRCV-HYARGMPZSA-N 0 2 446.434 4.080 40 10 IICBLN CCCOc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(OC)cc2)C1=O ZINC000409047110 556931594 /nfs/dbraw/zinc/93/15/94/556931594.db2.gz MRMJWLJJMPJLGU-MHWRWJLKSA-N 0 2 449.290 4.457 40 10 IICBLN COc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccccc4)C3=O)c2C)cc1Cl ZINC000409062917 556940451 /nfs/dbraw/zinc/94/04/51/556940451.db2.gz CXKYYOZEXCKETH-XDHOZWIPSA-N 0 2 449.894 4.423 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)ccc1OC(C)C ZINC000409102860 556956598 /nfs/dbraw/zinc/95/65/98/556956598.db2.gz FKHYOXCGSNWRKS-UKTHLTGXSA-N 0 2 449.290 4.456 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(-c3cccc(C)c3)c2C)C1=O ZINC000409228147 557014985 /nfs/dbraw/zinc/01/49/85/557014985.db2.gz UQZOCQFIHAOZNH-RCCKNPSSSA-N 0 2 443.503 4.468 40 10 IICBLN O=C1NC(=O)N(c2cccnc2)C(=O)/C1=C\c1ccc(-c2ccc(Cl)cc2Cl)o1 ZINC000409233314 557025017 /nfs/dbraw/zinc/02/50/17/557025017.db2.gz UVQLQEATYOYIMW-DHDCSXOGSA-N 0 2 428.231 4.315 40 10 IICBLN CCCc1[nH]n(-c2ccccc2)c(=O)c1C(C)=Nc1cc(C(=O)OC)ccc1C(=O)OC ZINC000103919254 557140793 /nfs/dbraw/zinc/14/07/93/557140793.db2.gz ICFQGCHQSVTBER-QNGOZBTKSA-N 0 2 435.480 4.149 40 10 IICBLN CCCC1=NN(c2ccccc2)C(=O)C1C(C)=Nc1cc(C(=O)OC)ccc1C(=O)OC ZINC000103919254 557140797 /nfs/dbraw/zinc/14/07/97/557140797.db2.gz ICFQGCHQSVTBER-QNGOZBTKSA-N 0 2 435.480 4.149 40 10 IICBLN COc1ccc(-c2[nH]n(-c3ccc([N+](=O)[O-])cc3)c(=O)c2C(C)=Nc2ccccn2)cc1 ZINC000103921863 557141380 /nfs/dbraw/zinc/14/13/80/557141380.db2.gz AFQKESOVKJRGMA-QNGOZBTKSA-N 0 2 429.436 4.135 40 10 IICBLN COC(=O)c1ccccc1-c1ccc(C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)o1 ZINC000033715950 557809151 /nfs/dbraw/zinc/80/91/51/557809151.db2.gz BSXIYDPZDVFFQL-LDADJPATSA-N 0 2 434.379 4.379 40 10 IICBLN O=C1C=CC(=NNc2cccc3ccccc32)C=C1C=Cc1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-] ZINC000105510001 569260499 /nfs/dbraw/zinc/26/04/99/569260499.db2.gz XIRGGSTWFUQYCM-GLGGBJCQSA-N 0 2 429.392 4.416 40 10 IICBLN Cc1cc(C)c(N2C(=O)NC(=O)C(=CNNc3cccc(Cl)c3Cl)C2=O)c(C)c1 ZINC000408529818 555724097 /nfs/dbraw/zinc/72/40/97/555724097.db2.gz IBZBMNRIPCDTKZ-UKTHLTGXSA-N 0 2 433.295 4.002 40 10 IICBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=CNc3ccc(Br)cc3Cl)C2=O)c1 ZINC000408536665 555774033 /nfs/dbraw/zinc/77/40/33/555774033.db2.gz XEOKRJAIZNDOSO-UKTHLTGXSA-N 0 2 448.704 4.298 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc(F)c(Cl)c4)o3)C2=O)cc1 ZINC000408604133 555973692 /nfs/dbraw/zinc/97/36/92/555973692.db2.gz SURDTMBNXOTVGX-LFIBNONCSA-N 0 2 440.814 4.414 40 10 IICBLN O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C\c1cccn1-c1ccc(O)cc1 ZINC000015013505 556484588 /nfs/dbraw/zinc/48/45/88/556484588.db2.gz GLXLATPCGNXTGM-PTNGSMBKSA-N 0 2 442.258 4.156 40 10 IICBLN CCOc1cc(C=C2C(=O)NC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc(Cl)c1OC ZINC000016688306 556626359 /nfs/dbraw/zinc/62/63/59/556626359.db2.gz AOXZHWIKGBAFEG-ZSOIEALJSA-N 0 2 445.815 4.162 40 10 IICBLN CCOc1cc(C=C2C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)ccc1OC ZINC000083292683 556662897 /nfs/dbraw/zinc/66/28/97/556662897.db2.gz FFQPDHVRJYIKKB-XNTDXEJSSA-N 0 2 445.269 4.363 40 10 IICBLN Cc1[nH]c2ccccc2c1C=C1C(=O)NC(=O)N(c2ccc(Br)c(C)c2)C1=O ZINC000408763600 556829163 /nfs/dbraw/zinc/82/91/63/556829163.db2.gz IZNMLMLGXDEJLH-MHWRWJLKSA-N 0 2 438.281 4.214 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c(OCc2ccc(C)cc2)c1 ZINC000408798374 556857473 /nfs/dbraw/zinc/85/74/73/556857473.db2.gz HZAMIMPDULPDFJ-HYARGMPZSA-N 0 2 442.471 4.249 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)ccc1OC(C)C ZINC000408798958 556857744 /nfs/dbraw/zinc/85/77/44/556857744.db2.gz JLQKHENZTGHRKU-XNTDXEJSSA-N 0 2 428.872 4.111 40 10 IICBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)cc1Br ZINC000408800162 556857977 /nfs/dbraw/zinc/85/79/77/556857977.db2.gz NHZHAWLHCKKFJF-RVDMUPIBSA-N 0 2 443.297 4.213 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)cc1OC ZINC000408819887 556865811 /nfs/dbraw/zinc/86/58/11/556865811.db2.gz YULMLOXGDCSMJP-MHWRWJLKSA-N 0 2 442.899 4.421 40 10 IICBLN CCOc1ccc(OCC)c(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccccc4)o3)C2=O)c1 ZINC000408846877 556869103 /nfs/dbraw/zinc/86/91/03/556869103.db2.gz KLTWMFBDXZIDCA-XMHGGMMESA-N 0 2 446.459 4.410 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)c(Cc2cccc(F)c2)c1 ZINC000408870775 556874716 /nfs/dbraw/zinc/87/47/16/556874716.db2.gz XLBXWMAWTQGCPU-PXLXIMEGSA-N 0 2 444.462 4.400 40 10 IICBLN COc1ccc2ccc(OC)c(/C=C3\C(=O)NC(=O)N(c4cc(C)cc(C)c4)C3=O)c2c1 ZINC000408898411 556883263 /nfs/dbraw/zinc/88/32/63/556883263.db2.gz MCJNJLBKHAJVAT-FYJGNVAPSA-N 0 2 430.460 4.140 40 10 IICBLN COC(=O)c1ccccc1-c1ccc(/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)o1 ZINC000408963201 556901873 /nfs/dbraw/zinc/90/18/73/556901873.db2.gz XVTHATOXVKPWHI-DEDYPNTBSA-N 0 2 444.443 4.016 40 10 IICBLN CCCOc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(O)cc2)C1=O ZINC000409046450 556930849 /nfs/dbraw/zinc/93/08/49/556930849.db2.gz KSBFNQUSLWVKSZ-OQLLNIDSSA-N 0 2 435.263 4.154 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)ccc1OC ZINC000409107670 556959361 /nfs/dbraw/zinc/95/93/61/556959361.db2.gz SJRXNOCFJPGRSE-FMIVXFBMSA-N 0 2 435.263 4.067 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(Sc3ccccc3)o2)C1=O ZINC000409225828 557014063 /nfs/dbraw/zinc/01/40/63/557014063.db2.gz LTOXHBQUBGXTAO-SAPNQHFASA-N 0 2 434.473 4.496 40 10 IICBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2cccn2-c2ccc(N(C)C)cc2)C1=O ZINC000409234119 557025329 /nfs/dbraw/zinc/02/53/29/557025329.db2.gz ZAUUXJANVUVYPM-XMHGGMMESA-N 0 2 448.910 4.172 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccncc3)C2=O)c(C)n1-c1c(C)cc(C)cc1C ZINC000409392378 557096895 /nfs/dbraw/zinc/09/68/95/557096895.db2.gz LUEMWBQAYFETBQ-FYJGNVAPSA-N 0 2 428.492 4.081 40 10 IICBLN Cn1c(=O)c(C2=NNC(=O)C2=Cc2c3ccccc3cc3ccccc32)c(O)c2ccccc21 ZINC000104854608 557329063 /nfs/dbraw/zinc/32/90/63/557329063.db2.gz OVYGFXBMPFWOHL-JCMHNJIXSA-N 0 2 445.478 4.468 40 10 IICBLN CCOc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccccc4C)C3=O)c2C)cc1 ZINC000014132955 557421607 /nfs/dbraw/zinc/42/16/07/557421607.db2.gz NEDHXGNFDYHISH-PXLXIMEGSA-N 0 2 443.503 4.468 40 10 IICBLN COc1ccc(Br)cc1S(=O)(=O)Nc1ccccc1C(=O)c1ccccc1 ZINC000225752433 557773289 /nfs/dbraw/zinc/77/32/89/557773289.db2.gz APOZCDNWVAMXPB-UHFFFAOYSA-N 0 2 446.322 4.490 40 10 IICBLN O=C1OC2(CCCCC2)OC(=O)C1=Cc1cc(Br)c(O)c(Br)c1 ZINC000058865821 557812369 /nfs/dbraw/zinc/81/23/69/557812369.db2.gz PFCATVXPGZTENI-UHFFFAOYSA-N 0 2 446.091 4.061 40 10 IICBLN O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1cc(Br)cc(Cl)c1O ZINC000059106222 557820290 /nfs/dbraw/zinc/82/02/90/557820290.db2.gz VBCLZQSKAYTVLA-SDQBBNPISA-N 0 2 439.624 4.454 40 10 IICBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2ccc(N3CCCCCC3)o2)C1=O ZINC000009324059 132313860 /nfs/dbraw/zinc/31/38/60/132313860.db2.gz KXAUIEKYLFYWTE-SSZFMOIBSA-N 0 2 427.888 4.288 40 10 IICBLN CC(C)COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)cc1Br ZINC000408601908 555970495 /nfs/dbraw/zinc/97/04/95/555970495.db2.gz MCECTJCRTJKWML-MHWRWJLKSA-N 0 2 443.297 4.150 40 10 IICBLN CCc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccc(OC)cc4)C3=O)c2C)cc1 ZINC000408759725 556687019 /nfs/dbraw/zinc/68/70/19/556687019.db2.gz KJPKQGZBECQLGM-HZHRSRAPSA-N 0 2 443.503 4.332 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cc(C(F)(F)F)ccc3Cl)C2=O)cc1 ZINC000408782967 556855093 /nfs/dbraw/zinc/85/50/93/556855093.db2.gz ZQCQCXMGJXMRIE-NTEUORMPSA-N 0 2 438.789 4.424 40 10 IICBLN CCOc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)c2C)cc1 ZINC000408781860 556855948 /nfs/dbraw/zinc/85/59/48/556855948.db2.gz FMTLBAZTXFELAL-HZHRSRAPSA-N 0 2 443.503 4.468 40 10 IICBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1OCC ZINC000408786468 556856463 /nfs/dbraw/zinc/85/64/63/556856463.db2.gz QJBGUDQYAWNJDY-SFQUDFHCSA-N 0 2 428.872 4.194 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)cc(Cl)c1OC(C)C ZINC000408799100 556857808 /nfs/dbraw/zinc/85/78/08/556857808.db2.gz JTBQEJOMPDOUQU-CXUHLZMHSA-N 0 2 442.899 4.419 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cc(C)ccc3C)C2=O)cc(Cl)c1OC ZINC000408806568 556859030 /nfs/dbraw/zinc/85/90/30/556859030.db2.gz FJRVRULBOKDAPB-OQLLNIDSSA-N 0 2 428.872 4.031 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccc(C)cc3)C2=O)cc1 ZINC000408805262 556860869 /nfs/dbraw/zinc/86/08/69/556860869.db2.gz FOGMIIPHOXKGSJ-PXLXIMEGSA-N 0 2 442.471 4.249 40 10 IICBLN Cc1ccc(COc2ccccc2/C=C2\C(=O)NC(=O)N(c3ccc(O)cc3)C2=O)cc1C ZINC000408809148 556861867 /nfs/dbraw/zinc/86/18/67/556861867.db2.gz KHMJGXKTRSTJPG-HYARGMPZSA-N 0 2 442.471 4.254 40 10 IICBLN O=C1NC(=O)N(c2ccccc2)C(=O)/C1=C/c1cn(Cc2ccc(F)cc2)c2ccccc12 ZINC000408815897 556863273 /nfs/dbraw/zinc/86/32/73/556863273.db2.gz VUIAFHHAWDTUJY-HYARGMPZSA-N 0 2 439.446 4.495 40 10 IICBLN O=C1NC(=O)N(c2ccccc2F)C(=O)/C1=C\c1ccc(OCc2ccc(F)cc2)cc1 ZINC000408866192 556873621 /nfs/dbraw/zinc/87/36/21/556873621.db2.gz GKPLCUDPSFRBGC-UYRXBGFRSA-N 0 2 434.398 4.210 40 10 IICBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccccc2OCc2ccccc2)C1=O ZINC000408868688 556874155 /nfs/dbraw/zinc/87/41/55/556874155.db2.gz AUDBZRMFKTZSLZ-PGMHBOJBSA-N 0 2 426.472 4.494 40 10 IICBLN CCOc1cc(/C=C2/C(=O)NC(=O)N(c3ccccc3F)C2=O)cc(Cl)c1OC(C)C ZINC000408870174 556874613 /nfs/dbraw/zinc/87/46/13/556874613.db2.gz VJGVSKPSTLWCOH-ZROIWOOFSA-N 0 2 446.862 4.331 40 10 IICBLN CCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccccc3CC)C2=O)cc1Br ZINC000408879695 556876041 /nfs/dbraw/zinc/87/60/41/556876041.db2.gz DTUABTHHYOTEFA-PTNGSMBKSA-N 0 2 443.297 4.077 40 10 IICBLN CCCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)ccc3OCC)C2=O)cc1 ZINC000408901774 556882822 /nfs/dbraw/zinc/88/28/22/556882822.db2.gz ZYCMOIXMCNVFBN-AQTBWJFISA-N 0 2 428.872 4.194 40 10 IICBLN CCOc1cc(/C=C2/C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc(Cl)c1OC ZINC000408983588 556908432 /nfs/dbraw/zinc/90/84/32/556908432.db2.gz MNRGIHZWVPEKIX-AUWJEWJLSA-N 0 2 449.290 4.376 40 10 IICBLN CC[C@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(OC)cc3)C2=O)cc1Cl ZINC000409012688 556918721 /nfs/dbraw/zinc/91/87/21/556918721.db2.gz LDSKOIUVDXOMHA-HNEYUBDGSA-N 0 2 428.872 4.192 40 10 IICBLN CC(C)COc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(O)cc3)C2=O)cc1Cl ZINC000409044123 556930050 /nfs/dbraw/zinc/93/00/50/556930050.db2.gz AYIFVWMZDVJCHP-VIZOYTHASA-N 0 2 449.290 4.400 40 10 IICBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2ccc(Br)s2)C1=O ZINC000409236978 557018748 /nfs/dbraw/zinc/01/87/48/557018748.db2.gz HMQOJPLCVJKMCG-JXMROGBWSA-N 0 2 425.691 4.139 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c(Cl)cc1OC ZINC000409249021 557029905 /nfs/dbraw/zinc/02/99/05/557029905.db2.gz IELLAYHBPXPKQJ-MDWZMJQESA-N 0 2 449.290 4.376 40 10 IICBLN Cc1ccc(S(=O)(=O)Nc2nc(-c3ccccc3)cs2)cc1C(=O)NCC(C)C ZINC000223259930 557451995 /nfs/dbraw/zinc/45/19/95/557451995.db2.gz KDHZAUUEGOCNBG-UHFFFAOYSA-N 0 2 429.567 4.305 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)ccc1OCc1ccc(F)cc1 ZINC000016214639 557471133 /nfs/dbraw/zinc/47/11/33/557471133.db2.gz LVHCNVDGVLSKAK-DEDYPNTBSA-N 0 2 446.434 4.080 40 10 IICBLN O=C1NN(c2ccccc2)C(=O)/C1=C\c1ccc(OCc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000033746561 569259807 /nfs/dbraw/zinc/25/98/07/569259807.db2.gz JQSGFJIOQZMBFR-PDGQHHTCSA-N 0 2 449.850 4.289 40 10 IICBLN CCCCOc1ccc(Cl)cc1/C=C1/C(=O)NC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000408532033 555738679 /nfs/dbraw/zinc/73/86/79/555738679.db2.gz NHAPFRHXIVSSHU-BOPFTXTBSA-N 0 2 443.843 4.094 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4)cc3)C2=O)cc1 ZINC000408743054 556216048 /nfs/dbraw/zinc/21/60/48/556216048.db2.gz YYIFZFYCLPDZMV-XQNSMLJCSA-N 0 2 442.471 4.331 40 10 IICBLN CC[C@H](C)Oc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1OC ZINC000015013083 556484143 /nfs/dbraw/zinc/48/41/43/556484143.db2.gz KLNHNFXKSZEVOS-MFVBVHDHSA-N 0 2 428.872 4.192 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc(Cl)c1OC ZINC000408798418 556857437 /nfs/dbraw/zinc/85/74/37/556857437.db2.gz DYSSUEZVMXZIMM-MDWZMJQESA-N 0 2 449.290 4.376 40 10 IICBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)cc1OC ZINC000408797545 556857635 /nfs/dbraw/zinc/85/76/35/556857635.db2.gz GPGXSOSMDLPDDR-VGOFMYFVSA-N 0 2 449.290 4.376 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)cc(Cl)c1OC ZINC000408804000 556859858 /nfs/dbraw/zinc/85/98/58/556859858.db2.gz BQPKYPCRNJAHAF-OQLLNIDSSA-N 0 2 428.872 4.031 40 10 IICBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)cc1OCC ZINC000408808385 556861505 /nfs/dbraw/zinc/86/15/05/556861505.db2.gz FWIIHQXVLGQXRQ-NTCAYCPXSA-N 0 2 428.872 4.194 40 10 IICBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1OC ZINC000408818613 556864546 /nfs/dbraw/zinc/86/45/46/556864546.db2.gz XPZVWSZRLNTBQD-NTEUORMPSA-N 0 2 449.290 4.457 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)cc(Cl)c1OC(C)C ZINC000408819243 556865090 /nfs/dbraw/zinc/86/50/90/556865090.db2.gz YRPNSZLJYRNUSP-CXUHLZMHSA-N 0 2 442.899 4.419 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c(Cc2ccccc2F)c1 ZINC000408875220 556874537 /nfs/dbraw/zinc/87/45/37/556874537.db2.gz HORWKZMGYNQSQG-PXLXIMEGSA-N 0 2 444.462 4.400 40 10 IICBLN CCOc1cc(Cl)c(/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)cc1OC ZINC000408895713 556880995 /nfs/dbraw/zinc/88/09/95/556880995.db2.gz FHVVCFIBIYPYBT-CXUHLZMHSA-N 0 2 428.872 4.031 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)c(Cl)cc1OC ZINC000408900808 556882249 /nfs/dbraw/zinc/88/22/49/556882249.db2.gz VFTKVQZAAZIGFT-CXUHLZMHSA-N 0 2 428.872 4.031 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCc4ccc(F)cc4)c3)C2=O)cc1 ZINC000408960935 556900541 /nfs/dbraw/zinc/90/05/41/556900541.db2.gz JSMOKGDBVONQEA-HYARGMPZSA-N 0 2 430.435 4.380 40 10 IICBLN CCOc1cc(/C=C2/C(=O)NC(=O)N(c3ccc(CC)cc3)C2=O)cc(Cl)c1OCC ZINC000408981417 556907914 /nfs/dbraw/zinc/90/79/14/556907914.db2.gz AXQAPYDYEAQNIN-BOPFTXTBSA-N 0 2 442.899 4.366 40 10 IICBLN O=C1NC(=O)N(c2ccc(Cl)cc2Cl)C(=O)/C1=C/c1cccn1-c1ccc(O)cc1 ZINC000409022141 556922735 /nfs/dbraw/zinc/92/27/35/556922735.db2.gz GDBOKOIBZILYNT-LFIBNONCSA-N 0 2 442.258 4.156 40 10 IICBLN CN(C)c1ccc(/C=C/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)cc1 ZINC000409105437 556958555 /nfs/dbraw/zinc/95/85/55/556958555.db2.gz JJYRCDWYNWWINS-PVZSTHCMSA-N 0 2 430.291 4.282 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)[C@H](C)CC(C)(C)N4C)C2=O)cc1 ZINC000208198344 557079383 /nfs/dbraw/zinc/07/93/83/557079383.db2.gz XNPTUJRMXISKMP-OOWUWCJESA-N 0 2 433.508 4.084 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3cc4c(cc3C)N(C)C(C)(C)C=C4C)C2=O)cc1 ZINC000208453452 557088006 /nfs/dbraw/zinc/08/80/06/557088006.db2.gz JBWGKSLXNOAHLN-FYJGNVAPSA-N 0 2 445.519 4.302 40 10 IICBLN CCc1cccc(C)c1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3ccncc3)C2=O)c1C ZINC000409394047 557098156 /nfs/dbraw/zinc/09/81/56/557098156.db2.gz UWCBZPWKYBIIJO-KGENOOAVSA-N 0 2 428.492 4.026 40 10 IICBLN O=C1NN(c2ccccc2)C(=O)/C1=C\c1ccc(OCc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC000107841084 569260689 /nfs/dbraw/zinc/26/06/89/569260689.db2.gz DGIQSZBBBSITMA-UNOMPAQXSA-N 0 2 449.850 4.289 40 10 IICBLN Cc1cccc(C(=O)Oc2ccccc2/C=C2/C(=O)NC(=O)N(c3ccccc3C)C2=O)c1 ZINC000408536899 555766633 /nfs/dbraw/zinc/76/66/33/555766633.db2.gz TWCPMJYHPBFBBM-HKWRFOASSA-N 0 2 440.455 4.189 40 10 IICBLN Cc1cc(Br)cc(C)c1NC=C1C(=O)NC(=O)N(c2ccccc2Cl)C1=O ZINC000408536576 555772957 /nfs/dbraw/zinc/77/29/57/555772957.db2.gz WSDQVCAOQKGFAB-UKTHLTGXSA-N 0 2 448.704 4.298 40 10 IICBLN Cc1nn(-c2ccc(C)cc2C)c(C)c1/C=C1\C(=O)NC(=O)N(c2ccc(C)c(C)c2)C1=O ZINC000408756612 556239910 /nfs/dbraw/zinc/23/99/10/556239910.db2.gz IFSMEOPQTCJNSU-LPYMAVHISA-N 0 2 442.519 4.389 40 10 IICBLN Cc1nn(-c2ccc(C)cc2)c(C)c1/C=C1/C(=O)NC(=O)N(c2cccc(C)c2C)C1=O ZINC000408758222 556847967 /nfs/dbraw/zinc/84/79/67/556847967.db2.gz WXHWHBSTDWIBLO-BKUYFWCQSA-N 0 2 428.492 4.081 40 10 IICBLN CCOc1ccc2ccc(OCC)c(/C=C3\C(=O)NC(=O)N(c4ccccc4F)C3=O)c2c1 ZINC000408772808 556847981 /nfs/dbraw/zinc/84/79/81/556847981.db2.gz FWBPBLMJKQSZSH-XMHGGMMESA-N 0 2 448.450 4.443 40 10 IICBLN CCOc1ccc(Br)cc1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000408779903 556854268 /nfs/dbraw/zinc/85/42/68/556854268.db2.gz NFOXMXQMLFYCIJ-XNTDXEJSSA-N 0 2 449.688 4.168 40 10 IICBLN CCOc1cccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(C)cc4)c3C)C2=O)c1 ZINC000408786210 556856484 /nfs/dbraw/zinc/85/64/84/556856484.db2.gz HAOFJDDEQYTJSB-OEAKJJBVSA-N 0 2 443.503 4.468 40 10 IICBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)cc1OC ZINC000408799961 556858135 /nfs/dbraw/zinc/85/81/35/556858135.db2.gz MBXZDQMWUJTHKW-XYOKQWHBSA-N 0 2 435.263 4.067 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)cc(Cl)c1OCC ZINC000408804395 556860195 /nfs/dbraw/zinc/86/01/95/556860195.db2.gz FKUZULBCZGICRD-UKTHLTGXSA-N 0 2 449.290 4.457 40 10 IICBLN CCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(Br)cc2)C1=O ZINC000408809355 556861793 /nfs/dbraw/zinc/86/17/93/556861793.db2.gz GZCYPQSXNTYYCC-XNTDXEJSSA-N 0 2 449.688 4.168 40 10 IICBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccc(F)cc4)cc3)C2=O)c1 ZINC000408809674 556861882 /nfs/dbraw/zinc/86/18/82/556861882.db2.gz HRQQRRSNACWBMW-HYARGMPZSA-N 0 2 430.435 4.380 40 10 IICBLN CCOc1ccc(Br)cc1/C=C1\C(=O)NC(=O)N(c2cccc(C)c2C)C1=O ZINC000408813602 556864997 /nfs/dbraw/zinc/86/49/97/556864997.db2.gz YANWPJCHQPZPEP-LFIBNONCSA-N 0 2 443.297 4.131 40 10 IICBLN CCCCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)ccc3OC)C2=O)cc1 ZINC000408896686 556881313 /nfs/dbraw/zinc/88/13/13/556881313.db2.gz HJHIDHVBPALPQR-AQTBWJFISA-N 0 2 428.872 4.194 40 10 IICBLN COc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(Br)c(C)c3)C2=O)cc1Cl ZINC000408901539 556882915 /nfs/dbraw/zinc/88/29/15/556882915.db2.gz YQNNGXSJJMIZQL-JYRVWZFOSA-N 0 2 449.688 4.086 40 10 IICBLN O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1cccc(OCc2ccccc2F)c1 ZINC000408965345 556902538 /nfs/dbraw/zinc/90/25/38/556902538.db2.gz KLIBXCLLWSTDDP-DEDYPNTBSA-N 0 2 434.398 4.210 40 10 IICBLN CCc1ccccc1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3ccc(OC)cc3)C2=O)c1C ZINC000408968790 556904001 /nfs/dbraw/zinc/90/40/01/556904001.db2.gz ZDODQTMONKHGIM-PXLXIMEGSA-N 0 2 443.503 4.332 40 10 IICBLN CCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(CC)cc3)C2=O)cc1Br ZINC000408984543 556910774 /nfs/dbraw/zinc/91/07/74/556910774.db2.gz IWAGZYURTRIZKP-WJDWOHSUSA-N 0 2 443.297 4.077 40 10 IICBLN Cc1ccc(Cl)cc1N1C(=O)NC(=O)C(=Cc2cc(Cl)c(O)c(Cl)c2)C1=O ZINC000409060380 556937293 /nfs/dbraw/zinc/93/72/93/556937293.db2.gz ZMAPURZXEGZGFV-NYYWCZLTSA-N 0 2 425.655 4.327 40 10 IICBLN CCOc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4cccc(C)c4)C3=O)c2C)cc1 ZINC000409187191 556988113 /nfs/dbraw/zinc/98/81/13/556988113.db2.gz NEOJXYODRKBBML-HZHRSRAPSA-N 0 2 443.503 4.468 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(-c3ccccc3F)c2C)C1=O ZINC000409238586 557020130 /nfs/dbraw/zinc/02/01/30/557020130.db2.gz FAIFEHGHIHNFTD-NBVRZTHBSA-N 0 2 447.466 4.298 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2cccn2-c2ccc(C)cc2C)C1=O ZINC000409239400 557020762 /nfs/dbraw/zinc/02/07/62/557020762.db2.gz MKTRKVBSJSYLSZ-XDJHFCHBSA-N 0 2 429.476 4.159 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)c(C)n1-c1cc(Cl)ccc1C ZINC000409234094 557025345 /nfs/dbraw/zinc/02/53/45/557025345.db2.gz YXHPWCCGLDRZHV-VXLYETTFSA-N 0 2 434.883 4.117 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)c(C)n1-c1cccc(Cl)c1C ZINC000409241278 557031643 /nfs/dbraw/zinc/03/16/43/557031643.db2.gz JYQIWIRNSNEBIT-WOJGMQOQSA-N 0 2 434.883 4.117 40 10 IICBLN O=C1NC(=O)N(c2cccnc2)C(=O)/C1=C/c1ccc(-c2cccc(C(F)(F)F)c2)o1 ZINC000409243344 557033218 /nfs/dbraw/zinc/03/32/18/557033218.db2.gz XWLDHLWDNNELIU-MHWRWJLKSA-N 0 2 427.338 4.027 40 10 IICBLN CCOc1cccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)[C@H](C)CC(C)(C)N4C)C2=O)c1 ZINC000208198088 557079363 /nfs/dbraw/zinc/07/93/63/557079363.db2.gz OQCNMVRPTBMUFV-WMRWHDLOSA-N 0 2 447.535 4.474 40 10 IICBLN O=C1NC(=O)N(c2ccncc2)C(=O)/C1=C/c1ccc(-c2cc(Cl)ccc2Cl)o1 ZINC000409392088 557096493 /nfs/dbraw/zinc/09/64/93/557096493.db2.gz KTUHMNRYRZTROS-XNTDXEJSSA-N 0 2 428.231 4.315 40 10 IICBLN CCOc1cc(C=C2C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)c(Br)cc1O ZINC000059135494 557815269 /nfs/dbraw/zinc/81/52/69/557815269.db2.gz XBUKIJXNZJQNGA-NTUHNPAUSA-N 0 2 449.232 4.199 40 10 IICBLN Cc1cc(Br)ccc1N1C(=O)NC(=O)C(=Cc2ccc(N3CCCC3)o2)C1=O ZINC000059138521 557816360 /nfs/dbraw/zinc/81/63/60/557816360.db2.gz WZPGFHILDGCPQX-RVDMUPIBSA-N 0 2 444.285 4.457 40 10 IICBLN CC1CCN(C2=NN3C(=NC(=O)/C(=C\c4cc(Cl)c(O)c(Cl)c4)C3=N)S2)CC1 ZINC000041084671 520992304 /nfs/dbraw/zinc/99/23/04/520992304.db2.gz ZWWMTUAEJVUMKG-FYWBKXHBSA-N 0 2 438.340 4.008 40 10 IICBLN COc1cc([N+](=O)[O-])ccc1N=CC1C(=O)N(c2ccc(Br)cc2C)N=C1C ZINC000408535572 555764378 /nfs/dbraw/zinc/76/43/78/555764378.db2.gz TYHSEXMFTBJLAG-GDNBJRDFSA-N 0 2 445.273 4.393 40 10 IICBLN Cc1ccc(C(=O)Oc2ccccc2/C=C2/C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1 ZINC000408537463 555773702 /nfs/dbraw/zinc/77/37/02/555773702.db2.gz VPQVEGNFKMVANG-QNGOZBTKSA-N 0 2 440.455 4.189 40 10 IICBLN CCCCCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1OC ZINC000408537662 555781713 /nfs/dbraw/zinc/78/17/13/555781713.db2.gz GRQDBWHNBVCNIG-XMHGGMMESA-N 0 2 440.471 4.460 40 10 IICBLN Cc1nn(-c2ccc(C)c(C)c2)c(C)c1/C=C1/C(=O)NC(=O)N(c2cccc(C)c2C)C1=O ZINC000408756793 556236387 /nfs/dbraw/zinc/23/63/87/556236387.db2.gz JOKPZJFZXKDZAA-XKZIYDEJSA-N 0 2 442.519 4.389 40 10 IICBLN Cc1nn(-c2ccc(C)cc2)c(C)c1/C=C1\C(=O)NC(=O)N(c2ccc(C)cc2C)C1=O ZINC000408755202 556238004 /nfs/dbraw/zinc/23/80/04/556238004.db2.gz BXLYRCLWGFRDHP-FYJGNVAPSA-N 0 2 428.492 4.081 40 10 IICBLN Cc1cc(C)c(/C=C2\C(=O)NC(=O)N(c3ccc(Br)c(C)c3)C2=O)c(C)c1 ZINC000408760236 556687221 /nfs/dbraw/zinc/68/72/21/556687221.db2.gz UYLVTUXYFNXKSD-LICLKQGHSA-N 0 2 427.298 4.349 40 10 IICBLN CCc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)c2C)cc1 ZINC000408767000 556830050 /nfs/dbraw/zinc/83/00/50/556830050.db2.gz USKIWRQRQUFAHR-LPYMAVHISA-N 0 2 431.467 4.462 40 10 IICBLN COc1ccc(/C=C2/C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)cc1Cl ZINC000408782279 556854790 /nfs/dbraw/zinc/85/47/90/556854790.db2.gz GQJLZWVGZCSIPU-YFHOEESVSA-N 0 2 425.655 4.322 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3cc(C)ccc3C)C2=O)cc(Cl)c1OC(C)C ZINC000408806347 556858945 /nfs/dbraw/zinc/85/89/45/556858945.db2.gz BBZOYYDMTCGWLQ-CXUHLZMHSA-N 0 2 442.899 4.419 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)cc1OC ZINC000408803702 556859984 /nfs/dbraw/zinc/85/99/84/556859984.db2.gz SGZQJIZAJBTJIX-MHWRWJLKSA-N 0 2 442.899 4.421 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Br)ccc3OC(C)C)C2=O)cc1 ZINC000408804153 556860310 /nfs/dbraw/zinc/86/03/10/556860310.db2.gz WLSOXCDSIPFHQJ-GZTJUZNOSA-N 0 2 443.297 4.211 40 10 IICBLN O=C1NC(=O)N(c2ccc(O)cc2)C(=O)/C1=C/c1ccc(OCc2cccc(Cl)c2)cc1 ZINC000408817432 556864254 /nfs/dbraw/zinc/86/42/54/556864254.db2.gz VYHHISGUGHIYST-FYJGNVAPSA-N 0 2 448.862 4.291 40 10 IICBLN CCOc1cc(/C=C2/C(=O)NC(=O)N(c3ccccc3)C2=O)ccc1Cc1ccccc1F ZINC000408874615 556876126 /nfs/dbraw/zinc/87/61/26/556876126.db2.gz CODAOUNFSDQYEP-KGENOOAVSA-N 0 2 444.462 4.482 40 10 IICBLN CCc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3ccccc3)cc2)C1=O ZINC000408881932 556878204 /nfs/dbraw/zinc/87/82/04/556878204.db2.gz MOOMDDANTSKLHQ-JWGURIENSA-N 0 2 426.472 4.494 40 10 IICBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3F)C2=O)c1 ZINC000408886339 556879424 /nfs/dbraw/zinc/87/94/24/556879424.db2.gz KAYCAJGUBTXNLA-XSFVSMFZSA-N 0 2 430.435 4.380 40 10 IICBLN CCOc1cc(Cl)c(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1OCC ZINC000408895285 556880496 /nfs/dbraw/zinc/88/04/96/556880496.db2.gz DPXBZRBQTWOGAG-MHWRWJLKSA-N 0 2 428.872 4.112 40 10 IICBLN CCCCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OC)c(Cl)c3)C2=O)cc1 ZINC000408900365 556882271 /nfs/dbraw/zinc/88/22/71/556882271.db2.gz SEEUQUHKKNLOJH-ATVHPVEESA-N 0 2 428.872 4.194 40 10 IICBLN CC[C@@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)cc1 ZINC000408903774 556886048 /nfs/dbraw/zinc/88/60/48/556886048.db2.gz YVFXJQYVFOUXAS-RNEAKCBISA-N 0 2 443.297 4.293 40 10 IICBLN O=C1NC(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1ccc(OCc2ccccc2F)cc1 ZINC000408908307 556886769 /nfs/dbraw/zinc/88/67/69/556886769.db2.gz BMVZATOCFPSOBD-UDWIEESQSA-N 0 2 434.398 4.210 40 10 IICBLN Cc1cc(Br)ccc1N1C(=O)NC(=O)C(=Cc2ccc(Cl)s2)C1=O ZINC000408966728 556901900 /nfs/dbraw/zinc/90/19/00/556901900.db2.gz NTFCPMGZHOQPEK-YRNVUSSQSA-N 0 2 425.691 4.139 40 10 IICBLN Cc1ccc(Cl)cc1N1C(=O)NC(=O)C(=Cc2cc(Cl)cc(Cl)c2O)C1=O ZINC000409044953 556930356 /nfs/dbraw/zinc/93/03/56/556930356.db2.gz DUCDAZINYRNRTA-LFYBBSHMSA-N 0 2 425.655 4.327 40 10 IICBLN O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1ccc(Br)s1 ZINC000409096587 556953261 /nfs/dbraw/zinc/95/32/61/556953261.db2.gz KPSUSKDTOFKVQQ-SOFGYWHQSA-N 0 2 446.109 4.484 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Br)c(N(C)C)o3)C2=O)cc1 ZINC000059105120 557814541 /nfs/dbraw/zinc/81/45/41/557814541.db2.gz WXNVHWZECCRGST-NTEUORMPSA-N 0 2 448.273 4.014 40 10 IICBLN Cc1cc2[nH]c(=NC=C3C(=O)NC(=O)N(c4cccc5ccccc54)C3=O)sc2cc1C ZINC000408529039 569584021 /nfs/dbraw/zinc/58/40/21/569584021.db2.gz GUKBDRZSRNSJNB-SFQUDFHCSA-N 0 2 442.500 4.645 40 10 IICBLN O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C\c1cc(Br)cs1 ZINC000009260114 132311490 /nfs/dbraw/zinc/31/14/90/132311490.db2.gz QGKBRZMEMYDXKK-UITAMQMPSA-N 0 2 446.109 4.484 40 10 IICBLN Cc1ccc(NC=C2C(=O)NC(=O)N(c3cc(C)c(Br)cc3C)C2=O)cc1C ZINC000408526851 555715929 /nfs/dbraw/zinc/71/59/29/555715929.db2.gz CNYVWORSKNENET-MHWRWJLKSA-N 0 2 442.313 4.262 40 10 IICBLN O=C1NC(=O)N(c2cccc(Br)c2)C(=O)/C1=C/c1ccc(Cl)c(Cl)c1 ZINC000408744031 556224504 /nfs/dbraw/zinc/22/45/04/556224504.db2.gz YGCSJYRAFFLDTJ-WUXMJOGZSA-N 0 2 440.080 4.422 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc(Cl)c1OC ZINC000408807122 556859060 /nfs/dbraw/zinc/85/90/60/556859060.db2.gz OGAXCHCRYMWHGX-VGOFMYFVSA-N 0 2 435.263 4.067 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)cc1OC ZINC000408803001 556859779 /nfs/dbraw/zinc/85/97/79/556859779.db2.gz KGPPFEPKRWPRSA-MHWRWJLKSA-N 0 2 428.872 4.112 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)c(OCc2ccccc2)c1 ZINC000408810121 556862070 /nfs/dbraw/zinc/86/20/70/556862070.db2.gz OYCLAIZFCATZCY-KGENOOAVSA-N 0 2 442.471 4.249 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)ccc1OCc1ccc(C)cc1 ZINC000408811436 556862735 /nfs/dbraw/zinc/86/27/35/556862735.db2.gz VMMDCQXSLUVHOC-KGENOOAVSA-N 0 2 442.471 4.249 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc(C)c([N+](=O)[O-])c4)o3)C2=O)cc1C ZINC000408847055 556869258 /nfs/dbraw/zinc/86/92/58/556869258.db2.gz MDFUWCPFOBBXPA-XDHOZWIPSA-N 0 2 445.431 4.446 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)ccc1Cc1cccc(F)c1 ZINC000408866064 556873601 /nfs/dbraw/zinc/87/36/01/556873601.db2.gz DGWBLVMIYQOMAW-PXLXIMEGSA-N 0 2 444.462 4.482 40 10 IICBLN COc1ccc(/C=C2/C(=O)NC(=O)N(c3ccccc3F)C2=O)c(OCc2ccccc2)c1 ZINC000408869369 556874540 /nfs/dbraw/zinc/87/45/40/556874540.db2.gz CKKXIDKHYCUIAS-UYRXBGFRSA-N 0 2 446.434 4.080 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c(OCc2ccccc2F)c1 ZINC000408888218 556878721 /nfs/dbraw/zinc/87/87/21/556878721.db2.gz TZPXZRUVNLHYHA-DEDYPNTBSA-N 0 2 446.434 4.080 40 10 IICBLN CC[C@H](C)Oc1c(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cccc1OC ZINC000408897909 556883372 /nfs/dbraw/zinc/88/33/72/556883372.db2.gz JOESTPAUZSUQBC-VLURKWGBSA-N 0 2 428.872 4.192 40 10 IICBLN CCOc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(OC)cc2)C1=O ZINC000409045764 556930526 /nfs/dbraw/zinc/93/05/26/556930526.db2.gz HMEUJTFTCRFIBP-OQLLNIDSSA-N 0 2 435.263 4.067 40 10 IICBLN O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/C=C/c1ccccc1[N+](=O)[O-] ZINC000409101510 556955804 /nfs/dbraw/zinc/95/58/04/556955804.db2.gz UKKGZBSQBBYASZ-FOOJRNJNSA-N 0 2 432.219 4.124 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)cc1OC ZINC000409102805 556956624 /nfs/dbraw/zinc/95/66/24/556956624.db2.gz UFMORDJTWKWIKB-FMIVXFBMSA-N 0 2 435.263 4.067 40 10 IICBLN CCCOc1ccc(N2C(=O)NC(=O)C(=Cc3cccc4ccccc34)C2=O)cc1OC ZINC000409212843 557007364 /nfs/dbraw/zinc/00/73/64/557007364.db2.gz RAVQFSFMNSXRSN-XSFVSMFZSA-N 0 2 430.460 4.304 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)c(C)n1-c1ccc2ccccc2c1 ZINC000409228221 557014927 /nfs/dbraw/zinc/01/49/27/557014927.db2.gz WBPTWLBKZQWTCH-OEAKJJBVSA-N 0 2 436.471 4.309 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)c(C)n1-c1c(C)cc(C)cc1C ZINC000409234206 557025567 /nfs/dbraw/zinc/02/55/67/557025567.db2.gz NKKQMNZQHAHUNV-CIAFOILYSA-N 0 2 428.492 4.081 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccncc3)C2=O)c(C)n1-c1ccc(C(C)C)cc1 ZINC000409392429 557096870 /nfs/dbraw/zinc/09/68/70/557096870.db2.gz MNLQLKXXYFXRPJ-HYARGMPZSA-N 0 2 428.492 4.279 40 10 IICBLN Cc1[nH]n(-c2ccc(Cl)cc2)c(=O)c1C=Nc1ccc(S(=O)(=O)NC(C)(C)C)cc1 ZINC000100931035 557278955 /nfs/dbraw/zinc/27/89/55/557278955.db2.gz MZNNTWODNNLXLW-CPNJWEJPSA-N 0 2 446.960 4.135 40 10 IICBLN Cc1nnc(NS(=O)(=O)c2ccc(NN=C3C=CC(=O)c4ncccc43)cc2)s1 ZINC000104090595 557320095 /nfs/dbraw/zinc/32/00/95/557320095.db2.gz SFILKVPTXQDZEH-DQRAZIAOSA-N 0 2 426.483 4.317 40 10 IICBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3cccc(F)c3)cc2)C1=O ZINC000014132746 557421578 /nfs/dbraw/zinc/42/15/78/557421578.db2.gz PBWAKCNABAAHLM-KGENOOAVSA-N 0 2 430.435 4.380 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(F)cc4)c3C)C2=O)cc1 ZINC000002377016 132253319 /nfs/dbraw/zinc/25/33/19/132253319.db2.gz CELZECPHYQQABU-HYARGMPZSA-N 0 2 447.466 4.298 40 10 IICBLN Cc1ccc(C(=O)Oc2ccccc2/C=C2/C(=O)NC(=O)N(c3ccccc3C)C2=O)cc1 ZINC000408534367 555751130 /nfs/dbraw/zinc/75/11/30/555751130.db2.gz LQSGYYBJIVWLMP-HKWRFOASSA-N 0 2 440.455 4.189 40 10 IICBLN Cc1cc(Br)cc(/C=C2/C(=O)NN(c3cc(Cl)cc(Cl)c3)C2=O)c1O ZINC000032099498 556528760 /nfs/dbraw/zinc/52/87/60/556528760.db2.gz SLQBECIOEYGIRA-CPSFFCFKSA-N 0 2 442.096 4.231 40 10 IICBLN Cc1nn(-c2ccc(C)c(C)c2)c(C)c1C=C1C(=O)NC(=O)N(c2ccc(C)cc2C)C1=O ZINC000408757701 556568986 /nfs/dbraw/zinc/56/89/86/556568986.db2.gz OWVPEIPRYQCSGH-LPYMAVHISA-N 0 2 442.519 4.389 40 10 IICBLN COC(=O)c1ccc(-c2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)o2)c(C)c1 ZINC000408782895 556855049 /nfs/dbraw/zinc/85/50/49/556855049.db2.gz LAOQLLAMBQFIAP-DEDYPNTBSA-N 0 2 444.443 4.016 40 10 IICBLN O=C1NC(=O)N(c2ccc(O)cc2)C(=O)/C1=C/c1ccc(OCc2ccc(Cl)cc2)cc1 ZINC000408797309 556857521 /nfs/dbraw/zinc/85/75/21/556857521.db2.gz CIEZNWMRIKLUBB-FYJGNVAPSA-N 0 2 448.862 4.291 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1OCC ZINC000408800983 556858407 /nfs/dbraw/zinc/85/84/07/556858407.db2.gz QUWCNYIBIYLGRN-RVDMUPIBSA-N 0 2 428.872 4.112 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1Br ZINC000408804267 556860315 /nfs/dbraw/zinc/86/03/15/556860315.db2.gz WQQNYFKHXBOTLM-RIYZIHGNSA-N 0 2 449.688 4.168 40 10 IICBLN COc1ccc(Br)cc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2C)C1=O ZINC000408809410 556861765 /nfs/dbraw/zinc/86/17/65/556861765.db2.gz LDKNQSBCNGIFHU-UKTHLTGXSA-N 0 2 449.688 4.086 40 10 IICBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(OCC)cc3)C2=O)cc1Cl ZINC000408809373 556861929 /nfs/dbraw/zinc/86/19/29/556861929.db2.gz HLKIPFCEZKZUMV-SFQUDFHCSA-N 0 2 428.872 4.194 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)cc(Br)c3O)C2=O)cc1C ZINC000408844781 556868649 /nfs/dbraw/zinc/86/86/49/556868649.db2.gz FHGFJHPNCGNYTH-VGOFMYFVSA-N 0 2 449.688 4.091 40 10 IICBLN COc1cc(/C=C2/C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)ccc1Cc1ccccc1F ZINC000408873057 556875566 /nfs/dbraw/zinc/87/55/66/556875566.db2.gz RDEIHUYHTMXDID-FYJGNVAPSA-N 0 2 444.462 4.400 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)ccc1Cc1cccc(F)c1 ZINC000408878803 556877371 /nfs/dbraw/zinc/87/73/71/556877371.db2.gz BVPSMGJBXWHYMK-KGENOOAVSA-N 0 2 444.462 4.400 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3F)C2=O)cc1 ZINC000408894063 556879879 /nfs/dbraw/zinc/87/98/79/556879879.db2.gz IPBJWYWUDNCUGX-XSFVSMFZSA-N 0 2 446.434 4.080 40 10 IICBLN CCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)cc1OCC ZINC000408984028 556907942 /nfs/dbraw/zinc/90/79/42/556907942.db2.gz PJKZUEPBWYEPAN-YBEGLDIGSA-N 0 2 428.872 4.112 40 10 IICBLN COc1cccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)c1OC(C)C ZINC000409009550 556917381 /nfs/dbraw/zinc/91/73/81/556917381.db2.gz AWSYTSRRVJYBNN-NTEUORMPSA-N 0 2 449.290 4.456 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)cc(Cl)c3OC)C2=O)cc1 ZINC000409046506 556929511 /nfs/dbraw/zinc/92/95/11/556929511.db2.gz LAEIGRTZORYQBR-OQLLNIDSSA-N 0 2 435.263 4.067 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(-c3ccc(C(C)=O)cc3)o2)C1=O ZINC000409239208 557020461 /nfs/dbraw/zinc/02/04/61/557020461.db2.gz CKPLREIDGJMSSE-XMHGGMMESA-N 0 2 444.443 4.214 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(-c3cccc(F)c3)c2C)C1=O ZINC000409235288 557026301 /nfs/dbraw/zinc/02/63/01/557026301.db2.gz ZKLGUJYEONQHGK-DEDYPNTBSA-N 0 2 447.466 4.298 40 10 IICBLN CCOc1ccc2ccccc2c1C=C1C(=O)NC(=O)N(c2ccccc2OCC)C1=O ZINC000409247157 557028528 /nfs/dbraw/zinc/02/85/28/557028528.db2.gz GPYSKEVFSXUYRN-XDJHFCHBSA-N 0 2 430.460 4.304 40 10 IICBLN O=C1NC(=O)N(c2cccnc2)C(=O)/C1=C/c1ccc(Sc2ccc(Cl)cc2)o1 ZINC000409249236 557029812 /nfs/dbraw/zinc/02/98/12/557029812.db2.gz JXJCHPGOVUIZMN-MHWRWJLKSA-N 0 2 425.853 4.146 40 10 IICBLN O=C1NC(=O)N(c2ccncc2)C(=O)/C1=C\c1ccc(-c2cccc(Cl)c2Cl)o1 ZINC000409391698 557096032 /nfs/dbraw/zinc/09/60/32/557096032.db2.gz JNOZLQBKVXBBEU-UVTDQMKNSA-N 0 2 428.231 4.315 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OC)c(Br)c3)C2=O)cc1 ZINC000001511669 557123198 /nfs/dbraw/zinc/12/31/98/557123198.db2.gz HLUMNPLHFJLPBU-XNTDXEJSSA-N 0 2 445.269 4.363 40 10 IICBLN CCn1c(=O)oc2cc(S(=O)(=O)Nc3nc(-c4ccccc4)cs3)c(Cl)cc21 ZINC000223367415 557463590 /nfs/dbraw/zinc/46/35/90/557463590.db2.gz KFAOPRLOUINDFY-UHFFFAOYSA-N 0 2 435.914 4.192 40 10 IICBLN O=C1NC(=O)N(c2cccc(Br)c2)C(=O)/C1=C/c1ccc(Cl)cc1Cl ZINC000009056464 132226386 /nfs/dbraw/zinc/22/63/86/132226386.db2.gz PTXDSYXVGAVMPD-AWNIVKPZSA-N 0 2 440.080 4.422 40 10 IICBLN Cc1ccc(C)c(N2C(=O)NC(=O)C(=CNc3ccc(Br)c(Cl)c3)C2=O)c1 ZINC000408531109 555729757 /nfs/dbraw/zinc/72/97/57/555729757.db2.gz NFSPFMDVRXNHOR-UKTHLTGXSA-N 0 2 448.704 4.298 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3c(OCC)ccc4ccccc43)C2=O)cc1 ZINC000408740137 556212041 /nfs/dbraw/zinc/21/20/41/556212041.db2.gz IRRSAEJVAZVNSR-QNGOZBTKSA-N 0 2 430.460 4.304 40 10 IICBLN COc1ccc(Br)cc1/C=C1/C(=O)NN(c2ccc(Cl)c(Cl)c2)C1=O ZINC000016226478 556592706 /nfs/dbraw/zinc/59/27/06/556592706.db2.gz BAPJUKPQOHMEGY-GHXNOFRVSA-N 0 2 442.096 4.226 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4F)cc3)C2=O)cc1 ZINC000408782820 556855029 /nfs/dbraw/zinc/85/50/29/556855029.db2.gz JXSXZUXNFPEEJT-KGENOOAVSA-N 0 2 430.435 4.380 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3F)C2=O)cc1 ZINC000408786619 556856455 /nfs/dbraw/zinc/85/64/55/556856455.db2.gz SWJAKKVXTIPIGG-XSFVSMFZSA-N 0 2 430.435 4.380 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)cc(Cl)c1OC(C)C ZINC000408811722 556862788 /nfs/dbraw/zinc/86/27/88/556862788.db2.gz KPTFYDPIDPVHOQ-MDWZMJQESA-N 0 2 449.290 4.456 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)ccc1OC(C)C ZINC000408816938 556863972 /nfs/dbraw/zinc/86/39/72/556863972.db2.gz SQAWGAACWBNWBW-CXUHLZMHSA-N 0 2 428.872 4.111 40 10 IICBLN CCCOc1cc(OC)ccc1/C=C1\C(=O)NC(=O)N(c2cc(Cl)ccc2C)C1=O ZINC000408813823 556864967 /nfs/dbraw/zinc/86/49/67/556864967.db2.gz VFLLMRBKXOFZCL-LICLKQGHSA-N 0 2 428.872 4.112 40 10 IICBLN CCOc1cc(Cl)c(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(C)c3)C2=O)cc1OC ZINC000408857958 556871196 /nfs/dbraw/zinc/87/11/96/556871196.db2.gz QQSCXKYEBGLGKB-CXUHLZMHSA-N 0 2 428.872 4.031 40 10 IICBLN CC(=O)c1ccc(-c2ccc(C=C3C(=O)NC(=O)N(c4ccc(C)c(C)c4)C3=O)o2)cc1 ZINC000408858259 556871207 /nfs/dbraw/zinc/87/12/07/556871207.db2.gz RBRSJILNDCJHKM-FYJGNVAPSA-N 0 2 428.444 4.432 40 10 IICBLN CCOc1cc(/C=C2/C(=O)NC(=O)N(c3ccccc3CC)C2=O)cc(Cl)c1OCC ZINC000408874861 556876034 /nfs/dbraw/zinc/87/60/34/556876034.db2.gz BONFEDXGFGOVJH-WJDWOHSUSA-N 0 2 442.899 4.366 40 10 IICBLN O=C1NC(=O)N(c2ccccc2F)C(=O)/C1=C\c1ccccc1OCc1cccc(F)c1 ZINC000408886307 556879303 /nfs/dbraw/zinc/87/93/03/556879303.db2.gz JVVIHIBLZRGXMM-AQTBWJFISA-N 0 2 434.398 4.210 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1OCc1ccccc1 ZINC000408901999 556883029 /nfs/dbraw/zinc/88/30/29/556883029.db2.gz DKIAVRGXHNWZGW-DEDYPNTBSA-N 0 2 446.434 4.080 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(Cl)cc1OC ZINC000408898952 556883643 /nfs/dbraw/zinc/88/36/43/556883643.db2.gz NJBKQQFUHKGSEV-RIYZIHGNSA-N 0 2 435.263 4.067 40 10 IICBLN O=C1NC(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1ccccc1OCc1ccc(F)cc1 ZINC000408913962 556889437 /nfs/dbraw/zinc/88/94/37/556889437.db2.gz WKEBKEBMCJMQRB-UDWIEESQSA-N 0 2 434.398 4.210 40 10 IICBLN O=C1NC(=O)N(c2ccccc2F)C(=O)/C1=C/c1cccc(OCc2cccc(F)c2)c1 ZINC000408937000 556895177 /nfs/dbraw/zinc/89/51/77/556895177.db2.gz LYAXFZMQTQIUMC-CPNJWEJPSA-N 0 2 434.398 4.210 40 10 IICBLN O=C1NC(=O)N(c2ccc(OCc3ccccc3Cl)cc2)C(=O)/C1=C/c1ccc(O)cc1 ZINC000408939357 556896417 /nfs/dbraw/zinc/89/64/17/556896417.db2.gz RWGKHPLUYLZQOG-DEDYPNTBSA-N 0 2 448.862 4.291 40 10 IICBLN Cn1cccc1/C=C1\C(=O)NC(=O)N(c2ccc(C34CC5CC(CC(C5)C3)C4)cc2)C1=O ZINC000408947777 556898272 /nfs/dbraw/zinc/89/82/72/556898272.db2.gz DDPGVSSRCUQCON-WSDLNYQXSA-N 0 2 429.520 4.159 40 10 IICBLN O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1ccc(N2CCCC2)cc1 ZINC000408960343 556900292 /nfs/dbraw/zinc/90/02/92/556900292.db2.gz LACQAQVCQSNDMH-NTCAYCPXSA-N 0 2 430.291 4.260 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccn3-c3cccc(C(F)(F)F)c3)C2=O)cc1 ZINC000408966126 556900663 /nfs/dbraw/zinc/90/06/63/556900663.db2.gz ZBINNOFIOJUDGR-CPNJWEJPSA-N 0 2 439.393 4.471 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)c(OC)c(Cl)c3)C2=O)cc1 ZINC000409056356 556934138 /nfs/dbraw/zinc/93/41/38/556934138.db2.gz LQRYFJRGAFGIID-RIYZIHGNSA-N 0 2 435.263 4.067 40 10 IICBLN CCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2cccc(Br)c2)C1=O ZINC000409103521 556952195 /nfs/dbraw/zinc/95/21/95/556952195.db2.gz ADIQETOVRMMPFW-OQLLNIDSSA-N 0 2 449.688 4.168 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(-c3ccc(F)cc3)c2C)C1=O ZINC000409236751 557018623 /nfs/dbraw/zinc/01/86/23/557018623.db2.gz HGSXQRQSWCPVNC-XSFVSMFZSA-N 0 2 447.466 4.298 40 10 IICBLN CCOc1cccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)C(C)=CC(C)(C)N4C)C2=O)c1 ZINC000208445223 557087635 /nfs/dbraw/zinc/08/76/35/557087635.db2.gz ATGYNLJSIDTYGY-FYJGNVAPSA-N 0 2 445.519 4.383 40 10 IICBLN O=C1NC(=O)N(c2ccccc2)C(=O)C1=Cc1ccc(-c2cc([N+](=O)[O-])ccc2Cl)o1 ZINC000033321668 557807409 /nfs/dbraw/zinc/80/74/09/557807409.db2.gz VIYHSDMFNMTDHD-LFIBNONCSA-N 0 2 437.795 4.379 40 10 IICBLN COc1ccc(OC)c(C=C2C(=O)NC(=O)N(c3ccc(Br)c(C)c3)C2=O)c1 ZINC000034138455 557810937 /nfs/dbraw/zinc/81/09/37/557810937.db2.gz PFTXIELUGAOIBY-XNTDXEJSSA-N 0 2 445.269 4.281 40 10 IICBLN Cc1cc(C=Cc2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])c(C)n1-c1ccc(-c2ccccc2)cc1 ZINC000108928335 569253232 /nfs/dbraw/zinc/25/32/32/569253232.db2.gz QYTRPPAUYIDJBO-JLHYYAGUSA-N 0 2 428.448 4.216 40 10 IICBLN Cc1nn(-c2ccc(C)cc2)c(C)c1/C=C1\C(=O)NC(=O)N(c2ccc(C)c(C)c2)C1=O ZINC000408758004 556634042 /nfs/dbraw/zinc/63/40/42/556634042.db2.gz UEAUWENEVIVZOC-LPYMAVHISA-N 0 2 428.492 4.081 40 10 IICBLN COc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1Cl ZINC000408778157 556853845 /nfs/dbraw/zinc/85/38/45/556853845.db2.gz CCVSMSAUTJGIGJ-WUXMJOGZSA-N 0 2 425.655 4.322 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cccc(F)c3)C2=O)cc1 ZINC000408779316 556854001 /nfs/dbraw/zinc/85/40/01/556854001.db2.gz VAQCROPUMRVZOZ-KGENOOAVSA-N 0 2 430.435 4.380 40 10 IICBLN Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccc(-c4ccc(C)c([N+](=O)[O-])c4)o3)C2=O)c1 ZINC000408779382 556854071 /nfs/dbraw/zinc/85/40/71/556854071.db2.gz DLRYNDAHHKSPES-XDHOZWIPSA-N 0 2 445.431 4.446 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cc(C)ccc3C)C2=O)cc1Br ZINC000408805612 556860781 /nfs/dbraw/zinc/86/07/81/556860781.db2.gz HGXRQWPSNQQBIV-XNTDXEJSSA-N 0 2 443.297 4.131 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)ccc1OC(C)C ZINC000408805569 556860865 /nfs/dbraw/zinc/86/08/65/556860865.db2.gz GTZAFAWHRUOMDZ-RVDMUPIBSA-N 0 2 428.872 4.192 40 10 IICBLN CCOc1ccc(Br)cc1/C=C1\C(=O)NC(=O)N(c2cc(C)ccc2C)C1=O ZINC000408812627 556862986 /nfs/dbraw/zinc/86/29/86/556862986.db2.gz WZXDXQAJDKKUOH-LFIBNONCSA-N 0 2 443.297 4.131 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)cc(Cl)c1OC ZINC000408814846 556865258 /nfs/dbraw/zinc/86/52/58/556865258.db2.gz ZUULFNWOHNRTGO-VGOFMYFVSA-N 0 2 449.290 4.376 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)ccc1OCc1ccccc1 ZINC000408845733 556868840 /nfs/dbraw/zinc/86/88/40/556868840.db2.gz LISUFUNYDLRMRF-DEDYPNTBSA-N 0 2 446.434 4.080 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Br)cc(Cl)c3O)C2=O)cc1C ZINC000408846578 556868971 /nfs/dbraw/zinc/86/89/71/556868971.db2.gz OFTPHSJLISOWIX-AUWJEWJLSA-N 0 2 449.688 4.091 40 10 IICBLN Cc1cc(C)cc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(O)cc4)C3=O)cc2)c1 ZINC000408880402 556876245 /nfs/dbraw/zinc/87/62/45/556876245.db2.gz HQJBQQHPGSMEEU-OEAKJJBVSA-N 0 2 442.471 4.254 40 10 IICBLN COc1ccc(/C=C2/C(=O)NC(=O)N(c3ccccc3F)C2=O)c(Cc2ccccc2F)c1 ZINC000408884221 556877794 /nfs/dbraw/zinc/87/77/94/556877794.db2.gz XEKMTPDUKWWYPM-RGEXLXHISA-N 0 2 448.425 4.231 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4ccccc4F)cc3)C2=O)cc1 ZINC000408882961 556878463 /nfs/dbraw/zinc/87/84/63/556878463.db2.gz OTSFZBKZPSCXKO-RCCKNPSSSA-N 0 2 430.435 4.092 40 10 IICBLN Cc1ccc(COc2ccc(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)cc2)cc1 ZINC000408907975 556886818 /nfs/dbraw/zinc/88/68/18/556886818.db2.gz ABCFPEMZVBYSGE-LPYMAVHISA-N 0 2 430.435 4.380 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)c(C)n1C(C)(C)C ZINC000408960184 556900007 /nfs/dbraw/zinc/90/00/07/556900007.db2.gz DEBHGZGTQWBFCJ-GZTJUZNOSA-N 0 2 444.329 4.289 40 10 IICBLN O=C1NC(=O)N(c2ccc(Cl)c(Cl)c2)C(=O)/C1=C/c1ccc(N2CCCC2)cc1 ZINC000408960477 556900503 /nfs/dbraw/zinc/90/05/03/556900503.db2.gz MABJHFYFSKOZRI-LFIBNONCSA-N 0 2 430.291 4.260 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)c(OCC)c(Cl)c3)C2=O)cc1 ZINC000409056405 556934237 /nfs/dbraw/zinc/93/42/37/556934237.db2.gz MAOGIVKDOZUDDH-OQLLNIDSSA-N 0 2 449.290 4.457 40 10 IICBLN O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1ccc(Br)o1 ZINC000409107506 556959334 /nfs/dbraw/zinc/95/93/34/556959334.db2.gz WJUXOYJOJDZDDM-SOFGYWHQSA-N 0 2 430.041 4.015 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(C)n(-c3ccccc3)c2C)C1=O ZINC000409221478 557016777 /nfs/dbraw/zinc/01/67/77/557016777.db2.gz QUUBMCZQDMPWJV-HKWRFOASSA-N 0 2 429.476 4.159 40 10 IICBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2ccc(N3CCCC3)cc2F)C1=O ZINC000409232040 557023640 /nfs/dbraw/zinc/02/36/40/557023640.db2.gz GSDUWGZEBSPPME-LFIBNONCSA-N 0 2 427.863 4.054 40 10 IICBLN CCCCc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4cccnc4)C3=O)c2C)cc1 ZINC000409233926 557025295 /nfs/dbraw/zinc/02/52/95/557025295.db2.gz IPANOMNFZRTZOD-HZHRSRAPSA-N 0 2 442.519 4.498 40 10 IICBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2ccc(N3CCCCC3)c(F)c2)C1=O ZINC000409235250 557026291 /nfs/dbraw/zinc/02/62/91/557026291.db2.gz OLJJQMXWGOTUGH-FOWTUZBSSA-N 0 2 441.890 4.444 40 10 IICBLN Cc1c(Cl)cccc1N1C(=O)NC(=O)C(=Cc2cc(Br)cs2)C1=O ZINC000409246910 557028605 /nfs/dbraw/zinc/02/86/05/557028605.db2.gz KXKASOFEZJGQIW-IZZDOVSWSA-N 0 2 425.691 4.139 40 10 IICBLN COc1ccc(-n2cccc2/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)cc1 ZINC000409241158 557031559 /nfs/dbraw/zinc/03/15/59/557031559.db2.gz JDSKYHFWMPKPGO-QGOAFFKASA-N 0 2 435.867 4.114 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)[C@H](C)CC(C)(C)N4C)C2=O)cc1 ZINC000208198014 557079460 /nfs/dbraw/zinc/07/94/60/557079460.db2.gz ILTWAXCSAXVDPP-ZFMLPXDISA-N 0 2 447.535 4.474 40 10 IICBLN O=C1NC(=O)N(c2ccncc2)C(=O)/C1=C\c1ccc(-c2ccc(Cl)c(Cl)c2)o1 ZINC000409391410 557096120 /nfs/dbraw/zinc/09/61/20/557096120.db2.gz ICIHLOZOLBWJNB-UVTDQMKNSA-N 0 2 428.231 4.315 40 10 IICBLN CCCCc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4ccncc4)C3=O)c2C)cc1 ZINC000409394088 557098112 /nfs/dbraw/zinc/09/81/12/557098112.db2.gz VMFGRHIWVHXAQN-XQNSMLJCSA-N 0 2 442.519 4.498 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3cc4c(cc3C)N(C)C(C)(C)C[C@H]4C)C2=O)cc1 ZINC000208230936 569261237 /nfs/dbraw/zinc/26/12/37/569261237.db2.gz GXJSJJIBHNARGA-WMRWHDLOSA-N 0 2 447.535 4.392 40 10 IICBLN Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cc(Br)c(O)c2ccccc12 ZINC000008974216 569492851 /nfs/dbraw/zinc/49/28/51/569492851.db2.gz LKMVHTQXCGTFFI-UHFFFAOYSA-N 0 2 437.271 4.325 40 10 IICBLN Cc1cc2c(cc1S(=O)(=O)Nc1nc(-c3ccc(Cl)cc3)cs1)oc(=O)n2C ZINC000223340773 193968657 /nfs/dbraw/zinc/96/86/57/193968657.db2.gz DEPVLRGHQXPFGJ-UHFFFAOYSA-N 0 2 435.914 4.018 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=CNc3ccc(Br)cc3Cl)C2=O)cc1C ZINC000408539877 555787305 /nfs/dbraw/zinc/78/73/05/555787305.db2.gz ZRUOXGUURXDCEB-NTEUORMPSA-N 0 2 448.704 4.298 40 10 IICBLN Cc1nn(-c2ccc(C)cc2C)c(C)c1C=C1C(=O)NC(=O)N(c2ccc(C)cc2)C1=O ZINC000408755787 556238725 /nfs/dbraw/zinc/23/87/25/556238725.db2.gz FQHAMOFMQMTAIT-FYJGNVAPSA-N 0 2 428.492 4.081 40 10 IICBLN Cc1nn(-c2ccc(C)cc2C)c(C)c1C=C1C(=O)NC(=O)N(c2cccc(C)c2)C1=O ZINC000408755852 556238746 /nfs/dbraw/zinc/23/87/46/556238746.db2.gz GCSPJKARELYNFV-FYJGNVAPSA-N 0 2 428.492 4.081 40 10 IICBLN Cc1nn(-c2ccc(C)c(C)c2)c(C)c1/C=C1/C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000408756052 556239199 /nfs/dbraw/zinc/23/91/99/556239199.db2.gz HFLNXHLHHQDZMC-MTJSOVHGSA-N 0 2 448.910 4.426 40 10 IICBLN COc1ccc(N2N=C(C)C(C=Nc3c(C)nn(-c4ccc([N+](=O)[O-])cc4)c3C)C2=O)cc1 ZINC000408758398 556676722 /nfs/dbraw/zinc/67/67/22/556676722.db2.gz ZHSVHPCHBATSCS-FYJGNVAPSA-N 0 2 446.467 4.124 40 10 IICBLN CCOc1ccc2ccc(OCC)c(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)c2c1 ZINC000408782939 556854974 /nfs/dbraw/zinc/85/49/74/556854974.db2.gz IXUBZQHFVULRHV-KGENOOAVSA-N 0 2 448.450 4.443 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)cc1Br ZINC000408782810 556855005 /nfs/dbraw/zinc/85/50/05/556855005.db2.gz JTPNYANGHLLTIK-MHWRWJLKSA-N 0 2 443.297 4.131 40 10 IICBLN CCOc1cccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccccc4)c3C)C2=O)c1 ZINC000408785025 556855589 /nfs/dbraw/zinc/85/55/89/556855589.db2.gz FJTCGKRLIAKVKR-HYARGMPZSA-N 0 2 429.476 4.159 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)cc(Cl)c1OCC ZINC000408803301 556859751 /nfs/dbraw/zinc/85/97/51/556859751.db2.gz NKVJRKNACRGQJT-MHWRWJLKSA-N 0 2 442.899 4.421 40 10 IICBLN COc1ccc(Br)cc1/C=C1\C(=O)NC(=O)N(c2cc(Cl)ccc2C)C1=O ZINC000408807797 556861373 /nfs/dbraw/zinc/86/13/73/556861373.db2.gz HRHPGNLWYSXHQL-RIYZIHGNSA-N 0 2 449.688 4.086 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Cc4cccc(F)c4)cc3)C2=O)cc1 ZINC000408867454 556873902 /nfs/dbraw/zinc/87/39/02/556873902.db2.gz KVZFZCSHIIQUHP-PXLXIMEGSA-N 0 2 430.435 4.092 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)ccc1Cc1cccc(F)c1 ZINC000408872686 556875174 /nfs/dbraw/zinc/87/51/74/556875174.db2.gz OFUSCPQJJRJYOB-HYARGMPZSA-N 0 2 444.462 4.400 40 10 IICBLN COc1cc(Br)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)c1 ZINC000408873659 556875603 /nfs/dbraw/zinc/87/56/03/556875603.db2.gz VWKNUMCPIZJBRW-VIZOYTHASA-N 0 2 449.688 4.086 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)ccc1Cc1cccc(F)c1 ZINC000408877766 556877161 /nfs/dbraw/zinc/87/71/61/556877161.db2.gz YKBSMMWWGQIZKZ-HYARGMPZSA-N 0 2 444.462 4.400 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c(OCc2cccc(F)c2)c1 ZINC000408881019 556878302 /nfs/dbraw/zinc/87/83/02/556878302.db2.gz LSUBLKRAWANTSD-FYJGNVAPSA-N 0 2 446.434 4.080 40 10 IICBLN CCCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(Br)cc3C)C2=O)cc1 ZINC000408901371 556882634 /nfs/dbraw/zinc/88/26/34/556882634.db2.gz XMUOIYUMWGXNKT-ATVHPVEESA-N 0 2 443.297 4.213 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)cc1OCc1ccccc1 ZINC000408913556 556889432 /nfs/dbraw/zinc/88/94/32/556889432.db2.gz LUPNSARUWZNSOS-UDWIEESQSA-N 0 2 446.434 4.080 40 10 IICBLN CCc1ccccc1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3F)C2=O)c1C ZINC000408964799 556902306 /nfs/dbraw/zinc/90/23/06/556902306.db2.gz FAKJMRYINBVXIV-XMHGGMMESA-N 0 2 431.467 4.462 40 10 IICBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4)cc3)C2=O)cc1 ZINC000408986554 556909708 /nfs/dbraw/zinc/90/97/08/556909708.db2.gz MYHONIMWQVMHBN-KQWNVCNZSA-N 0 2 426.472 4.494 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(Br)s3)C2=O)cc1Cl ZINC000408984138 556910686 /nfs/dbraw/zinc/91/06/86/556910686.db2.gz IAISDDVLMQIWDZ-XFFZJAGNSA-N 0 2 425.691 4.139 40 10 IICBLN CC[C@@H](C)Oc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(OC)cc3)C2=O)cc1Cl ZINC000409012690 556918673 /nfs/dbraw/zinc/91/86/73/556918673.db2.gz LDSKOIUVDXOMHA-VVBXCHJUSA-N 0 2 428.872 4.192 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OC(C)C)c(Cl)c2)C1=O ZINC000409233398 557025057 /nfs/dbraw/zinc/02/50/57/557025057.db2.gz VVJXSUBLSVKKNH-RVDMUPIBSA-N 0 2 428.872 4.192 40 10 IICBLN CCOc1cccc(N2C(=O)NC(=O)C(=Cc3ccc4c(c3)[C@@H](C)CC(C)(C)N4C)C2=O)c1 ZINC000208198134 557079406 /nfs/dbraw/zinc/07/94/06/557079406.db2.gz OQCNMVRPTBMUFV-REIAIGDLSA-N 0 2 447.535 4.474 40 10 IICBLN CCOc1ccc(Br)cc1C=C1C(=O)NC(=O)N(c2ccc(F)cc2)C1=O ZINC000059135662 557815548 /nfs/dbraw/zinc/81/55/48/557815548.db2.gz AMVMCEBZPASHLE-XNTDXEJSSA-N 0 2 433.233 4.494 40 10 IICBLN O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccc(Sc2nc3ccccc3[nH]2)o1 ZINC000059336649 557822190 /nfs/dbraw/zinc/82/21/90/557822190.db2.gz DXOQQJKVIZFCNG-RVDMUPIBSA-N 0 2 448.435 4.113 40 10 IICBLN O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)C1=Cc1ccc(Br)o1 ZINC000002303696 132251668 /nfs/dbraw/zinc/25/16/68/132251668.db2.gz ZHCVQUHDWWMXJC-YRNVUSSQSA-N 0 2 440.047 4.311 40 10 IICBLN COc1cc(/C=C2/C(=O)NN(c3ccc(Cl)c(Cl)c3)C2=O)cc(Cl)c1OC ZINC000012418450 521946193 /nfs/dbraw/zinc/94/61/93/521946193.db2.gz ATYPXBXHSKMKIC-WZUFQYTHSA-N 0 2 427.671 4.125 40 10 IICBLN Cc1[nH]n(-c2ccc(Br)c(C)c2)c(=O)c1C=Nc1ccc([N+](=O)[O-])cc1O ZINC000408535872 555756495 /nfs/dbraw/zinc/75/64/95/555756495.db2.gz UHVFNEQMZKAVGT-ZROIWOOFSA-N 0 2 431.246 4.090 40 10 IICBLN CCCOc1ccc(C=C2C(=O)NC(=O)N(c3ccc([N+](=O)[O-])cc3)C2=O)cc1OCC ZINC000032101793 556529808 /nfs/dbraw/zinc/52/98/08/556529808.db2.gz VIIKDNKEBZWVQQ-ATVHPVEESA-N 0 2 439.424 4.289 40 10 IICBLN COc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4cc(C)cc(C)c4)C3=O)c2C)cc1 ZINC000408766282 556829644 /nfs/dbraw/zinc/82/96/44/556829644.db2.gz BJZUQYNBLUHDQE-OEAKJJBVSA-N 0 2 443.503 4.386 40 10 IICBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(OC(C)C)c(Br)c3)C2=O)c1 ZINC000408803962 556859925 /nfs/dbraw/zinc/85/99/25/556859925.db2.gz VFIVTGIJRQZOEM-MHWRWJLKSA-N 0 2 443.297 4.211 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)c(O)c(Br)c3)C2=O)cc1C ZINC000408855635 556871991 /nfs/dbraw/zinc/87/19/91/556871991.db2.gz FHPDMNFNGKVRAX-AWNIVKPZSA-N 0 2 449.688 4.091 40 10 IICBLN CCOc1cc(Br)cc(/C=C2/C(=O)NC(=O)N(c3ccccc3CC)C2=O)c1 ZINC000408866927 556873972 /nfs/dbraw/zinc/87/39/72/556873972.db2.gz IMPJXDUTABWJOW-BOPFTXTBSA-N 0 2 443.297 4.077 40 10 IICBLN COc1cc(Br)cc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)c1 ZINC000408879853 556876158 /nfs/dbraw/zinc/87/61/58/556876158.db2.gz HIEHVTJMQOMVLV-VIZOYTHASA-N 0 2 449.688 4.086 40 10 IICBLN CCOc1cc(Br)cc(/C=C2\C(=O)NC(=O)N(c3cc(C)ccc3C)C2=O)c1 ZINC000408878764 556877511 /nfs/dbraw/zinc/87/75/11/556877511.db2.gz AVICYWIGARYCNG-LICLKQGHSA-N 0 2 443.297 4.131 40 10 IICBLN CCc1cccc(C)c1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3cccnc3)C2=O)c1C ZINC000409222046 557017179 /nfs/dbraw/zinc/01/71/79/557017179.db2.gz BNDJUZCGIQOQDX-FYJGNVAPSA-N 0 2 428.492 4.026 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c(C)n1-c1ccc(C)cn1 ZINC000409236095 557018216 /nfs/dbraw/zinc/01/82/16/557018216.db2.gz QZDGPYKCYOUVKJ-WOJGMQOQSA-N 0 2 448.910 4.426 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2cccn2-c2cccc(C)c2C)C1=O ZINC000409246596 557028239 /nfs/dbraw/zinc/02/82/39/557028239.db2.gz JIMUWOXQUJFQPX-XDJHFCHBSA-N 0 2 429.476 4.159 40 10 IICBLN CCOc1ccc(C=C2C(=O)NC(=O)N(c3ccccc3OCC)C2=O)c2ccccc12 ZINC000409242320 557032254 /nfs/dbraw/zinc/03/22/54/557032254.db2.gz QNIBJLLOJPTKIU-XDJHFCHBSA-N 0 2 430.460 4.304 40 10 IICBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(OC)cc4)C3=O)cc2C(C)=CC1(C)C ZINC000208503321 557093199 /nfs/dbraw/zinc/09/31/99/557093199.db2.gz UAMDUSNHNSVWPN-KGENOOAVSA-N 0 2 445.519 4.383 40 10 IICBLN CCn1c(=O)oc2cc(S(=O)(=O)Nc3nc(-c4ccc(Cl)cc4)cs3)ccc21 ZINC000223351054 557461287 /nfs/dbraw/zinc/46/12/87/557461287.db2.gz RXMAMUOZEJLVIE-UHFFFAOYSA-N 0 2 435.914 4.192 40 10 IICBLN O=C1NC(=O)N(c2ccc(F)cc2)C(=O)C1=Cc1cc(Cl)c(O)c(Br)c1 ZINC000059135146 557815112 /nfs/dbraw/zinc/81/51/12/557815112.db2.gz ZPMKFOQJCYDROV-VZUCSPMQSA-N 0 2 439.624 4.454 40 10 IICBLN N#Cc1ccccc1COc1ccc(Cl)cc1/C=C1/C(=O)NN(c2ccccc2)C1=O ZINC000033645348 569259463 /nfs/dbraw/zinc/25/94/63/569259463.db2.gz HAFFASPAACACQP-BKUYFWCQSA-N 0 2 429.863 4.252 40 10 IICBLN O=C1NN(c2ccccc2)C(=O)/C1=C\c1cc(Cl)c(OCc2ccccc2)c([N+](=O)[O-])c1 ZINC000034690436 569259879 /nfs/dbraw/zinc/25/98/79/569259879.db2.gz NRYYFNNAJRHQBO-WQRHYEAKSA-N 0 2 449.850 4.289 40 10 IICBLN COc1cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc(Br)c1OC(C)(C)C ZINC000034805687 569259999 /nfs/dbraw/zinc/25/99/99/569259999.db2.gz MHRIKWNDUJGKLM-GDNBJRDFSA-N 0 2 445.313 4.096 40 10 IICBLN COc1ccc(C(=O)Oc2ccc(Cl)cc2/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1 ZINC000108136368 569260774 /nfs/dbraw/zinc/26/07/74/569260774.db2.gz KBAHINWFMBGQME-ZHZULCJRSA-N 0 2 448.862 4.029 40 10 IICBLN Cc1nn(-c2ccc(C)cc2)c(C)c1/C=C1/C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000408755106 556237959 /nfs/dbraw/zinc/23/79/59/556237959.db2.gz BNOBKRGXCYUOFM-NDENLUEZSA-N 0 2 434.883 4.117 40 10 IICBLN CCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(OCc3ccccc3)cc2)C1=O ZINC000408800650 556858336 /nfs/dbraw/zinc/85/83/36/556858336.db2.gz QJJDOXSBARWJHD-CJLVFECKSA-N 0 2 442.471 4.331 40 10 IICBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)cc1OC ZINC000408804884 556860507 /nfs/dbraw/zinc/86/05/07/556860507.db2.gz BZDSIVQDISECEE-OQLLNIDSSA-N 0 2 428.872 4.031 40 10 IICBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)cc1OC ZINC000408814573 556865309 /nfs/dbraw/zinc/86/53/09/556865309.db2.gz RQIWNVCPBMGTDD-MHWRWJLKSA-N 0 2 428.872 4.112 40 10 IICBLN CCOc1cc(Br)cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)c1 ZINC000408878386 556877219 /nfs/dbraw/zinc/87/72/19/556877219.db2.gz AGBQRPIVFOSUHG-LICLKQGHSA-N 0 2 443.297 4.131 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)ccc1Cc1cccc(F)c1 ZINC000408883886 556877789 /nfs/dbraw/zinc/87/77/89/556877789.db2.gz RROUOHHBIQSQAT-KGENOOAVSA-N 0 2 430.435 4.092 40 10 IICBLN CCOc1cc(Cl)c(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1OCC ZINC000408900420 556882370 /nfs/dbraw/zinc/88/23/70/556882370.db2.gz SLADKZMWRJENDF-OQLLNIDSSA-N 0 2 449.290 4.457 40 10 IICBLN O=C1NC(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1ccc(OCc2cccc(F)c2)cc1 ZINC000408912166 556886334 /nfs/dbraw/zinc/88/63/34/556886334.db2.gz PTCGRPPSHKHJLX-CIAFOILYSA-N 0 2 434.398 4.210 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)ccc1OCc1ccccc1 ZINC000408915493 556890272 /nfs/dbraw/zinc/89/02/72/556890272.db2.gz WGPDUURHZMPTGM-UDWIEESQSA-N 0 2 446.434 4.080 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1-c1ccc(C)cn1 ZINC000408961828 556901132 /nfs/dbraw/zinc/90/11/32/556901132.db2.gz OHULIFNKJUPHOE-YBFXNURJSA-N 0 2 434.883 4.117 40 10 IICBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3ccccc3)C2=O)cc1 ZINC000408989507 556910818 /nfs/dbraw/zinc/91/08/18/556910818.db2.gz KXFYHJQYYFXDBO-JWGURIENSA-N 0 2 426.472 4.494 40 10 IICBLN O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1ccc(N2CCCC2)cc1F ZINC000409102297 556956248 /nfs/dbraw/zinc/95/62/48/556956248.db2.gz RQEJYNALIMQKHJ-GXDHUFHOSA-N 0 2 448.281 4.399 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c(OCC)c1 ZINC000409229567 557015716 /nfs/dbraw/zinc/01/57/16/557015716.db2.gz RDUHDPGSDZIWRM-LFIBNONCSA-N 0 2 428.872 4.112 40 10 IICBLN CCOc1ccccc1N1C(=O)NC(=O)C(=Cc2cc(Br)ccc2OC)C1=O ZINC000002979287 557134410 /nfs/dbraw/zinc/13/44/10/557134410.db2.gz JWAWJOKATKFVDL-SDNWHVSQSA-N 0 2 445.269 4.363 40 10 IICBLN CCN(CC)S(=O)(=O)c1ccc(N=Cc2c(C)[nH]n(-c3cccc(Cl)c3)c2=O)cc1 ZINC000102773532 557307794 /nfs/dbraw/zinc/30/77/94/557307794.db2.gz VYYKNQNHPUJGEN-ZHZULCJRSA-N 0 2 446.960 4.089 40 10 IICBLN Cc1ccccc1N1C(=O)NC(=O)C(=Cc2ccc(OCc3ccccc3F)cc2)C1=O ZINC000014132749 557421550 /nfs/dbraw/zinc/42/15/50/557421550.db2.gz IJYLNDSAKUHPRE-XSFVSMFZSA-N 0 2 430.435 4.380 40 10 IICBLN CCN1c2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(OC)cc4)C3=O)cc2[C@H](C)CC1(C)C ZINC000208314097 569261272 /nfs/dbraw/zinc/26/12/72/569261272.db2.gz JGIKVJFWQSNCFR-ZFMLPXDISA-N 0 2 447.535 4.474 40 10 IICBLN O=C1C(=Cc2cc([N+](=O)[O-])ccc2O)C(=O)N(c2ccccc2)C(=S)N1c1ccccc1 ZINC000003017918 132260597 /nfs/dbraw/zinc/26/05/97/132260597.db2.gz ITDMXXXAMREYAI-UHFFFAOYSA-N 0 2 445.456 4.049 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccccc4)c3C)C2=O)cc1 ZINC000408739273 556210059 /nfs/dbraw/zinc/21/00/59/556210059.db2.gz ARVVECGESREZIB-JCMHNJIXSA-N 0 2 429.476 4.159 40 10 IICBLN Cc1nn(-c2ccc(C)cc2C)c(C)c1C=C1C(=O)NC(=O)N(c2ccc(C)cc2C)C1=O ZINC000408756996 556236851 /nfs/dbraw/zinc/23/68/51/556236851.db2.gz LGJRINYFGZVBDL-FYJGNVAPSA-N 0 2 442.519 4.389 40 10 IICBLN CC(=O)c1ccc(-c2ccc(C=C3C(=O)NC(=O)N(c4ccc(Cl)cc4)C3=O)o2)cc1 ZINC000408770862 556846715 /nfs/dbraw/zinc/84/67/15/556846715.db2.gz ANBWKIDUXRYJPQ-XDHOZWIPSA-N 0 2 434.835 4.469 40 10 IICBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1OC ZINC000408770887 556846729 /nfs/dbraw/zinc/84/67/29/556846729.db2.gz CFDWPORWZDIUPK-RIYZIHGNSA-N 0 2 435.263 4.067 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3cc(C)cc(C)c3)C2=O)cc(Cl)c1OC ZINC000408782928 556854964 /nfs/dbraw/zinc/85/49/64/556854964.db2.gz IWBSDKRBRNMNJC-CXUHLZMHSA-N 0 2 428.872 4.031 40 10 IICBLN COc1cc(N2C(=O)NC(=O)C(=Cc3cccc4ccccc34)C2=O)c(OC)cc1Cl ZINC000408783806 556855287 /nfs/dbraw/zinc/85/52/87/556855287.db2.gz NCSSSZOEPYADHF-MHWRWJLKSA-N 0 2 436.851 4.177 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)cc1OC ZINC000408797987 556857489 /nfs/dbraw/zinc/85/74/89/556857489.db2.gz DFJGJGOCISJPBT-UKTHLTGXSA-N 0 2 449.290 4.457 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1OC ZINC000408799820 556857802 /nfs/dbraw/zinc/85/78/02/556857802.db2.gz LPRKHWASPZWPED-OQLLNIDSSA-N 0 2 449.290 4.457 40 10 IICBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1OC ZINC000408800828 556858400 /nfs/dbraw/zinc/85/84/00/556858400.db2.gz RHSHUMQKFCEJHI-VGOFMYFVSA-N 0 2 435.263 4.067 40 10 IICBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)cc1Br ZINC000408806361 556858905 /nfs/dbraw/zinc/85/89/05/556858905.db2.gz IWPRQFRNFZSADM-LFIBNONCSA-N 0 2 443.297 4.213 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)cc(Cl)c1OC(C)C ZINC000408811024 556862535 /nfs/dbraw/zinc/86/25/35/556862535.db2.gz NGDUOYQSVVGSGH-CXUHLZMHSA-N 0 2 428.872 4.111 40 10 IICBLN CCCOc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2ccc(OCC)cc2)C1=O ZINC000408818907 556864850 /nfs/dbraw/zinc/86/48/50/556864850.db2.gz YSDUZBSDSDNAOL-QGOAFFKASA-N 0 2 428.872 4.194 40 10 IICBLN COc1cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc(Cl)c1OC(C)C ZINC000408814788 556865350 /nfs/dbraw/zinc/86/53/50/556865350.db2.gz WFOCVBOFMTUBRU-VIZOYTHASA-N 0 2 449.290 4.456 40 10 IICBLN CCOc1cc(Br)cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)c1 ZINC000408865560 556873411 /nfs/dbraw/zinc/87/34/11/556873411.db2.gz BFLYXUPZMORWMZ-LICLKQGHSA-N 0 2 443.297 4.131 40 10 IICBLN O=C1NC(=O)N(c2ccc(O)cc2)C(=O)/C1=C/c1ccc(Cc2ccccc2Cl)cc1 ZINC000408869168 556874362 /nfs/dbraw/zinc/87/43/62/556874362.db2.gz RLZCJBQTTZUIGB-XSFVSMFZSA-N 0 2 432.863 4.303 40 10 IICBLN Cc1ccc(COc2ccccc2/C=C2/C(=O)NC(=O)N(c3ccccc3F)C2=O)cc1 ZINC000408873810 556875789 /nfs/dbraw/zinc/87/57/89/556875789.db2.gz VZTXMZNOHDXYCG-RGEXLXHISA-N 0 2 430.435 4.380 40 10 IICBLN O=C1NC(=O)N(c2ccccc2F)C(=O)/C1=C\c1ccccc1OCc1ccc(F)cc1 ZINC000408874031 556875812 /nfs/dbraw/zinc/87/58/12/556875812.db2.gz YTEHOZWBVHPGKZ-AQTBWJFISA-N 0 2 434.398 4.210 40 10 IICBLN COc1cc(Br)cc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c1 ZINC000408875954 556876660 /nfs/dbraw/zinc/87/66/60/556876660.db2.gz IDZOZLTVXAYROG-RIYZIHGNSA-N 0 2 449.688 4.086 40 10 IICBLN CCCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OCC)c(Cl)c3)C2=O)cc1 ZINC000408900032 556882092 /nfs/dbraw/zinc/88/20/92/556882092.db2.gz RBPNTDBRRLNTOV-ATVHPVEESA-N 0 2 428.872 4.194 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)cc(Cl)c3OCC)C2=O)cc1 ZINC000409045195 556930304 /nfs/dbraw/zinc/93/03/04/556930304.db2.gz FPGBFGGRODCUJT-MHWRWJLKSA-N 0 2 449.290 4.457 40 10 IICBLN O=C(NN1C(=O)/C(=C/c2cc(Cl)c(O)c(Cl)c2)SC1=S)c1ccccc1 ZINC000409174779 556985217 /nfs/dbraw/zinc/98/52/17/556985217.db2.gz VAPRYAUPWKMWFN-JYRVWZFOSA-N 0 2 425.318 4.245 40 10 IICBLN CCN(CC)c1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c(OC)c1 ZINC000409246777 557028204 /nfs/dbraw/zinc/02/82/04/557028204.db2.gz BCNFGTHFSHSFOL-SFQUDFHCSA-N 0 2 441.915 4.170 40 10 IICBLN COc1ccc(-c2[nH]n(-c3ccc([N+](=O)[O-])cc3)c(=O)c2C(C)=Nc2cccc(C)n2)cc1 ZINC000103921426 557140947 /nfs/dbraw/zinc/14/09/47/557140947.db2.gz RRNXFFNOHKRJOX-JWGURIENSA-N 0 2 443.463 4.444 40 10 IICBLN CCOc1cc(C=C2C(=O)NC(=O)N(c3ccccc3)C2=O)cc(Br)c1O ZINC000016688228 557475462 /nfs/dbraw/zinc/47/54/62/557475462.db2.gz FMBBWTNLVMUDTR-MDWZMJQESA-N 0 2 431.242 4.060 40 10 IICBLN O=C1NC(=O)N(c2ccccc2)C(=O)C1=Cc1cc(Br)c(Br)o1 ZINC000059104892 557814310 /nfs/dbraw/zinc/81/43/10/557814310.db2.gz QMFSXYYVUOEWCT-UXBLZVDNSA-N 0 2 440.047 4.311 40 10 IICBLN CC(C)Oc1c(Cl)cc(/C=C2/C(=O)NN(c3ccccc3)C2=O)cc1Br ZINC000035152528 569260240 /nfs/dbraw/zinc/26/02/40/569260240.db2.gz RICZWJHSBMUHSA-ZSOIEALJSA-N 0 2 435.705 4.351 40 10 IICBLN Cc1ccc(NN=C2C=CC(=O)C(C=Cc3[nH]c(=O)[nH]c(=O)c3[N+](=O)[O-])=C2)cc1Cl ZINC000110094605 569261047 /nfs/dbraw/zinc/26/10/47/569261047.db2.gz QLCVRSYQTFJQOK-TZCCRGFNSA-N 0 2 427.804 4.225 40 10 IICBLN Cc1cccc(C(=O)Oc2ccccc2/C=C2/C(=O)NC(=O)N(c3cccc(C)c3)C2=O)c1 ZINC000408534877 555755599 /nfs/dbraw/zinc/75/55/99/555755599.db2.gz MTNSZCRLWPNQDM-QNGOZBTKSA-N 0 2 440.455 4.189 40 10 IICBLN O=C1NC(=O)N(c2cccc3ccccc32)C(=O)C1=CNc1cccc(Br)c1 ZINC000408536514 555772367 /nfs/dbraw/zinc/77/23/67/555772367.db2.gz WQJXLEAIOMCJAX-SFQUDFHCSA-N 0 2 436.265 4.181 40 10 IICBLN CCN(CC)c1ccc(/C=C2\C(=O)NC(=O)N(c3cccc4ccccc43)C2=O)c(O)c1 ZINC000016678425 556623219 /nfs/dbraw/zinc/62/32/19/556623219.db2.gz FAYPXQOSUJJRMR-XSFVSMFZSA-N 0 2 429.476 4.058 40 10 IICBLN COC(=O)c1ccc(F)c(S(=O)(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)c1 ZINC000063183273 556820105 /nfs/dbraw/zinc/82/01/05/556820105.db2.gz USCUPIULTGWQLL-UHFFFAOYSA-N 0 2 426.878 4.190 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4cccc(Cl)c4)c3C)C2=O)cc1 ZINC000408764082 556829245 /nfs/dbraw/zinc/82/92/45/556829245.db2.gz VYTPCYQHLADIIO-CIAFOILYSA-N 0 2 449.894 4.423 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3C)C2=O)cc(Cl)c1OC ZINC000408801507 556858645 /nfs/dbraw/zinc/85/86/45/556858645.db2.gz UGBYILFIUNSNRW-OQLLNIDSSA-N 0 2 428.872 4.031 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c(OCc2ccccc2)c1 ZINC000408804241 556860218 /nfs/dbraw/zinc/86/02/18/556860218.db2.gz DPZRROSDVYTFOG-HYARGMPZSA-N 0 2 442.471 4.249 40 10 IICBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)c(OC(C)C)c(OC)c3)C2=O)cc1 ZINC000408819588 556865704 /nfs/dbraw/zinc/86/57/04/556865704.db2.gz XWWUXJDNWVEXNU-LICLKQGHSA-N 0 2 442.899 4.365 40 10 IICBLN CCOc1cc(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)c1 ZINC000408872423 556875257 /nfs/dbraw/zinc/87/52/57/556875257.db2.gz NCHDLBIPMFQTPV-CXUHLZMHSA-N 0 2 449.688 4.168 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)c(Cc2cccc(F)c2)c1 ZINC000408877689 556877205 /nfs/dbraw/zinc/87/72/05/556877205.db2.gz TUBPIVAWWROVHR-HZHRSRAPSA-N 0 2 444.462 4.400 40 10 IICBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4ccccc4F)cc3)C2=O)c1 ZINC000408878442 556877352 /nfs/dbraw/zinc/87/73/52/556877352.db2.gz BGLXSQOQRYQYOF-KGENOOAVSA-N 0 2 430.435 4.380 40 10 IICBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCc3cccc(F)c3)C2=O)c1 ZINC000408883537 556877455 /nfs/dbraw/zinc/87/74/55/556877455.db2.gz VPCFLPAJCMZTAD-KGENOOAVSA-N 0 2 430.435 4.380 40 10 IICBLN CCOc1cc(Cl)c(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1OC ZINC000408895909 556880976 /nfs/dbraw/zinc/88/09/76/556880976.db2.gz GBOAAPWYJVTZJQ-RIYZIHGNSA-N 0 2 435.263 4.067 40 10 IICBLN CC[C@H](C)Oc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(Br)cc2)C1=O ZINC000408902811 556885521 /nfs/dbraw/zinc/88/55/21/556885521.db2.gz LNUJZROMTNGITR-VLURKWGBSA-N 0 2 443.297 4.293 40 10 IICBLN O=C1NC(=O)N(c2ccc(OCc3ccccc3Cl)cc2)C(=O)/C1=C/c1ccccc1O ZINC000408940765 556896666 /nfs/dbraw/zinc/89/66/66/556896666.db2.gz VAFBLNDUMFNIOZ-CPNJWEJPSA-N 0 2 448.862 4.291 40 10 IICBLN O=C1NN(c2ccccc2)C(=O)/C1=C\c1cc([N+](=O)[O-])ccc1OCc1ccccc1Cl ZINC000409400084 557101670 /nfs/dbraw/zinc/10/16/70/557101670.db2.gz OQDYDYMVAADDRT-UYRXBGFRSA-N 0 2 449.850 4.289 40 10 IICBLN COC(=O)c1ccccc1-c1ccc(C=C2C(=O)NC(=O)N(c3ccc(OC)cc3)C2=O)o1 ZINC000033330850 557114271 /nfs/dbraw/zinc/11/42/71/557114271.db2.gz VURTZWPXHSRRHG-UYRXBGFRSA-N 0 2 446.415 4.249 40 10 IICBLN C=CCOc1c(Br)cc(Cl)cc1/C=C1/C(=O)NN(c2ccccc2)C1=O ZINC000033745137 569259746 /nfs/dbraw/zinc/25/97/46/569259746.db2.gz GYMJKGOATSQABZ-GDNBJRDFSA-N 0 2 433.689 4.129 40 10 IICBLN CCOc1cccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4cccc(C)c4)c3C)C2=O)c1 ZINC000408752402 556236141 /nfs/dbraw/zinc/23/61/41/556236141.db2.gz AKJZVKULVBATKH-OEAKJJBVSA-N 0 2 443.503 4.468 40 10 IICBLN Cc1nn(-c2ccc(C)cc2)c(C)c1/C=C1/C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O ZINC000408755054 556238012 /nfs/dbraw/zinc/23/80/12/556238012.db2.gz BECIIRQXHKCZCV-NDENLUEZSA-N 0 2 434.883 4.117 40 10 IICBLN Cc1cc(N2C(=O)NC(=O)C(=Cc3ccc(OC(C)C)cc3)C2=O)ccc1Br ZINC000408756056 556239160 /nfs/dbraw/zinc/23/91/60/556239160.db2.gz SZLFWBBVFBVQLB-GZTJUZNOSA-N 0 2 443.297 4.211 40 10 IICBLN O=C1NC(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1ccc(Sc2nc3ccccc3[nH]2)o1 ZINC000408779921 556854224 /nfs/dbraw/zinc/85/42/24/556854224.db2.gz NPEJQZBVGIEGNQ-RVDMUPIBSA-N 0 2 448.435 4.113 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3Cl)C2=O)cc1Br ZINC000408802271 556859448 /nfs/dbraw/zinc/85/94/48/556859448.db2.gz XXPFUWMSWRQPJA-FMIVXFBMSA-N 0 2 449.688 4.168 40 10 IICBLN O=C1NC(=O)N(c2ccc(O)cc2)C(=O)/C1=C/c1ccccc1OCc1ccc(Cl)cc1 ZINC000408803534 556859842 /nfs/dbraw/zinc/85/98/42/556859842.db2.gz QEBZIANNCCJLNG-DEDYPNTBSA-N 0 2 448.862 4.291 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3C)C2=O)c(Cc2ccccc2F)c1 ZINC000408865211 556873283 /nfs/dbraw/zinc/87/32/83/556873283.db2.gz BXNTYUAMIBCVGR-RCCKNPSSSA-N 0 2 444.462 4.400 40 10 IICBLN CC(C)Oc1ccc(/C=C2/C(=O)NC(=O)N(c3ccccc3F)C2=O)cc1Br ZINC000408865291 556873332 /nfs/dbraw/zinc/87/33/32/556873332.db2.gz CWJYQANCPSYFLO-LCYFTJDESA-N 0 2 447.260 4.042 40 10 IICBLN O=C1NC(=O)N(c2ccc(O)cc2)C(=O)/C1=C\c1ccccc1Cc1ccccc1Cl ZINC000408865770 556873351 /nfs/dbraw/zinc/87/33/51/556873351.db2.gz FKCCCRGGIKCPPG-XSFVSMFZSA-N 0 2 432.863 4.303 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3)C2=O)c(Cc2ccccc2F)c1 ZINC000408866779 556873596 /nfs/dbraw/zinc/87/35/96/556873596.db2.gz IWEBZTLJOGZYRY-PXLXIMEGSA-N 0 2 444.462 4.400 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C)cc3)C2=O)c(Cc2cccc(F)c2)c1 ZINC000408868578 556874203 /nfs/dbraw/zinc/87/42/03/556874203.db2.gz OZIGOSSRNSNARD-HZHRSRAPSA-N 0 2 444.462 4.400 40 10 IICBLN COc1cc(/C=C2/C(=O)NC(=O)N(c3ccccc3F)C2=O)ccc1Cc1cccc(F)c1 ZINC000408869608 556874527 /nfs/dbraw/zinc/87/45/27/556874527.db2.gz SLSOKQHKEXFNKT-UYRXBGFRSA-N 0 2 448.425 4.231 40 10 IICBLN COc1cc(/C=C2/C(=O)NC(=O)N(c3cccc(C)c3)C2=O)ccc1Cc1ccccc1F ZINC000408870768 556874698 /nfs/dbraw/zinc/87/46/98/556874698.db2.gz XKXVLIFXLWACSX-FYJGNVAPSA-N 0 2 444.462 4.400 40 10 IICBLN CCCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccccc3F)C2=O)cc1Br ZINC000408872819 556875313 /nfs/dbraw/zinc/87/53/13/556875313.db2.gz JHIVDWSKYNYQMY-RAXLEYEMSA-N 0 2 447.260 4.043 40 10 IICBLN COc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)c(Cc2cccc(F)c2)c1 ZINC000408878497 556877493 /nfs/dbraw/zinc/87/74/93/556877493.db2.gz BMBBJJJKVXAVFP-PXLXIMEGSA-N 0 2 430.435 4.092 40 10 IICBLN Cc1cccc(N2C(=O)NC(=O)C(=Cc3ccc(OCc4cccc(F)c4)cc3)C2=O)c1 ZINC000408885951 556878011 /nfs/dbraw/zinc/87/80/11/556878011.db2.gz HDMPSWTXTVNLKK-HYARGMPZSA-N 0 2 430.435 4.380 40 10 IICBLN CC[C@H](C)Oc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1OC ZINC000408902599 556885322 /nfs/dbraw/zinc/88/53/22/556885322.db2.gz KVTQSRSJKSBSNS-RGZVIEDOSA-N 0 2 446.862 4.331 40 10 IICBLN O=C1NC(=O)N(c2cc(C(F)(F)F)ccc2Cl)C(=O)/C1=C\c1cc(Cl)ccc1O ZINC000408938235 556897229 /nfs/dbraw/zinc/89/72/29/556897229.db2.gz PMQVGQUWMWMVNX-WDZFZDKYSA-N 0 2 445.180 4.384 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)c(C)n1Cc1ccccc1 ZINC000408960107 556899933 /nfs/dbraw/zinc/89/99/33/556899933.db2.gz BUBYDJYRVUHHEH-FYJGNVAPSA-N 0 2 433.895 4.473 40 10 IICBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccc(O)cc4)c3C)C2=O)cc1 ZINC000408982519 556907961 /nfs/dbraw/zinc/90/79/61/556907961.db2.gz HMCMHRRBPLBQPR-HMAPJEAMSA-N 0 2 429.476 4.029 40 10 IICBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(Cl)c(O)c(Br)c3)C2=O)cc1 ZINC000408986023 556909244 /nfs/dbraw/zinc/90/92/44/556909244.db2.gz ZDAJANSZELHJTH-QPEQYQDCSA-N 0 2 449.688 4.037 40 10 IICBLN COc1c(Cl)cc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2)C1=O ZINC000409039987 556928777 /nfs/dbraw/zinc/92/87/77/556928777.db2.gz DYVKOHZUCXYWRY-AWNIVKPZSA-N 0 2 425.655 4.322 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3Cl)C2=O)cc1OCC ZINC000409100815 556955506 /nfs/dbraw/zinc/95/55/06/556955506.db2.gz VFLITBFEYVMKSM-JLHYYAGUSA-N 0 2 449.290 4.457 40 10 IICBLN CCOc1ccc(-n2c(C)cc(/C=C3\C(=O)NC(=O)N(c4cccc(F)c4)C3=O)c2C)cc1 ZINC000409186770 556991179 /nfs/dbraw/zinc/99/11/79/556991179.db2.gz HQPRJKBAYQBWTJ-LPYMAVHISA-N 0 2 447.466 4.298 40 10 IICBLN O=C1NC(=O)N(c2ccc(Br)cc2)C(=O)/C1=C/c1c(Cl)cccc1Cl ZINC000409201479 557000521 /nfs/dbraw/zinc/00/05/21/557000521.db2.gz NLHLELJGFBBMKT-XYOKQWHBSA-N 0 2 440.080 4.422 40 10 IICBLN O=C1/C(=C\c2ccc(O)c([N+](=O)[O-])c2)SC(=S)N1c1cccc(Br)c1 ZINC000409205069 557003339 /nfs/dbraw/zinc/00/33/39/557003339.db2.gz KTSRWIZODXLXNZ-VGOFMYFVSA-N 0 2 437.296 4.469 40 10 IICBLN O=C1NN(c2ccccc2)C(=O)/C1=C\c1cc(Cl)cc([N+](=O)[O-])c1OCc1ccccc1 ZINC000107900484 569260712 /nfs/dbraw/zinc/26/07/12/569260712.db2.gz ILKLZFVFYMLMBR-UNOMPAQXSA-N 0 2 449.850 4.289 40 10 IICBLN CCCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(Cl)c3)C2=O)cc1OCC ZINC000211087814 569261516 /nfs/dbraw/zinc/26/15/16/569261516.db2.gz CGMZEPSZCJKZID-GZTJUZNOSA-N 0 2 428.872 4.194 40 10 IICBLN Cc1cccc(C(=O)Oc2ccccc2/C=C2/C(=O)NC(=O)N(c3ccccc3F)C2=O)c1 ZINC000408529191 555722571 /nfs/dbraw/zinc/72/25/71/555722571.db2.gz CJQLXARGSPGUGA-JXAWBTAJSA-N 0 2 444.418 4.020 40 10 IICBLN Cc1cccc(N2C(=O)NC(=O)C(=CNc3ccc(Br)cc3Cl)C2=O)c1C ZINC000408532328 555741433 /nfs/dbraw/zinc/74/14/33/555741433.db2.gz MIWQODRPWJWWEW-LCYFTJDESA-N 0 2 448.704 4.298 40 10 IICBLN Cc1cccc(C)c1NC=C1C(=O)NC(=O)N(c2ccc(Br)c(C)c2C)C1=O ZINC000408535540 555764293 /nfs/dbraw/zinc/76/42/93/555764293.db2.gz TWWLNKNYXUCXLF-XNTDXEJSSA-N 0 2 442.313 4.262 40 10 IICBLN CC[C@@H](C)Oc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)cc1OC ZINC000015013081 556484159 /nfs/dbraw/zinc/48/41/59/556484159.db2.gz KLNHNFXKSZEVOS-GPLLRDDGSA-N 0 2 428.872 4.192 40 10 IICBLN COc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1Cl ZINC000408781166 556853811 /nfs/dbraw/zinc/85/38/11/556853811.db2.gz AOCRHNOXWUFYOF-WDZFZDKYSA-N 0 2 425.655 4.322 40 10 IICBLN O=C1NC(=O)N(c2ccc(O)cc2)C(=O)/C1=C/c1ccccc1OCc1cccc(Cl)c1 ZINC000408798018 556857535 /nfs/dbraw/zinc/85/75/35/556857535.db2.gz DKJKETOZNGSUAG-DEDYPNTBSA-N 0 2 448.862 4.291 40 10 IICBLN CCCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)cc1OCC ZINC000408808543 556861536 /nfs/dbraw/zinc/86/15/36/556861536.db2.gz QCDFDJNHMAWSTN-LFIBNONCSA-N 0 2 428.872 4.194 40 10 IICBLN CCOc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OC(C)C)c(Cl)c3)C2=O)cc1 ZINC000408810399 556862124 /nfs/dbraw/zinc/86/21/24/556862124.db2.gz PJVMRADOBCJJBR-GZTJUZNOSA-N 0 2 428.872 4.192 40 10 IICBLN CCOc1c(Cl)cc(/C=C2\C(=O)NC(=O)N(c3cccc(C)c3C)C2=O)cc1OC ZINC000408816117 556863657 /nfs/dbraw/zinc/86/36/57/556863657.db2.gz SNYANDSJCKBSHO-OQLLNIDSSA-N 0 2 428.872 4.031 40 10 IICBLN CCCOc1ccc(N2C(=O)NC(=O)C(=Cc3c(OC)ccc4ccccc43)C2=O)cc1 ZINC000408894210 556879824 /nfs/dbraw/zinc/87/98/24/556879824.db2.gz BQYPOLTZGGTPIJ-QNGOZBTKSA-N 0 2 430.460 4.304 40 10 IICBLN CCOc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(C)c(Cl)c3)C2=O)c(OCC)c1 ZINC000408985682 556909313 /nfs/dbraw/zinc/90/93/13/556909313.db2.gz XORDDIYCBFLLNQ-YVLHZVERSA-N 0 2 428.872 4.112 40 10 IICBLN O=C1NC(=O)N(c2cccc(Cl)c2Cl)C(=O)/C1=C/c1ccc(N2CCCC2)c(F)c1 ZINC000409103161 556956602 /nfs/dbraw/zinc/95/66/02/556956602.db2.gz BEYWWNXWTOABGH-JLHYYAGUSA-N 0 2 448.281 4.399 40 10 IICBLN COc1cc(N2CCCCC2)ccc1/C=C1\C(=O)NC(=O)N(c2ccc(Cl)cc2)C1=O ZINC000409220682 557016119 /nfs/dbraw/zinc/01/61/19/557016119.db2.gz DFAHEXVSGSWDIA-CPNJWEJPSA-N 0 2 439.899 4.005 40 10 IICBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c(C)n1-c1ccc(O)cc1 ZINC000409243298 557033183 /nfs/dbraw/zinc/03/31/83/557033183.db2.gz RONUJNOMQPKERI-XDHOZWIPSA-N 0 2 449.894 4.428 40 10 IICBLN COc1ccc(N2C(=O)NC(=O)C(=Cc3cc4c(cc3C)N(C)C(C)(C)C[C@@H]4C)C2=O)cc1 ZINC000208230979 557079842 /nfs/dbraw/zinc/07/98/42/557079842.db2.gz GXJSJJIBHNARGA-REIAIGDLSA-N 0 2 447.535 4.392 40 10 IICBLN Cc1cccc(Cn2cc(/C=C3\C(=O)NC(=O)N(c4ccncc4)C3=O)c3ccccc32)c1 ZINC000409390448 557095259 /nfs/dbraw/zinc/09/52/59/557095259.db2.gz FLJUSSSRXAPGDY-HYARGMPZSA-N 0 2 436.471 4.059 40 10 IICBLN O=C1NC(=O)N(c2ccncc2)C(=O)/C1=C\c1ccc(-c2ccc(Cl)cc2Cl)o1 ZINC000409391840 557096508 /nfs/dbraw/zinc/09/65/08/557096508.db2.gz JZDHVRVUMQTYJB-GDNBJRDFSA-N 0 2 428.231 4.315 40 10 IICBLN CNC(=O)/C=C/c1ccc(S(=O)(=O)Nc2nc(-c3ccc(Cl)cc3)cs2)cc1 ZINC000223294133 557456510 /nfs/dbraw/zinc/45/65/10/557456510.db2.gz ZBHLWGIPAFRODQ-NYYWCZLTSA-N 0 2 433.942 4.024 40 10 IICBLN Cc1cc(C=C2C(=O)NC(=O)N(c3ccc4c(c3)OCO4)C2=O)c(C)n1-c1cccc(F)c1 ZINC000059137408 557816110 /nfs/dbraw/zinc/81/61/10/557816110.db2.gz GUBJSWHOOBEORD-DJKKODMXSA-N 0 2 447.422 4.469 40 10 IICBLN CCCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(Br)cc2C)C1=O ZINC000008895159 132297148 /nfs/dbraw/zinc/29/71/48/132297148.db2.gz CYSBTHQHPBSYCG-FOWTUZBSSA-N 0 2 443.297 4.213 40 10 IICBLN Cc1ccc(N2C(=O)NC(=O)C(=CNc3ccc(Br)cc3Cl)C2=O)c(C)c1 ZINC000408537948 555782926 /nfs/dbraw/zinc/78/29/26/555782926.db2.gz ILDZGEIVJNISKA-UKTHLTGXSA-N 0 2 448.704 4.298 40 10 IICBLN Cc1nn(-c2ccc([N+](=O)[O-])cc2)c(C)c1N=CC1C(=O)N(c2ccc(F)cc2)N=C1C ZINC000408758157 556842953 /nfs/dbraw/zinc/84/29/53/556842953.db2.gz WECBNPZYHLFOAF-UDWIEESQSA-N 0 2 434.431 4.255 40 10 IICBLN COC(=O)c1cccc(-c2ccc(/C=C3\C(=O)NC(=O)N(c4ccc(C)cc4)C3=O)o2)c1C ZINC000408780124 556854404 /nfs/dbraw/zinc/85/44/04/556854404.db2.gz STDOFANXBWVELO-DEDYPNTBSA-N 0 2 444.443 4.016 40 10 IICBLN CC(=O)c1ccc(-c2ccc(C=C3C(=O)NC(=O)N(c4cc(C)cc(C)c4)C3=O)o2)cc1 ZINC000408783750 556855339 /nfs/dbraw/zinc/85/53/39/556855339.db2.gz QMVDFWBJVHAUNZ-FYJGNVAPSA-N 0 2 428.444 4.432 40 10 IICBLN CCOc1ccc(Br)cc1/C=C1\C(=O)NC(=O)N(c2ccccc2Cl)C1=O ZINC000408797540 556857445 /nfs/dbraw/zinc/85/74/45/556857445.db2.gz GOWGFCKQLSXZRU-JLHYYAGUSA-N 0 2 449.688 4.168 40 10 IICBLN CC(C)Oc1ccc2ccccc2c1/C=C1\C(=O)NC(=O)N(c2cccc([N+](=O)[O-])c2)C1=O ZINC000408803472 556859849 /nfs/dbraw/zinc/85/98/49/556859849.db2.gz PHFNWKQCPIXMSN-DEDYPNTBSA-N 0 2 445.431 4.202 40 10 IICBLN CCOc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)cc3)C2=O)ccc1OC(C)C ZINC000408803911 556859958 /nfs/dbraw/zinc/85/99/58/556859958.db2.gz URIDQMLXHFKOSI-GZTJUZNOSA-N 0 2 428.872 4.192 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(Cl)c(Cl)c3)C2=O)cc1OCC ZINC000408804631 556860486 /nfs/dbraw/zinc/86/04/86/556860486.db2.gz ZBELWKXNABZCPJ-NTEUORMPSA-N 0 2 449.290 4.457 40 10 IICBLN CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3cc(Cl)ccc3C)C2=O)cc1OCC ZINC000408808961 556861591 /nfs/dbraw/zinc/86/15/91/556861591.db2.gz GXGDWYFFXCGNMC-MHWRWJLKSA-N 0 2 428.872 4.112 40 10 IICBLN COc1ccc(Cl)cc1/C=C1/C(=O)NC(=O)N(c2ccc(Br)cc2C)C1=O ZINC000408892926 556881674 /nfs/dbraw/zinc/88/16/74/556881674.db2.gz APAXAAXYPZGHLV-ZROIWOOFSA-N 0 2 449.688 4.086 40 10 IICBLN Cc1cc(/C=C2\C(=O)NC(=O)N(c3ccc(Br)cc3)C2=O)c(C)n1C(C)C ZINC000408962131 556901373 /nfs/dbraw/zinc/90/13/73/556901373.db2.gz GVQDMSKPEAIPQK-LICLKQGHSA-N 0 2 430.302 4.115 40 10 IICBLN CCc1ccccc1-n1c(C)cc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)c1C ZINC000408964245 556901988 /nfs/dbraw/zinc/90/19/88/556901988.db2.gz CKSFMIFBRYWQTE-FYJGNVAPSA-N 0 2 431.467 4.462 40 10 IICBLN CCc1ccc(N2C(=O)NC(=O)C(=Cc3cc(C)n(-c4ccccc4F)c3C)C2=O)cc1 ZINC000408982583 556907948 /nfs/dbraw/zinc/90/79/48/556907948.db2.gz IBILVRQSKMXERN-ZHZULCJRSA-N 0 2 431.467 4.462 40 10 IICBLN COc1ccc(Cl)cc1/C=C1\C(=O)NC(=O)N(c2cccc(Cl)c2Cl)C1=O ZINC000409106128 556958962 /nfs/dbraw/zinc/95/89/62/556958962.db2.gz MLYHPRJJMPIUOO-DHZHZOJOSA-N 0 2 425.655 4.322 40 10 IICBLN Cc1cc(C=C2C(=O)NC(=O)N(c3cccc(Cl)c3C)C2=O)c(C)n1-c1ccccn1 ZINC000409239509 557020788 /nfs/dbraw/zinc/02/07/88/557020788.db2.gz NWLLNRHFMSFKBJ-SFQUDFHCSA-N 0 2 434.883 4.117 40 10 IICBLN Cc1ccc(Cn2cc(/C=C3\C(=O)NC(=O)N(c4cccnc4)C3=O)c3ccccc32)cc1 ZINC000409241953 557031910 /nfs/dbraw/zinc/03/19/10/557031910.db2.gz SXVNCFMIUVWMHW-LPYMAVHISA-N 0 2 436.471 4.059 40 10 IICBLN CCOc1ccc(OCC)c(N2C(=O)NC(=O)C(=Cc3ccc(OC)c(OC)c3)C2=O)c1 ZINC000059104474 557814111 /nfs/dbraw/zinc/81/41/11/557814111.db2.gz ACUHOCWLTMAJAY-LFIBNONCSA-N 0 2 440.452 4.008 40 10 IICBLN CCCCOc1ccc(Cl)cc1/C=C1/C(=O)NC(=O)N(c2ccc([N+](=O)[O-])cc2)C1=O ZINC000107966534 569251909 /nfs/dbraw/zinc/25/19/09/569251909.db2.gz VJWTZBQGHASDGL-ATVHPVEESA-N 0 2 443.843 4.094 40 10 IICBLN